#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rjh n THR 65 N 0.00 0.00 -2.00 4.37 -1.04 -1.26 -1.05 114.28 113.30 1rjh n THR 65 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1rjh n THR 65 Cb 0.00 -0.63 -0.03 0.00 -1.82 0.00 0.00 70.33 67.85 1rjh n THR 65 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1rjh s GLN 66 N -2.00 4.23 -0.24 -2.82 -0.44 -1.26 -4.63 119.66 112.51 1rjh s GLN 66 Ca 0.34 2.26 -0.09 0.00 -2.50 0.00 0.00 55.36 55.36 1rjh s GLN 66 Cb 0.15 -3.39 -0.04 0.00 -1.64 0.00 0.00 33.01 28.09 1rjh s GLN 66 CO 0.26 -0.62 0.12 0.95 0.50 0.00 0.00 175.29 176.50 1rjh s THR 67 N 1.85 4.97 0.30 -0.34 -4.23 -1.26 -3.88 115.64 113.06 1rjh s THR 67 Ca 0.70 0.05 -0.08 0.00 -1.18 0.00 0.00 61.69 61.18 1rjh s THR 67 Cb -0.40 -3.31 0.00 0.00 1.34 0.00 0.00 72.50 70.13 1rjh s THR 67 CO 0.31 0.35 0.48 -1.59 -0.54 0.00 0.00 174.62 173.63 1rjh s LYS 68 N 1.17 1.76 0.73 3.99 0.00 -0.90 -4.67 119.74 121.83 1rjh s LYS 68 Ca 0.06 -1.53 -0.11 0.00 0.00 0.00 0.00 55.97 54.39 1rjh s LYS 68 Cb -0.14 0.46 0.04 0.00 0.00 0.00 0.00 37.83 38.19 1rjh s LYS 68 CO 0.05 -0.73 1.11 0.95 0.00 0.00 0.00 175.35 176.72 1rjh s THR 69 N -3.42 2.96 0.18 3.79 -4.23 -1.26 -2.60 115.64 111.06 1rjh s THR 69 Ca 0.27 0.26 -0.13 0.00 -1.18 0.00 0.00 61.69 60.91 1rjh s THR 69 Cb -0.00 -3.30 0.08 0.00 1.34 0.00 0.00 72.50 70.62 1rjh s THR 69 CO 0.15 -0.39 1.82 0.15 -0.54 0.00 0.00 174.62 175.81 1rjh h PHE 70 N -0.76 0.76 -0.79 3.99 3.57 -1.50 0.19 116.94 122.40 1rjh h PHE 70 Ca -0.45 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 1rjh h PHE 70 Cb 1.28 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.73 1rjh h PHE 70 CO 0.43 0.51 0.47 1.25 -2.23 0.00 0.00 178.31 178.74 1rjh h HIS 71 N 0.79 1.04 -0.41 0.41 2.76 -1.94 -1.58 115.15 116.22 1rjh h HIS 71 Ca 0.21 -0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.25 1rjh h HIS 71 Cb -0.04 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 28.57 1rjh h HIS 71 CO -0.02 0.70 -0.25 0.93 -1.30 0.00 0.00 177.93 177.99 1rjh h GLU 72 N 1.08 0.83 -1.01 5.26 5.08 -1.84 -2.89 114.58 121.09 1rjh h GLU 72 Ca 0.28 -0.36 0.11 0.00 -1.00 0.00 0.00 59.36 58.40 1rjh h GLU 72 Cb -0.03 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.11 1rjh h GLU 72 CO -0.05 0.99 0.64 0.00 -1.00 0.00 0.00 179.01 179.58 1rjh h ALA 73 N 1.00 1.51 0.03 3.43 0.00 0.33 0.61 119.26 126.16 1rjh h ALA 73 Ca 0.09 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1rjh h ALA 73 Cb 0.78 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1rjh h ALA 73 CO 0.06 0.26 -0.01 0.77 0.00 0.00 0.00 179.25 180.33 1rjh h SER 74 N 1.02 -0.03 -0.67 0.00 0.02 -1.30 -2.83 113.55 109.76 1rjh h SER 74 Ca 0.49 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.53 1rjh h SER 74 Cb 0.45 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 62.92 1rjh h SER 74 CO -0.25 -0.02 0.31 -0.08 -1.14 0.00 0.00 176.83 175.65 1rjh h GLU 75 N -0.05 0.52 0.89 3.45 4.81 -1.29 -0.90 114.58 122.02 1rjh h GLU 75 Ca -0.00 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1rjh h GLU 75 Cb 0.03 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.30 1rjh h GLU 75 CO 0.01 0.35 -0.43 0.22 -0.73 0.00 0.00 179.01 178.43 1rjh h ASP 76 N 0.54 -1.01 -0.82 1.04 3.58 0.08 -0.86 116.42 118.98 1rjh h ASP 76 Ca 0.33 0.03 0.03 0.00 0.42 0.00 0.00 57.03 57.85 1rjh h ASP 76 Cb 0.36 0.26 -0.05 0.00 1.72 0.00 0.00 39.33 41.62 1rjh h ASP 76 CO -0.27 -0.71 0.52 0.00 -2.88 0.00 0.00 179.24 175.90 1rjh h ILE 78 N 1.01 1.08 0.00 0.00 1.08 -1.11 -1.59 117.51 117.97 1rjh h ILE 78 Ca 0.33 -0.36 -0.06 0.00 -0.39 0.00 0.00 64.86 64.38 1rjh h ILE 78 Cb 0.02 -0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 33.69 1rjh h ILE 78 CO -0.12 0.19 -0.27 -1.28 -0.69 0.00 0.00 178.15 175.99 1rjh h SER 79 N 1.05 0.00 0.76 1.72 0.87 0.53 -2.38 113.55 116.11 1rjh h SER 