#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 0.46 -1.72 4.37 5.66 -1.26 -0.98 114.28 120.81 1rjh n THR 65 Ca 0.00 0.12 -0.42 0.00 -3.05 0.00 0.00 64.05 60.70 1rjh n THR 65 Cb 0.00 -0.75 -0.03 0.00 -1.55 0.00 0.00 70.33 68.00 1rjh n THR 65 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1rjh n GLN 66 N -1.44 2.80 -3.68 1.09 7.27 -1.26 -4.55 117.38 117.62 1rjh n GLN 66 Ca 0.07 1.01 -0.36 0.00 0.07 0.00 0.00 57.00 57.79 1rjh n GLN 66 Cb 0.23 -2.87 -0.08 0.00 2.41 0.00 0.00 30.24 29.94 1rjh n GLN 66 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1rjh s THR 67 N 1.34 5.38 0.31 1.69 -4.23 -1.26 -3.76 115.64 115.12 1rjh s THR 67 Ca 0.76 0.31 -0.18 0.00 -1.18 0.00 0.00 61.69 61.40 1rjh s THR 67 Cb -0.50 -3.52 0.07 0.00 1.34 0.00 0.00 72.50 69.89 1rjh s THR 67 CO 0.33 0.44 0.90 -1.59 -0.54 0.00 0.00 174.62 174.15 1rjh s LYS 68 N 0.25 1.91 0.76 3.99 0.00 -0.41 -4.66 119.74 121.57 1rjh s LYS 68 Ca 0.11 -1.24 -0.12 0.00 0.00 0.00 0.00 55.97 54.73 1rjh s LYS 68 Cb -0.12 0.52 0.05 0.00 0.00 0.00 0.00 37.83 38.28 1rjh s LYS 68 CO 0.01 -0.90 1.12 0.95 0.00 0.00 0.00 175.35 176.53 1rjh s THR 69 N -2.09 3.02 0.12 3.79 -4.23 -1.25 -2.27 115.64 112.73 1rjh s THR 69 Ca 0.19 0.33 -0.18 0.00 -1.18 0.00 0.00 61.69 60.85 1rjh s THR 69 Cb -0.04 -3.26 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 1rjh s THR 69 CO 0.09 -0.43 1.70 0.15 -0.54 0.00 0.00 174.62 175.59 1rjh h PHE 70 N -0.87 0.45 -0.43 3.99 3.57 -1.48 0.18 116.94 122.34 1rjh h PHE 70 Ca -0.46 -0.02 -0.14 0.00 3.53 0.00 0.00 57.97 60.88 1rjh h PHE 70 Cb 1.28 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.87 1rjh h PHE 70 CO 0.44 0.39 -0.29 1.25 -2.23 0.00 0.00 178.31 177.87 1rjh h HIS 71 N 0.37 1.11 -0.73 0.41 2.76 -1.95 -0.23 115.15 116.90 1rjh h HIS 71 Ca 0.11 -0.30 -0.02 0.00 -2.20 0.00 0.00 60.37 57.96 1rjh h HIS 71 Cb 0.11 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 28.78 1rjh h HIS 71 CO -0.02 1.12 0.38 1.49 -1.30 0.00 0.00 177.93 179.60 1rjh h GLU 72 N 0.80 1.03 -0.21 5.26 4.81 -1.88 -2.37 114.58 122.02 1rjh h GLU 72 Ca 0.09 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1rjh h GLU 72 Cb 0.88 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1rjh h GLU 72 CO 0.08 0.77 0.04 0.00 -0.73 0.00 0.00 179.01 179.17 1rjh h ALA 73 N 1.39 0.28 0.60 2.92 0.00 -0.02 -1.47 119.26 122.96 1rjh h ALA 73 Ca 0.26 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1rjh h ALA 73 Cb 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1rjh h ALA 73 CO -0.04 -0.05 -0.36 0.66 0.00 0.00 0.00 179.25 179.45 1rjh h SER 74 N 0.15 -0.91 -0.24 0.00 4.64 -0.78 -0.49 113.55 115.91 1rjh h SER 74 Ca 0.06 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1rjh h SER 74 Cb 0.30 0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1rjh h SER 74 CO 0.00 -0.57 0.16 -0.33 -0.87 0.00 0.00 176.83 175.22 1rjh h GLU 75 N -0.91 0.33 0.34 4.77 4.39 -1.49 0.22 114.58 122.24 1rjh h GLU 75 Ca -0.07 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 1rjh h GLU 75 Cb 0.74 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.32 1rjh h GLU 75 CO 0.08 0.23 -0.17 0.22 -1.16 0.00 0.00 179.01 178.21 1rjh h ASP 76 N 0.34 -0.39 -0.84 1.42 1.82 -0.87 -1.58 116.42 116.31 1rjh h ASP 76 Ca 0.09 -0.10 -0.01 0.00 -0.39 0.00 0.00 57.03 56.63 1rjh h ASP 76 Cb -0.02 0.10 -0.04 0.00 0.68 0.00 0.00 39.33 40.05 1rjh h ASP 76 CO -0.02 -0.13 0.49 0.00 -1.61 0.00 0.00 179.24 177.97 1rjh h ILE 78 N 1.17 0.74 0.11 0.00 1.08 -0.41 0.49 117.51 120.70 1rjh h ILE 78 Ca 0.30 -0.21 -0.27 0.00 -0.39 0.00 0.00 64.86 64.29 1rjh h ILE 78 Cb -0.02 0.07 -0.00 0.00 -3.07 0.00 0.00 36.82 33.79 1rjh h ILE 78 CO -0.05 0.11 -1.24 0.28 -0.69 0.00 0.00 178.15 176.56 1rjh h SER 79 N 0.62 0.35 0.66 1.72 0.02 -0.59 -2.79 113.55 113.55 1rjh h SER 79 Ca 0.45 -0.38 -0.15 0.00 -0.84 0.00 0.00 61.79 60.86 1rjh h SER 79 Cb 0.61 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 63.01 1rjh h SER 79 CO -0.35 1.30 -1.45 0.54 -1.14 0.00 0.00 176.83 175.73 1rjh n ARG 80 N -3.49 0.62 0.00 3.45 1.74 -0.70 -4.75 116.66 113.54 1rjh n ARG 80 Ca -0.08 0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 1rjh n ARG 80 Cb 1.01 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 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 1.39 0.02 0.00 -0.13 0.00 0.36 -4.80 105.19 102.03 1rjh n GLY 81 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 1.28 1.13 3.23 -0.02 0.00 0.15 -4.82 105.19 106.13 1rjh n GLY 82 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.04 0.10 0.20 2.61 -4.23 -1.24 -4.44 115.64 107.60 1rjh s THR 83 Ca 0.00 -0.81 -0.01 0.00 -1.18 0.00 0.00 61.69 59.69 1rjh s THR 83 Cb 0.00 -0.99 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 1rjh s THR 83 CO 0.00 -0.44 0.40 -0.22 -0.54 0.00 0.00 174.62 173.82 1rjh s LEU 84 N -2.21 4.22 -0.40 4.79 0.20 -1.26 -0.44 118.68 123.58 1rjh s LEU 84 Ca -0.03 0.44 -0.28 0.00 0.69 0.00 0.00 54.13 54.95 1rjh s LEU 84 Cb -0.00 -3.21 -0.01 0.00 -0.43 0.00 0.00 46.19 42.54 1rjh s LEU 84 CO -0.05 -0.05 1.68 -0.44 -0.29 0.00 0.00 176.35 177.21 1rjh s SER 85 N -3.10 5.95 -0.37 3.68 0.01 -0.20 -4.59 113.70 115.09 1rjh s SER 85 Ca 0.39 1.01 -0.06 0.00 1.31 0.00 0.00 55.95 58.60 1rjh s SER 85 Cb -0.11 -2.53 0.06 0.00 0.21 0.00 0.00 66.02 63.65 1rjh s SER 85 CO 0.29 -1.71 0.15 -0.89 0.41 0.00 0.00 173.24 171.49 1rjh s THR 86 N 6.70 3.71 -0.33 1.44 2.01 -1.26 -4.31 115.64 123.61 1rjh s THR 86 Ca 0.72 -1.41 -0.26 0.00 0.31 0.00 0.00 61.69 61.05 1rjh s THR 86 Cb -0.18 -3.23 0.01 0.00 0.01 0.00 0.00 72.50 69.10 1rjh s THR 86 CO 0.31 -0.36 0.91 -2.16 -0.69 0.00 0.00 174.62 172.64 1rjh s PRO 87 N 1.34 3.94 0.00 4.92 0.04 -1.26 -4.89 135.00 139.09 1rjh s PRO 87 Ca 0.01 0.71 0.05 0.00 0.04 0.00 0.00 61.00 61.80 1rjh s PRO 87 Cb -0.21 -3.76 0.11 0.00 0.04 0.00 0.00 34.50 30.68 1rjh s PRO 87 CO 0.01 -0.83 0.98 0.00 0.04 0.00 0.00 177.00 177.20 1rjh n GLN 88 N 6.57 2.05 -4.30 4.56 10.64 -1.26 -4.80 117.38 130.84 1rjh n GLN 88 Ca 0.07 -1.48 -0.18 0.00 -1.83 0.00 0.00 57.00 53.58 1rjh n GLN 88 Cb 0.48 -1.11 -0.09 0.00 -0.86 0.00 0.00 30.24 28.66 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 -0.84 0.13 0.09 -0.39 -4.23 -1.26 -2.21 115.64 106.94 1rjh s THR 89 Ca 0.09 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.44 1rjh s THR 89 Cb 0.05 -2.49 -0.11 0.00 1.34 0.00 0.00 72.50 71.29 1rjh s THR 89 CO 0.07 0.00 1.38 1.23 -0.54 0.00 0.00 174.62 176.75 1rjh h GLY 90 N 2.22 0.71 0.68 3.99 0.00 -1.95 -2.51 103.07 106.21 1rjh h GLY 90 Ca -0.30 -0.78 0.05 0.00 0.00 0.00 0.00 47.33 46.30 1rjh h GLY 90 CO 0.45 0.70 0.26 1.48 0.00 0.00 0.00 176.54 179.43 1rjh h SER 91 N 0.36 0.35 0.82 0.19 4.64 -1.99 0.73 113.55 118.66 1rjh h SER 91 Ca 0.03 0.04 -0.14 0.00 -0.47 0.00 0.00 61.79 61.24 1rjh h SER 91 Cb 0.92 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.96 1rjh h SER 91 CO 0.08 0.24 -0.67 -0.33 -0.87 0.00 0.00 176.83 175.28 1rjh h GLU 92 N 0.49 0.00 0.07 4.77 3.07 -1.96 -2.30 114.58 118.73 1rjh h GLU 92 Ca 0.24 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.98 1rjh h GLU 92 Cb 0.17 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1rjh h GLU 92 CO -0.18 0.67 -0.56 -0.91 -1.40 0.00 0.00 179.01 176.63 1rjh h ASN 93 N 0.00 0.24 0.28 1.42 2.35 -1.01 -2.21 115.58 116.65 1rjh h ASN 93 Ca -0.01 -0.94 -0.08 0.00 -0.55 0.00 0.00 56.30 54.73 1rjh h ASN 93 Cb 