#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 0.27 -1.69 4.37 -2.24 -1.26 -0.72 114.28 113.00 1rjh n THR 65 Ca 0.00 0.07 -0.44 0.00 -2.27 0.00 0.00 64.05 61.40 1rjh n THR 65 Cb 0.00 -0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 67.44 1rjh n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rjh n GLN 66 N -1.18 2.41 -3.39 -0.78 6.02 -1.26 -4.34 117.38 114.87 1rjh n GLN 66 Ca 0.11 0.87 -0.38 0.00 -0.01 0.00 0.00 57.00 57.59 1rjh n GLN 66 Cb 0.12 -2.68 -0.07 0.00 1.02 0.00 0.00 30.24 28.63 1rjh n GLN 66 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1rjh s THR 67 N 1.24 5.20 0.24 5.09 -4.23 -1.26 -3.75 115.64 118.18 1rjh s THR 67 Ca 0.78 0.72 -0.21 0.00 -1.18 0.00 0.00 61.69 61.80 1rjh s THR 67 Cb -0.61 -3.73 0.06 0.00 1.34 0.00 0.00 72.50 69.56 1rjh s THR 67 CO 0.36 0.26 0.89 -1.59 -0.54 0.00 0.00 174.62 174.01 1rjh s LYS 68 N 1.25 1.58 0.78 3.99 0.00 -1.04 -4.78 119.74 121.52 1rjh s LYS 68 Ca 0.19 -0.95 -0.12 0.00 0.00 0.00 0.00 55.97 55.09 1rjh s LYS 68 Cb -0.15 0.49 0.06 0.00 0.00 0.00 0.00 37.83 38.23 1rjh s LYS 68 CO 0.08 -0.73 1.11 0.95 0.00 0.00 0.00 175.35 176.76 1rjh s THR 69 N -2.90 2.94 0.21 3.79 -4.23 -1.26 -2.33 115.64 111.86 1rjh s THR 69 Ca 0.15 0.31 -0.10 0.00 -1.18 0.00 0.00 61.69 60.87 1rjh s THR 69 Cb -0.03 -3.19 0.14 0.00 1.34 0.00 0.00 72.50 70.75 1rjh s THR 69 CO 0.06 -0.40 1.81 0.15 -0.54 0.00 0.00 174.62 175.70 1rjh h PHE 70 N -0.96 0.66 -0.34 3.99 3.57 -1.41 0.25 116.94 122.71 1rjh h PHE 70 Ca -0.46 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.03 1rjh h PHE 70 Cb 1.28 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.80 1rjh h PHE 70 CO 0.44 0.32 0.10 1.25 -2.23 0.00 0.00 178.31 178.18 1rjh h HIS 71 N 0.67 0.55 -0.36 0.41 2.76 -1.93 -0.25 115.15 116.99 1rjh h HIS 71 Ca 0.29 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.39 1rjh h HIS 71 Cb 0.18 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 28.97 1rjh h HIS 71 CO -0.08 0.55 0.18 0.93 -1.30 0.00 0.00 177.93 178.21 1rjh h GLU 72 N 0.39 0.52 -0.84 5.26 5.08 -1.83 -2.56 114.58 120.61 1rjh h GLU 72 Ca 0.11 -0.08 0.09 0.00 -1.00 0.00 0.00 59.36 58.49 1rjh h GLU 72 Cb 0.26 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.35 1rjh h GLU 72 CO -0.00 0.47 0.48 0.00 -1.00 0.00 0.00 179.01 178.96 1rjh h ALA 73 N 1.03 1.19 0.90 3.43 0.00 -0.17 0.12 119.26 125.76 1rjh h ALA 73 Ca 0.13 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1rjh h ALA 73 Cb 0.12 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1rjh h ALA 73 CO -0.02 0.11 -0.43 0.77 0.00 0.00 0.00 179.25 179.68 1rjh h SER 74 N 0.81 -1.03 0.91 0.00 0.02 -0.75 -2.25 113.55 111.27 1rjh h SER 74 Ca 0.40 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 1rjh h SER 74 Cb 0.36 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.17 1rjh h SER 74 CO -0.24 -0.73 0.00 1.05 -1.14 0.00 0.00 176.83 175.77 1rjh h GLU 75 N -1.22 0.00 0.00 3.45 4.11 -1.19 -1.97 114.58 117.76 1rjh h GLU 75 Ca -0.12 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.31 1rjh h GLU 75 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1rjh h GLU 75 CO 0.20 0.00 -0.00 0.22 0.07 0.00 0.00 179.01 179.50 1rjh h ASP 76 N 0.00 -0.00 0.09 3.06 3.58 -0.56 -1.32 116.42 121.28 1rjh h ASP 76 Ca 0.00 -0.76 -0.09 0.00 0.42 0.00 0.00 57.03 56.61 1rjh h ASP 76 Cb 0.46 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 1rjh h ASP 76 CO 0.00 0.76 -0.29 0.00 -2.88 0.00 0.00 179.24 176.83 1rjh h ILE 78 N 0.27 1.22 0.00 0.00 5.03 -1.11 -1.32 117.51 121.61 1rjh h ILE 78 Ca 0.04 -0.42 0.00 0.00 -0.12 0.00 0.00 64.86 64.36 1rjh h ILE 78 Cb 0.65 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.45 1rjh h ILE 78 CO 0.05 0.22 0.00 -1.54 -0.68 0.00 0.00 178.15 176.19 1rjh n SER 79 N -4.49 0.17 0.10 1.72 3.41 -0.50 -1.90 113.62 112.13 1rjh n SER 79 Ca 0.09 0.52 0.13 0.00 -0.26 0.00 0.00 58.87 59.34 1rjh n SER 79 Cb 0.02 -0.56 0.43 0.00 -0.26 0.00 0.00 64.21 63.84 1rjh n SER 79 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1rjh n ARG 80 N -1.66 0.23 0.00 4.33 5.12 -0.53 -4.91 116.66 119.23 1rjh n ARG 80 Ca 0.06 0.22 0.00 0.00 -1.93 0.00 0.00 57.85 56.21 1rjh n ARG 80 Cb 0.35 -1.78 0.00 0.00 -1.16 0.00 0.00 32.46 29.86 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 1.15 1.22 0.00 -0.13 0.00 -0.80 -5.08 105.19 101.55 1rjh n GLY 81 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.20 0.96 3.62 -0.02 0.00 -0.98 -5.04 105.19 103.54 1rjh n GLY 82 Ca 0.00 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.13 1rjh n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rjh s THR 83 N -2.11 1.82 0.88 2.61 -4.23 -1.26 -2.62 115.64 110.72 1rjh s THR 83 Ca 0.00 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.40 1rjh s THR 83 Cb 0.00 -2.87 0.12 0.00 1.34 0.00 0.00 72.50 71.08 1rjh s THR 83 CO 0.00 0.00 1.10 -0.76 -0.54 0.00 0.00 174.62 174.42 1rjh s LEU 84 N -3.71 2.57 -0.46 4.79 1.02 -1.26 0.42 118.68 122.04 1rjh s LEU 84 Ca 0.31 1.79 -0.28 0.00 0.02 0.00 0.00 54.13 55.97 1rjh s LEU 84 Cb 0.09 -4.26 0.00 0.00 0.02 0.00 0.00 46.19 42.04 1rjh s LEU 84 CO 0.16 -2.66 1.52 -0.94 0.02 0.00 0.00 176.35 174.46 1rjh s SER 85 N -3.16 6.09 -0.38 2.29 1.04 -1.08 -4.27 113.70 114.24 1rjh s SER 85 Ca 0.64 0.70 -0.06 0.00 0.48 0.00 0.00 55.95 57.71 1rjh s SER 85 Cb -0.19 -2.54 0.07 0.00 0.10 0.00 0.00 66.02 63.46 1rjh s SER 85 CO 0.57 -1.66 0.16 0.42 0.98 0.00 0.00 173.24 173.72 1rjh s THR 86 N 6.22 3.66 0.08 2.02 -4.23 -1.26 -4.48 115.64 117.66 1rjh s THR 86 Ca 0.62 -1.50 -0.21 0.00 -1.18 0.00 0.00 61.69 59.43 1rjh s THR 86 Cb -0.14 -3.24 -0.07 0.00 1.34 0.00 0.00 72.50 70.39 1rjh s THR 86 CO 0.29 -0.40 0.62 -2.16 -0.54 0.00 0.00 174.62 172.43 1rjh s PRO 87 N 1.32 4.30 0.00 3.99 0.04 -1.26 -4.95 135.00 138.44 1rjh s PRO 87 Ca 0.02 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.89 1rjh s PRO 87 Cb -0.22 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.07 1rjh s PRO 87 CO 0.00 0.58 0.57 0.00 0.04 0.00 0.00 177.00 178.19 1rjh n GLN 88 N 1.84 0.62 -4.16 4.56 10.64 -1.26 -4.92 117.38 124.71 1rjh n GLN 88 Ca -0.09 -0.68 -0.11 0.00 -1.83 0.00 0.00 57.00 54.29 1rjh n GLN 88 Cb 0.50 -0.62 -0.09 0.00 -0.86 0.00 0.00 30.24 29.17 1rjh n GLN 88 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 1rjh s THR 89 N -0.21 0.03 0.16 -0.39 -4.23 -1.26 -2.72 115.64 107.02 1rjh s THR 89 Ca 0.00 -1.89 -0.13 0.00 -1.18 0.00 0.00 61.69 58.49 1rjh s THR 89 Cb 0.00 -2.33 0.05 0.00 1.34 0.00 0.00 72.50 71.57 1rjh s THR 89 CO 0.00 -0.13 1.74 1.23 -0.54 0.00 0.00 174.62 176.92 1rjh h GLY 90 N 2.64 0.83 1.46 3.99 0.00 -1.98 -1.38 103.07 108.64 1rjh h GLY 90 Ca -0.35 -0.42 0.01 0.00 0.00 0.00 0.00 47.33 46.57 1rjh h GLY 90 CO 0.52 0.40 0.36 1.76 0.00 0.00 0.00 176.54 179.59 1rjh h SER 91 N 0.72 0.63 0.25 0.19 0.02 -1.99 0.11 113.55 113.48 1rjh h SER 91 Ca 0.18 -0.02 -0.24 0.00 -0.84 0.00 0.00 61.79 60.87 1rjh h SER 91 Cb 0.14 -0.16 0.01 0.00 0.14 0.00 0.00 62.40 62.53 1rjh h SER 91 CO -0.02 0.45 -1.00 -0.33 -1.14 0.00 0.00 176.83 174.80 1rjh h GLU 92 N 0.74 0.49 -0.37 3.45 5.08 -1.89 -2.25 114.58 119.83 1rjh h GLU 92 Ca 0.20 -0.54 -0.12 0.00 -1.00 0.00 0.00 59.36 57.90 1rjh h GLU 92 Cb -0.08 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1rjh h GLU 92 CO -0.04 1.18 -0.25 -0.97 -1.00 0.00 0.00 179.01 177.93 1rjh h ASN 93 N 0.27 0.86 -0.46 1.42 -1.24 -0.59 -2.18 115.58 113.65 1rjh h ASN 93 Ca -0.10 -0.43 -0.03 0.00 0.71 0.00 0.00 56.30 56.45 1rjh h ASN 93 Cb 1.64 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 40.43 1rjh h ASN 93 CO 0.18 1.10 0.18 -0.78 -1.29 0.00 