79 Ca 0.38 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.94 1rjh h SER 79 Cb 0.13 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1rjh h SER 79 CO -0.16 0.27 0.00 0.54 -0.53 0.00 0.00 176.83 176.95 1rjh n ARG 80 N -3.39 0.02 -0.83 2.24 5.12 0.05 -4.86 116.66 115.00 1rjh n ARG 80 Ca 0.00 0.14 0.00 0.00 -1.93 0.00 0.00 57.85 56.07 1rjh n ARG 80 Cb 0.47 -1.52 0.00 0.00 -1.16 0.00 0.00 32.46 30.25 1rjh n ARG 80 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1rjh n GLY 81 N 0.71 1.09 0.09 -0.13 0.00 -0.89 -5.08 105.19 100.97 1rjh n GLY 81 Ca 0.05 -0.25 -0.00 0.00 0.00 0.00 0.00 46.02 45.81 1rjh n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rjh n GLY 82 N -0.36 1.76 3.15 -0.02 0.00 -1.01 -4.53 105.19 104.17 1rjh n GLY 82 Ca 0.00 -0.99 -0.20 0.00 0.00 0.00 0.00 46.02 44.84 1rjh n GLY 82 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1rjh s THR 83 N -2.85 1.11 0.32 2.61 -1.32 -0.84 -3.24 115.64 111.42 1rjh s THR 83 Ca 0.00 -1.07 -0.29 0.00 -1.21 0.00 0.00 61.69 59.13 1rjh s THR 83 Cb -0.00 -1.02 -0.11 0.00 -1.51 0.00 0.00 72.50 69.86 1rjh s THR 83 CO 0.00 -0.05 1.45 -0.22 -2.21 0.00 0.00 174.62 173.59 1rjh s LEU 84 N -1.28 4.37 -0.26 9.08 0.20 -1.26 0.11 118.68 129.63 1rjh s LEU 84 Ca 0.01 2.85 -0.28 0.00 0.69 0.00 0.00 54.13 57.40 1rjh s LEU 84 Cb -0.08 -3.65 -0.04 0.00 -0.43 0.00 0.00 46.19 41.99 1rjh s LEU 84 CO 0.01 -0.75 2.14 -0.94 -0.29 0.00 0.00 176.35 176.53 1rjh s SER 85 N -0.01 5.48 -0.36 3.68 1.04 0.16 -4.66 113.70 119.02 1rjh s SER 85 Ca 0.55 1.71 -0.06 0.00 0.48 0.00 0.00 55.95 58.63 1rjh s SER 85 Cb -0.44 -2.51 0.06 0.00 0.10 0.00 0.00 66.02 63.23 1rjh s SER 85 CO 0.53 -1.97 0.14 0.42 0.98 0.00 0.00 173.24 173.34 1rjh s THR 86 N 8.28 3.72 -0.30 2.02 -4.23 -1.26 -4.19 115.64 119.68 1rjh s THR 86 Ca 0.96 -1.33 -0.29 0.00 -1.18 0.00 0.00 61.69 59.86 1rjh s THR 86 Cb -0.30 -3.20 -0.02 0.00 1.34 0.00 0.00 72.50 70.32 1rjh s THR 86 CO 0.34 -0.30 1.74 -2.84 -0.54 0.00 0.00 174.62 173.02 1rjh s PRO 87 N 1.36 3.48 0.09 3.99 0.02 -1.26 -4.85 135.00 137.82 1rjh s PRO 87 Ca 0.00 1.50 0.13 0.00 0.02 0.00 0.00 61.00 62.64 1rjh s PRO 87 Cb -0.21 -4.15 -0.14 0.00 0.02 0.00 0.00 34.50 30.02 1rjh s PRO 87 CO 0.01 -1.68 1.02 1.96 -0.33 0.00 0.00 177.00 177.99 1rjh h GLN 88 N 12.20 0.00 -5.11 5.54 7.50 -1.94 -3.43 115.11 129.87 1rjh h GLN 88 Ca -0.34 0.00 -0.49 0.00 0.50 0.00 0.00 58.65 58.32 1rjh h GLN 88 Cb 1.16 0.00 -0.14 0.00 0.05 0.00 0.00 27.48 28.56 1rjh h GLN 88 CO 1.02 0.58 -0.57 0.95 -1.50 0.00 0.00 178.83 179.31 1rjh s THR 89 N -2.78 0.88 0.27 -0.54 -4.23 -1.26 -1.11 115.64 106.86 1rjh s THR 89 Ca -0.01 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.46 1rjh s THR 89 Cb 0.09 -2.59 0.24 0.00 1.34 0.00 0.00 72.50 71.57 1rjh s THR 89 CO 0.80 0.00 1.92 1.23 -0.54 0.00 0.00 174.62 178.04 1rjh h GLY 90 N 2.01 1.25 0.93 3.99 0.00 -1.93 -2.46 103.07 106.87 1rjh h GLY 90 Ca -0.38 -0.50 0.02 0.00 0.00 0.00 0.00 47.33 46.46 1rjh h GLY 90 CO 0.64 0.49 0.44 1.76 0.00 0.00 0.00 176.54 179.86 1rjh h SER 91 N 1.19 0.73 -0.24 0.19 0.02 -1.98 0.18 113.55 113.65 1rjh h SER 91 Ca 0.31 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.26 1rjh h SER 91 Cb -0.07 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 1rjh h SER 91 CO -0.06 0.52 0.14 -0.33 -1.14 0.00 0.00 176.83 175.96 1rjh h GLU 92 N 0.87 0.29 -0.38 3.45 4.39 -1.84 0.76 114.58 122.11 1rjh h GLU 92 Ca 0.26 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.91 1rjh h GLU 92 Cb -0.04 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 1rjh h GLU 92 CO -0.08 0.19 0.11 -0.97 -1.16 0.00 0.00 179.01 177.10 1rjh h ASN 93 N 0.29 0.56 -0.17 1.42 -1.24 -1.07 -0.03 115.58 115.34 1rjh h ASN 93 Ca 0.09 -0.21 0.02 0.00 0.71 0.00 0.00 56.30 56.91 1rjh h ASN 93 Cb -0.01 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 38.87 1rjh h