#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 0.05 -2.79 4.37 -1.04 -1.26 -1.03 114.28 112.58 1rjh n THR 65 Ca 0.00 -0.04 -0.40 0.00 -2.04 0.00 0.00 64.05 61.57 1rjh n THR 65 Cb 0.00 -0.14 -0.05 0.00 -1.82 0.00 0.00 70.33 68.32 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 -1.70 4.74 -0.15 -2.82 0.74 -1.26 -4.71 119.66 114.50 1rjh s GLN 66 Ca 0.02 1.40 -0.15 0.00 0.05 0.00 0.00 55.36 56.68 1rjh s GLN 66 Cb 0.01 -3.32 -0.05 0.00 1.10 0.00 0.00 33.01 30.76 1rjh s GLN 66 CO 0.01 0.40 0.33 0.95 -0.55 0.00 0.00 175.29 176.43 1rjh s THR 67 N -0.68 5.28 0.38 -0.34 -4.23 -1.26 -3.73 115.64 111.06 1rjh s THR 67 Ca 0.42 0.64 -0.11 0.00 -1.18 0.00 0.00 61.69 61.46 1rjh s THR 67 Cb -0.24 -3.67 0.04 0.00 1.34 0.00 0.00 72.50 69.96 1rjh s THR 67 CO 0.30 0.38 0.69 -1.59 -0.54 0.00 0.00 174.62 173.86 1rjh s LYS 68 N 0.45 2.15 0.62 3.99 0.00 -0.49 -4.72 119.74 121.73 1rjh s LYS 68 Ca 0.19 -1.55 -0.06 0.00 0.00 0.00 0.00 55.97 54.54 1rjh s LYS 68 Cb -0.13 0.57 0.02 0.00 0.00 0.00 0.00 37.83 38.28 1rjh s LYS 68 CO 0.05 -0.97 0.93 0.95 0.00 0.00 0.00 175.35 176.31 1rjh s THR 69 N -2.52 3.33 0.14 3.79 -4.23 -1.26 -1.78 115.64 113.11 1rjh s THR 69 Ca 0.20 -0.05 -0.17 0.00 -1.18 0.00 0.00 61.69 60.49 1rjh s THR 69 Cb -0.04 -3.35 -0.02 0.00 1.34 0.00 0.00 72.50 70.44 1rjh s THR 69 CO 0.15 -0.36 1.80 0.15 -0.54 0.00 0.00 174.62 175.81 1rjh h PHE 70 N -0.28 0.39 -0.61 3.99 3.04 -1.60 0.44 116.94 122.31 1rjh h PHE 70 Ca -0.45 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.51 1rjh h PHE 70 Cb 1.27 -0.13 -0.03 0.00 2.56 0.00 0.00 35.95 39.62 1rjh h PHE 70 CO 0.44 0.24 0.37 1.25 -2.02 0.00 0.00 178.31 178.59 1rjh h HIS 71 N 0.42 0.79 -0.23 0.41 2.76 -1.95 0.75 115.15 118.11 1rjh h HIS 71 Ca 0.12 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.27 1rjh h HIS 71 Cb -0.03 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 28.66 1rjh h HIS 71 CO -0.06 0.54 0.05 0.93 -1.30 0.00 0.00 177.93 178.08 1rjh h GLU 72 N 0.82 0.38 -0.96 5.26 5.08 -1.82 -2.84 114.58 120.50 1rjh h GLU 72 Ca 0.22 -0.10 0.07 0.00 -1.00 0.00 0.00 59.36 58.56 1rjh h GLU 72 Cb -0.03 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.11 1rjh h GLU 72 CO -0.04 0.50 0.62 0.00 -1.00 0.00 0.00 179.01 179.09 1rjh h ALA 73 N 0.86 1.48 0.83 3.43 0.00 0.43 0.57 119.26 126.86 1rjh h ALA 73 Ca 0.07 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1rjh h ALA 73 Cb 0.30 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1rjh h ALA 73 CO 0.00 0.36 -0.49 1.03 0.00 0.00 0.00 179.25 180.15 1rjh h SER 74 N 1.07 -1.24 0.06 0.00 0.87 -0.72 -0.58 113.55 113.01 1rjh h SER 74 Ca 0.42 0.07 -0.08 0.00 -1.23 0.00 0.00 61.79 60.97 1rjh h SER 74 Cb 0.24 0.36 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 1rjh h SER 74 CO -0.17 -0.77 -0.24 -0.33 -0.53 0.00 0.00 176.83 174.79 1rjh h GLU 75 N -1.23 0.31 -0.74 2.24 5.08 -1.23 0.12 114.58 119.12 1rjh h GLU 75 Ca -0.11 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1rjh h GLU 75 Cb 0.98 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 1rjh h GLU 75 CO 0.12 0.54 0.36 0.22 -1.00 0.00 0.00 179.01 179.26 1rjh h ASP 76 N 0.28 0.95 0.15 1.42 3.58 0.29 -2.70 116.42 120.39 1rjh h ASP 76 Ca 0.05 -0.10 -0.36 0.00 0.42 0.00 0.00 57.03 57.04 1rjh h ASP 76 Cb 0.58 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 41.35 1rjh h ASP 76 CO 0.04 0.80 -2.10 0.00 -2.88 0.00 0.00 179.24 175.10 1rjh h ILE 78 N 0.03 1.14 -0.03 0.00 5.03 -0.79 -2.12 117.51 120.78 1rjh h ILE 78 Ca -0.45 -0.29 0.00 0.00 -0.12 0.00 0.00 64.86 64.01 1rjh h ILE 78 Cb 2.02 0.24 0.00 0.00 -3.03 0.00 0.00 36.82 36.05 1rjh h ILE 78 CO 0.04 0.15 -0.05 -0.24 -0.68 0.00 0.00 178.15 177.37 1rjh n SER 79 N -4.45 2.73 -0.49 1.72 2.88 -1.02 -3.46 113.62 111.54 