#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 0.08 -2.09 4.37 5.66 -1.26 -0.72 114.28 120.32 1rjh n THR 65 Ca 0.00 0.02 -0.41 0.00 -3.05 0.00 0.00 64.05 60.61 1rjh n THR 65 Cb 0.00 -0.57 -0.02 0.00 -1.55 0.00 0.00 70.33 68.19 1rjh n THR 65 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 1rjh s GLN 66 N -2.41 4.32 -0.14 1.09 0.74 -1.26 -4.67 119.66 117.34 1rjh s GLN 66 Ca 0.31 2.21 -0.05 0.00 0.05 0.00 0.00 55.36 57.88 1rjh s GLN 66 Cb 0.19 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 31.14 1rjh s GLN 66 CO 0.39 -0.31 0.05 0.95 -0.55 0.00 0.00 175.29 175.82 1rjh s THR 67 N -0.31 4.71 0.23 -0.34 -4.23 -1.26 -3.73 115.64 110.71 1rjh s THR 67 Ca 0.56 -0.08 -0.21 0.00 -1.18 0.00 0.00 61.69 60.78 1rjh s THR 67 Cb -0.40 -3.06 0.07 0.00 1.34 0.00 0.00 72.50 70.44 1rjh s THR 67 CO 0.45 0.53 0.95 -1.59 -0.54 0.00 0.00 174.62 174.42 1rjh s LYS 68 N -0.24 1.54 0.77 3.99 0.00 -0.46 -4.70 119.74 120.64 1rjh s LYS 68 Ca 0.08 -0.96 -0.12 0.00 0.00 0.00 0.00 55.97 54.97 1rjh s LYS 68 Cb -0.12 0.45 0.05 0.00 0.00 0.00 0.00 37.83 38.21 1rjh s LYS 68 CO 0.02 -0.72 1.12 0.95 0.00 0.00 0.00 175.35 176.72 1rjh s THR 69 N -2.48 2.91 0.35 3.79 -4.23 -1.24 -1.70 115.64 113.05 1rjh s THR 69 Ca 0.18 0.30 0.03 0.00 -1.18 0.00 0.00 61.69 61.02 1rjh s THR 69 Cb -0.03 -3.21 0.24 0.00 1.34 0.00 0.00 72.50 70.84 1rjh s THR 69 CO 0.06 -0.39 1.99 0.15 -0.54 0.00 0.00 174.62 175.89 1rjh h PHE 70 N -0.93 0.74 0.06 3.99 3.57 -1.71 0.28 116.94 122.94 1rjh h PHE 70 Ca -0.46 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.04 1rjh h PHE 70 Cb 1.28 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.78 1rjh h PHE 70 CO 0.43 0.50 -0.03 1.25 -2.23 0.00 0.00 178.31 178.23 1rjh h HIS 71 N 0.77 -0.08 -0.41 0.41 2.76 -1.93 0.09 115.15 116.76 1rjh h HIS 71 Ca 0.20 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.31 1rjh h HIS 71 Cb -0.01 0.03 -0.02 0.00 1.55 0.00 0.00 27.41 28.95 1rjh h HIS 71 CO 0.00 0.14 -0.01 0.93 -1.30 0.00 0.00 177.93 177.70 1rjh h GLU 72 N -0.30 0.67 -0.73 5.26 5.08 -1.85 -1.90 114.58 120.81 1rjh h GLU 72 Ca -0.01 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1rjh h GLU 72 Cb 0.26 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1rjh h GLU 72 CO 0.01 0.69 0.43 0.00 -1.00 0.00 0.00 179.01 179.15 1rjh h ALA 73 N 1.36 0.93 0.41 3.43 0.00 -0.22 0.60 119.26 125.77 1rjh h ALA 73 Ca 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1rjh h ALA 73 Cb 0.41 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1rjh h ALA 73 CO 0.02 0.40 -0.19 0.77 0.00 0.00 0.00 179.25 180.24 1rjh h SER 74 N 0.99 -0.46 -0.82 0.00 0.02 -0.52 -1.67 113.55 111.10 1rjh h SER 74 Ca 0.26 -0.01 0.08 0.00 -0.84 0.00 0.00 61.79 61.28 1rjh h SER 74 Cb -0.02 0.12 -0.07 0.00 0.14 0.00 0.00 62.40 62.57 1rjh h SER 74 CO -0.05 -0.30 0.48 -0.33 -1.14 0.00 0.00 176.83 175.49 1rjh h GLU 75 N -0.58 0.82 0.25 3.45 4.39 -1.12 0.52 114.58 122.30 1rjh h GLU 75 Ca -0.06 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 1rjh h GLU 75 Cb 0.44 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1rjh h GLU 75 CO 0.09 0.54 -0.12 0.22 -1.16 0.00 0.00 179.01 178.58 1rjh h ASP 76 N 0.84 -0.28 -0.46 1.42 1.82 -0.77 -0.34 116.42 118.65 1rjh h ASP 76 Ca 0.38 0.01 -0.04 0.00 -0.39 0.00 0.00 57.03 56.98 1rjh h ASP 76 Cb 0.27 0.07 -0.02 0.00 0.68 0.00 0.00 39.33 40.33 1rjh h ASP 76 CO -0.21 -0.20 0.16 0.00 -1.61 0.00 0.00 179.24 177.38 1rjh h ILE 78 N 0.76 1.04 0.00 0.00 1.08 0.44 0.43 117.51 121.25 1rjh h ILE 78 Ca 0.17 -0.31 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1rjh h ILE 78 Cb 0.23 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 1rjh h ILE 78 CO -0.01 0.17 0.00 -1.28 -0.69 0.00 0.00 178.15 176.34 1rjh h SER 79 N 0.92 0.00 -0.42 1.72 0.87 -0.39 -2.65 113.55 113.60 1rjh h SER 79 Ca 0.35 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 1rjh h SER 79 Cb 0.