ASN 93 CO -0.04 0.62 0.03 -0.78 -1.29 0.00 0.00 177.43 175.97 1rjh h ASP 94 N 0.47 0.00 0.45 1.15 1.82 -0.40 -0.26 116.42 119.65 1rjh h ASP 94 Ca 0.12 0.03 -0.12 0.00 -0.39 0.00 0.00 57.03 56.67 1rjh h ASP 94 Cb 0.27 0.04 -0.01 0.00 0.68 0.00 0.00 39.33 40.30 1rjh h ASP 94 CO -0.00 0.03 -0.55 0.00 -1.61 0.00 0.00 179.24 177.11 1rjh h ALA 95 N 1.13 1.02 -0.10 -0.78 0.00 -0.75 -1.83 119.26 117.95 1rjh h ALA 95 Ca 0.08 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1rjh h ALA 95 Cb 0.07 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1rjh h ALA 95 CO -0.11 0.69 -0.14 1.25 0.00 0.00 0.00 179.25 180.94 1rjh h LEU 96 N 0.08 0.30 -1.39 0.00 5.85 -0.60 0.20 115.31 119.75 1rjh h LEU 96 Ca -0.00 -0.52 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 1rjh h LEU 96 Cb 0.99 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 1rjh h LEU 96 CO 0.08 0.76 0.31 0.22 -0.34 0.00 0.00 178.44 179.47 1rjh h TYR 97 N -0.16 0.70 -0.17 1.25 3.20 -1.03 -1.05 116.97 119.71 1rjh h TYR 97 Ca 0.01 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.74 1rjh h TYR 97 Cb 0.70 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1rjh h TYR 97 CO 0.10 0.48 -0.50 1.49 -1.64 0.00 0.00 178.16 178.09 1rjh h GLU 98 N 0.73 0.46 0.00 1.82 4.22 -1.18 -3.06 114.58 117.57 1rjh h GLU 98 Ca 0.19 -0.27 -0.07 0.00 0.08 0.00 0.00 59.36 59.30 1rjh h GLU 98 Cb -0.01 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1rjh h GLU 98 CO -0.03 0.85 -0.31 -0.92 -2.18 0.00 0.00 179.01 176.42 1rjh h TYR 99 N 0.36 0.00 0.39 0.92 3.20 0.66 -2.66 116.97 119.85 1rjh h TYR 99 Ca 0.02 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1rjh h TYR 99 Cb 1.00 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 1rjh h TYR 99 CO 0.03 0.31 -0.25 -0.07 -1.64 0.00 0.00 178.16 176.55 1rjh h LEU 100 N 0.00 -0.63 -1.68 2.82 3.38 -1.25 -2.48 115.31 115.47 1rjh h LEU 100 Ca -0.00 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1rjh h LEU 100 Cb 0.65 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1rjh h LEU 100 CO 0.04 -0.39 0.27 -0.09 0.09 0.00 0.00 178.44 178.36 1rjh h ARG 101 N -0.62 0.40 -0.06 1.13 1.12 -1.55 0.82 114.38 115.63 1rjh h ARG 101 Ca -0.04 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.80 1rjh h ARG 101 Cb 0.51 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.38 1rjh h ARG 101 CO 0.04 0.26 0.00 0.00 -3.11 0.00 0.00 179.97 177.16 1rjh n GLN 102 N -4.48 1.80 0.17 0.20 10.64 -1.13 -4.43 117.38 120.15 1rjh n GLN 102 Ca 0.04 -1.17 0.00 0.00 -1.83 0.00 0.00 57.00 54.05 1rjh n GLN 102 Cb 0.17 -1.46 0.00 0.00 -0.86 0.00 0.00 30.24 28.08 1rjh n GLN 102 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1rjh n SER 103 N 0.41 -1.48 -0.00 2.61 2.88 -0.36 -4.97 113.62 112.71 1rjh n SER 103 Ca 0.18 0.62 -0.05 0.00 -1.33 0.00 0.00 58.87 58.29 1rjh n SER 103 Cb 0.39 1.54 -0.12 0.00 -0.75 0.00 0.00 64.21 65.27 1rjh n SER 103 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1rjh n VAL 104 N -3.45 1.44 0.00 2.46 0.31 0.13 -5.04 118.33 114.18 1rjh n VAL 104 Ca 0.00 -0.75 0.00 0.00 -0.01 0.00 0.00 64.34 63.58 1rjh n VAL 104 Cb 0.00 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 1rjh n VAL 104 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1rjh n GLY 105 N 1.49 1.72 0.39 2.92 0.00 0.24 -4.80 105.19 107.15 1rjh n GLY 105 Ca -0.14 -1.16 0.18 0.00 0.00 0.00 0.00 46.02 44.90 1rjh n GLY 105 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1rjh h ASN 106 N 0.00 0.52 -0.08 1.61 -1.24 -1.81 -0.19 115.58 114.39 1rjh h ASN 106 Ca 0.00 0.06 -0.05 0.00 0.71 0.00 0.00 56.30 57.02 1rjh h ASN 106 Cb 0.00 -0.03 -0.03 0.00 0.73 0.00 0.00 38.32 38.99 1rjh h ASN 106 CO 0.00 0.19 0.06 -1.84 -1.29 0.00 0.00 177.43 174.55 1rjh n GLU 107 N -4.59 1.11 -3.73 6.67 0.28 -1.26 -3.33 120.64 115.79 1rjh n GLU 107 Ca 0.21 -0.26 -0.37 0.00 -0.16 0.00 