0.00 177.43 176.83 1rjh h ASP 94 N 0.62 0.68 -0.16 1.15 3.58 -0.85 -2.38 116.42 119.06 1rjh h ASP 94 Ca 0.07 -0.09 -0.08 0.00 0.42 0.00 0.00 57.03 57.35 1rjh h ASP 94 Cb 0.81 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.67 1rjh h ASP 94 CO 0.07 0.64 -0.15 0.00 -2.88 0.00 0.00 179.24 176.91 1rjh h ALA 95 N 1.47 1.16 0.00 -0.78 0.00 -1.10 0.24 119.26 120.24 1rjh h ALA 95 Ca 0.17 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1rjh h ALA 95 Cb 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1rjh h ALA 95 CO -0.01 0.53 0.00 1.28 0.00 0.00 0.00 179.25 181.05 1rjh n LEU 96 N -4.17 0.00 -0.10 0.00 4.77 -0.85 0.66 117.00 117.30 1rjh n LEU 96 Ca 0.00 0.25 -0.17 0.00 -0.03 0.00 0.00 56.01 56.07 1rjh n LEU 96 Cb 0.35 -0.25 -0.13 0.00 -2.33 0.00 0.00 43.42 41.06 1rjh n LEU 96 CO 0.41 -0.02 -1.20 0.00 -1.33 0.00 0.00 177.39 175.25 1rjh n TYR 97 N -1.25 0.22 -0.05 -1.77 9.36 -0.71 -4.03 117.16 118.94 1rjh n TYR 97 Ca 0.14 0.05 -0.11 0.00 3.32 0.00 0.00 57.90 61.31 1rjh n TYR 97 Cb 0.21 -1.03 -0.10 0.00 -0.63 0.00 0.00 39.34 37.79 1rjh n TYR 97 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 1rjh h GLU 98 N 0.01 -0.02 -0.44 2.98 4.57 -0.22 -0.97 114.58 120.49 1rjh h GLU 98 Ca -0.54 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 57.61 1rjh h GLU 98 Cb 1.99 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 30.56 1rjh h GLU 98 CO -0.03 0.68 0.13 -0.92 -1.18 0.00 0.00 179.01 177.69 1rjh h TYR 99 N -0.95 0.65 -0.28 0.92 3.20 -0.01 -0.86 116.97 119.64 1rjh h TYR 99 Ca -0.00 -0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.86 1rjh h TYR 99 Cb 0.71 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.76 1rjh h TYR 99 CO 0.19 0.54 0.10 1.25 -1.64 0.00 0.00 178.16 178.61 1rjh h LEU 100 N 0.63 0.13 -2.49 2.82 5.85 -1.65 -0.78 115.31 119.82 1rjh h LEU 100 Ca 0.15 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1rjh h LEU 100 Cb 0.20 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1rjh h LEU 100 CO -0.01 0.11 0.00 -0.09 -0.34 0.00 0.00 178.44 178.11 1rjh h ARG 101 N 0.23 0.00 -0.30 1.25 1.12 0.17 0.23 114.38 117.09 1rjh h ARG 101 Ca 0.12 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.99 1rjh h ARG 101 Cb 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.04 1rjh h ARG 101 CO -0.11 0.00 0.00 0.00 -3.11 0.00 0.00 179.97 176.75 1rjh n GLN 102 N -3.05 2.43 0.06 0.20 10.64 -0.62 -4.47 117.38 122.58 1rjh n GLN 102 Ca -0.02 -1.91 0.00 0.00 -1.83 0.00 0.00 57.00 53.25 1rjh n GLN 102 Cb 0.14 -1.27 0.00 0.00 -0.86 0.00 0.00 30.24 28.25 1rjh n GLN 102 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1rjh n SER 103 N 0.58 0.04 0.05 2.61 7.64 -0.36 -4.90 113.62 119.27 1rjh n SER 103 Ca 0.11 0.20 -0.05 0.00 1.01 0.00 0.00 58.87 60.14 1rjh n SER 103 Cb 0.41 0.13 -0.10 0.00 -1.01 0.00 0.00 64.21 63.64 1rjh n SER 103 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1rjh h VAL 104 N 0.00 1.23 0.00 0.44 2.07 -1.33 -3.49 116.25 115.17 1rjh h VAL 104 Ca 0.00 -2.89 0.00 0.00 0.82 0.00 0.00 66.70 64.63 1rjh h VAL 104 Cb 0.00 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1rjh h VAL 104 CO 0.00 0.70 0.00 0.61 0.02 0.00 0.00 177.57 178.90 1rjh n GLY 105 N 1.38 0.02 0.00 2.17 0.00 0.66 -4.89 105.19 104.54 1rjh n GLY 105 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1rjh n GLY 105 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rjh n ASN 106 N 0.00 0.00 -2.41 1.61 6.94 -1.24 -3.93 115.26 116.23 1rjh n ASN 106 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 54.58 54.26 1rjh n ASN 106 Cb 0.00 0.00 0.02 0.00 -2.36 0.00 0.00 39.78 37.44 1rjh n ASN 106 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 1rjh n GLU 107 N 0.00 3.25 -4.48 -3.83 0.28 -1.26 -3.81 120.64 110.79 1rjh n GLU 107 Ca 0.00 -4.05 -0.30 