1rjh n SER 79 Ca 0.07 -1.89 0.08 0.00 -1.33 0.00 0.00 58.87 55.80 1rjh n SER 79 Cb 0.07 0.05 0.03 0.00 -0.75 0.00 0.00 64.21 63.60 1rjh n SER 79 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1rjh n ARG 80 N 1.08 1.56 0.00 -1.46 1.85 -0.84 -4.94 116.66 113.91 1rjh n ARG 80 Ca 0.14 -1.08 0.00 0.00 -1.00 0.00 0.00 57.85 55.91 1rjh n ARG 80 Cb 0.56 -1.29 0.00 0.00 -1.05 0.00 0.00 32.46 30.68 1rjh n ARG 80 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rjh n GLY 81 N 1.08 -1.02 0.00 2.89 0.00 -0.96 -5.05 105.19 102.12 1rjh n GLY 81 Ca 0.08 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.40 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 -1.85 3.32 -0.02 0.00 -1.00 -4.83 105.19 100.81 1rjh n GLY 82 Ca 0.00 0.73 -0.11 0.00 0.00 0.00 0.00 46.02 46.65 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 0.21 0.02 0.87 2.61 -4.23 -1.12 -3.56 115.64 110.44 1rjh s THR 83 Ca 0.00 -1.76 -0.11 0.00 -1.18 0.00 0.00 61.69 58.64 1rjh s THR 83 Cb 0.00 -2.30 0.12 0.00 1.34 0.00 0.00 72.50 71.65 1rjh s THR 83 CO 0.00 -0.08 1.10 -0.76 -0.54 0.00 0.00 174.62 174.34 1rjh s LEU 84 N -3.09 2.52 -0.55 4.79 2.01 -1.26 -0.15 118.68 122.96 1rjh s LEU 84 Ca 0.31 1.70 -0.28 0.00 0.01 0.00 0.00 54.13 55.86 1rjh s LEU 84 Cb 0.04 -4.18 0.03 0.00 0.01 0.00 0.00 46.19 42.09 1rjh s LEU 84 CO 0.09 -2.59 1.19 -0.44 1.01 0.00 0.00 176.35 175.61 1rjh s SER 85 N -3.26 6.49 -0.29 2.29 0.01 -0.87 -4.38 113.70 113.68 1rjh s SER 85 Ca 0.63 0.23 -0.11 0.00 1.31 0.00 0.00 55.95 58.01 1rjh s SER 85 Cb -0.19 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 1rjh s SER 85 CO 0.57 -1.43 0.20 -0.89 0.41 0.00 0.00 173.24 172.10 1rjh s THR 86 N 4.87 5.30 -0.20 1.44 2.01 -1.26 -4.59 115.64 123.20 1rjh s THR 86 Ca 0.45 0.09 -0.25 0.00 0.31 0.00 0.00 61.69 62.29 1rjh s THR 86 Cb -0.08 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 1rjh s THR 86 CO 0.27 0.20 0.84 -2.16 -0.69 0.00 0.00 174.62 173.08 1rjh s PRO 87 N 1.75 4.25 0.00 4.92 0.04 -1.26 -4.89 135.00 139.80 1rjh s PRO 87 Ca 0.07 1.00 0.01 0.00 0.04 0.00 0.00 61.00 62.12 1rjh s PRO 87 Cb -0.16 -3.61 0.01 0.00 0.04 0.00 0.00 34.50 30.78 1rjh s PRO 87 CO 0.11 -0.42 0.67 0.00 0.04 0.00 0.00 177.00 177.40 1rjh n GLN 88 N 5.62 0.23 -3.97 4.56 10.64 -1.26 -4.91 117.38 128.29 1rjh n GLN 88 Ca 0.05 -0.84 -0.12 0.00 -1.83 0.00 0.00 57.00 54.26 1rjh n GLN 88 Cb 0.48 -1.02 -0.02 0.00 -0.86 0.00 0.00 30.24 28.82 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 -0.35 0.00 0.21 -0.39 2.01 -1.26 -4.53 115.64 111.34 1rjh s THR 89 Ca 0.02 -1.35 -0.07 0.00 0.31 0.00 0.00 61.69 60.60 1rjh s THR 89 Cb 0.01 -2.65 0.11 0.00 0.01 0.00 0.00 72.50 69.98 1rjh s THR 89 CO 0.01 0.00 1.72 1.23 -0.69 0.00 0.00 174.62 176.89 1rjh h GLY 90 N 2.08 1.13 0.32 4.40 0.00 -1.99 -2.54 103.07 106.47 1rjh h GLY 90 Ca -0.29 -0.74 0.09 0.00 0.00 0.00 0.00 47.33 46.39 1rjh h GLY 90 CO 0.38 0.69 0.08 1.76 0.00 0.00 0.00 176.54 179.45 1rjh h SER 91 N 0.99 -0.04 -0.29 0.19 0.02 -1.99 -0.21 113.55 112.22 1rjh h SER 91 Ca 0.20 0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 61.11 1rjh h SER 91 Cb 0.42 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1rjh h SER 91 CO 0.01 0.01 -0.29 -0.33 -1.14 0.00 0.00 176.83 175.09 1rjh h GLU 92 N 0.21 0.80 -0.53 3.45 3.07 -1.92 0.74 114.58 120.40 1rjh h GLU 92 Ca 0.25 -0.36 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1rjh h GLU 92 Cb 0.34 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 1rjh h GLU 92 CO -0.34 0.98 0.34 -0.97 -1.40 0.00 0.00 179.01 177.63 1rjh h ASN 93 N 0.68 0.61 -0.23 1.42 -1.24 -0.89 0.11 115.58 116.03 1rjh h ASN 93 Ca 0.08 -0.02 -0.05 0.00 0.71 0.00 0.00 56.30 57.01 1rjh h ASN 93 Cb 0.82 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.71 