0.00 57.16 56.58 1rjh n GLU 107 Cb 0.68 -1.10 -0.06 0.00 1.43 0.00 0.00 31.44 32.39 1rjh n GLU 107 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1rjh s ALA 108 N -0.29 3.81 -0.24 -1.84 0.00 -0.08 -4.34 121.76 118.78 1rjh s ALA 108 Ca 0.05 -0.48 -0.16 0.00 0.00 0.00 0.00 51.96 51.37 1rjh s ALA 108 Cb 0.04 -2.13 -0.04 0.00 0.00 0.00 0.00 23.12 21.00 1rjh s ALA 108 CO 0.01 0.56 0.42 -1.21 0.00 0.00 0.00 175.76 175.54 1rjh s GLU 109 N -1.03 4.10 0.06 0.00 0.41 -1.26 -3.50 118.70 117.48 1rjh s GLU 109 Ca 0.18 0.18 0.01 0.00 -0.41 0.00 0.00 54.97 54.93 1rjh s GLU 109 Cb -0.14 -3.60 -0.03 0.00 -1.78 0.00 0.00 34.13 28.58 1rjh s GLU 109 CO 0.07 -0.19 -0.06 0.96 -0.49 0.00 0.00 175.26 175.55 1rjh s ILE 110 N 1.79 0.51 0.41 -1.63 -0.00 -0.93 -3.26 121.20 118.09 1rjh s ILE 110 Ca 0.18 -1.48 -0.25 0.00 -0.00 0.00 0.00 60.65 59.10 1rjh s ILE 110 Cb -0.15 -1.10 -0.08 0.00 -0.00 0.00 0.00 42.46 41.12 1rjh s ILE 110 CO 0.09 -0.66 1.14 0.26 -0.00 0.00 0.00 174.94 175.77 1rjh s TRP 111 N -2.57 3.08 -1.34 1.37 0.52 -1.23 0.61 118.94 119.39 1rjh s TRP 111 Ca -0.00 1.57 0.28 0.00 0.02 0.00 0.00 56.10 57.97 1rjh s TRP 111 Cb -0.02 -3.33 1.06 0.00 -1.15 0.00 0.00 33.47 30.03 1rjh s TRP 111 CO -0.03 -1.19 1.78 -0.11 0.02 0.00 0.00 176.95 177.41 1rjh n LEU 112 N -0.05 0.36 0.00 2.99 -0.00 0.39 -4.69 117.00 116.01 1rjh n LEU 112 Ca 0.05 0.13 0.00 0.00 -0.00 0.00 0.00 56.01 56.19 1rjh n LEU 112 Cb 0.47 -0.28 0.00 0.00 -0.00 0.00 0.00 43.42 43.62 1rjh n LEU 112 CO 0.49 0.07 0.00 0.61 -0.00 0.00 0.00 177.39 178.56 1rjh n GLY 113 N 1.39 1.28 3.83 -3.96 0.00 -1.26 -4.20 105.19 102.27 1rjh n GLY 113 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1rjh n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rjh s LEU 114 N 0.00 4.46 0.29 0.99 2.01 -1.26 -2.03 118.68 123.14 1rjh s LEU 114 Ca 0.00 0.94 -0.06 0.00 0.01 0.00 0.00 54.13 55.02 1rjh s LEU 114 Cb 0.00 -2.57 -0.06 0.00 0.01 0.00 0.00 46.19 43.57 1rjh s LEU 114 CO 0.00 0.31 0.57 0.21 1.01 0.00 0.00 176.35 178.45 1rjh s ASN 115 N -0.97 6.47 -0.02 2.29 3.84 -0.77 -3.74 114.94 122.04 1rjh s ASN 115 Ca 0.23 0.78 0.21 0.00 0.21 0.00 0.00 52.86 54.30 1rjh s ASN 115 Cb -0.16 -2.17 0.66 0.00 -0.55 0.00 0.00 41.25 39.02 1rjh s ASN 115 CO 0.13 -0.20 1.55 -0.90 -2.79 0.00 0.00 177.10 174.89 1rjh n ASP 116 N -0.86 4.05 -3.19 -4.21 5.75 -1.26 -4.58 116.55 112.25 1rjh n ASP 116 Ca -0.01 -2.09 0.00 0.00 -0.01 0.00 0.00 54.79 52.68 1rjh n ASP 116 Cb 0.54 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 1rjh n ASP 116 CO 0.00 0.00 0.00 0.80 -0.11 0.00 0.00 177.20 177.89 1rjh n MET 117 N 1.52 0.35 -1.93 0.11 1.56 -1.26 -4.77 117.12 112.70 1rjh n MET 117 Ca 0.25 0.00 -0.24 0.00 -0.27 0.00 0.00 57.70 57.44 1rjh n MET 117 Cb 0.67 0.00 -0.06 0.00 2.15 0.00 0.00 33.22 35.98 1rjh n MET 117 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1rjh s ALA 118 N -2.98 1.42 -0.53 -5.12 0.00 -1.26 -4.81 121.76 108.48 1rjh s ALA 118 Ca 0.00 -1.41 0.04 0.00 0.00 0.00 0.00 51.96 50.58 1rjh s ALA 118 Cb 0.00 -4.58 0.15 0.00 0.00 0.00 0.00 23.12 18.69 1rjh s ALA 118 CO 0.00 -5.17 0.34 0.00 0.00 0.00 0.00 175.76 170.93 1rjh s ALA 119 N 11.43 2.69 -1.06 0.00 0.00 -1.26 -5.04 121.76 128.53 1rjh s ALA 119 Ca 0.75 -3.05 -0.22 0.00 0.00 0.00 0.00 51.96 49.44 1rjh s ALA 119 Cb -0.07 -1.96 0.05 0.00 0.00 0.00 0.00 23.12 21.14 1rjh s ALA 119 CO 0.03 -2.05 1.49 -1.83 0.00 0.00 0.00 175.76 173.39 1rjh s GLU 120 N -0.36 3.65 0.00 0.00 -1.05 -1.26 -4.19 118.70 115.48 1rjh s GLU 120 Ca 0.23 -1.25 0.00 0.00 -0.15 0.00 0.00 54.97 53.80 1rjh s GLU 120 Cb -0.13 -5.38 0.00 0.00 -0.44 0.00 0.00 34.13 28.18 1rjh s GLU 120 CO -0.09 -2.21 0.00 0.41 0.95 0.00 0.00 175.26 174.32 1rjh n GLY 121 N 6.67 2.05 3.40 -3.83 0.00 -1.26 -4.91 105.19 107.31 1rjh n GLY 121 Ca 0.35 -0.36 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 