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1rjh h SER 79 CO -0.17 0.00 0.00 0.54 -0.53 0.00 0.00 176.83 176.67 1rjh n ARG 80 N -2.97 3.26 0.00 2.24 1.74 -0.77 -4.88 116.66 115.28 1rjh n ARG 80 Ca 0.03 -2.64 0.00 0.00 -0.77 0.00 0.00 57.85 54.47 1rjh n ARG 80 Cb 0.45 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 1rjh n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rjh n GLY 81 N 0.33 1.42 0.00 -0.13 0.00 -0.64 -4.35 105.19 101.82 1rjh n GLY 81 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 1.28 3.38 -0.02 0.00 0.14 -4.91 105.19 105.05 1rjh n GLY 82 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1rjh n GLY 82 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rjh s THR 83 N -1.93 -0.00 0.49 2.61 2.01 -1.21 -4.64 115.64 112.97 1rjh s THR 83 Ca 0.00 0.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.94 1rjh s THR 83 Cb 0.00 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.79 1rjh s THR 83 CO 0.00 0.01 0.83 -0.22 -0.69 0.00 0.00 174.62 174.54 1rjh s LEU 84 N 0.49 3.60 -0.40 4.42 0.20 -1.26 -2.07 118.68 123.66 1rjh s LEU 84 Ca -0.02 1.06 -0.28 0.00 0.69 0.00 0.00 54.13 55.58 1rjh s LEU 84 Cb -0.04 -4.02 -0.01 0.00 -0.43 0.00 0.00 46.19 41.69 1rjh s LEU 84 CO -0.02 -0.59 1.72 -0.44 -0.29 0.00 0.00 176.35 176.72 1rjh s SER 85 N -3.92 5.89 -0.30 3.68 0.01 -0.12 -4.65 113.70 114.29 1rjh s SER 85 Ca 0.50 1.03 -0.06 0.00 1.31 0.00 0.00 55.95 58.73 1rjh s SER 85 Cb -0.10 -2.53 0.02 0.00 0.21 0.00 0.00 66.02 63.62 1rjh s SER 85 CO 0.44 -1.76 0.06 -0.89 0.41 0.00 0.00 173.24 171.50 1rjh s THR 86 N 6.92 3.69 -0.13 1.44 2.01 -1.26 -4.35 115.64 123.95 1rjh s THR 86 Ca 0.73 -0.94 -0.27 0.00 0.31 0.00 0.00 61.69 61.52 1rjh s THR 86 Cb -0.19 -2.98 -0.01 0.00 0.01 0.00 0.00 72.50 69.33 1rjh s THR 86 CO 0.31 -0.01 0.91 -2.16 -0.69 0.00 0.00 174.62 172.98 1rjh s PRO 87 N 1.43 4.36 0.00 4.92 0.04 -1.26 -4.91 135.00 139.57 1rjh s PRO 87 Ca 0.00 1.19 0.03 0.00 0.04 0.00 0.00 61.00 62.26 1rjh s PRO 87 Cb -0.18 -3.55 -0.01 0.00 0.04 0.00 0.00 34.50 30.80 1rjh s PRO 87 CO 0.01 -0.30 0.30 0.00 0.04 0.00 0.00 177.00 177.05 1rjh n GLN 88 N 5.06 3.38 -4.13 4.56 10.64 -1.26 -4.87 117.38 130.76 1rjh n GLN 88 Ca 0.06 -0.28 -0.10 0.00 -1.83 0.00 0.00 57.00 54.86 1rjh n GLN 88 Cb 0.49 -0.80 -0.10 0.00 -0.86 0.00 0.00 30.24 28.98 1rjh n GLN 88 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 1rjh s THR 89 N -0.82 0.10 0.30 -0.39 2.01 -1.26 -3.30 115.64 112.28 1rjh s THR 89 Ca 0.02 -1.85 0.02 0.00 0.31 0.00 0.00 61.69 60.18 1rjh s THR 89 Cb 0.02 -2.02 0.29 0.00 0.01 0.00 0.00 72.50 70.80 1rjh s THR 89 CO 0.07 -0.45 1.88 1.23 -0.69 0.00 0.00 174.62 176.66 1rjh h GLY 90 N 2.83 1.44 0.44 4.40 0.00 -1.98 -1.86 103.07 108.34 1rjh h GLY 90 Ca -0.35 -0.41 0.13 0.00 0.00 0.00 0.00 47.33 46.70 1rjh h GLY 90 CO 0.58 0.23 0.63 1.48 0.00 0.00 0.00 176.54 179.46 1rjh h SER 91 N 0.99 0.91 0.20 0.19 4.64 -1.99 0.17 113.55 118.66 1rjh h SER 91 Ca 0.44 0.05 -0.32 0.00 -0.47 0.00 0.00 61.79 61.49 1rjh h SER 91 Cb 0.37 -0.13 0.03 0.00 -0.31 0.00 0.00 62.40 62.36 1rjh h SER 91 CO -0.20 0.47 -1.37 -0.33 -0.87 0.00 0.00 176.83 174.53 1rjh h GLU 92 N 0.97 0.58 0.01 4.77 3.07 -1.77 -3.05 114.58 119.15 1rjh h GLU 92 Ca 0.51 -0.89 -0.00 0.00 -0.50 0.00 0.00 59.36 58.48 1rjh h GLU 92 Cb 0.54 0.31 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1rjh h GLU 92 CO -0.27 1.42 -0.00 -0.91 -1.40 0.00 0.00 179.01 177.84 1rjh h ASN 93 N 0.21 -0.01 -0.32 1.42 2.35 -0.61 0.12 115.58 118.74 1rjh h ASN 93 Ca -0.23 -0.30 -0.05 0.00 -0.55 0.00 0.00 56.30 55.17 1rjh h ASN 93 Cb 2.06 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 