0.00 -0.16 0.00 0.00 57.16 52.64 1rjh n GLU 107 Cb 0.00 -2.27 -0.12 0.00 1.43 0.00 0.00 31.44 30.49 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 -3.70 2.72 -0.13 -1.84 0.00 -1.26 -4.00 121.76 113.55 1rjh s ALA 108 Ca 0.52 -1.22 -0.15 0.00 0.00 0.00 0.00 51.96 51.11 1rjh s ALA 108 Cb 0.43 -0.79 -0.05 0.00 0.00 0.00 0.00 23.12 22.71 1rjh s ALA 108 CO -0.14 0.59 0.36 -1.21 0.00 0.00 0.00 175.76 175.36 1rjh s GLU 109 N -1.72 4.25 0.05 0.00 8.01 -1.25 -2.63 118.70 125.40 1rjh s GLU 109 Ca 0.17 0.24 0.07 0.00 0.01 0.00 0.00 54.97 55.45 1rjh s GLU 109 Cb -0.11 -3.41 -0.03 0.00 -4.31 0.00 0.00 34.13 26.28 1rjh s GLU 109 CO 0.08 0.25 -0.20 0.42 0.01 0.00 0.00 175.26 175.83 1rjh s ILE 110 N 0.38 1.57 0.15 -1.63 1.09 -0.92 -3.89 121.20 117.95 1rjh s ILE 110 Ca 0.20 -1.19 -0.30 0.00 -1.10 0.00 0.00 60.65 58.26 1rjh s ILE 110 Cb -0.14 -1.38 -0.08 0.00 -1.06 0.00 0.00 42.46 39.80 1rjh s ILE 110 CO 0.07 0.15 1.29 0.26 -0.10 0.00 0.00 174.94 176.61 1rjh s TRP 111 N -0.84 3.32 -1.92 3.97 0.52 -1.26 -0.11 118.94 122.63 1rjh s TRP 111 Ca 0.06 1.20 0.12 0.00 0.02 0.00 0.00 56.10 57.50 1rjh s TRP 111 Cb -0.09 -3.56 0.35 0.00 -1.15 0.00 0.00 33.47 29.02 1rjh s TRP 111 CO 0.02 -1.78 1.28 1.28 0.02 0.00 0.00 176.95 177.77 1rjh n LEU 112 N 3.19 2.16 -2.55 2.99 4.77 -1.07 -4.70 117.00 121.79 1rjh n LEU 112 Ca 0.08 -1.08 -0.17 0.00 -0.03 0.00 0.00 56.01 54.80 1rjh n LEU 112 Cb 0.44 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1rjh n LEU 112 CO 0.57 0.51 -0.18 0.61 -1.33 0.00 0.00 177.39 177.58 1rjh n GLY 113 N 1.07 -0.50 3.02 -0.72 0.00 -1.26 -4.33 105.19 102.47 1rjh n GLY 113 Ca 0.13 0.02 -0.17 0.00 0.00 0.00 0.00 46.02 46.00 1rjh n GLY 113 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1rjh s LEU 114 N -5.94 2.06 -0.17 0.99 2.34 -1.26 -2.01 118.68 114.69 1rjh s LEU 114 Ca 0.06 -0.21 -0.19 0.00 0.06 0.00 0.00 54.13 53.84 1rjh s LEU 114 Cb -0.03 -0.38 0.05 0.00 -0.56 0.00 0.00 46.19 45.28 1rjh s LEU 114 CO 0.07 0.05 0.52 0.54 -1.06 0.00 0.00 176.35 176.47 1rjh s ASN 115 N -0.43 -0.53 -0.16 1.48 4.22 -0.47 -4.39 114.94 114.65 1rjh s ASN 115 Ca 0.01 0.96 0.02 0.00 -2.14 0.00 0.00 52.86 51.70 1rjh s ASN 115 Cb -0.04 0.97 0.02 0.00 1.28 0.00 0.00 41.25 43.48 1rjh s ASN 115 CO -0.00 -0.24 -0.20 -0.62 -2.04 0.00 0.00 177.10 174.00 1rjh s ASP 116 N 0.03 3.10 0.00 3.54 2.15 -1.26 -2.82 116.67 121.41 1rjh s ASP 116 Ca -0.02 -0.63 0.00 0.00 0.43 0.00 0.00 52.55 52.33 1rjh s ASP 116 Cb -0.04 -1.45 0.00 0.00 -0.30 0.00 0.00 42.92 41.13 1rjh s ASP 116 CO 0.02 0.03 0.00 1.15 -0.17 0.00 0.00 175.17 176.19 1rjh n MET 117 N 4.43 2.61 0.03 4.34 0.00 -1.26 -4.80 117.12 122.46 1rjh n MET 117 Ca -0.20 0.00 -0.01 0.00 0.00 0.00 0.00 57.70 57.48 1rjh n MET 117 Cb 0.51 -0.73 -0.00 0.00 0.00 0.00 0.00 33.22 32.99 1rjh n MET 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1rjh n ALA 118 N -0.88 2.73 -1.52 3.17 0.00 -1.26 -4.77 120.51 117.98 1rjh n ALA 118 Ca 0.00 -0.11 -0.41 0.00 0.00 0.00 0.00 53.44 52.92 1rjh n ALA 118 Cb 0.00 0.23 -0.02 0.00 0.00 0.00 0.00 19.45 19.66 1rjh n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rjh n ALA 119 N -3.61 5.15 -1.57 0.00 0.00 -1.26 -4.90 120.51 114.32 1rjh n ALA 119 Ca -0.02 -3.65 -0.42 0.00 0.00 0.00 0.00 53.44 49.35 1rjh n ALA 119 Cb 0.08 -3.53 -0.04 0.00 0.00 0.00 0.00 19.45 15.96 1rjh n ALA 119 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1rjh n GLU 120 N 6.04 1.57 0.00 0.00 1.02 -1.26 -0.98 120.64 127.03 1rjh n GLU 120 Ca 0.53 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 1rjh n GLU 120 Cb 0.37 -3.18 0.00 0.00 -0.02 0.00 0.00 31.44 28.61 1rjh n GLU 120 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rjh n GLY 121 N 5.95 0.97 2.59 0.62 0.00 -1.26 -5.08 105.19 108.98 1rjh n GLY 121 Ca 0.34 