1rjh n GLY 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rjh s THR 122 N -0.20 4.93 0.55 2.61 2.01 -1.26 -5.05 115.64 119.23 1rjh s THR 122 Ca 0.00 -0.82 -0.15 0.00 0.31 0.00 0.00 61.69 61.03 1rjh s THR 122 Cb 0.00 -4.34 -0.06 0.00 0.01 0.00 0.00 72.50 68.10 1rjh s THR 122 CO 0.00 -0.89 1.00 0.26 -0.69 0.00 0.00 174.62 174.30 1rjh s TRP 123 N 2.43 3.50 -0.12 4.92 0.52 -1.26 -4.60 118.94 124.33 1rjh s TRP 123 Ca 0.11 1.41 0.01 0.00 0.02 0.00 0.00 56.10 57.66 1rjh s TRP 123 Cb -0.22 -2.77 -0.01 0.00 -1.15 0.00 0.00 33.47 29.31 1rjh s TRP 123 CO 0.09 -0.49 -0.17 0.08 0.02 0.00 0.00 176.95 176.47 1rjh s VAL 124 N -2.80 2.71 0.83 4.03 1.01 -1.26 -4.35 120.40 120.56 1rjh s VAL 124 Ca 0.58 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.66 1rjh s VAL 124 Cb -0.10 -2.11 0.09 0.00 0.00 0.00 0.00 36.38 34.26 1rjh s VAL 124 CO 0.39 0.54 1.09 -1.81 0.00 0.00 0.00 175.10 175.31 1rjh s ASP 125 N 0.33 4.18 0.41 3.32 1.11 0.75 -1.85 116.67 124.91 1rjh s ASP 125 Ca -0.13 1.38 0.08 0.00 0.18 0.00 0.00 52.55 54.06 1rjh s ASP 125 Cb -0.17 -2.10 0.86 0.00 1.07 0.00 0.00 42.92 42.58 1rjh s ASP 125 CO 0.07 -2.18 2.02 0.24 1.18 0.00 0.00 175.17 176.50 1rjh h MET 126 N -1.23 0.43 0.00 8.23 2.86 -1.70 -1.92 114.93 121.60 1rjh h MET 126 Ca -0.48 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.12 1rjh h MET 126 Cb 1.27 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.84 1rjh h MET 126 CO 0.58 0.35 0.00 0.25 1.06 0.00 0.00 176.91 179.15 1rjh n THR 127 N -4.42 0.20 -0.79 2.22 -2.24 -1.26 -4.84 114.28 103.14 1rjh n THR 127 Ca 0.02 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1rjh n THR 127 Cb 0.12 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 1rjh n THR 127 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rjh n GLY 128 N 0.85 0.53 3.99 3.38 0.00 -0.72 -5.06 105.19 108.16 1rjh n GLY 128 Ca 0.12 -0.68 -0.19 0.00 0.00 0.00 0.00 46.02 45.28 1rjh n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rjh s ALA 129 N -2.00 4.30 -0.23 4.61 0.00 -1.26 -4.85 121.76 122.33 1rjh s ALA 129 Ca 0.00 -1.54 -0.04 0.00 0.00 0.00 0.00 51.96 50.38 1rjh s ALA 129 Cb 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.50 1rjh s ALA 129 CO 0.00 -0.11 -0.04 0.50 0.00 0.00 0.00 175.76 176.11 1rjh s ARG 130 N -4.21 3.23 0.64 0.00 3.52 -1.26 -0.18 118.95 120.69 1rjh s ARG 130 Ca 0.48 -0.72 -0.18 0.00 -0.13 0.00 0.00 55.73 55.18 1rjh s ARG 130 Cb -0.09 -3.02 -0.02 0.00 -1.56 0.00 0.00 34.95 30.25 1rjh s ARG 130 CO 0.31 -0.26 1.15 0.44 -0.81 0.00 0.00 175.30 176.14 1rjh n ILE 131 N 4.77 4.47 0.71 4.11 -0.00 -1.26 -4.93 119.36 127.23 1rjh n ILE 131 Ca -0.18 -0.50 0.08 0.00 -0.00 0.00 0.00 62.75 62.15 1rjh n ILE 131 Cb 0.50 -1.34 -0.01 0.00 -0.00 0.00 0.00 39.64 38.78 1rjh n ILE 131 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1rjh n ALA 132 N -1.89 3.24 -3.94 -1.28 0.00 -0.72 -4.88 120.51 111.04 1rjh n ALA 132 Ca 0.15 -0.53 -0.29 0.00 0.00 0.00 0.00 53.44 52.77 1rjh n ALA 132 Cb 0.48 -0.56 -0.16 0.00 0.00 0.00 0.00 19.45 19.21 1rjh n ALA 132 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1rjh s TYR 133 N -1.93 2.03 -0.16 0.00 5.04 -0.27 -4.97 117.35 117.09 1rjh s TYR 133 Ca 0.13 -1.30 -0.04 0.00 -2.44 0.00 0.00 57.07 53.41 1rjh s TYR 133 Cb 0.13 -1.47 0.07 0.00 0.35 0.00 0.00 41.96 41.04 1rjh s TYR 133 CO 0.42 -0.67 0.20 -1.59 -1.34 0.00 0.00 175.55 172.57 1rjh s LYS 134 N 1.53 0.13 -0.16 4.97 -2.85 -1.26 -4.76 119.74 117.34 1rjh s LYS 134 Ca 0.00 0.35 -0.03 0.00 -1.00 0.00 0.00 55.97 55.29 1rjh s LYS 134 Cb -0.15 -0.85 0.05 0.00 -2.06 0.00 0.00 37.83 34.81 1rjh s LYS 134 CO -0.08 -0.51 0.04 1.21 0.10 0.00 0.00 175.35 176.11 1rjh s ASN 135 N 2.31 2.45 -0.11 0.03 3.84 -1.26 -5.13 114.94 117.07 1rjh s ASN 135 Ca 0.05 -0.59 -0.00 0.00 0.21 0.00 0.00 52.86 52.52 1rjh s ASN 135 Cb -0.14 -0.46 -0.02 0.00 -0.55 