40.41 1rjh h ASN 93 CO 0.26 0.30 0.04 0.44 -1.65 0.00 0.00 177.43 176.82 1rjh h ASP 94 N -0.32 0.59 0.02 5.81 5.19 -0.84 -1.59 116.42 125.28 1rjh h ASP 94 Ca -0.00 -0.11 -0.21 0.00 -0.62 0.00 0.00 57.03 56.09 1rjh h ASP 94 Cb 0.32 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.67 1rjh h ASP 94 CO 0.00 0.63 -0.76 0.00 -3.12 0.00 0.00 179.24 176.00 1rjh h ALA 95 N 1.44 0.44 -0.31 3.45 0.00 -1.41 -2.68 119.26 120.19 1rjh h ALA 95 Ca 0.13 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1rjh h ALA 95 Cb 0.32 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1rjh h ALA 95 CO 0.01 0.72 -0.02 1.25 0.00 0.00 0.00 179.25 181.21 1rjh h LEU 96 N 0.43 0.55 -0.75 0.00 5.85 -0.33 0.31 115.31 121.37 1rjh h LEU 96 Ca -0.04 -0.32 0.01 0.00 0.84 0.00 0.00 57.88 58.36 1rjh h LEU 96 Cb 1.36 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 1rjh h LEU 96 CO 0.15 0.74 0.49 0.22 -0.34 0.00 0.00 178.44 179.70 1rjh h TYR 97 N 0.34 0.93 -0.61 1.25 3.20 -1.36 0.82 116.97 121.55 1rjh h TYR 97 Ca 0.08 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 1rjh h TYR 97 Cb 0.47 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 1rjh h TYR 97 CO 0.04 0.59 0.09 1.49 -1.64 0.00 0.00 178.16 178.72 1rjh h GLU 98 N 1.01 1.01 -0.18 1.82 4.57 -1.24 -2.78 114.58 118.80 1rjh h GLU 98 Ca 0.27 -0.28 -0.06 0.00 -1.18 0.00 0.00 59.36 58.11 1rjh h GLU 98 Cb -0.11 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.35 1rjh h GLU 98 CO -0.06 0.96 -0.17 -0.92 -1.18 0.00 0.00 179.01 177.64 1rjh h TYR 99 N 0.92 0.31 -0.39 0.92 3.20 0.30 -2.54 116.97 119.70 1rjh h TYR 99 Ca 0.18 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 62.06 1rjh h TYR 99 Cb 0.44 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.58 1rjh h TYR 99 CO 0.03 0.46 0.11 -0.07 -1.64 0.00 0.00 178.16 177.05 1rjh h LEU 100 N 0.27 0.08 -1.24 2.82 3.38 -0.57 -1.09 115.31 118.97 1rjh h LEU 100 Ca 0.05 0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.20 1rjh h LEU 100 Cb 0.46 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 1rjh h LEU 100 CO 0.03 0.08 0.57 0.03 0.09 0.00 0.00 178.44 179.25 1rjh h ARG 101 N 0.25 0.76 0.00 1.13 3.08 -1.39 0.77 114.38 118.98 1rjh h ARG 101 Ca 0.18 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1rjh h ARG 101 Cb 0.19 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1rjh h ARG 101 CO -0.21 0.51 -0.89 0.00 -1.07 0.00 0.00 179.97 178.31 1rjh n GLN 102 N -4.55 0.07 0.03 0.04 10.64 -1.00 -4.30 117.38 118.30 1rjh n GLN 102 Ca 0.16 -0.01 -0.00 0.00 -1.83 0.00 0.00 57.00 55.32 1rjh n GLN 102 Cb 0.39 -1.51 -0.00 0.00 -0.86 0.00 0.00 30.24 28.26 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 -1.60 0.69 -0.06 2.61 2.88 -0.45 -4.91 113.62 112.79 1rjh n SER 103 Ca 0.04 0.09 -0.14 0.00 -1.33 0.00 0.00 58.87 57.53 1rjh n SER 103 Cb 0.36 -0.22 -0.14 0.00 -0.75 0.00 0.00 64.21 63.46 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 -3.12 1.57 0.00 2.46 0.31 0.21 -4.93 118.33 114.84 1rjh n VAL 104 Ca -0.00 -0.74 0.00 0.00 -0.01 0.00 0.00 64.34 63.59 1rjh n VAL 104 Cb 0.01 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 31.82 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 1.84 3.74 0.35 2.92 0.00 0.24 -4.82 105.19 109.47 1rjh n GLY 105 Ca -0.30 -1.09 0.14 0.00 0.00 0.00 0.00 46.02 44.77 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 0.76 -0.02 1.61 -0.00 -1.75 -0.69 115.58 115.50 1rjh h ASN 106 Ca 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 56.30 56.40 1rjh h ASN 106 Cb 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 38.32 38.29 1rjh h ASN 106 CO 0.00 0.25 0.00 -1.84 -0.00 0.00 0.00 177.43 175.84 1rjh n GLU 107 N -4.78 1.09 -3.40 6.67 0.28 -1.26 -2.28 120.64 116.96 1rjh n GLU 107 Ca 0.24 -0.09 -0.23 0.00 -0.16 0.00 0.00 57.16 56.91 1rjh n GLU 107 Cb 0.60 -1.28 -0.01 0.00 1.43 0.00 0.00 31.44 32.18 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 -1.50 3.72 -0.15 -1.84 0.00 -0.27 -4.10 121.76 117.62 1rjh s ALA 108 Ca 0.02 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.04 1rjh s ALA 108 Cb 0.01 -2.08 0.02 0.00 0.00 0.00 0.00 23.12 21.07 1rjh s ALA 108 CO 0.01 -0.02 -0.19 -1.21 0.00 0.00 0.00 175.76 174.35 1rjh s GLU 109 N -4.30 2.79 0.11 0.00 2.02 -1.26 -1.46 118.70 116.59 1rjh s GLU 109 Ca 0.40 -0.76 0.10 0.00 0.02 0.00 0.00 54.97 54.73 1rjh s GLU 109 Cb -0.10 -2.35 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 1rjh s GLU 109 CO 0.36 -0.12 -0.25 0.42 0.02 0.00 0.00 175.26 175.68 1rjh s ILE 110 N 1.10 2.11 0.58 -1.63 1.09 -0.75 -3.21 121.20 120.49 1rjh s ILE 110 Ca -0.01 -1.64 -0.18 0.00 -1.10 0.00 0.00 60.65 57.72 1rjh s ILE 110 Cb -0.14 -1.87 -0.04 0.00 -1.06 0.00 0.00 42.46 39.35 1rjh s ILE 110 CO -0.07 0.11 1.12 0.26 -0.10 0.00 0.00 174.94 176.26 1rjh s TRP 111 N -1.03 2.67 -2.54 3.97 0.52 -1.25 0.27 118.94 121.54 1rjh s TRP 111 Ca 0.12 1.55 0.23 0.00 0.02 0.00 0.00 56.10 58.02 1rjh s TRP 111 Cb -0.10 -3.24 0.41 0.00 -1.15 0.00 0.00 33.47 29.40 1rjh s TRP 111 CO 0.05 -1.58 1.40 1.28 0.02 0.00 0.00 176.95 178.11 1rjh n LEU 112 N -1.68 3.37 0.00 2.99 4.77 -0.77 -4.73 117.00 120.95 1rjh n LEU 112 Ca 0.11 -1.41 0.00 0.00 -0.03 0.00 0.00 56.01 54.68 1rjh n LEU 112 Cb 0.51 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1rjh n LEU 112 CO 0.44 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.82 1rjh n GLY 113 N 1.48 2.08 3.92 -0.72 0.00 -1.26 -4.05 105.19 106.65 1rjh n GLY 113 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 4.13 0.12 0.99 2.34 -1.26 -3.80 118.68 121.20 1rjh s LEU 114 Ca 0.00 0.51 -0.17 0.00 0.06 0.00 0.00 54.13 54.54 1rjh s LEU 114 Cb 0.00 -3.32 0.04 0.00 -0.56 0.00 0.00 46.19 42.35 1rjh s LEU 114 CO 0.00 -0.14 0.41 0.54 -1.06 0.00 0.00 176.35 176.10 1rjh s ASN 115 N -3.33 -0.25 -0.14 1.48 2.20 -0.25 -4.57 114.94 110.07 1rjh s ASN 115 Ca 0.41 -0.29 -0.05 0.00 -0.94 0.00 0.00 52.86 51.99 1rjh s ASN 115 Cb -0.11 0.48 -0.03 0.00 -2.00 0.00 0.00 41.25 39.59 1rjh s ASN 115 CO 0.31 -0.85 0.02 -0.62 -2.94 0.00 0.00 177.10 173.01 1rjh s ASP 116 N -2.77 5.33 0.00 3.54 2.15 -1.26 -1.05 116.67 122.61 1rjh s ASP 116 Ca 0.02 0.06 0.00 0.00 0.43 0.00 0.00 52.55 53.07 1rjh s ASP 116 Cb 0.02 -1.78 0.00 0.00 -0.30 0.00 0.00 42.92 40.86 1rjh s ASP 116 CO -0.12 0.24 0.72 1.15 -0.17 0.00 0.00 175.17 176.99 1rjh n MET 117 N 3.05 0.99 0.00 4.34 0.00 -1.26 -4.87 117.12 119.37 1rjh n MET 117 Ca -0.18 -0.95 -0.00 0.00 0.00 0.00 0.00 57.70 56.57 1rjh n MET 117 Cb 0.53 -0.96 -0.00 0.00 0.00 0.00 0.00 33.22 32.79 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 -0.24 2.44 0.00 3.17 0.00 -1.26 -5.06 120.51 119.56 1rjh n ALA 118 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1rjh n ALA 118 Cb 0.15 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.63 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 -2.63 0.00 -1.94 0.00 0.00 -1.26 -5.17 120.51 109.51 1rjh n ALA 119 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 1rjh n ALA 119 Cb 0.01 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.53 1rjh n ALA 119 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1rjh s GLU 120 N 0.00 2.31 0.12 0.00 -1.05 -1.26 -5.00 118.70 113.82 1rjh s GLU 120 Ca 0.00 -0.11 0.24 0.00 -0.15 0.00 0.00 54.97 54.95 1rjh s GLU 120 Cb 0.00 -2.14 0.24 0.00 -0.44 0.00 0.00 34.13 31.79 1rjh s GLU 120 CO 0.00 -1.21 1.23 0.78 0.95 0.00 0.00 175.26 177.01 1rjh h GLY 121 N -0.62 0.00 -7.77 -3.83 0.00 -2.02 -3.41 103.07 85.43 1rjh h GLY 121 Ca -0.45 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.18 