1.26 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 1rjh h ASN 93 CO 0.09 1.26 -0.33 0.44 -1.65 0.00 0.00 177.43 177.23 1rjh h ASP 94 N -0.66 0.09 0.47 5.81 3.32 -0.94 -0.31 116.42 124.21 1rjh h ASP 94 Ca -0.11 -0.03 -0.19 0.00 0.02 0.00 0.00 57.03 56.72 1rjh h ASP 94 Cb 1.37 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.89 1rjh h ASP 94 CO 0.06 0.43 -0.80 0.00 -1.72 0.00 0.00 179.24 177.21 1rjh h ALA 95 N 1.58 0.60 -0.10 3.45 0.00 -1.51 -2.58 119.26 120.69 1rjh h ALA 95 Ca 0.01 -0.66 -0.12 0.00 0.00 0.00 0.00 54.91 54.14 1rjh h ALA 95 Cb 0.63 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1rjh h ALA 95 CO 0.05 0.84 -0.39 1.25 0.00 0.00 0.00 179.25 181.00 1rjh h LEU 96 N 0.15 0.52 -1.53 0.00 5.85 -0.71 0.25 115.31 119.86 1rjh h LEU 96 Ca -0.04 -0.62 -0.02 0.00 0.84 0.00 0.00 57.88 58.04 1rjh h LEU 96 Cb 1.39 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 1rjh h LEU 96 CO 0.12 1.06 0.08 0.22 -0.34 0.00 0.00 178.44 179.58 1rjh h TYR 97 N 0.02 0.39 -0.20 1.25 3.20 -1.16 0.16 116.97 120.63 1rjh h TYR 97 Ca -0.02 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.76 1rjh h TYR 97 Cb 1.02 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.17 1rjh h TYR 97 CO 0.11 0.34 -0.19 1.49 -1.64 0.00 0.00 178.16 178.27 1rjh h GLU 98 N 0.39 0.48 -0.23 1.82 4.57 -1.31 -3.15 114.58 117.15 1rjh h GLU 98 Ca 0.10 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.01 1rjh h GLU 98 Cb 0.13 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 1rjh h GLU 98 CO -0.01 0.82 0.08 -0.92 -1.18 0.00 0.00 179.01 177.80 1rjh h TYR 99 N 0.15 0.31 -0.87 0.92 3.20 0.53 -1.31 116.97 119.89 1rjh h TYR 99 Ca 0.03 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.97 1rjh h TYR 99 Cb 0.74 -0.10 -0.07 0.00 1.54 0.00 0.00 36.73 38.84 1rjh h TYR 99 CO 0.08 0.26 0.54 -0.07 -1.64 0.00 0.00 178.16 177.33 1rjh h LEU 100 N 0.32 0.82 -1.19 2.82 3.38 -0.68 -1.94 115.31 118.85 1rjh h LEU 100 Ca 0.08 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1rjh h LEU 100 Cb 0.09 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1rjh h LEU 100 CO -0.01 0.51 0.00 0.03 0.09 0.00 0.00 178.44 179.06 1rjh h ARG 101 N 0.95 0.00 -0.02 1.13 3.08 -1.27 0.64 114.38 118.89 1rjh h ARG 101 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 1rjh h ARG 101 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1rjh h ARG 101 CO -0.20 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.70 1rjh n GLN 102 N -2.44 0.16 0.07 0.04 10.64 -0.79 -4.59 117.38 120.48 1rjh n GLN 102 Ca 0.01 -0.88 0.00 0.00 -1.83 0.00 0.00 57.00 54.29 1rjh n GLN 102 Cb 0.18 -1.06 0.00 0.00 -0.86 0.00 0.00 30.24 28.49 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 0.09 -0.02 -0.10 2.61 7.64 -0.83 -4.96 113.62 118.05 1rjh n SER 103 Ca 0.02 0.25 -0.11 0.00 1.01 0.00 0.00 58.87 60.04 1rjh n SER 103 Cb 0.12 0.18 -0.15 0.00 -1.01 0.00 0.00 64.21 63.35 1rjh n SER 103 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1rjh n VAL 104 N -3.06 1.38 0.00 0.44 0.31 -0.51 -4.90 118.33 111.99 1rjh n VAL 104 Ca 0.00 -0.82 0.00 0.00 -0.01 0.00 0.00 64.34 63.51 1rjh n VAL 104 Cb 0.03 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.40 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 1.82 3.82 0.38 2.92 0.00 0.21 -4.75 105.19 109.60 1rjh n GLY 105 Ca -0.34 -1.25 0.15 0.00 0.00 0.00 0.00 46.02 44.58 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 0.53 -0.63 1.61 -0.00 -1.81 -1.34 115.58 113.94 1rjh h ASN 106 Ca 0.00 0.04 -0.28 0.00 -0.00 0.00 0.00 56.30 56.05 1rjh h ASN 106 Cb 0.00 -0.07 -0.17 0.00 -0.00 0.00 0.00 38.32 38.09 1rjh h ASN 106 CO 0.00 0.25 0.36 -1.84 -0.00 0.00 0.00 177.43 176.20 1rjh n