0.00 0.00 41.25 40.08 1rjh s ASN 135 CO -0.10 -0.29 -0.10 0.26 -2.79 0.00 0.00 177.10 174.08 1rjh s TRP 136 N 1.96 2.86 0.31 0.43 0.52 -1.26 -2.71 118.94 121.04 1rjh s TRP 136 Ca 0.01 -0.38 0.17 0.00 0.02 0.00 0.00 56.10 55.93 1rjh s TRP 136 Cb -0.16 -1.81 0.81 0.00 -1.15 0.00 0.00 33.47 31.16 1rjh s TRP 136 CO -0.07 -0.01 1.82 1.49 0.02 0.00 0.00 176.95 180.19 1rjh h GLU 137 N 6.23 0.00 -0.83 4.98 4.57 -1.26 -2.45 114.58 125.82 1rjh h GLU 137 Ca -0.34 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.59 1rjh h GLU 137 Cb 1.19 0.00 -0.15 0.00 -0.16 0.00 0.00 28.75 29.63 1rjh h GLU 137 CO 0.56 0.35 0.31 0.25 -1.18 0.00 0.00 179.01 179.30 1rjh n THR 138 N -3.81 2.72 -1.84 0.32 -2.24 -1.26 -4.91 114.28 103.27 1rjh n THR 138 Ca -0.01 -1.48 -0.39 0.00 -2.27 0.00 0.00 64.05 59.89 1rjh n THR 138 Cb 0.43 -0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 1rjh n THR 138 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1rjh s GLU 139 N -2.75 2.63 -0.21 -0.78 2.02 -0.93 -4.95 118.70 113.73 1rjh s GLU 139 Ca 0.49 1.15 -0.06 0.00 0.02 0.00 0.00 54.97 56.57 1rjh s GLU 139 Cb 0.40 -4.41 -0.03 0.00 0.10 0.00 0.00 34.13 30.19 1rjh s GLU 139 CO 0.12 -2.69 0.03 -1.50 0.02 0.00 0.00 175.26 171.24 1rjh s ILE 140 N 9.61 4.19 -1.70 -1.63 2.07 -1.26 -4.98 121.20 127.50 1rjh s ILE 140 Ca 0.82 -0.23 0.16 0.00 -1.41 0.00 0.00 60.65 59.99 1rjh s ILE 140 Cb -0.18 -2.91 0.26 0.00 0.13 0.00 0.00 42.46 39.75 1rjh s ILE 140 CO 0.26 0.41 1.15 0.35 -1.91 0.00 0.00 174.94 175.20 1rjh n THR 141 N 4.34 0.42 -4.37 4.00 -2.24 -1.26 -4.95 114.28 110.23 1rjh n THR 141 Ca -0.17 -0.71 -0.24 0.00 -2.27 0.00 0.00 64.05 60.66 1rjh n THR 141 Cb 0.52 0.98 -0.13 0.00 -2.10 0.00 0.00 70.33 69.60 1rjh n THR 141 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rjh s ALA 142 N -1.19 1.79 -0.18 6.98 0.00 -1.26 -5.11 121.76 122.80 1rjh s ALA 142 Ca 0.25 -1.20 -0.29 0.00 0.00 0.00 0.00 51.96 50.71 1rjh s ALA 142 Cb 0.15 -0.27 -0.00 0.00 0.00 0.00 0.00 23.12 23.00 1rjh s ALA 142 CO 0.21 0.37 1.13 1.14 0.00 0.00 0.00 175.76 178.61 1rjh s GLN 143 N -1.74 4.27 0.00 0.00 0.00 -1.26 -4.97 119.66 115.96 1rjh s GLN 143 Ca 0.07 1.50 0.00 0.00 -0.00 0.00 0.00 55.36 56.92 1rjh s GLN 143 Cb -0.10 -3.67 0.00 0.00 0.00 0.00 0.00 33.01 29.24 1rjh s GLN 143 CO 0.04 -0.62 0.65 -0.35 0.00 0.00 0.00 175.29 175.00 1rjh n PRO 144 N 6.23 0.00 -0.00 9.60 -0.04 -1.26 -4.35 135.00 145.18 1rjh n PRO 144 Ca 0.12 0.35 0.08 0.00 -0.04 0.00 0.00 63.50 64.02 1rjh n PRO 144 Cb 0.46 -1.23 -0.11 0.00 -0.04 0.00 0.00 33.50 32.58 1rjh n PRO 144 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1rjh n ASP 145 N -1.55 0.83 0.00 3.54 5.75 -1.26 -4.91 116.55 118.95 1rjh n ASP 145 Ca 0.00 -0.80 0.00 0.00 -0.01 0.00 0.00 54.79 53.98 1rjh n ASP 145 Cb 0.00 1.11 0.00 0.00 -1.03 0.00 0.00 41.12 41.20 1rjh n ASP 145 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rjh n GLY 146 N 1.42 0.61 0.00 6.12 0.00 -1.26 -4.97 105.19 107.11 1rjh n GLY 146 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1rjh n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rjh n GLY 147 N 0.00 -0.36 3.46 -0.02 0.00 -1.26 -4.90 105.19 102.12 1rjh n GLY 147 Ca 0.00 0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1rjh n GLY 147 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rjh s LYS 148 N 0.00 3.26 0.20 1.61 2.47 -1.26 -4.98 119.74 121.04 1rjh s LYS 148 Ca 0.00 -1.03 -0.01 0.00 -1.56 0.00 0.00 55.97 53.37 1rjh s LYS 148 Cb 0.00 -4.46 -0.04 0.00 -1.46 0.00 0.00 37.83 31.87 1rjh s LYS 148 CO 0.00 -1.85 0.13 0.95 0.16 0.00 0.00 175.35 174.74 1rjh s THR 149 N 3.90 0.00 0.09 3.43 -4.23 -1.26 -4.92 115.64 112.65 1rjh s THR 149 Ca 0.27 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.85 1rjh s THR 149 Cb -0.13 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.18 1rjh s THR 149 CO 0.05 0.00 -0.13 -1.61 -0.54 0.00 0.00 174.62 172.39 1rjh s GLU 150 N -4.15 2.08 0.66 3.99 2.02 -1.26 -5.14 118.70 116.90 1rjh s GLU 150 Ca 0.39 -1.02 0.01 0.00 0.02 0.00 0.00 54.97 54.37 1rjh s GLU 150 Cb 0.07 -2.26 0.10 0.00 0.10 0.00 0.00 34.13 32.13 1rjh s GLU 150 CO 0.12 0.52 0.91 -0.80 0.02 0.00 0.00 175.26 176.03 1rjh s ASN 151 N -1.98 4.69 0.04 -0.19 -0.87 -1.26 -4.68 114.94 110.70 1rjh s ASN 151 Ca 0.19 -0.32 0.00 0.00 -1.57 0.00 0.00 52.86 51.16 1rjh s ASN 151 Cb -0.11 -0.22 0.00 0.00 -0.02 0.00 0.00 41.25 40.90 1rjh s ASN 151 CO 0.11 -1.60 0.00 0.00 -2.57 0.00 0.00 177.10 173.03 1rjh s ALA 153 N -0.12 3.24 0.05 0.00 0.00 -1.25 -3.19 121.76 120.49 1rjh s ALA 153 Ca 0.00 0.42 0.04 0.00 0.00 0.00 0.00 51.96 52.43 1rjh s ALA 153 Cb 0.00 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 1rjh s ALA 153 CO 0.00 -0.13 -0.13 0.08 0.00 0.00 0.00 175.76 175.58 1rjh s VAL 154 N 0.66 0.98 -0.23 0.00 1.01 0.10 -0.46 120.40 122.45 1rjh s VAL 154 Ca 0.46 -1.08 -0.10 0.00 0.00 0.00 0.00 61.98 61.27 1rjh s VAL 154 Cb -0.21 -0.93 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 1rjh s VAL 154 CO 0.26 -0.13 0.14 -0.22 0.00 0.00 0.00 175.10 175.14 1rjh s LEU 155 N -1.36 4.02 -0.43 3.92 0.20 0.20 0.30 118.68 125.53 1rjh s LEU 155 Ca -0.01 0.08 -0.02 0.00 0.69 0.00 0.00 54.13 54.87 1rjh s LEU 155 Cb -0.09 -2.07 0.12 0.00 -0.43 0.00 0.00 46.19 43.72 1rjh s LEU 155 CO 0.01 0.07 0.21 -0.55 -0.29 0.00 0.00 176.35 175.81 1rjh s SER 156 N 1.02 5.15 0.42 3.68 0.15 -1.24 -2.19 113.70 120.69 1rjh s SER 156 Ca 0.07 -2.19 0.23 0.00 0.70 0.00 0.00 55.95 54.77 1rjh s SER 156 Cb -0.13 -1.80 0.63 0.00 -1.71 0.00 0.00 66.02 63.01 1rjh s SER 156 CO 0.04 -0.49 1.70 1.23 1.20 0.00 0.00 173.24 176.92 1rjh h GLY 157 N 7.81 0.00 1.96 9.45 0.00 -1.59 -2.75 103.07 117.94 1rjh h GLY 157 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 1rjh h GLY 157 CO 0.67 0.00 -0.46 0.00 0.00 0.00 0.00 176.54 176.75 1rjh h ALA 158 N 1.82 1.20 0.36 3.60 0.00 -1.75 -3.25 119.26 121.24 1rjh h ALA 158 Ca -0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 1rjh h ALA 158 Cb 0.93 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1rjh h ALA 158 CO 0.02 0.59 -0.17 0.00 0.00 0.00 0.00 179.25 179.69 1rjh h ALA 159 N 1.50 -0.48 0.00 0.00 0.00 -1.88 -3.48 119.26 114.91 1rjh h ALA 159 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1rjh h ALA 159 Cb 0.83 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1rjh h ALA 159 CO 0.06 -0.47 0.00 -1.71 0.00 0.00 0.00 179.25 177.13 1rjh n ASN 160 N -5.10 0.00 0.00 0.00 4.05 -1.14 -5.01 115.26 108.06 1rjh n ASN 160 Ca -0.07 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.96 1rjh n ASN 160 Cb 0.23 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.24 1rjh n ASN 160 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1rjh n GLY 161 N -0.52 -0.12 3.90 8.20 0.00 -1.05 -4.93 105.19 110.67 1rjh n GLY 161 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1rjh n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rjh s LYS 162 N 0.00 2.37 0.19 1.61 3.01 -1.26 -4.89 119.74 120.77 1rjh s LYS 162 Ca 0.00 0.19 -0.18 0.00 -1.01 0.00 0.00 55.97 54.97 1rjh s LYS 162 Cb 0.00 -2.02 -0.08 0.00 -1.01 0.00 0.00 37.83 34.72 1rjh s LYS 162 CO 0.00 -1.30 0.66 -1.58 0.51 0.00 0.00 175.35 173.65 1rjh s TRP 163 N -3.43 3.65 0.34 3.18 0.51 -1.10 -3.63 118.94 118.46 1rjh s TRP 163 Ca 0.60 1.29 0.05 0.00 -2.12 0.00 0.00 56.10 55.91 1rjh s TRP 163 Cb -0.11 -2.54 -0.03 0.00 -0.81 0.00 0.00 33.47 29.98 1rjh s TRP 163 CO 0.49 0.38 0.20 -0.06 -0.51 0.00 0.00 176.95 177.45 1rjh s PHE 164 N -1.47 1.69 0.23 -1.98 0.40 0.15 -0.75 117.98 116.24 1rjh s PHE 164 Ca 0.40 -1.46 0.10 0.00 -0.60 0.00 0.00 56.93 55.37 1rjh s PHE 164 Cb -0.16 -0.87 -0.04 0.00 0.51 0.00 0.00 43.02 42.45 1rjh s PHE 164 CO 0.20 -0.60 -0.10 0.16 0.70 0.00 0.00 175.22 