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.10 1rjh n GLY 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rjh s THR 122 N -1.48 -0.13 0.30 2.61 -4.23 -0.15 -5.13 115.64 107.43 1rjh s THR 122 Ca 0.00 -0.62 -0.29 0.00 -1.18 0.00 0.00 61.69 59.60 1rjh s THR 122 Cb 0.00 -0.92 -0.10 0.00 1.34 0.00 0.00 72.50 72.82 1rjh s THR 122 CO 0.00 -0.62 1.43 0.26 -0.54 0.00 0.00 174.62 175.16 1rjh s TRP 123 N 2.15 2.91 -0.09 3.99 0.52 -1.26 -4.73 118.94 122.43 1rjh s TRP 123 Ca 0.08 1.12 -0.01 0.00 0.02 0.00 0.00 56.10 57.31 1rjh s TRP 123 Cb -0.16 -3.86 -0.03 0.00 -1.15 0.00 0.00 33.47 28.27 1rjh s TRP 123 CO -0.32 -2.64 -0.02 0.54 0.02 0.00 0.00 176.95 174.53 1rjh s VAL 124 N -0.52 4.14 0.65 4.03 0.11 -1.13 -3.48 120.40 124.20 1rjh s VAL 124 Ca 0.56 -0.31 0.06 0.00 -2.93 0.00 0.00 61.98 59.36 1rjh s VAL 124 Cb -0.43 -2.74 0.12 0.00 -1.53 0.00 0.00 36.38 31.80 1rjh s VAL 124 CO 0.50 0.59 0.89 -0.90 -3.33 0.00 0.00 175.10 172.86 1rjh n ASP 125 N 2.28 1.81 0.10 3.54 5.75 0.07 -1.37 116.55 128.74 1rjh n ASP 125 Ca -0.18 -2.39 -0.02 0.00 -0.01 0.00 0.00 54.79 52.19 1rjh n ASP 125 Cb 0.53 -0.52 0.22 0.00 -1.03 0.00 0.00 41.12 40.32 1rjh n ASP 125 CO 0.00 0.00 0.00 0.24 -0.11 0.00 0.00 177.20 177.33 1rjh h MET 126 N 0.00 0.23 -0.00 0.11 2.86 -1.73 -2.41 114.93 113.98 1rjh h MET 126 Ca -0.30 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.23 1rjh h MET 126 Cb 1.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.91 1rjh h MET 126 CO 0.38 0.62 -0.03 -2.37 1.06 0.00 0.00 176.91 176.57 1rjh n THR 127 N -4.01 0.00 -0.62 2.22 5.66 -1.26 -4.89 114.28 111.38 1rjh n THR 127 Ca -0.02 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 1rjh n THR 127 Cb 0.49 -0.41 0.00 0.00 -1.55 0.00 0.00 70.33 68.86 1rjh n THR 127 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rjh n GLY 128 N 1.27 1.12 3.34 1.09 0.00 -0.91 -5.11 105.19 106.00 1rjh n GLY 128 Ca 0.15 -0.19 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.20 1.95 -0.23 4.61 0.00 -1.26 -4.93 121.76 119.71 1rjh s ALA 129 Ca 0.00 -1.70 -0.11 0.00 0.00 0.00 0.00 51.96 50.14 1rjh s ALA 129 Cb 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 1rjh s ALA 129 CO 0.00 -0.05 0.19 1.03 0.00 0.00 0.00 175.76 176.93 1rjh s ARG 130 N -3.72 4.11 0.11 0.00 3.00 -1.26 -0.75 118.95 120.45 1rjh s ARG 130 Ca 0.24 -0.19 -0.31 0.00 0.00 0.00 0.00 55.73 55.47 1rjh s ARG 130 Cb 0.02 -3.51 -0.10 0.00 0.00 0.00 0.00 34.95 31.36 1rjh s ARG 130 CO 0.07 0.10 1.72 0.96 0.00 0.00 0.00 175.30 178.15 1rjh s ILE 131 N 0.94 2.70 -0.40 1.52 -0.00 -1.23 -4.87 121.20 119.86 1rjh s ILE 131 Ca 0.09 0.27 0.23 0.00 -0.00 0.00 0.00 60.65 61.24 1rjh s ILE 131 Cb -0.13 -3.17 0.21 0.00 -0.00 0.00 0.00 42.46 39.36 1rjh s ILE 131 CO 0.04 0.00 1.42 0.00 -0.00 0.00 0.00 174.94 176.40 1rjh h ALA 132 N 8.11 0.81 -3.44 2.27 0.00 -1.95 -3.43 119.26 121.63 1rjh h ALA 132 Ca -0.44 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 53.81 1rjh h ALA 132 Cb 1.21 0.00 -0.36 0.00 0.00 0.00 0.00 17.79 18.64 1rjh h ALA 132 CO 0.94 0.00 -0.83 -0.47 0.00 0.00 0.00 179.25 178.89 1rjh s TYR 133 N -3.25 2.95 -0.09 0.00 5.04 -1.10 -5.05 117.35 115.84 1rjh s TYR 133 Ca 0.05 -1.93 -0.04 0.00 -2.44 0.00 0.00 57.07 52.71 1rjh s TYR 133 Cb 0.07 -1.90 0.05 0.00 0.35 0.00 0.00 41.96 40.54 1rjh s TYR 133 CO 0.71 -0.83 0.18 -1.59 -1.34 0.00 0.00 175.55 172.67 1rjh s LYS 134 N 1.22 0.05 -0.22 4.97 0.00 -1.26 -4.58 119.74 119.92 1rjh s LYS 134 Ca -0.02 0.59 0.01 0.00 0.00 0.00 0.00 55.97 56.55 1rjh s LYS 134 Cb -0.16 -0.23 0.06 0.00 0.00 0.00 0.00 37.83 37.49 1rjh s LYS 134 CO -0.09 -0.30 -0.06 0.54 0.00 0.00 0.00 175.35 175.44 1rjh s ASN 135 N 2.30 3.69 -0.24 0.03 4.22 -1.26 -5.10 114.94 118.58 1rjh s ASN 135 Ca 0.03 -1.09 -0.04 0.00 -2.14 0.00 0.00 52.86 49.62 1rjh s ASN 135 