1rjh h GLY 121 CO 0.62 0.00 1.82 -1.59 0.00 0.00 0.00 176.54 177.38 1rjh s THR 122 N -3.20 4.50 0.43 4.70 2.01 -1.26 -4.98 115.64 117.84 1rjh s THR 122 Ca 0.05 -2.18 -0.24 0.00 0.31 0.00 0.00 61.69 59.62 1rjh s THR 122 Cb 0.13 -5.07 -0.10 0.00 0.01 0.00 0.00 72.50 67.47 1rjh s THR 122 CO 0.75 -1.85 1.14 0.79 -0.69 0.00 0.00 174.62 174.75 1rjh n TRP 123 N 7.25 1.64 -4.13 4.92 7.02 -1.26 -4.83 117.44 128.04 1rjh n TRP 123 Ca 0.43 0.52 -0.31 0.00 -1.02 0.00 0.00 57.50 57.12 1rjh n TRP 123 Cb 0.45 -2.30 -0.08 0.00 -2.42 0.00 0.00 31.31 26.97 1rjh n TRP 123 CO 0.00 0.00 0.00 0.14 -2.02 0.00 0.00 177.69 175.81 1rjh s VAL 124 N -1.25 4.29 0.77 -0.99 -7.23 -0.22 -3.44 120.40 112.33 1rjh s VAL 124 Ca 0.63 -0.77 -0.12 0.00 -1.81 0.00 0.00 61.98 59.91 1rjh s VAL 124 Cb -0.52 -3.01 0.05 0.00 0.56 0.00 0.00 36.38 33.45 1rjh s VAL 124 CO 0.57 0.20 1.13 -0.62 -0.31 0.00 0.00 175.10 176.07 1rjh s ASP 125 N -2.11 4.88 0.56 4.85 2.15 0.12 -1.09 116.67 126.04 1rjh s ASP 125 Ca 0.25 1.01 0.25 0.00 0.43 0.00 0.00 52.55 54.49 1rjh s ASP 125 Cb -0.12 -1.67 1.58 0.00 -0.30 0.00 0.00 42.92 42.41 1rjh s ASP 125 CO 0.17 -1.69 2.16 0.24 -0.17 0.00 0.00 175.17 175.89 1rjh h MET 126 N -0.90 0.00 0.00 4.34 2.86 -1.88 0.78 114.93 120.13 1rjh h MET 126 Ca -0.46 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 1rjh h MET 126 Cb 1.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.95 1rjh h MET 126 CO 0.64 0.00 -0.17 0.25 1.06 0.00 0.00 176.91 178.69 1rjh n THR 127 N -4.08 0.22 0.00 2.22 -2.24 -1.26 -4.89 114.28 104.25 1rjh n THR 127 Ca -0.01 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1rjh n THR 127 Cb 0.19 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 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 1.42 0.53 3.77 3.38 0.00 0.27 -5.08 105.19 109.49 1rjh n GLY 128 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 2.47 0.09 4.61 0.00 -1.26 -4.69 121.76 120.98 1rjh s ALA 129 Ca 0.00 0.50 0.05 0.00 0.00 0.00 0.00 51.96 52.51 1rjh s ALA 129 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 1rjh s ALA 129 CO 0.00 -1.29 -0.01 -0.98 0.00 0.00 0.00 175.76 173.48 1rjh s ARG 130 N -4.19 2.53 0.47 0.00 1.70 -1.26 0.16 118.95 118.36 1rjh s ARG 130 Ca 0.66 -0.84 0.03 0.00 -0.47 0.00 0.00 55.73 55.11 1rjh s ARG 130 Cb -0.20 -2.53 0.01 0.00 -0.57 0.00 0.00 34.95 31.67 1rjh s ARG 130 CO 0.43 0.54 0.67 0.96 -1.08 0.00 0.00 175.30 176.82 1rjh s ILE 131 N -1.30 3.31 0.00 4.99 -4.36 -1.22 -4.95 121.20 117.67 1rjh s ILE 131 Ca 0.25 -0.71 0.00 0.00 -0.26 0.00 0.00 60.65 59.93 1rjh s ILE 131 Cb -0.12 -3.20 0.00 0.00 1.25 0.00 0.00 42.46 40.40 1rjh s ILE 131 CO 0.18 -0.12 0.43 0.00 0.24 0.00 0.00 174.94 175.67 1rjh n ALA 132 N -2.09 1.11 -4.03 2.27 0.00 -1.24 -4.95 120.51 111.58 1rjh n ALA 132 Ca 0.05 -0.43 -0.33 0.00 0.00 0.00 0.00 53.44 52.72 1rjh n ALA 132 Cb 0.59 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.88 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 -0.18 2.83 -0.30 0.00 6.14 -1.21 -5.01 117.35 119.62 1rjh s TYR 133 Ca 0.00 -1.59 -0.03 0.00 0.64 0.00 0.00 57.07 56.09 1rjh s TYR 133 Cb 0.00 -1.95 0.11 0.00 0.42 0.00 0.00 41.96 40.54 1rjh s TYR 133 CO 0.00 -0.78 0.14 0.15 0.64 0.00 0.00 175.55 175.70 1rjh s LYS 134 N 1.30 0.34 -0.21 4.97 1.02 -1.26 -4.97 119.74 120.93 1rjh s LYS 134 Ca 0.04 -0.74 -0.00 0.00 0.02 0.00 0.00 55.97 55.30 1rjh s LYS 134 Cb -0.14 -1.34 0.05 0.00 -0.52 0.00 0.00 37.83 35.89 1rjh s LYS 134 CO -0.11 -1.04 -0.04 -0.80 -0.92 0.00 0.00 175.35 172.44 1rjh s ASN 135 N 1.87 3.45 -0.12 2.83 0.01 -1.26 -5.11 114.94 116.60 1rjh s ASN 135 Ca 0.10 -0.99 0.01 0.00 -0.71 0.00 0.00 52.86 51.28 1rjh s ASN 135 Cb -0.17 -1.03 0.02 0.00 0.41 0.00 0.00 41.25 40.47 1rjh s ASN 135 CO -0.30 -0.23 -0.14 0.26 -1.51 0.00 0.00 177.10 175.18 1rjh s TRP 136 N 1.52 2.00 -0.03 2.20 0.52 -1.26 -2.05 118.94 121.83 1rjh s TRP 136 Ca -0.03 -1.01 0.29 0.00 0.02 0.00 0.00 56.10 55.37 1rjh s TRP 136 Cb -0.18 -1.46 1.03 0.00 -1.15 0.00 0.00 33.47 31.71 1rjh s TRP 136 CO -0.07 -0.54 1.86 0.93 0.02 0.00 0.00 176.95 179.15 1rjh h GLU 137 N 7.69 0.00 -0.58 4.98 4.39 -1.90 -2.72 114.58 126.44 1rjh h GLU 137 Ca -0.33 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.37 1rjh h GLU 137 Cb 1.