GLU 107 N -4.53 2.22 -3.94 6.67 0.28 -1.26 -2.70 120.64 117.38 1rjh n GLU 107 Ca 0.17 -2.08 -0.21 0.00 -0.16 0.00 0.00 57.16 54.88 1rjh n GLU 107 Cb 0.54 -1.85 -0.03 0.00 1.43 0.00 0.00 31.44 31.53 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 -2.24 3.81 -0.12 -1.84 0.00 -0.51 -4.14 121.76 116.72 1rjh s ALA 108 Ca 0.39 -1.41 0.02 0.00 0.00 0.00 0.00 51.96 50.96 1rjh s ALA 108 Cb 0.32 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.99 1rjh s ALA 108 CO 0.08 0.17 -0.21 -1.21 0.00 0.00 0.00 175.76 174.59 1rjh s GLU 109 N -3.95 3.11 0.04 0.00 2.02 -1.26 -0.96 118.70 117.70 1rjh s GLU 109 Ca 0.36 -0.83 0.06 0.00 0.02 0.00 0.00 54.97 54.59 1rjh s GLU 109 Cb -0.08 -2.43 -0.02 0.00 0.10 0.00 0.00 34.13 31.70 1rjh s GLU 109 CO 0.27 0.11 -0.18 0.42 0.02 0.00 0.00 175.26 175.90 1rjh s ILE 110 N 0.53 1.48 0.53 -1.63 1.09 -0.97 -2.94 121.20 119.29 1rjh s ILE 110 Ca -0.13 -1.13 -0.20 0.00 -1.10 0.00 0.00 60.65 58.09 1rjh s ILE 110 Cb -0.17 -1.30 -0.06 0.00 -1.06 0.00 0.00 42.46 39.87 1rjh s ILE 110 CO 0.04 0.13 1.11 0.26 -0.10 0.00 0.00 174.94 176.39 1rjh s TRP 111 N -0.82 2.73 -1.33 3.97 0.52 -1.25 -0.27 118.94 122.50 1rjh s TRP 111 Ca 0.05 1.55 0.17 0.00 0.02 0.00 0.00 56.10 57.90 1rjh s TRP 111 Cb -0.08 -3.25 0.55 0.00 -1.15 0.00 0.00 33.47 29.53 1rjh s TRP 111 CO 0.02 -1.44 1.46 1.28 0.02 0.00 0.00 176.95 178.29 1rjh n LEU 112 N -1.21 3.81 0.00 2.99 4.77 -0.92 -4.63 117.00 121.81 1rjh n LEU 112 Ca 0.11 -2.17 0.00 0.00 -0.03 0.00 0.00 56.01 53.92 1rjh n LEU 112 Cb 0.51 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1rjh n LEU 112 CO 0.42 0.85 0.00 0.61 -1.33 0.00 0.00 177.39 177.94 1rjh n GLY 113 N 1.03 1.71 3.83 -0.72 0.00 -1.26 -4.07 105.19 105.71 1rjh n GLY 113 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 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 4.48 -0.23 0.99 2.34 -1.26 -3.96 118.68 121.04 1rjh s LEU 114 Ca 0.00 1.01 -0.18 0.00 0.06 0.00 0.00 54.13 55.02 1rjh s LEU 114 Cb 0.00 -2.65 0.06 0.00 -0.56 0.00 0.00 46.19 43.04 1rjh s LEU 114 CO 0.00 0.30 0.60 0.54 -1.06 0.00 0.00 176.35 176.73 1rjh s ASN 115 N -1.00 -0.69 -0.09 1.48 2.20 -0.14 -4.76 114.94 111.94 1rjh s ASN 115 Ca 0.25 1.24 0.01 0.00 -0.94 0.00 0.00 52.86 53.42 1rjh s ASN 115 Cb -0.17 1.21 -0.02 0.00 -2.00 0.00 0.00 41.25 40.26 1rjh s ASN 115 CO 0.14 -0.21 -0.10 -0.62 -2.94 0.00 0.00 177.10 173.37 1rjh s ASP 116 N 0.75 4.31 -0.06 3.54 2.15 -1.26 -3.62 116.67 122.49 1rjh s ASP 116 Ca -0.03 -0.17 0.09 0.00 0.43 0.00 0.00 52.55 52.86 1rjh s ASP 116 Cb -0.05 -1.29 0.13 0.00 -0.30 0.00 0.00 42.92 41.41 1rjh s ASP 116 CO -0.06 0.27 1.02 1.15 -0.17 0.00 0.00 175.17 177.39 1rjh n MET 117 N 2.80 1.27 -0.06 4.34 0.00 -1.26 -4.87 117.12 119.34 1rjh n MET 117 Ca -0.18 -1.79 -0.06 0.00 0.00 0.00 0.00 57.70 55.67 1rjh n MET 117 Cb 0.53 -1.07 -0.02 0.00 0.00 0.00 0.00 33.22 32.65 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 -0.78 0.59 0.00 3.17 0.00 -1.26 -5.04 120.51 117.19 1rjh n ALA 118 Ca 0.07 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1rjh n ALA 118 Cb 0.55 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.02 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 -3.82 0.00 -2.70 0.00 0.00 -1.26 -5.15 120.51 107.58 1rjh n ALA 119 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.01 1rjh n ALA 119 Cb 0.35 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.75 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 -0.23 3.63 0.00 0.00 -1.05 -1.26 -4.96 118.70 114.84 1rjh s GLU 120 Ca 0.00 -0.03 0.25 0.00 -0.15 0.00 0.00 54.97 55.04 1rjh s GLU 120 Cb 0.00 -2.99 1.29 0.00 -0.44 0.00 0.00 34.13 31.99 1rjh s GLU 120 CO 0.00 0.57 1.83 0.41 