Cb -0.12 -1.16 -0.00 0.00 1.28 0.00 0.00 41.25 41.25 1rjh s ASN 135 CO -0.06 -0.22 -0.02 0.26 -2.04 0.00 0.00 177.10 175.02 1rjh s TRP 136 N 1.42 3.01 0.12 1.54 0.52 -1.26 -1.10 118.94 123.20 1rjh s TRP 136 Ca -0.05 -1.00 -0.13 0.00 0.02 0.00 0.00 56.10 54.94 1rjh s TRP 136 Cb -0.18 -2.13 -0.07 0.00 -1.15 0.00 0.00 33.47 29.94 1rjh s TRP 136 CO -0.07 -0.57 1.44 1.49 0.02 0.00 0.00 176.95 179.27 1rjh h GLU 137 N 8.12 0.82 -0.78 4.98 4.57 -1.74 -3.05 114.58 127.51 1rjh h GLU 137 Ca -0.38 -0.45 -0.12 0.00 -1.18 0.00 0.00 59.36 57.23 1rjh h GLU 137 Cb 1.15 0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 29.69 1rjh h GLU 137 CO 0.60 1.08 0.16 0.25 -1.18 0.00 0.00 179.01 179.92 1rjh n THR 138 N -4.15 2.29 -2.12 0.32 -2.24 -1.26 -4.88 114.28 102.25 1rjh n THR 138 Ca -0.03 -1.19 -0.40 0.00 -2.27 0.00 0.00 64.05 60.16 1rjh n THR 138 Cb 0.52 -0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 68.31 1rjh n THR 138 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1rjh s GLU 139 N -2.40 2.86 -0.38 -0.78 -6.30 -1.16 -4.92 118.70 105.62 1rjh s GLU 139 Ca 0.42 0.65 -0.00 0.00 -2.50 0.00 0.00 54.97 53.54 1rjh s GLU 139 Cb 0.33 -4.31 0.11 0.00 0.00 0.00 0.00 34.13 30.26 1rjh s GLU 139 CO 0.11 -2.46 0.14 0.96 0.02 0.00 0.00 175.26 174.03 1rjh s ILE 140 N 8.13 2.89 -1.36 -3.70 -4.36 -1.26 -5.01 121.20 116.53 1rjh s ILE 140 Ca 0.65 -2.18 -0.07 0.00 -0.26 0.00 0.00 60.65 58.79 1rjh s ILE 140 Cb -0.13 -3.03 0.10 0.00 1.25 0.00 0.00 42.46 40.65 1rjh s ILE 140 CO 0.23 -0.66 2.33 1.07 0.24 0.00 0.00 174.94 178.15 1rjh n THR 141 N 4.45 4.84 -3.74 8.37 5.66 -1.26 -4.77 114.28 127.83 1rjh n THR 141 Ca 0.00 -4.07 -0.36 0.00 -3.05 0.00 0.00 64.05 56.57 1rjh n THR 141 Cb 0.42 -2.23 -0.10 0.00 -1.55 0.00 0.00 70.33 66.86 1rjh n THR 141 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1rjh s ALA 142 N -0.19 3.41 -0.48 1.79 0.00 -1.26 -5.07 121.76 119.96 1rjh s ALA 142 Ca 0.52 -2.97 -0.15 0.00 0.00 0.00 0.00 51.96 49.36 1rjh s ALA 142 Cb 0.16 -2.56 0.09 0.00 0.00 0.00 0.00 23.12 20.81 1rjh s ALA 142 CO -0.07 -1.98 0.41 -0.65 0.00 0.00 0.00 175.76 173.47 1rjh s GLN 143 N 0.42 2.96 0.45 0.00 -1.52 -1.26 -4.91 119.66 115.80 1rjh s GLN 143 Ca 0.13 -1.44 0.25 0.00 -1.95 0.00 0.00 55.36 52.36 1rjh s GLN 143 Cb -0.21 -4.15 0.60 0.00 -0.22 0.00 0.00 33.01 29.03 1rjh s GLN 143 CO -0.04 -1.09 1.70 -1.35 -0.25 0.00 0.00 175.29 174.26 1rjh h PRO 144 N 8.76 0.00 0.09 2.91 0.11 -1.97 -3.24 132.00 138.66 1rjh h PRO 144 Ca -0.28 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.53 1rjh h PRO 144 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1rjh h PRO 144 CO 0.91 0.07 -1.49 0.22 -0.21 0.00 0.00 178.00 177.50 1rjh h ASP 145 N 0.00 0.31 0.00 -2.05 3.58 -1.90 -3.48 116.42 112.87 1rjh h ASP 145 Ca -0.00 -0.44 0.00 0.00 0.42 0.00 0.00 57.03 57.01 1rjh h ASP 145 Cb 0.91 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.85 1rjh h ASP 145 CO 0.01 1.36 0.00 0.61 -2.88 0.00 0.00 179.24 178.34 1rjh n GLY 146 N 1.62 2.84 0.00 -0.78 0.00 -1.22 -4.92 105.19 102.73 1rjh n GLY 146 Ca -0.15 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 0.00 3.19 -0.02 0.00 -1.26 -4.95 105.19 102.15 1rjh n GLY 147 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1rjh n GLY 147 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rjh s LYS 148 N 0.00 1.30 -0.01 1.61 0.00 -1.26 -4.74 119.74 116.63 1rjh s LYS 148 Ca 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 55.97 55.22 1rjh s LYS 148 Cb 0.00 -1.32 0.01 0.00 0.00 0.00 0.00 37.83 36.52 1rjh s LYS 148 CO 0.00 0.35 -0.02 0.95 0.00 0.00 0.00 175.35 176.63 1rjh s THR 149 N -0.63 0.18 -0.87 3.79 -4.23 -1.26 -4.87 115.64 107.74 1rjh s THR 149 Ca 0.06 -0.05 -0.20 0.00 -1.18 0.00 0.00 61.69 60.32 1rjh s THR 149 Cb -0.08 -0.19 0.11 0.00 