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1rjh h GLU 137 CO 0.50 0.04 0.00 -2.37 -1.16 0.00 0.00 179.01 176.02 1rjh n THR 138 N -3.14 2.76 -1.61 1.13 5.66 -1.26 -4.97 114.28 112.85 1rjh n THR 138 Ca 0.01 -1.40 -0.45 0.00 -3.05 0.00 0.00 64.05 59.16 1rjh n THR 138 Cb 0.39 -0.27 -0.04 0.00 -1.55 0.00 0.00 70.33 68.86 1rjh n THR 138 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1rjh n GLU 139 N 0.64 2.12 -4.00 1.09 4.07 -1.03 -4.95 120.64 118.58 1rjh n GLU 139 Ca 0.28 0.70 -0.30 0.00 -0.06 0.00 0.00 57.16 57.77 1rjh n GLU 139 Cb 1.20 -2.92 -0.05 0.00 -0.06 0.00 0.00 31.44 29.61 1rjh n GLU 139 CO 0.00 0.00 0.00 0.96 -0.06 0.00 0.00 177.13 178.03 1rjh s ILE 140 N 6.13 4.86 0.00 6.31 -4.36 -1.26 -5.01 121.20 127.88 1rjh s ILE 140 Ca 0.97 -0.64 0.00 0.00 -0.26 0.00 0.00 60.65 60.72 1rjh s ILE 140 Cb -0.53 -3.37 0.00 0.00 1.25 0.00 0.00 42.46 39.82 1rjh s ILE 140 CO 0.43 0.11 0.66 0.35 0.24 0.00 0.00 174.94 176.73 1rjh n THR 141 N 0.33 0.41 -4.25 8.37 -2.24 -1.26 -5.06 114.28 110.57 1rjh n THR 141 Ca -0.07 -0.61 -0.20 0.00 -2.27 0.00 0.00 64.05 60.90 1rjh n THR 141 Cb 0.52 0.89 -0.11 0.00 -2.10 0.00 0.00 70.33 69.52 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 -0.41 1.57 -0.17 6.98 0.00 -1.26 -5.12 121.76 123.35 1rjh s ALA 142 Ca 0.00 -1.27 -0.28 0.00 0.00 0.00 0.00 51.96 50.42 1rjh s ALA 142 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 1rjh s ALA 142 CO 0.00 0.17 0.95 -0.65 0.00 0.00 0.00 175.76 176.23 1rjh s GLN 143 N -2.41 4.32 0.00 0.00 -0.21 -1.26 -4.98 119.66 115.11 1rjh s GLN 143 Ca 0.08 1.23 0.00 0.00 0.02 0.00 0.00 55.36 56.69 1rjh s GLN 143 Cb -0.07 -3.59 0.00 0.00 1.00 0.00 0.00 33.01 30.35 1rjh s GLN 143 CO 0.04 -0.43 0.52 -2.30 -2.12 0.00 0.00 175.29 170.99 1rjh n PRO 144 N 5.55 0.00 -2.43 2.91 -0.02 -1.26 -4.49 135.00 135.26 1rjh n PRO 144 Ca 0.08 0.33 -0.23 0.00 -2.02 0.00 0.00 63.50 61.66 1rjh n PRO 144 Cb 0.48 -1.14 0.01 0.00 -0.02 0.00 0.00 33.50 32.82 1rjh n PRO 144 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1rjh n ASP 145 N -1.50 4.26 0.00 2.55 2.03 -1.26 -4.83 116.55 117.79 1rjh n ASP 145 Ca 0.00 -3.55 0.00 0.00 0.52 0.00 0.00 54.79 51.76 1rjh n ASP 145 Cb 0.00 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 39.95 1rjh n ASP 145 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rjh n GLY 146 N -0.48 0.95 3.07 0.27 0.00 -1.26 -4.33 105.19 103.41 1rjh n GLY 146 Ca 0.35 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.89 1.89 3.57 -0.02 0.00 -1.26 -4.94 105.19 102.53 1rjh n GLY 147 Ca 0.00 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.37 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 2.45 0.02 1.61 0.00 -1.26 -4.86 119.74 117.70 1rjh s LYS 148 Ca 0.00 1.57 -0.00 0.00 0.00 0.00 0.00 55.97 57.54 1rjh s LYS 148 Cb 0.00 -4.51 -0.02 0.00 0.00 0.00 0.00 37.83 33.30 1rjh s LYS 148 CO 0.00 -2.89 -0.02 0.95 0.00 0.00 0.00 175.35 173.40 1rjh s THR 149 N 10.85 0.10 -1.09 3.79 -4.23 -1.26 -4.71 115.64 119.08 1rjh s THR 149 Ca 0.97 -0.85 -0.22 0.00 -1.18 0.00 0.00 61.69 60.42 1rjh s THR 149 Cb -0.22 -0.26 0.05 0.00 1.34 0.00 0.00 72.50 73.41 1rjh s THR 149 CO 0.29 -0.46 1.56 -1.83 -0.54 0.00 0.00 174.62 173.63 1rjh s GLU 150 N -1.37 3.62 -0.37 3.99 1.03 -1.26 -4.95 118.70 119.38 