1rjh h ASN 93 CO 0.07 0.45 -0.06 0.44 -1.29 0.00 0.00 177.43 177.04 1rjh h ASP 94 N 0.71 0.45 -0.59 1.15 3.32 -0.93 -3.04 116.42 117.49 1rjh h ASP 94 Ca 0.19 -0.37 0.07 0.00 0.02 0.00 0.00 57.03 56.94 1rjh h ASP 94 Cb -0.07 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.30 1rjh h ASP 94 CO -0.04 0.72 0.27 0.00 -1.72 0.00 0.00 179.24 178.46 1rjh h ALA 95 N 0.75 0.77 0.29 3.45 0.00 -0.39 0.40 119.26 124.53 1rjh h ALA 95 Ca 0.06 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1rjh h ALA 95 Cb 0.52 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1rjh h ALA 95 CO 0.02 -0.11 -0.14 -0.07 0.00 0.00 0.00 179.25 178.95 1rjh h LEU 96 N 0.49 -0.34 -1.33 0.00 3.38 -1.01 0.20 115.31 116.71 1rjh h LEU 96 Ca 0.28 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1rjh h LEU 96 Cb 0.27 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1rjh h LEU 96 CO -0.24 -0.22 0.38 0.22 0.09 0.00 0.00 178.44 178.68 1rjh h TYR 97 N -0.42 0.81 0.00 1.13 3.20 -1.34 0.18 116.97 120.54 1rjh h TYR 97 Ca -0.04 0.01 -0.24 0.00 3.14 0.00 0.00 58.73 61.59 1rjh h TYR 97 Cb 0.32 -0.27 0.01 0.00 1.54 0.00 0.00 36.73 38.33 1rjh h TYR 97 CO -0.05 0.53 -0.99 0.93 -1.64 0.00 0.00 178.16 176.94 1rjh h GLU 98 N 0.86 0.53 -0.09 1.82 4.39 -0.73 -2.97 114.58 118.39 1rjh h GLU 98 Ca 0.23 -0.58 -0.18 0.00 0.34 0.00 0.00 59.36 59.17 1rjh h GLU 98 Cb -0.05 0.17 0.01 0.00 -0.10 0.00 0.00 28.75 28.78 1rjh h GLU 98 CO -0.04 1.20 -0.63 -0.92 -1.16 0.00 0.00 179.01 177.46 1rjh h TYR 99 N 0.30 0.81 0.00 4.33 3.20 -0.09 -3.17 116.97 122.34 1rjh h TYR 99 Ca -0.10 -0.38 -0.02 0.00 3.14 0.00 0.00 58.73 61.37 1rjh h TYR 99 Cb 1.64 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.79 1rjh h TYR 99 CO 0.08 1.18 -0.10 1.37 -1.64 0.00 0.00 178.16 179.04 1rjh h LEU 100 N 0.21 0.00 -1.70 2.82 8.10 -0.72 -1.54 115.31 122.49 1rjh h LEU 100 Ca -0.05 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 57.90 1rjh h LEU 100 Cb 1.28 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.50 1rjh h LEU 100 CO 0.13 0.10 -0.18 -0.09 -4.11 0.00 0.00 178.44 174.29 1rjh h ARG 101 N 0.00 0.00 -0.21 0.17 2.43 -1.49 0.48 114.38 115.75 1rjh h ARG 101 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1rjh h ARG 101 Cb 0.32 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1rjh h ARG 101 CO 0.01 0.18 0.00 0.00 -1.51 0.00 0.00 179.97 178.65 1rjh n GLN 102 N -3.78 2.84 0.03 0.20 10.64 -0.61 -4.18 117.38 122.52 1rjh n GLN 102 Ca -0.02 -1.97 0.00 0.00 -1.83 0.00 0.00 57.00 53.18 1rjh n GLN 102 Cb 0.28 -1.25 0.00 0.00 -0.86 0.00 0.00 30.24 28.42 1rjh n GLN 102 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1rjh n SER 103 N 0.00 -0.01 -0.10 2.61 3.41 -1.00 -4.93 113.62 113.60 1rjh n SER 103 Ca 0.09 0.11 -0.11 0.00 -0.26 0.00 0.00 58.87 58.71 1rjh n SER 103 Cb 0.42 0.08 -0.16 0.00 -0.26 0.00 0.00 64.21 64.30 1rjh n SER 103 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1rjh n VAL 104 N -2.78 1.40 0.00 -3.33 0.31 0.11 -4.90 118.33 109.15 1rjh n VAL 104 Ca 0.00 -0.84 0.00 0.00 -0.01 0.00 0.00 64.34 63.49 1rjh n VAL 104 Cb 0.04 -0.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.43 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 1.78 2.99 0.33 2.92 0.00 0.14 -4.77 105.19 108.59 1rjh n GLY 105 Ca -0.34 -1.26 0.22 0.00 0.00 0.00 0.00 46.02 44.64 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 0.00 -0.33 1.61 -1.24 -1.73 -0.65 115.58 113.24 1rjh h ASN 106 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1rjh h ASN 106 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 1rjh h ASN 106 CO 0.00 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.52 1rjh n GLU 107 N -3.19 2.75 -3.83 6.67 1.02 -1.26 -2.11 120.64 120.69 1rjh n GLU 107 Ca -0.03 -1.60 -0.21 0.00 -0.02 0.00 0.00 57.16 55.30 1rjh n GLU 107 Cb 0.07 -1.74 -0.02 0.00 -0.02 0.00 0.00 31.44 29.73 1rjh n GLU 107 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rjh s ALA 108 N -1.81 3.97 -0.14 0.62 0.00 -0.25 -4.26 121.76 119.89 1rjh s ALA 108 Ca 0.28 -1.36 0.01 0.00 0.00 0.00 0.00 51.96 50.89 1rjh s ALA 108 Cb 0.20 -1.61 -0.01 0.00 0.00 0.00 0.00 23.12 21.70 1rjh s ALA 108 CO 0.11 0.14 -0.16 -1.83 0.00 0.00 0.00 175.76 174.02 1rjh s GLU 109 N -4.02 3.24 0.11 0.00 -1.05 -1.26 -1.04 118.70 114.69 1rjh s GLU 109 Ca 0.38 -0.75 0.10 0.00 -0.15 0.00 0.00 54.97 54.54 1rjh s GLU 109 Cb -0.09 -2.57 -0.04 0.00 -0.44 0.00 0.00 34.13 30.99 1rjh s GLU 109 CO 0.29 0.11 -0.24 0.42 0.95 0.00 0.00 175.26 176.78 1rjh s ILE 110 N 0.59 2.02 0.65 1.83 1.09 -0.11 -3.35 121.20 123.92 1rjh s ILE 110 Ca -0.09 -1.64 -0.15 0.00 -1.10 0.00 0.00 60.65 57.67 1rjh s ILE 110 Cb -0.16 -1.80 -0.01 0.00 -1.06 0.00 0.00 42.46 39.43 1rjh s ILE 110 CO 0.03 0.05 1.11 0.26 -0.10 0.00 0.00 174.94 176.29 1rjh s TRP 111 N -1.08 2.65 -2.33 3.97 0.52 -1.25 0.13 118.94 121.55 1rjh s TRP 111 Ca 0.11 1.55 0.28 0.00 0.02 0.00 0.00 56.10 58.06 1rjh s TRP 111 Cb -0.10 -3.16 1.15 0.00 -1.15 0.00 0.00 33.47 30.20 1rjh s TRP 111 CO 0.05 -1.64 1.80 -0.11 0.02 0.00 0.00 176.95 177.06 1rjh n LEU 112 N -2.33 1.21 -0.19 2.99 -0.00 -1.04 -4.71 117.00 112.94 1rjh n LEU 112 Ca 0.10 -0.39 -0.03 0.00 -0.00 0.00 0.00 56.01 55.70 1rjh n LEU 112 Cb 0.52 -0.02 -0.01 0.00 -0.00 0.00 0.00 43.42 43.91 1rjh n LEU 112 CO 0.47 0.20 -0.02 0.61 -0.00 0.00 0.00 177.39 178.65 1rjh n GLY 113 N 1.17 0.50 3.89 -3.96 0.00 -1.26 -4.51 105.19 101.02 1rjh n GLY 113 Ca 0.19 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.58 4.27 -0.40 0.99 1.02 -1.26 -1.72 118.68 121.00 1rjh s LEU 114 Ca 0.00 0.66 -0.17 0.00 0.02 0.00 0.00 54.13 54.64 1rjh s LEU 114 Cb 0.00 -3.30 0.01 0.00 0.02 0.00 0.00 46.19 42.92 1rjh s LEU 114 CO 0.00 0.06 0.41 0.20 0.02 0.00 0.00 176.35 177.04 1rjh s ASN 115 N -2.32 6.19 -0.75 2.29 0.02 0.17 -4.85 114.94 115.69 1rjh s ASN 115 Ca 0.40 -0.56 -0.26 0.00 -1.02 0.00 0.00 52.86 51.42 1rjh s ASN 115 Cb -0.12 -2.21 0.02 0.00 0.02 0.00 0.00 41.25 38.95 1rjh s ASN 115 CO 0.23 -0.51 1.48 -0.62 0.02 0.00 0.00 177.10 177.70 1rjh s ASP 116 N 1.78 5.93 0.00 -1.22 2.15 -1.26 -4.27 116.67 119.77 1rjh s ASP 116 Ca 0.12 -0.38 0.00 0.00 0.43 0.00 0.00 52.55 52.72 1rjh s ASP 116 Cb -0.17 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 1rjh s ASP 116 CO 0.13 -1.98 0.00 0.80 -0.17 0.00 0.00 175.17 173.95 1rjh n MET 117 N 9.25 2.50 -4.34 4.34 1.56 -1.26 -5.03 117.12 124.13 1rjh n MET 117 Ca 0.13 0.00 -0.29 0.00 -0.27 0.00 0.00 57.70 57.27 1rjh n MET 117 Cb 0.50 -0.84 -0.12 0.00 2.15 0.00 0.00 33.22 34.91 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 -1.59 2.56 -2.24 -5.12 0.00 -1.26 -4.99 121.76 109.11 1rjh s ALA 118 Ca 0.00 -1.42 0.20 0.00 0.00 0.00 0.00 51.96 50.75 1rjh s ALA 118 Cb 0.00 -0.53 0.53 0.00 0.00 0.00 0.00 23.12 23.12 1rjh s ALA 118 CO 0.00 0.56 1.44 0.00 0.00 0.00 0.00 175.76 177.76 1rjh n ALA 119 N 0.80 2.44 -2.01 0.00 0.00 -1.26 -4.91 120.51 115.57 1rjh n ALA 119 Ca -0.16 -0.88 -0.22 0.00 0.00 0.00 0.00 53.44 52.18 1rjh n ALA 119 Cb 0.53 -0.96 0.04 0.00 0.00 0.00 0.00 19.45 19.06 1rjh n ALA 119 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1rjh s GLU 120 N -1.47 2.57 0.00 0.00 2.02 -1.26 -4.97 118.70 115.59 1rjh s GLU 120 Ca 0.37 -0.68 0.19 0.00 0.02 0.00 0.00 54.97 54.87 1rjh s GLU 120 Cb 0.20 -2.46 0.99 0.00 0.10 0.00 0.00 34.13 32.96 1rjh s GLU 120 CO 0.28 -0.72 1.57 0.41 0.02 0.00 0.00 175.26 176.82 1rjh n GLY 121 N -2.38 -0.85 2.73 -1.39 0.00 -1.26 -4.29 105.19 97.75 1rjh n GLY 121 Ca 0.07 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1rjh