1.34 0.00 0.00 72.50 73.68 1rjh s THR 149 CO 0.01 0.08 1.11 -1.61 -0.54 0.00 0.00 174.62 173.67 1rjh s GLU 150 N 0.24 3.48 0.23 3.99 2.02 -1.26 -4.95 118.70 122.44 1rjh s GLU 150 Ca -0.02 -1.50 -0.14 0.00 0.02 0.00 0.00 54.97 53.34 1rjh s GLU 150 Cb -0.04 -4.80 0.00 0.00 0.10 0.00 0.00 34.13 29.39 1rjh s GLU 150 CO -0.01 -1.82 0.47 0.54 0.02 0.00 0.00 175.26 174.47 1rjh s ASN 151 N 3.76 -0.12 -0.03 -0.19 4.22 -1.26 -4.90 114.94 116.42 1rjh s ASN 151 Ca 0.31 -0.82 -0.01 0.00 -2.14 0.00 0.00 52.86 50.20 1rjh s ASN 151 Cb -0.07 0.57 0.03 0.00 1.28 0.00 0.00 41.25 43.06 1rjh s ASN 151 CO -0.05 -1.10 0.05 0.00 -2.04 0.00 0.00 177.10 173.96 1rjh s ALA 153 N 1.72 3.35 0.05 0.00 0.00 -1.26 -2.40 121.76 123.22 1rjh s ALA 153 Ca -0.01 0.78 0.07 0.00 0.00 0.00 0.00 51.96 52.80 1rjh s ALA 153 Cb -0.12 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 1rjh s ALA 153 CO -0.03 -0.19 -0.21 0.14 0.00 0.00 0.00 175.76 175.47 1rjh s VAL 154 N -0.13 1.69 -0.47 0.00 -7.23 0.70 -2.59 120.40 112.36 1rjh s VAL 154 Ca 0.49 -1.26 -0.22 0.00 -1.81 0.00 0.00 61.98 59.18 1rjh s VAL 154 Cb -0.28 -1.48 0.03 0.00 0.56 0.00 0.00 36.38 35.21 1rjh s VAL 154 CO 0.34 0.17 0.76 -0.22 -0.31 0.00 0.00 175.10 175.84 1rjh s LEU 155 N -1.29 4.35 -0.54 1.32 1.98 0.85 -0.07 118.68 125.29 1rjh s LEU 155 Ca 0.07 -0.28 -0.17 0.00 -2.89 0.00 0.00 54.13 50.87 1rjh s LEU 155 Cb -0.09 -2.84 0.12 0.00 0.66 0.00 0.00 46.19 44.03 1rjh s LEU 155 CO 0.02 -0.93 0.53 -0.55 -1.89 0.00 0.00 176.35 173.52 1rjh s SER 156 N 2.27 6.18 0.40 3.68 0.15 -1.22 -2.17 113.70 122.99 1rjh s SER 156 Ca 0.27 -1.65 0.22 0.00 0.70 0.00 0.00 55.95 55.48 1rjh s SER 156 Cb -0.13 -2.22 0.65 0.00 -1.71 0.00 0.00 66.02 62.60 1rjh s SER 156 CO 0.20 -0.88 1.71 1.23 1.20 0.00 0.00 173.24 176.70 1rjh h GLY 157 N 9.08 0.00 1.96 9.45 0.00 -1.66 -1.99 103.07 119.91 1rjh h GLY 157 Ca -0.30 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.93 1rjh h GLY 157 CO 1.03 0.00 -0.48 0.00 0.00 0.00 0.00 176.54 177.09 1rjh h ALA 158 N 1.72 1.17 0.11 3.60 0.00 -1.69 -3.31 119.26 120.86 1rjh h ALA 158 Ca -0.00 -0.44 -0.01 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 0.04 0.61 -0.05 0.00 0.00 0.00 0.00 179.25 179.84 1rjh h ALA 159 N 1.48 -0.24 0.00 0.00 0.00 -1.89 -3.49 119.26 115.12 1rjh h ALA 159 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rjh h ALA 159 Cb 0.86 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1rjh h ALA 159 CO 0.06 -0.23 0.00 0.27 0.00 0.00 0.00 179.25 179.35 1rjh n ASN 160 N -3.52 0.00 0.00 0.00 0.23 -1.13 -5.02 115.26 105.82 1rjh n ASN 160 Ca -0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.03 1rjh n ASN 160 Cb 0.06 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.76 1rjh n ASN 160 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1rjh n GLY 161 N -0.16 1.00 3.93 4.83 0.00 -0.76 -4.95 105.19 109.08 1rjh n GLY 161 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 1.44 -0.10 1.61 3.01 -1.26 -4.82 119.74 119.62 1rjh s LYS 162 Ca 0.00 -0.33 -0.26 0.00 -1.01 0.00 0.00 55.97 54.37 1rjh s LYS 162 Cb 0.00 -2.00 -0.02 0.00 -1.01 0.00 0.00 37.83 34.80 1rjh s LYS 162 CO 0.00 -1.84 0.84 -1.58 0.51 0.00 0.00 175.35 173.28 1rjh s TRP 163 N -3.58 3.52 0.10 3.18 0.52 -0.25 -3.46 118.94 118.96 1rjh s TRP 163 Ca 0.67 1.37 0.00 0.00 0.02 0.00 0.00 56.10 58.16 1rjh s TRP 163 Cb -0.07 -2.99 -0.00 0.00 -1.15 0.00 0.00 33.47 29.26 1rjh s TRP 163 CO 0.49 -0.10 0.00 1.19 0.02 0.00 0.00 176.95 178.55 1rjh n PHE 164 N 4.54 0.22 -3.91 -1.98 3.01 0.90 -2.04 117.46 118.20 1rjh n PHE 164 Ca 0.03 -0.48 -0.11 0.00 1.01 0.00 0.00 57.45 57.91 1rjh n PHE 164 Cb 0.50 -0.06 -0.12 0.00 -0.01 0.00 0.00 39.48 39.79 1rjh n PHE 164 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1rjh s ASP 165 N -1.53 0.08 0.32 4.37 