1rjh s GLU 150 Ca -0.15 -1.31 -0.23 0.00 0.03 0.00 0.00 54.97 53.31 1rjh s GLU 150 Cb -0.09 -5.39 0.01 0.00 -0.80 0.00 0.00 34.13 27.86 1rjh s GLU 150 CO -0.01 -2.32 0.76 0.54 -1.33 0.00 0.00 175.26 172.90 1rjh s ASN 151 N 4.97 6.52 -0.13 0.83 2.20 -1.26 -4.50 114.94 123.56 1rjh s ASN 151 Ca 0.50 0.27 0.02 0.00 -0.94 0.00 0.00 52.86 52.71 1rjh s ASN 151 Cb 0.01 -2.38 0.01 0.00 -2.00 0.00 0.00 41.25 36.89 1rjh s ASN 151 CO -0.04 -0.72 -0.19 0.00 -2.94 0.00 0.00 177.10 173.20 1rjh s ALA 153 N 0.92 3.64 -0.01 0.00 0.00 -1.26 -1.69 121.76 123.35 1rjh s ALA 153 Ca -0.06 0.32 0.06 0.00 0.00 0.00 0.00 51.96 52.28 1rjh s ALA 153 Cb -0.15 -3.62 -0.02 0.00 0.00 0.00 0.00 23.12 19.33 1rjh s ALA 153 CO -0.03 -1.21 -0.20 0.08 0.00 0.00 0.00 175.76 174.41 1rjh s VAL 154 N 3.51 1.57 -0.47 0.00 1.01 0.56 -1.85 120.40 124.73 1rjh s VAL 154 Ca 0.51 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.50 1rjh s VAL 154 Cb -0.19 -1.31 0.10 0.00 0.00 0.00 0.00 36.38 34.98 1rjh s VAL 154 CO 0.13 0.42 0.35 -0.22 0.00 0.00 0.00 175.10 175.78 1rjh s LEU 155 N -0.54 5.59 -0.52 3.92 0.20 0.14 0.22 118.68 127.70 1rjh s LEU 155 Ca 0.08 -1.66 -0.18 0.00 0.69 0.00 0.00 54.13 53.06 1rjh s LEU 155 Cb -0.08 -2.07 0.08 0.00 -0.43 0.00 0.00 46.19 43.69 1rjh s LEU 155 CO -0.00 -0.66 0.57 -0.44 -0.29 0.00 0.00 176.35 175.52 1rjh s SER 156 N 2.64 6.19 0.46 3.68 0.01 -1.25 -1.82 113.70 123.61 1rjh s SER 156 Ca 0.04 -1.19 0.26 0.00 1.31 0.00 0.00 55.95 56.37 1rjh s SER 156 Cb -0.25 -2.26 0.66 0.00 0.21 0.00 0.00 66.02 64.37 1rjh s SER 156 CO 0.02 -0.87 1.72 1.23 0.41 0.00 0.00 173.24 175.75 1rjh h GLY 157 N 9.45 0.00 1.86 3.44 0.00 -1.31 -2.72 103.07 113.79 1rjh h GLY 157 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1rjh h GLY 157 CO 0.98 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.52 1rjh n ALA 158 N -2.11 1.49 -0.00 3.60 0.00 -0.97 -3.92 120.51 118.60 1rjh n ALA 158 Ca 0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 1rjh n ALA 158 Cb 0.47 -1.15 -0.00 0.00 0.00 0.00 0.00 19.45 18.76 1rjh n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rjh n ALA 159 N -1.43 1.93 0.00 0.00 0.00 -1.12 -4.99 120.51 114.90 1rjh n ALA 159 Ca 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1rjh n ALA 159 Cb 0.10 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1rjh n ALA 159 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1rjh n ASN 160 N -2.99 0.00 0.00 0.00 4.13 -1.18 -5.03 115.26 110.19 1rjh n ASN 160 Ca -0.02 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.24 1rjh n ASN 160 Cb 0.07 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.31 1rjh n ASN 160 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rjh n GLY 161 N 0.16 0.66 3.65 7.41 0.00 -1.04 -4.97 105.19 111.05 1rjh n GLY 161 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1rjh n GLY 161 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rjh n LYS 162 N -1.33 -0.57 -2.79 1.61 4.01 -1.26 -4.88 118.16 112.96 1rjh n LYS 162 Ca 0.00 -2.29 -0.41 0.00 -0.51 0.00 0.00 58.31 55.10 1rjh n LYS 162 Cb 0.00 -0.91 -0.04 0.00 -0.51 0.00 0.00 35.03 33.57 1rjh n LYS 162 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 1rjh s TRP 163 N -3.26 3.70 0.43 2.13 0.52 -0.87 -3.95 118.94 117.63 1rjh s TRP 163 Ca 0.66 1.64 0.03 0.00 0.02 0.00 0.00 56.10 58.46 1rjh s TRP 163 Cb -0.03 -3.03 -0.03 0.00 -1.15 0.00 0.00 33.47 29.24 1rjh s TRP 163 CO 0.45 0.09 0.08 -0.06 0.02 0.00 0.00 176.95 177.53 1rjh s PHE 164 N 0.60 1.85 0.06 -1.98 0.08 0.13 -3.27 117.98 115.46 1rjh s PHE 164 Ca 0.47 -1.13 0.06 0.00 0.12 0.00 0.00 56.93 56.45 1rjh s PHE 164 Cb -0.21 -1.33 -0.03 0.00 -0.57 0.00 0.00 43.02 40.88 1rjh s PHE 164 CO 0.27 -0.08 -0.16 0.16 -0.10 0.00 0.00 175.22 175.30 1rjh s ASP 165 N -3.68 