n GLY 121 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rjh n THR 122 N -1.23 3.16 -2.66 2.61 -1.04 -1.26 -4.93 114.28 108.93 1rjh n THR 122 Ca 0.10 -2.50 -0.41 0.00 -2.04 0.00 0.00 64.05 59.19 1rjh n THR 122 Cb 0.13 -2.51 -0.04 0.00 -1.82 0.00 0.00 70.33 66.09 1rjh n THR 122 CO 0.00 0.00 0.00 0.26 -0.64 0.00 0.00 175.07 174.69 1rjh s TRP 123 N 3.44 3.73 -0.12 -1.42 0.52 -1.26 -4.81 118.94 119.02 1rjh s TRP 123 Ca 0.53 1.72 -0.03 0.00 0.02 0.00 0.00 56.10 58.34 1rjh s TRP 123 Cb 0.14 -3.13 -0.03 0.00 -1.15 0.00 0.00 33.47 29.30 1rjh s TRP 123 CO -0.03 -0.09 -0.02 0.08 0.02 0.00 0.00 176.95 176.90 1rjh s VAL 124 N 0.06 4.04 0.48 4.03 1.01 -1.26 -2.58 120.40 126.18 1rjh s VAL 124 Ca 0.48 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 1rjh s VAL 124 Cb -0.25 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 1rjh s VAL 124 CO 0.31 0.54 0.79 -0.62 0.00 0.00 0.00 175.10 176.12 1rjh s ASP 125 N -0.20 6.27 0.41 3.32 -1.08 0.58 0.44 116.67 126.42 1rjh s ASP 125 Ca 0.04 0.94 0.16 0.00 -0.52 0.00 0.00 52.55 53.17 1rjh s ASP 125 Cb -0.13 -2.25 0.90 0.00 -1.46 0.00 0.00 42.92 39.98 1rjh s ASP 125 CO 0.02 -0.58 1.89 0.00 0.52 0.00 0.00 175.17 177.03 1rjh h MET 126 N 0.25 0.00 0.00 4.34 -0.00 -1.63 -2.51 114.93 115.38 1rjh h MET 126 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.23 1rjh h MET 126 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.80 1rjh h MET 126 CO 0.62 0.30 0.00 0.25 -0.00 0.00 0.00 176.91 178.07 1rjh n THR 127 N -3.99 0.49 0.00 -0.10 -2.24 -1.26 -4.85 114.28 102.33 1rjh n THR 127 Ca -0.02 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1rjh n THR 127 Cb 0.36 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 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 0.91 1.17 3.72 3.38 0.00 -0.94 -5.10 105.19 108.33 1rjh n GLY 128 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 3.60 -0.37 4.61 0.00 -1.25 -4.90 121.76 121.45 1rjh s ALA 129 Ca 0.00 -0.71 -0.18 0.00 0.00 0.00 0.00 51.96 51.08 1rjh s ALA 129 Cb 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 23.12 21.12 1rjh s ALA 129 CO 0.00 0.28 0.48 0.50 0.00 0.00 0.00 175.76 177.02 1rjh s ARG 130 N 0.02 3.48 0.27 0.00 3.00 -1.26 -0.31 118.95 124.15 1rjh s ARG 130 Ca 0.08 -0.34 -0.29 0.00 -1.00 0.00 0.00 55.73 54.17 1rjh s ARG 130 Cb -0.12 -3.85 -0.09 0.00 0.00 0.00 0.00 34.95 30.89 1rjh s ARG 130 CO 0.00 -0.69 1.19 0.96 0.00 0.00 0.00 175.30 176.76 1rjh s ILE 131 N 2.31 3.28 -0.12 4.11 -4.36 -1.06 -4.91 121.20 120.45 1rjh s ILE 131 Ca 0.16 1.22 0.12 0.00 -0.26 0.00 0.00 60.65 61.90 1rjh s ILE 131 Cb -0.16 -3.78 -0.18 0.00 1.25 0.00 0.00 42.46 39.59 1rjh s ILE 131 CO 0.14 0.27 0.31 0.00 0.24 0.00 0.00 174.94 175.90 1rjh n ALA 132 N 1.45 2.66 -2.67 2.27 0.00 -1.26 -4.64 120.51 118.32 1rjh n ALA 132 Ca 0.01 -0.30 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 1rjh n ALA 132 Cb 0.44 -0.43 -0.03 0.00 0.00 0.00 0.00 19.45 19.43 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 -2.73 3.40 -0.04 0.00 5.04 -1.26 -5.02 117.35 116.74 1rjh s TYR 133 Ca -0.03 1.46 -0.01 0.00 -2.44 0.00 0.00 57.07 56.05 1rjh s TYR 133 Cb 0.08 -3.20 0.03 0.00 0.35 0.00 0.00 41.96 39.22 1rjh s TYR 133 CO 0.51 -0.37 0.04 0.15 -1.34 0.00 0.00 175.55 174.55 1rjh s LYS 134 N 2.68 0.06 -0.17 4.97 1.02 -1.26 -4.94 119.74 122.09 1rjh s LYS 134 Ca 0.44 0.28 -0.01 0.00 0.02 0.00 0.00 55.97 56.70 1rjh s LYS 134 Cb -0.16 -0.52 0.05 0.00 -0.52 0.00 0.00 37.83 36.67 1rjh s LYS 134 CO 0.11 -0.28 -0.02 0.54 -0.92 0.00 0.00 175.35 174.78 1rjh s ASN 135 N 1.84 2.86 -0.12 2.83 2.20 -1.26 -5.12 114.94 118.17 1rjh s ASN 135 Ca 0.01 -0.72 0.01 0.00 -0.94 0.00 0.00 52.86 51.22 1rjh s ASN 135 Cb -0.12 -0.79 0.02 0.00 -2.00 0.00 0.00 41.25 38.36 1rjh