2.15 -1.26 -0.22 116.67 120.57 1rjh s ASP 165 Ca 0.00 -0.20 -0.03 0.00 0.43 0.00 0.00 52.55 52.76 1rjh s ASP 165 Cb 0.00 0.13 -0.00 0.00 -0.30 0.00 0.00 42.92 42.75 1rjh s ASP 165 CO 0.00 -0.21 0.44 -0.54 -0.17 0.00 0.00 175.17 174.69 1rjh s LYS 166 N -0.87 1.81 0.38 4.34 1.02 -1.01 -4.88 119.74 120.53 1rjh s LYS 166 Ca -0.10 -1.70 -0.25 0.00 0.02 0.00 0.00 55.97 53.94 1rjh s LYS 166 Cb -0.06 0.43 -0.09 0.00 -0.52 0.00 0.00 37.83 37.59 1rjh s LYS 166 CO 0.00 -0.74 1.13 1.03 -0.92 0.00 0.00 175.35 175.85 1rjh s ARG 167 N -3.27 4.16 0.26 1.68 3.00 -1.26 -3.13 118.95 120.39 1rjh s ARG 167 Ca 0.31 1.74 0.23 0.00 0.00 0.00 0.00 55.73 58.01 1rjh s ARG 167 Cb 0.00 -2.70 1.00 0.00 0.00 0.00 0.00 34.95 33.25 1rjh s ARG 167 CO 0.19 -0.20 1.70 0.00 0.00 0.00 0.00 175.30 176.98 1rjh n ARG 169 N -2.23 1.29 -2.42 0.00 0.63 -1.26 -1.45 116.66 111.22 1rjh n ARG 169 Ca 0.02 -0.89 -0.41 0.00 -0.92 0.00 0.00 57.85 55.65 1rjh n ARG 169 Cb 0.20 -1.48 -0.04 0.00 0.45 0.00 0.00 32.46 31.59 1rjh n ARG 169 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1rjh s ASP 170 N -2.32 7.15 -0.37 6.15 1.01 0.05 -4.76 116.67 123.58 1rjh s ASP 170 Ca 0.27 2.21 -0.06 0.00 0.71 0.00 0.00 52.55 55.68 1rjh s ASP 170 Cb 0.19 -2.61 0.07 0.00 1.01 0.00 0.00 42.92 41.58 1rjh s ASP 170 CO 0.46 -0.30 0.16 0.00 0.21 0.00 0.00 175.17 175.70 1rjh s GLN 171 N -0.48 2.45 0.33 8.23 0.00 -1.26 -4.03 119.66 124.89 1rjh s GLN 171 Ca 0.51 -1.42 0.03 0.00 -0.00 0.00 0.00 55.36 54.48 1rjh s GLN 171 Cb -0.32 -3.54 -0.06 0.00 0.00 0.00 0.00 33.01 29.09 1rjh s GLN 171 CO 0.37 -0.84 0.07 -0.48 0.00 0.00 0.00 175.29 174.42 1rjh s LEU 172 N 1.33 2.07 1.26 2.60 0.05 -0.98 -4.37 118.68 120.64 1rjh s LEU 172 Ca 0.01 -1.42 -0.18 0.00 0.05 0.00 0.00 54.13 52.59 1rjh s LEU 172 Cb -0.21 -0.29 0.28 0.00 -2.05 0.00 0.00 46.19 43.92 1rjh s LEU 172 CO 0.00 -0.67 0.69 -0.81 -0.55 0.00 0.00 176.35 175.01 1rjh n PRO 173 N -0.69 -3.24 -4.26 1.48 -0.04 -1.25 -2.49 135.00 124.51 1rjh n PRO 173 Ca -0.02 -0.94 -0.19 0.00 -0.04 0.00 0.00 63.50 62.30 1rjh n PRO 173 Cb 0.66 -1.90 -0.08 0.00 -0.04 0.00 0.00 33.50 32.15 1rjh n PRO 173 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1rjh s TYR 174 N -2.22 1.71 -0.09 0.54 1.13 0.10 -4.23 117.35 114.29 1rjh s TYR 174 Ca 0.61 -1.64 -0.05 0.00 -1.41 0.00 0.00 57.07 54.58 1rjh s TYR 174 Cb -0.16 -0.65 0.04 0.00 -1.10 0.00 0.00 41.96 40.09 1rjh s TYR 174 CO 0.58 -0.91 0.21 0.42 -2.51 0.00 0.00 175.55 173.34 1rjh s ILE 175 N -3.36 -0.03 0.17 -3.49 1.01 -1.26 -4.46 121.20 109.78 1rjh s ILE 175 Ca 0.40 0.12 0.02 0.00 0.00 0.00 0.00 60.65 61.19 1rjh s ILE 175 Cb 0.02 -0.32 -0.04 0.00 0.01 0.00 0.00 42.46 42.13 1rjh s ILE 175 CO 0.28 0.05 0.32 0.00 0.00 0.00 0.00 174.94 175.58 1rjh s GLN 177 N -3.39 3.38 -0.02 0.00 2.00 0.17 -4.50 119.66 117.29 1rjh s GLN 177 Ca 0.35 -0.18 0.01 0.00 -2.00 0.00 0.00 55.36 53.55 1rjh s GLN 177 Cb -0.11 -3.98 0.01 0.00 0.80 0.00 0.00 33.01 29.73 1rjh s GLN 177 CO 0.29 -1.24 -0.05 -0.06 -0.50 0.00 0.00 175.29 173.73 1rjh s PHE 178 N 3.47 0.62 0.00 1.67 0.08 -1.26 -4.58 117.98 117.99 1rjh s PHE 178 Ca 0.30 -0.14 0.00 0.00 0.12 0.00 0.00 56.93 57.21 1rjh s PHE 178 Cb -0.12 -0.50 0.00 0.00 -0.57 0.00 0.00 43.02 41.82 1rjh s PHE 178 CO 0.21 -0.10 0.00 0.41 -0.10 0.00 0.00 175.22 175.64 1rjh n GLY 179 N 3.55 3.83 4.90 4.36 0.00 -1.26 -4.90 105.19 115.68 1rjh n GLY 179 Ca -0.20 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1rjh n GLY 179 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rjh n ILE 180 N 0.00 0.00 1.39 -0.61 5.41 -1.26 -5.25 119.36 119.04 1rjh n ILE 180 Ca 0.00 0.00 0.14 0.00 1.00 0.00 0.00 62.75 63.89 1rjh n ILE 180 Cb 0.00 0.00 0.43 0.00 -0.71 0.00 0.00 39.64 39.36 1rjh n ILE 180 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07