0.95 0.00 0.00 175.26 179.02 1rjh n GLY 121 N 0.74 -1.03 3.16 -3.83 0.00 -1.26 -4.24 105.19 98.73 1rjh n GLY 121 Ca -0.08 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 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 3.83 -1.59 2.61 -1.04 -1.26 -4.97 114.28 110.64 1rjh n THR 122 Ca 0.13 -3.78 -0.55 0.00 -2.04 0.00 0.00 64.05 57.81 1rjh n THR 122 Cb 0.17 -2.46 -0.07 0.00 -1.82 0.00 0.00 70.33 66.15 1rjh n THR 122 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1rjh n TRP 123 N 6.71 1.38 -3.66 -1.42 7.02 -1.26 -4.69 117.44 121.52 1rjh n TRP 123 Ca 0.48 0.75 -0.27 0.00 -1.02 0.00 0.00 57.50 57.44 1rjh n TRP 123 Cb 0.42 -2.29 -0.03 0.00 -2.42 0.00 0.00 31.31 26.99 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 0.84 5.19 0.83 -0.99 -7.23 -1.24 -3.89 120.40 113.90 1rjh s VAL 124 Ca 0.89 -0.37 -0.12 0.00 -1.81 0.00 0.00 61.98 60.57 1rjh s VAL 124 Cb -1.07 -3.75 0.09 0.00 0.56 0.00 0.00 36.38 32.22 1rjh s VAL 124 CO 0.53 -0.22 1.10 -0.62 -0.31 0.00 0.00 175.10 175.57 1rjh s ASP 125 N -3.27 4.12 0.52 4.85 2.15 0.17 -0.97 116.67 124.25 1rjh s ASP 125 Ca 0.39 1.35 0.23 0.00 0.43 0.00 0.00 52.55 54.95 1rjh s ASP 125 Cb -0.11 -2.06 1.36 0.00 -0.30 0.00 0.00 42.92 41.82 1rjh s ASP 125 CO 0.30 -2.21 2.02 0.24 -0.17 0.00 0.00 175.17 175.35 1rjh h MET 126 N -1.25 0.02 0.00 4.34 2.86 -1.89 0.16 114.93 119.16 1rjh h MET 126 Ca -0.48 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 1rjh h MET 126 Cb 1.28 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.93 1rjh h MET 126 CO 0.58 0.01 -0.06 1.79 1.06 0.00 0.00 176.91 180.29 1rjh h THR 127 N 0.02 0.00 0.00 2.22 1.35 -1.94 -3.47 112.91 111.09 1rjh h THR 127 Ca 0.21 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1rjh h THR 127 Cb 0.84 1.86 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1rjh h THR 127 CO -0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 1rjh n GLY 128 N 1.15 0.86 3.78 5.82 0.00 0.54 -5.10 105.19 112.24 1rjh n GLY 128 Ca 0.04 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 2.69 0.24 4.61 0.00 -1.25 -4.68 121.76 121.36 1rjh s ALA 129 Ca 0.00 0.74 0.04 0.00 0.00 0.00 0.00 51.96 52.75 1rjh s ALA 129 Cb 0.00 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 1rjh s ALA 129 CO 0.00 -0.79 0.37 -0.98 0.00 0.00 0.00 175.76 174.36 1rjh s ARG 130 N -3.42 3.44 0.00 0.00 1.70 -1.26 0.44 118.95 119.85 1rjh s ARG 130 Ca 0.71 -0.71 -0.01 0.00 -0.47 0.00 0.00 55.73 55.25 1rjh s ARG 130 Cb -0.22 -2.88 -0.04 0.00 -0.57 0.00 0.00 34.95 31.24 1rjh s ARG 130 CO 0.28 0.42 0.14 0.96 -1.08 0.00 0.00 175.30 176.03 1rjh s ILE 131 N -1.98 5.14 -0.11 4.99 -4.36 -1.25 -4.89 121.20 118.74 1rjh s ILE 131 Ca 0.34 -0.30 0.15 0.00 -0.26 0.00 0.00 60.65 60.59 1rjh s ILE 131 Cb -0.09 -3.40 0.24 0.00 1.25 0.00 0.00 42.46 40.46 1rjh s ILE 131 CO 0.29 0.31 1.13 0.00 0.24 0.00 0.00 174.94 176.91 1rjh n ALA 132 N 0.95 2.26 -3.73 2.27 0.00 -0.94 -4.97 120.51 116.36 1rjh n ALA 132 Ca -0.11 -2.35 -0.21 0.00 0.00 0.00 0.00 53.44 50.76 1rjh n ALA 132 Cb 0.52 -0.40 -0.18 0.00 0.00 0.00 0.00 19.45 19.39 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 -2.34 0.40 -0.33 0.00 6.14 -1.22 -4.95 117.35 115.05 1rjh s TYR 133 Ca 0.26 0.02 -0.01 0.00 0.64 0.00 0.00 57.07 57.98 1rjh s TYR 133 Cb 0.23 -0.65 0.11 0.00 0.42 0.00 0.00 41.96 42.07 1rjh s TYR 133 CO 0.02 -0.26 0.14 0.15 0.64 0.00 0.00 175.55 176.24 1rjh s LYS 134 N 2.01 0.61 -0.27 4.97 1.02 -1.26 -4.91 119.74 121.90 1rjh s LYS 134 Ca 0.04 -1.07 0.01 0.00 0.02 0.00 0.00 55.97 54.98 1rjh s LYS 134 Cb -0.12 -1.69 0.05 0.00 -0.52 0.00 0.00 37.83 35.55 1rjh s LYS 134 CO -0.04 -1.05 -0.07 -0.80 -0.92 0.00 0.00 175.35 172.47 1rjh s ASN 135 N 1.52 