s ASN 135 CO -0.03 -0.23 -0.13 0.26 -2.94 0.00 0.00 177.10 174.02 1rjh s TRP 136 N 1.72 1.91 -0.20 1.54 0.52 -1.26 -2.63 118.94 120.53 1rjh s TRP 136 Ca -0.00 -0.96 0.26 0.00 0.02 0.00 0.00 56.10 55.42 1rjh s TRP 136 Cb -0.16 -1.42 0.71 0.00 -1.15 0.00 0.00 33.47 31.45 1rjh s TRP 136 CO -0.07 -0.53 1.74 1.49 0.02 0.00 0.00 176.95 179.60 1rjh h GLU 137 N 7.73 0.00 -0.22 4.98 4.57 -1.86 -3.06 114.58 126.73 1rjh h GLU 137 Ca -0.33 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 57.75 1rjh h GLU 137 Cb 1.15 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.69 1rjh h GLU 137 CO 0.49 0.05 -0.18 -2.37 -1.18 0.00 0.00 179.01 175.82 1rjh n THR 138 N -3.13 2.38 -1.76 0.32 5.66 -1.26 -5.02 114.28 111.48 1rjh n THR 138 Ca 0.02 -2.75 -0.43 0.00 -3.05 0.00 0.00 64.05 57.85 1rjh n THR 138 Cb 0.46 -0.29 -0.03 0.00 -1.55 0.00 0.00 70.33 68.93 1rjh n THR 138 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1rjh s GLU 139 N -3.17 3.57 0.09 1.09 2.12 -1.16 -4.93 118.70 116.32 1rjh s GLU 139 Ca 0.41 2.08 -0.30 0.00 0.36 0.00 0.00 54.97 57.52 1rjh s GLU 139 Cb 0.38 -4.23 -0.06 0.00 0.26 0.00 0.00 34.13 30.47 1rjh s GLU 139 CO -0.01 -1.59 1.21 0.96 -0.54 0.00 0.00 175.26 175.29 1rjh s ILE 140 N 6.46 3.89 -0.15 -3.70 -4.36 -1.26 -4.91 121.20 117.18 1rjh s ILE 140 Ca 0.90 1.41 0.19 0.00 -0.26 0.00 0.00 60.65 62.88 1rjh s ILE 140 Cb -0.33 -3.90 -0.13 0.00 1.25 0.00 0.00 42.46 39.35 1rjh s ILE 140 CO 0.36 0.14 0.79 0.35 0.24 0.00 0.00 174.94 176.82 1rjh n THR 141 N 3.57 0.91 -4.33 8.37 -2.24 -1.26 -4.89 114.28 114.41 1rjh n THR 141 Ca 0.08 -0.64 -0.22 0.00 -2.27 0.00 0.00 64.05 61.00 1rjh n THR 141 Cb 0.46 -0.53 -0.13 0.00 -2.10 0.00 0.00 70.33 68.03 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 -3.08 1.45 -0.43 6.98 0.00 -1.26 -5.10 121.76 120.32 1rjh s ALA 142 Ca -0.03 -1.03 -0.29 0.00 0.00 0.00 0.00 51.96 50.61 1rjh s ALA 142 Cb 0.09 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.02 1rjh s ALA 142 CO 0.82 0.28 1.34 -1.14 0.00 0.00 0.00 175.76 177.05 1rjh s GLN 143 N -1.53 3.61 -0.01 0.00 0.74 -1.26 -4.94 119.66 116.28 1rjh s GLN 143 Ca 0.03 0.83 -0.08 0.00 0.05 0.00 0.00 55.36 56.19 1rjh s GLN 143 Cb -0.09 -4.00 -0.05 0.00 1.10 0.00 0.00 33.01 29.98 1rjh s GLN 143 CO 0.02 -1.52 0.65 -1.35 -0.55 0.00 0.00 175.29 172.54 1rjh h PRO 144 N 10.32 -0.29 -1.88 1.67 0.11 -1.97 -3.34 132.00 136.62 1rjh h PRO 144 Ca -0.26 0.02 -0.26 0.00 0.11 0.00 0.00 66.00 65.61 1rjh h PRO 144 Cb 1.09 0.07 -0.10 0.00 0.11 0.00 0.00 31.00 32.17 1rjh h PRO 144 CO 1.10 -0.20 0.09 -3.47 -0.21 0.00 0.00 178.00 175.31 1rjh n ASP 145 N -3.40 5.87 -3.51 -2.05 -0.08 -1.22 -4.74 116.55 107.43 1rjh n ASP 145 Ca -0.04 -2.79 -0.26 0.00 -1.51 0.00 0.00 54.79 50.20 1rjh n ASP 145 Cb 0.12 -1.22 0.00 0.00 2.34 0.00 0.00 41.12 42.36 1rjh n ASP 145 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1rjh n GLY 146 N 1.35 -0.49 0.00 0.27 0.00 -1.25 -1.46 105.19 103.60 1rjh n GLY 146 Ca 0.32 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.33 1.88 3.75 -0.02 0.00 -1.26 -5.09 105.19 103.12 1rjh n GLY 147 Ca -0.00 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 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 4.63 0.01 1.61 2.20 -0.54 -5.05 119.74 122.59 1rjh s LYS 148 Ca 0.00 1.26 0.01 0.00 -0.36 0.00 0.00 55.97 56.88 1rjh s LYS 148 Cb 0.00 -3.33 -0.01 0.00 -1.51 0.00 0.00 37.83 32.99 1rjh s LYS 148 CO 0.00 0.38 -0.04 0.95 -0.36 0.00 0.00 175.35 176.28 1rjh s THR 149 N -0.50 0.26 0.43 3.43 -4.23 -1.26 -3.36 115.64 110.40 1rjh s THR 149 Ca 0.40 -0.35 -0.25 0.00 -1.18 0.00 0.00 61.69 60.32 1rjh s THR 149 Cb -0.23 -0.27 -0.08 0.00 1.34 0.00 0.00 72.50 73.26 1rjh s THR 149 CO 0.27 -0.06 1.32 -1.61 -0.54 0.00 0.00 174.62 174.00 1rjh s GLU 150 N -0.43 3.83 0.45 3.99 8.01 -1.26 -5.02 118.70 128.26 1rjh s GLU 150 Ca -0.02 2.18 0.03 0.00 0.01 0.00 0.00 54.97 57.17 1rjh s GLU 150 Cb -0.03 -2.67 -0.03 0.00 -4.31 0.00 0.00 34.13 27.09 1rjh s GLU 150 CO -0.00 -0.62 0.03 0.54 0.01 0.00 0.00 175.26 175.23 1rjh s ASN 151 N -0.76 3.66 -0.02 -0.19 4.22 -1.26 -4.96 114.94 115.63 1rjh s ASN 151 Ca 0.59 -1.57 -0.02 0.00 -2.14 0.00 0.00 52.86 49.72 1rjh s ASN 151 Cb -0.38 0.27 0.01 0.00 1.28 0.00 0.00 41.25 42.43 1rjh s ASN 151 CO 0.49 -0.76 0.04 0.00 -2.04 0.00 0.00 177.10 174.83 1rjh s ALA 153 N -0.34 3.32 0.01 0.00 0.00 -1.26 -1.02 121.76 122.47 1rjh s ALA 153 Ca -0.05 0.69 0.02 0.00 0.00 0.00 0.00 51.96 52.62 1rjh s ALA 153 Cb 0.00 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 1rjh s ALA 153 CO 0.14 -0.03 -0.07 0.08 0.00 0.00 0.00 175.76 175.88 1rjh s VAL 154 N -0.51 0.51 -0.49 0.00 1.01 0.13 -2.48 120.40 118.57 1rjh s VAL 154 Ca 0.46 -0.58 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 1rjh s VAL 154 Cb -0.27 -0.49 0.07 0.00 0.00 0.00 0.00 36.38 35.69 1rjh s VAL 154 CO 0.33 -0.06 0.47 -0.22 0.00 0.00 0.00 175.10 175.61 1rjh s LEU 155 N -0.71 5.46 -0.38 3.92 2.96 0.12 -0.16 118.68 129.89 1rjh s LEU 155 Ca -0.02 -1.23 -0.13 0.00 -0.22 0.00 0.00 54.13 52.53 1rjh s LEU 155 Cb -0.05 -2.26 0.02 0.00 0.50 0.00 0.00 46.19 44.40 1rjh s LEU 155 CO 0.00 -0.73 0.25 -0.44 -1.32 0.00 0.00 176.35 174.11 1rjh s SER 156 N 2.67 5.93 0.22 3.68 0.01 -1.25 -0.93 113.70 124.02 1rjh s SER 156 Ca 0.07 -0.84 0.11 0.00 1.31 0.00 0.00 55.95 56.61 1rjh s SER 156 Cb -0.23 -2.10 0.06 0.00 0.21 0.00 0.00 66.02 63.96 1rjh s SER 156 CO 0.08 -0.38 1.43 1.23 0.41 0.00 0.00 173.24 176.01 1rjh h GLY 157 N 8.52 0.00 2.00 3.44 0.00 -1.19 -2.81 103.07 113.04 1rjh h GLY 157 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1rjh h GLY 157 CO 0.69 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.23 1rjh n ALA 158 N -2.32 1.49 -0.07 3.60 0.00 -0.90 -3.04 120.51 119.27 1rjh n ALA 158 Ca 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 53.44 53.51 1rjh n ALA 158 Cb 0.78 -1.35 -0.01 0.00 0.00 0.00 0.00 19.45 18.87 1rjh n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rjh h ALA 159 N 2.21 0.00 0.00 0.00 0.00 -1.85 -3.50 119.26 116.12 1rjh h ALA 159 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1rjh h ALA 159 Cb 0.26 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1rjh h ALA 159 CO 0.00 0.46 0.00 0.27 0.00 0.00 0.00 179.25 179.98 1rjh n ASN 160 N -4.54 0.00 0.00 0.00 0.23 -1.17 -5.02 115.26 104.76 1rjh n ASN 160 Ca -0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.99 1rjh n ASN 160 Cb 0.24 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.94 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 -0.48 1.74 3.99 4.83 0.00 -1.07 -4.92 105.19 109.27 1rjh n GLY 161 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.02 2.18 -0.04 1.61 -0.14 -1.26 -4.93 119.74 117.14 1rjh s LYS 162 Ca 0.00 -1.02 -0.27 0.00 -1.36 0.00 0.00 55.97 53.32 1rjh s LYS 162 Cb 0.00 -2.45 -0.03 0.00 -1.68 0.00 0.00 37.83 33.67 1rjh s LYS 162 CO 0.00 -1.01 0.86 -1.58 -0.76 0.00 0.00 175.35 172.86 1rjh s TRP 163 N -2.89 3.61 0.16 3.18 0.51 -1.08 -3.89 118.94 118.53 1rjh s TRP 163 Ca 0.61 1.49 0.01 0.00 -2.12 0.00 0.00 56.10 56.09 1rjh s TRP 163 Cb -0.08 -2.99 -0.00 0.00 -0.81 0.00 0.00 33.47 29.59 1rjh s TRP 163 CO 0.41 0.01 0.02 1.19 -0.51 0.00 0.00 176.95 178.07 1rjh n PHE 164 N 3.95 0.26 -4.73 -1.98 3.72 0.77 -2.85 117.46 116.61 1rjh n PHE 164 Ca 0.03 -0.87 -0.26 0.00 -0.05 0.00 0.00 57.45 56.31 1rjh n PHE 164 Cb 0.51 -0.07 -0.14 0.00 -0.94 0.00 0.00 39.48 38.83 1rjh n PHE 164 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 1rjh s ASP 165 N -1.91 2.43 -0.17 4.37 1.47 -1.26 0.17 116.67 