175.59 1rjh s ASP 165 N -3.43 4.15 0.01 1.36 -4.77 -1.26 0.02 116.67 112.75 1rjh s ASP 165 Ca 0.34 -0.72 -0.00 0.00 -3.30 0.00 0.00 52.55 48.88 1rjh s ASP 165 Cb 0.03 -0.64 0.00 0.00 -1.09 0.00 0.00 42.92 41.23 1rjh s ASP 165 CO 0.20 0.06 0.02 1.17 0.70 0.00 0.00 175.17 177.33 1rjh n LYS 166 N -0.39 0.03 -2.68 2.11 4.81 -1.19 -4.86 118.16 116.00 1rjh n LYS 166 Ca -0.08 -0.10 -0.43 0.00 -0.87 0.00 0.00 58.31 56.83 1rjh n LYS 166 Cb 0.58 0.11 -0.02 0.00 0.02 0.00 0.00 35.03 35.71 1rjh n LYS 166 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1rjh s ARG 167 N -2.02 4.34 0.59 1.64 0.52 -1.26 -4.06 118.95 118.70 1rjh s ARG 167 Ca 0.01 1.36 0.29 0.00 -0.52 0.00 0.00 55.73 56.88 1rjh s ARG 167 Cb -0.00 -3.59 1.75 0.00 0.52 0.00 0.00 34.95 33.63 1rjh s ARG 167 CO 0.01 -0.47 2.18 0.00 0.02 0.00 0.00 175.30 177.04 1rjh n ARG 169 N -3.81 2.12 -2.85 0.00 0.63 -1.26 -1.50 116.66 109.99 1rjh n ARG 169 Ca -0.01 -1.73 -0.41 0.00 -0.92 0.00 0.00 57.85 54.78 1rjh n ARG 169 Cb 0.20 -1.40 -0.04 0.00 0.45 0.00 0.00 32.46 31.67 1rjh n ARG 169 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1rjh s ASP 170 N -1.12 7.27 -0.70 6.15 -1.08 -0.06 -4.81 116.67 122.32 1rjh s ASP 170 Ca 0.34 1.53 -0.19 0.00 -0.52 0.00 0.00 52.55 53.70 1rjh s ASP 170 Cb 0.18 -2.51 0.12 0.00 -1.46 0.00 0.00 42.92 39.24 1rjh s ASP 170 CO 0.24 -0.13 0.85 -1.10 0.52 0.00 0.00 175.17 175.55 1rjh s GLN 171 N 0.54 3.23 0.27 4.34 -0.21 -1.26 -4.10 119.66 122.48 1rjh s GLN 171 Ca 0.45 -1.45 0.07 0.00 0.02 0.00 0.00 55.36 54.45 1rjh s GLN 171 Cb -0.21 -4.42 -0.06 0.00 1.00 0.00 0.00 33.01 29.33 1rjh s GLN 171 CO 0.25 -1.62 -0.06 -0.48 -2.12 0.00 0.00 175.29 171.26 1rjh s LEU 172 N 2.68 2.48 0.00 2.90 0.05 -1.07 -4.47 118.68 121.25 1rjh s LEU 172 Ca 0.19 -1.18 -0.19 0.00 0.05 0.00 0.00 54.13 53.00 1rjh s LEU 172 Cb -0.17 -0.63 0.28 0.00 -2.05 0.00 0.00 46.19 43.62 1rjh s LEU 172 CO 0.02 -0.33 0.88 -2.65 -0.55 0.00 0.00 176.35 173.72 1rjh n PRO 173 N -0.56 -3.31 -3.77 1.48 -0.02 -1.20 -2.11 135.00 125.51 1rjh n PRO 173 Ca -0.06 -1.42 -0.08 0.00 -2.02 0.00 0.00 63.50 59.92 1rjh n PRO 173 Cb 0.63 -1.46 -0.02 0.00 -0.02 0.00 0.00 33.50 32.63 1rjh n PRO 173 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1rjh s TYR 174 N -2.48 -0.25 -0.05 6.00 1.13 -0.21 -3.48 117.35 118.01 1rjh s TYR 174 Ca 0.60 -0.15 0.03 0.00 -1.41 0.00 0.00 57.07 56.14 1rjh s TYR 174 Cb -0.07 0.68 0.00 0.00 -1.10 0.00 0.00 41.96 41.47 1rjh s TYR 174 CO 0.47 -1.14 -0.15 0.42 -2.51 0.00 0.00 175.55 172.65 1rjh s ILE 175 N -3.84 1.27 -0.08 -3.49 1.09 -1.26 -4.43 121.20 110.46 1rjh s ILE 175 Ca 0.09 -0.60 0.00 0.00 -1.10 0.00 0.00 60.65 59.04 1rjh s ILE 175 Cb -0.05 -1.11 -0.03 0.00 -1.06 0.00 0.00 42.46 40.21 1rjh s ILE 175 CO 0.03 0.38 -0.06 0.00 -0.10 0.00 0.00 174.94 175.18 1rjh s GLN 177 N -0.73 3.31 -0.07 0.00 -0.21 0.30 -4.79 119.66 117.47 1rjh s GLN 177 Ca 0.11 -0.44 0.04 0.00 0.02 0.00 0.00 55.36 55.09 1rjh s GLN 177 Cb -0.11 -3.92 -0.01 0.00 1.00 0.00 0.00 33.01 29.96 1rjh s GLN 177 CO 0.02 -0.87 -0.20 -0.59 -2.12 0.00 0.00 175.29 171.52 1rjh s PHE 178 N 2.50 2.57 0.00 0.91 -0.71 -1.26 -1.99 117.98 119.99 1rjh s PHE 178 Ca 0.18 -0.61 0.00 0.00 -1.04 0.00 0.00 56.93 55.46 1rjh s PHE 178 Cb -0.15 -1.66 0.00 0.00 -1.21 0.00 0.00 43.02 40.00 1rjh s PHE 178 CO 0.16 -0.14 0.00 0.41 -1.34 0.00 0.00 175.22 174.30 1rjh n GLY 179 N 2.96 1.78 1.86 1.99 0.00 -1.26 -5.09 105.19 107.43 1rjh n GLY 179 Ca -0.18 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1rjh n GLY 179 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1rjh n ILE 180 N 0.00 0.00 0.00 -0.61 3.06 -1.26 -5.06 119.36 115.49 1rjh n ILE 180 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1rjh n ILE 180 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1rjh n ILE 180 CO 0.00 0.00 0.00 0.55 -2.50 0.00 0.00 176.55 174.60