4.60 -0.03 2.83 -0.87 -1.26 -5.10 114.94 116.63 1rjh s ASN 135 Ca 0.12 -1.33 0.03 0.00 -1.57 0.00 0.00 52.86 50.11 1rjh s ASN 135 Cb -0.19 -1.61 -0.00 0.00 -0.02 0.00 0.00 41.25 39.43 1rjh s ASN 135 CO -0.22 -0.21 -0.12 0.26 -2.57 0.00 0.00 177.10 174.24 1rjh s TRP 136 N 1.17 1.26 -0.19 2.20 0.52 -1.26 -0.76 118.94 121.86 1rjh s TRP 136 Ca -0.07 -0.33 0.22 0.00 0.02 0.00 0.00 56.10 55.94 1rjh s TRP 136 Cb -0.20 -0.86 -0.07 0.00 -1.15 0.00 0.00 33.47 31.19 1rjh s TRP 136 CO -0.04 -0.12 0.92 0.39 0.02 0.00 0.00 176.95 178.13 1rjh n GLU 137 N 3.19 0.62 -0.78 4.98 -0.58 -1.19 -3.89 120.64 122.99 1rjh n GLU 137 Ca -0.18 0.07 0.07 0.00 -0.42 0.00 0.00 57.16 56.70 1rjh n GLU 137 Cb 0.54 -1.77 0.37 0.00 -0.57 0.00 0.00 31.44 30.01 1rjh n GLU 137 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 1rjh n THR 138 N -2.61 2.37 -1.64 2.62 5.66 -1.26 -4.96 114.28 114.46 1rjh n THR 138 Ca -0.01 -1.26 -0.46 0.00 -3.05 0.00 0.00 64.05 59.26 1rjh n THR 138 Cb 0.57 -0.20 -0.04 0.00 -1.55 0.00 0.00 70.33 69.11 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 0.71 2.20 -3.75 1.09 4.07 -1.25 -4.94 120.64 118.77 1rjh n GLU 139 Ca 0.26 0.77 -0.37 0.00 -0.06 0.00 0.00 57.16 57.75 1rjh n GLU 139 Cb 1.07 -2.82 -0.06 0.00 -0.06 0.00 0.00 31.44 29.57 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 5.25 5.33 0.00 6.31 -4.36 -1.26 -4.96 121.20 127.51 1rjh s ILE 140 Ca 0.95 0.41 0.00 0.00 -0.26 0.00 0.00 60.65 61.75 1rjh s ILE 140 Cb -0.58 -3.52 0.00 0.00 1.25 0.00 0.00 42.46 39.61 1rjh s ILE 140 CO 0.46 0.58 0.73 0.35 0.24 0.00 0.00 174.94 177.30 1rjh n THR 141 N 1.82 0.48 -4.36 8.37 -2.24 -1.26 -5.05 114.28 112.04 1rjh n THR 141 Ca -0.17 -0.72 -0.19 0.00 -2.27 0.00 0.00 64.05 60.70 1rjh n THR 141 Cb 0.54 0.78 -0.10 0.00 -2.10 0.00 0.00 70.33 69.45 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 -0.48 2.04 -0.57 6.98 0.00 -1.26 -5.11 121.76 123.37 1rjh s ALA 142 Ca 0.00 -1.74 -0.20 0.00 0.00 0.00 0.00 51.96 50.01 1rjh s ALA 142 Cb 0.00 0.11 0.07 0.00 0.00 0.00 0.00 23.12 23.31 1rjh s ALA 142 CO 0.00 -0.05 0.76 -0.65 0.00 0.00 0.00 175.76 175.82 1rjh s GLN 143 N -3.72 3.12 0.00 0.00 -0.21 -1.26 -4.92 119.66 112.67 1rjh s GLN 143 Ca 0.25 -0.95 0.00 0.00 0.02 0.00 0.00 55.36 54.69 1rjh s GLN 143 Cb 0.02 -4.18 0.00 0.00 1.00 0.00 0.00 33.01 29.86 1rjh s GLN 143 CO 0.08 -1.49 0.05 -2.30 -2.12 0.00 0.00 175.29 169.51 1rjh n PRO 144 N 6.70 0.00 -1.69 2.91 -0.02 -1.26 -4.41 135.00 137.23 1rjh n PRO 144 Ca -0.06 0.38 -0.38 0.00 -2.02 0.00 0.00 63.50 61.43 1rjh n PRO 144 Cb 0.45 -0.91 0.06 0.00 -0.02 0.00 0.00 33.50 33.07 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 -1.65 7.60 -0.37 2.55 2.03 -1.04 -4.71 116.55 120.96 1rjh n ASP 145 Ca 0.00 -3.82 0.00 0.00 0.52 0.00 0.00 54.79 51.49 1rjh n ASP 145 Cb 0.00 -1.03 0.00 0.00 -0.72 0.00 0.00 41.12 39.37 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 -0.69 0.87 2.32 0.27 0.00 -1.26 -3.98 105.19 102.71 1rjh n GLY 146 Ca 0.57 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.37 2.32 3.17 -0.02 0.00 -1.26 -4.97 105.19 104.06 1rjh n GLY 147 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.25 0.82 0.01 1.61 0.00 -1.26 -4.88 119.74 115.80 1rjh s LYS 148 Ca 0.00 -1.32 0.01 0.00 0.00 0.00 0.00 55.97 54.65 1rjh s LYS 148 Cb 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 37.83 37.63 1rjh s LYS 148 CO 0.00 -0.02 -0.03 0.95 0.00 0.00 0.00 175.35 176.25 1rjh s THR 149 N -3.61 0.18 -1.25 3.79 -4.23 -1.26 -2.50 115.64 106.76 1rjh s THR 149 Ca 0.11 -0.37 -0.19 0.00 -1.18 0.00 0.00 61.69 60.07 1rjh s THR 149 Cb 0.05 -0.21 0.05 0.00 1.34 0.00 0.00 72.50 73.73 1rjh s THR 149 CO -0.05 -0.12 1.73 -1.83 -0.54 0.00 