121.77 1rjh s ASP 165 Ca 0.03 -0.48 -0.15 0.00 1.18 0.00 0.00 52.55 53.13 1rjh s ASP 165 Cb 0.00 -0.22 0.05 0.00 -0.34 0.00 0.00 42.92 42.41 1rjh s ASP 165 CO 0.02 0.18 0.45 -0.75 0.68 0.00 0.00 175.17 175.75 1rjh s LYS 166 N -0.98 0.51 0.30 2.11 2.36 -0.19 -4.84 119.74 119.01 1rjh s LYS 166 Ca 0.07 0.65 -0.30 0.00 -2.55 0.00 0.00 55.97 53.85 1rjh s LYS 166 Cb -0.08 0.22 -0.11 0.00 -1.05 0.00 0.00 37.83 36.80 1rjh s LYS 166 CO 0.01 -0.07 1.59 1.03 1.55 0.00 0.00 175.35 179.46 1rjh s ARG 167 N 0.39 4.11 0.65 4.03 0.52 -1.26 -4.46 118.95 122.95 1rjh s ARG 167 Ca -0.01 2.59 0.41 0.00 -0.52 0.00 0.00 55.73 58.20 1rjh s ARG 167 Cb -0.04 -3.02 2.29 0.00 0.52 0.00 0.00 34.95 34.71 1rjh s ARG 167 CO -0.01 -0.63 2.35 0.00 0.02 0.00 0.00 175.30 177.02 1rjh n ARG 169 N -3.27 2.39 -3.56 0.00 3.00 -1.26 -1.72 116.66 112.23 1rjh n ARG 169 Ca -0.03 -2.11 -0.37 0.00 -0.00 0.00 0.00 57.85 55.33 1rjh n ARG 169 Cb 0.08 -1.49 -0.06 0.00 0.00 0.00 0.00 32.46 30.98 1rjh n ARG 169 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1rjh s ASP 170 N -1.37 6.61 -0.26 6.15 -1.08 -0.40 -4.86 116.67 121.47 1rjh s ASP 170 Ca 0.39 0.72 -0.17 0.00 -0.52 0.00 0.00 52.55 52.96 1rjh s ASP 170 Cb 0.22 -2.20 -0.03 0.00 -1.46 0.00 0.00 42.92 39.45 1rjh s ASP 170 CO 0.30 0.24 0.49 -1.10 0.52 0.00 0.00 175.17 175.62 1rjh s GLN 171 N -0.42 4.07 0.22 4.34 -0.21 -1.26 -4.48 119.66 121.92 1rjh s GLN 171 Ca 0.20 0.28 0.04 0.00 0.02 0.00 0.00 55.36 55.90 1rjh s GLN 171 Cb -0.15 -3.64 -0.05 0.00 1.00 0.00 0.00 33.01 30.17 1rjh s GLN 171 CO 0.08 -0.32 -0.01 -0.48 -2.12 0.00 0.00 175.29 172.44 1rjh s LEU 172 N 2.20 2.22 1.13 2.90 0.05 -0.74 -4.58 118.68 121.86 1rjh s LEU 172 Ca 0.20 -1.20 -0.18 0.00 0.05 0.00 0.00 54.13 53.00 1rjh s LEU 172 Cb -0.16 -0.27 0.26 0.00 -2.05 0.00 0.00 46.19 43.98 1rjh s LEU 172 CO 0.09 -0.50 1.18 -2.84 -0.55 0.00 0.00 176.35 173.73 1rjh s PRO 173 N -3.85 -0.68 0.30 1.48 0.02 -1.21 -1.40 135.00 129.66 1rjh s PRO 173 Ca 0.27 -0.20 -0.04 0.00 0.02 0.00 0.00 61.00 61.06 1rjh s PRO 173 Cb 0.05 -1.67 -0.01 0.00 0.02 0.00 0.00 34.50 32.89 1rjh s PRO 173 CO 0.08 -3.33 0.41 1.52 -0.33 0.00 0.00 177.00 175.35 1rjh s TYR 174 N -3.29 1.00 -0.05 6.54 1.13 -0.20 -3.97 117.35 118.51 1rjh s TYR 174 Ca 0.72 -1.22 -0.02 0.00 -1.41 0.00 0.00 57.07 55.14 1rjh s TYR 174 Cb -0.07 -0.14 0.03 0.00 -1.10 0.00 0.00 41.96 40.68 1rjh s TYR 174 CO 0.55 -1.02 0.08 0.42 -2.51 0.00 0.00 175.55 173.07 1rjh s ILE 175 N -3.41 -0.12 -0.02 -3.49 1.01 -1.26 -4.43 121.20 109.48 1rjh s ILE 175 Ca 0.31 0.32 -0.02 0.00 0.00 0.00 0.00 60.65 61.26 1rjh s ILE 175 Cb 0.01 -0.17 -0.04 0.00 0.01 0.00 0.00 42.46 42.26 1rjh s ILE 175 CO 0.18 0.13 0.13 0.00 0.00 0.00 0.00 174.94 175.38 1rjh s GLN 177 N -1.77 2.34 -0.02 0.00 2.00 0.79 -4.73 119.66 118.27 1rjh s GLN 177 Ca 0.24 -1.35 -0.06 0.00 -2.00 0.00 0.00 55.36 52.19 1rjh s GLN 177 Cb -0.12 -3.21 0.01 0.00 0.80 0.00 0.00 33.01 30.48 1rjh s GLN 177 CO 0.15 -0.68 0.14 -0.59 -0.50 0.00 0.00 175.29 173.82 1rjh s PHE 178 N 1.22 -0.05 0.00 1.67 -0.71 -1.26 -2.81 117.98 116.05 1rjh s PHE 178 Ca -0.03 0.10 0.00 0.00 -1.04 0.00 0.00 56.93 55.96 1rjh s PHE 178 Cb -0.20 -0.01 0.00 0.00 -1.21 0.00 0.00 43.02 41.60 1rjh s PHE 178 CO -0.02 -0.19 0.00 0.41 -1.34 0.00 0.00 175.22 174.08 1rjh n GLY 179 N 2.17 2.60 3.35 1.99 0.00 -1.26 -5.00 105.19 109.04 1rjh n GLY 179 Ca -0.18 -1.31 -0.45 0.00 0.00 0.00 0.00 46.02 44.08 1rjh n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rjh s ILE 180 N 0.00 5.08 -2.82 -0.61 1.01 -1.26 -5.21 121.20 117.39 1rjh s ILE 180 Ca 0.00 -1.20 0.23 0.00 0.00 0.00 0.00 60.65 59.68 1rjh s ILE 180 Cb 0.00 -4.34 0.18 0.00 0.01 0.00 0.00 42.46 38.31 1rjh s ILE 180 CO 0.00 -0.88 1.22 0.52 0.00 0.00 0.00 174.94 175.80