1.93 0.36 1.36 -4.77 -1.26 -0.32 116.67 110.29 1rjh s ASP 165 Ca 0.20 -0.53 -0.06 0.00 -3.30 0.00 0.00 52.55 48.85 1rjh s ASP 165 Cb 0.03 -0.12 0.02 0.00 -1.09 0.00 0.00 42.92 41.76 1rjh s ASP 165 CO 0.11 0.04 0.58 -0.75 0.70 0.00 0.00 175.17 175.85 1rjh s LYS 166 N -1.37 2.04 0.03 2.11 2.20 -0.68 -4.89 119.74 119.18 1rjh s LYS 166 Ca 0.03 -1.68 -0.18 0.00 -0.36 0.00 0.00 55.97 53.77 1rjh s LYS 166 Cb -0.09 0.50 -0.06 0.00 -1.51 0.00 0.00 37.83 36.67 1rjh s LYS 166 CO 0.02 -0.89 0.53 1.03 -0.36 0.00 0.00 175.35 175.69 1rjh s ARG 167 N -2.76 4.16 0.00 4.03 0.52 -1.26 -2.53 118.95 121.11 1rjh s ARG 167 Ca 0.26 0.65 0.07 0.00 -0.52 0.00 0.00 55.73 56.19 1rjh s ARG 167 Cb -0.02 -3.26 0.44 0.00 0.52 0.00 0.00 34.95 32.63 1rjh s ARG 167 CO 0.18 0.59 0.85 0.00 0.02 0.00 0.00 175.30 176.94 1rjh n ARG 169 N -0.85 2.30 -3.01 0.00 1.74 -1.26 -2.50 116.66 113.08 1rjh n ARG 169 Ca 0.06 -1.94 -0.39 0.00 -0.77 0.00 0.00 57.85 54.80 1rjh n ARG 169 Cb 0.03 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 29.92 1rjh n ARG 169 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1rjh s ASP 170 N -1.63 7.34 -0.86 0.55 2.15 -0.95 -4.82 116.67 118.44 1rjh s ASP 170 Ca 0.35 1.60 -0.17 0.00 0.43 0.00 0.00 52.55 54.76 1rjh s ASP 170 Cb 0.21 -2.48 0.15 0.00 -0.30 0.00 0.00 42.92 40.50 1rjh s ASP 170 CO 0.30 0.20 0.98 -1.10 -0.17 0.00 0.00 175.17 175.38 1rjh s GLN 171 N -1.23 3.54 0.32 4.34 -1.52 -1.26 -3.59 119.66 120.26 1rjh s GLN 171 Ca 0.36 -1.91 0.06 0.00 -1.95 0.00 0.00 55.36 51.92 1rjh s GLN 171 Cb -0.22 -4.69 -0.06 0.00 -0.22 0.00 0.00 33.01 27.81 1rjh s GLN 171 CO 0.25 -1.61 -0.01 -0.48 -0.25 0.00 0.00 175.29 173.19 1rjh s LEU 172 N 1.96 2.48 1.48 2.90 0.05 -0.69 -4.31 118.68 122.55 1rjh s LEU 172 Ca 0.26 -1.28 -0.24 0.00 0.05 0.00 0.00 54.13 52.92 1rjh s LEU 172 Cb -0.08 -0.63 0.38 0.00 -2.05 0.00 0.00 46.19 43.81 1rjh s LEU 172 CO -0.07 -0.43 0.88 -2.65 -0.55 0.00 0.00 176.35 173.52 1rjh n PRO 173 N -0.70 -4.87 -3.81 1.48 -0.02 -1.20 -1.35 135.00 124.53 1rjh n PRO 173 Ca -0.04 -1.45 -0.10 0.00 -2.02 0.00 0.00 63.50 59.89 1rjh n PRO 173 Cb 0.65 -1.93 -0.05 0.00 -0.02 0.00 0.00 33.50 32.15 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 -2.12 0.08 -0.11 6.00 1.13 0.11 -3.97 117.35 118.48 1rjh s TYR 174 Ca 0.67 -0.43 -0.03 0.00 -1.41 0.00 0.00 57.07 55.87 1rjh s TYR 174 Cb -0.12 0.18 0.04 0.00 -1.10 0.00 0.00 41.96 40.96 1rjh s TYR 174 CO 0.57 -0.79 0.06 0.42 -2.51 0.00 0.00 175.55 173.30 1rjh s ILE 175 N -3.90 0.01 0.12 -3.49 1.01 -1.26 -4.28 121.20 109.41 1rjh s ILE 175 Ca 0.11 0.09 0.03 0.00 0.00 0.00 0.00 60.65 60.88 1rjh s ILE 175 Cb 0.01 -0.43 -0.04 0.00 0.01 0.00 0.00 42.46 42.02 1rjh s ILE 175 CO -0.04 -0.01 0.21 0.00 0.00 0.00 0.00 174.94 175.10 1rjh s GLN 177 N -2.95 3.34 -0.12 0.00 -0.21 -0.88 -4.71 119.66 114.14 1rjh s GLN 177 Ca 0.33 -0.25 -0.05 0.00 0.02 0.00 0.00 55.36 55.41 1rjh s GLN 177 Cb -0.11 -3.94 -0.04 0.00 1.00 0.00 0.00 33.01 29.92 1rjh s GLN 177 CO 0.26 -1.05 0.07 0.12 -2.12 0.00 0.00 175.29 172.58 1rjh s PHE 178 N 3.01 3.36 0.00 0.91 5.36 -1.26 -4.52 117.98 124.84 1rjh s PHE 178 Ca 0.26 0.32 0.00 0.00 -0.96 0.00 0.00 56.93 56.54 1rjh s PHE 178 Cb -0.13 -1.90 0.00 0.00 -0.34 0.00 0.00 43.02 40.65 1rjh s PHE 178 CO 0.20 0.53 0.00 0.41 -1.46 0.00 0.00 175.22 174.91 1rjh n GLY 179 N 2.31 1.68 1.65 13.12 0.00 -1.26 -4.70 105.19 117.98 1rjh n GLY 179 Ca -0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 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 -6.29 -0.54 -0.61 2.08 -1.26 -5.12 119.36 107.62 1rjh n ILE 180 Ca 0.00 1.08 0.00 0.00 0.56 0.00 0.00 62.75 64.39 1rjh n ILE 180 Cb 0.00 -4.31 0.00 0.00 -0.75 0.00 0.00 39.64 34.58 1rjh n ILE 180 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63