0.00 174.62 173.82 1rjh s GLU 150 N -0.51 3.77 0.15 3.99 -1.05 -1.26 -4.93 118.70 118.85 1rjh s GLU 150 Ca -0.04 -1.80 0.10 0.00 -0.15 0.00 0.00 54.97 53.09 1rjh s GLU 150 Cb -0.04 -5.48 -0.04 0.00 -0.44 0.00 0.00 34.13 28.13 1rjh s GLU 150 CO -0.00 -2.46 -0.23 0.54 0.95 0.00 0.00 175.26 174.06 1rjh s ASN 151 N 4.60 3.57 -0.00 0.83 2.20 -1.26 -4.53 114.94 120.35 1rjh s ASN 151 Ca 0.55 -0.72 0.02 0.00 -0.94 0.00 0.00 52.86 51.77 1rjh s ASN 151 Cb 0.03 -0.35 -0.00 0.00 -2.00 0.00 0.00 41.25 38.92 1rjh s ASN 151 CO 0.07 0.16 -0.06 0.00 -2.94 0.00 0.00 177.10 174.32 1rjh s ALA 153 N -0.16 3.42 -0.01 0.00 0.00 -1.26 -0.97 121.76 122.78 1rjh s ALA 153 Ca 0.02 0.21 0.07 0.00 0.00 0.00 0.00 51.96 52.26 1rjh s ALA 153 Cb -0.02 -3.75 -0.02 0.00 0.00 0.00 0.00 23.12 19.33 1rjh s ALA 153 CO -0.00 -1.66 -0.22 0.14 0.00 0.00 0.00 175.76 174.02 1rjh s VAL 154 N 4.26 1.72 -0.54 0.00 -7.23 0.30 -2.17 120.40 116.75 1rjh s VAL 154 Ca 0.57 -0.97 -0.16 0.00 -1.81 0.00 0.00 61.98 59.61 1rjh s VAL 154 Cb -0.18 -1.43 0.13 0.00 0.56 0.00 0.00 36.38 35.45 1rjh s VAL 154 CO 0.22 0.45 0.49 -0.22 -0.31 0.00 0.00 175.10 175.73 1rjh s LEU 155 N -0.61 6.15 -0.69 1.32 0.20 0.63 -0.53 118.68 125.15 1rjh s LEU 155 Ca 0.08 -1.78 -0.22 0.00 0.69 0.00 0.00 54.13 52.91 1rjh s LEU 155 Cb -0.08 -2.20 0.08 0.00 -0.43 0.00 0.00 46.19 43.56 1rjh s LEU 155 CO -0.00 -0.85 0.96 -0.44 -0.29 0.00 0.00 176.35 175.73 1rjh s SER 156 N 3.53 6.24 0.38 3.68 0.01 -1.26 -2.29 113.70 123.99 1rjh s SER 156 Ca 0.03 -1.19 0.14 0.00 1.31 0.00 0.00 55.95 56.25 1rjh s SER 156 Cb -0.30 -2.40 0.77 0.00 0.21 0.00 0.00 66.02 64.30 1rjh s SER 156 CO 0.03 -1.36 1.84 1.23 0.41 0.00 0.00 173.24 175.39 1rjh h GLY 157 N 11.09 0.00 2.00 3.44 0.00 -1.17 -2.05 103.07 116.38 1rjh h GLY 157 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1rjh h GLY 157 CO 1.17 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.71 1rjh n ALA 158 N -2.44 1.54 -0.09 3.60 0.00 -1.10 -3.54 120.51 118.48 1rjh n ALA 158 Ca -0.02 -0.03 -0.12 0.00 0.00 0.00 0.00 53.44 53.27 1rjh n ALA 158 Cb 0.40 -1.20 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 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 -1.52 0.81 0.00 0.00 0.00 -0.78 -5.01 120.51 114.01 1rjh n ALA 159 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.74 1rjh n ALA 159 Cb 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.59 1rjh n ALA 159 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1rjh n ASN 160 N -4.47 0.00 0.00 0.00 4.05 -1.16 -5.02 115.26 108.66 1rjh n ASN 160 Ca -0.20 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.83 1rjh n ASN 160 Cb 0.52 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.53 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 -0.50 0.98 3.96 8.20 0.00 -1.21 -5.01 105.19 111.62 1rjh n GLY 161 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.27 1.33 0.03 1.61 3.01 -1.26 -4.93 119.74 119.26 1rjh s LYS 162 Ca 0.00 -0.74 -0.29 0.00 -1.01 0.00 0.00 55.97 53.93 1rjh s LYS 162 Cb 0.00 -2.12 -0.04 0.00 -1.01 0.00 0.00 37.83 34.66 1rjh s LYS 162 CO 0.00 -1.80 0.94 -1.58 0.51 0.00 0.00 175.35 173.42 1rjh s TRP 163 N -3.45 3.71 0.40 3.18 0.52 0.06 -4.12 118.94 119.23 1rjh s TRP 163 Ca 0.69 1.68 0.05 0.00 0.02 0.00 0.00 56.10 58.54 1rjh s TRP 163 Cb -0.05 -3.06 -0.06 0.00 -1.15 0.00 0.00 33.47 29.15 1rjh s TRP 163 CO 0.48 0.08 0.04 -0.06 0.02 0.00 0.00 176.95 177.51 1rjh s PHE 164 N 0.61 2.15 0.02 -1.98 0.40 0.31 -3.14 117.98 116.34 1rjh s PHE 164 Ca 0.48 -0.88 0.07 0.00 -0.60 0.00 0.00 56.93 56.01 1rjh s PHE 164 Cb -0.21 -1.52 -0.02 0.00 0.51 0.00 0.00 43.02 41.77 1rjh s PHE 164 CO 0.28 0.19 -0.20 0.16 0.70 0.00 0.00 175.22 176.34 1rjh s ASP 165 N -3.65 2.43 0.25 1.36 -4.77 -1.26 -0.54 116.67 110.49 1rjh s ASP 165 Ca 0.30 -0.46 -0.06 0.00 -3.30 0.00 0.00 52.55 49.02 1rjh s ASP 165 Cb 0.07 -0.23 -0.02 0.00 -1.09 0.00 0.00 42.92 41.66 1rjh s ASP 165 CO 0.14 0.19 0.36 -0.75 0.70 0.00 0.00 175.17 175.81 1rjh s LYS 166 N -0.92 1.50 0.32 2.11 2.20 -0.15 -4.86 119.74 119.94 1rjh s LYS 166 Ca 0.08 -1.49 -0.28 0.00 -0.36 0.00 0.00 55.97 53.92 1rjh s LYS 166 Cb -0.08 0.39 -0.09 0.00 -1.51 0.00 0.00 37.83 36.54 1rjh s LYS 166 CO 0.01 -0.59 1.08 1.03 -0.36 0.00 0.00 175.35 176.53 1rjh s ARG 167 N -3.88 4.50 0.00 4.03 0.52 -1.26 -0.37 118.95 122.48 1rjh s ARG 167 Ca 0.30 1.72 0.09 0.00 -0.52 0.00 0.00 55.73 57.32 1rjh s ARG 167 Cb 0.02 -3.00 0.45 0.00 0.52 0.00 0.00 34.95 32.95 1rjh s ARG 167 CO 0.13 0.11 1.23 0.00 0.02 0.00 0.00 175.30 176.78 1rjh n ARG 169 N -1.36 3.04 -3.25 0.00 1.74 -1.26 -1.46 116.66 114.12 1rjh n ARG 169 Ca 0.04 -2.39 -0.39 0.00 -0.77 0.00 0.00 57.85 54.34 1rjh n ARG 169 Cb 0.09 -1.70 -0.06 0.00 -1.02 0.00 0.00 32.46 29.77 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 -0.89 7.02 -0.96 0.55 2.15 -0.79 -4.87 116.67 118.89 1rjh s ASP 170 Ca 0.43 1.22 -0.16 0.00 0.43 0.00 0.00 52.55 54.47 1rjh s ASP 170 Cb 0.26 -2.36 0.16 0.00 -0.30 0.00 0.00 42.92 40.69 1rjh s ASP 170 CO 0.24 0.21 1.09 -1.10 -0.17 0.00 0.00 175.17 175.44 1rjh s GLN 171 N -0.74 3.71 0.29 4.34 -1.52 -1.26 -3.77 119.66 120.71 1rjh s GLN 171 Ca 0.30 -2.13 0.06 0.00 -1.95 0.00 0.00 55.36 51.64 1rjh s GLN 171 Cb -0.19 -4.81 -0.06 0.00 -0.22 0.00 0.00 33.01 27.73 1rjh s GLN 171 CO 0.18 -1.63 -0.04 -0.48 -0.25 0.00 0.00 175.29 173.07 1rjh s LEU 172 N 1.73 2.45 0.00 2.90 0.05 -0.96 -4.36 118.68 120.49 1rjh s LEU 172 Ca 0.31 -1.22 -0.22 0.00 0.05 0.00 0.00 54.13 53.04 1rjh s LEU 172 Cb -0.06 -0.60 0.35 0.00 -2.05 0.00 0.00 46.19 43.82 1rjh s LEU 172 CO -0.08 -0.39 0.84 -2.65 -0.55 0.00 0.00 176.35 173.52 1rjh n PRO 173 N -0.61 -4.47 -3.83 1.48 -0.02 -1.15 -1.28 135.00 125.11 1rjh n PRO 173 Ca -0.05 -1.39 -0.07 0.00 -2.02 0.00 0.00 63.50 59.96 1rjh n PRO 173 Cb 0.64 -1.73 -0.02 0.00 -0.02 0.00 0.00 33.50 32.37 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 -2.14 -0.20 -0.05 6.00 1.13 -0.15 -3.78 117.35 118.17 1rjh s TYR 174 Ca 0.63 -0.24 -0.01 0.00 -1.41 0.00 0.00 57.07 56.03 1rjh s TYR 174 Cb -0.10 0.68 0.03 0.00 -1.10 0.00 0.00 41.96 41.47 1rjh s TYR 174 CO 0.52 -1.20 0.03 0.42 -2.51 0.00 0.00 175.55 172.81 1rjh s ILE 175 N -3.91 0.07 0.19 -3.49 1.01 -1.26 -4.40 121.20 109.40 1rjh s ILE 175 Ca 0.11 0.28 0.04 0.00 0.00 0.00 0.00 60.65 61.08 1rjh s ILE 175 Cb -0.05 -0.27 -0.04 0.00 0.01 0.00 0.00 42.46 42.11 1rjh s ILE 175 CO 0.06 0.19 0.24 0.00 0.00 0.00 0.00 174.94 175.43 1rjh s GLN 177 N -3.44 3.35 -0.09 0.00 -0.21 0.42 -4.63 119.66 115.06 1rjh s GLN 177 Ca 0.33 -0.23 0.00 0.00 0.02 0.00 0.00 55.36 55.48 1rjh s GLN 177 Cb -0.10 -3.96 -0.03 0.00 1.00 0.00 0.00 33.01 29.93 1rjh s GLN 177 CO 0.27 -1.12 -0.07 0.12 -2.12 0.00 0.00 175.29 172.37 1rjh s PHE 178 N 3.17 2.93 0.00 0.91 5.36 -1.26 -4.37 117.98 124.72 1rjh s PHE 178 Ca 0.27 -0.09 0.00 0.00 -0.96 0.00 0.00 56.93 56.15 1rjh s PHE 178 Cb -0.13 -1.76 0.00 0.00 -0.34 0.00 0.00 43.02 40.79 1rjh s PHE 178 CO 0.21 0.22 0.00 0.41 -1.46 0.00 0.00 175.22 174.60 1rjh n GLY 179 N 2.55 2.59 2.73 13.12 0.00 -1.26 -4.41 105.19 120.51 1rjh n GLY 179 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.24-11.72 -0.77 -0.61 2.08 -1.26 -5.20 119.36 101.64 1rjh n ILE 180 Ca 0.00 1.60 0.00 0.00 0.56 0.00 0.00 62.75 64.91 1rjh n ILE 180 Cb 0.00 -7.00 0.00 0.00 -0.75 0.00 0.00 39.64 31.89 1rjh n ILE 180 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63