#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 0.41 -1.94 4.37 -1.04 -1.26 -1.59 114.28 113.24 1rjh n THR 65 Ca 0.00 0.10 -0.42 0.00 -2.04 0.00 0.00 64.05 61.70 1rjh n THR 65 Cb 0.00 -0.77 -0.02 0.00 -1.82 0.00 0.00 70.33 67.72 1rjh n THR 65 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1rjh s GLN 66 N -2.62 4.22 -0.10 -2.82 -1.52 -1.26 -4.40 119.66 111.16 1rjh s GLN 66 Ca 0.18 2.38 -0.15 0.00 -1.95 0.00 0.00 55.36 55.82 1rjh s GLN 66 Cb 0.13 -3.10 -0.05 0.00 -0.22 0.00 0.00 33.01 29.78 1rjh s GLN 66 CO 0.31 -0.51 0.38 0.95 -0.25 0.00 0.00 175.29 176.18 1rjh s THR 67 N 0.21 5.19 0.29 -0.19 -4.23 -1.26 -4.17 115.64 111.47 1rjh s THR 67 Ca 0.62 0.76 -0.19 0.00 -1.18 0.00 0.00 61.69 61.70 1rjh s THR 67 Cb -0.44 -3.71 0.06 0.00 1.34 0.00 0.00 72.50 69.75 1rjh s THR 67 CO 0.42 0.43 0.89 -1.59 -0.54 0.00 0.00 174.62 174.23 1rjh s LYS 68 N 0.00 1.79 0.76 3.99 0.00 -0.99 -4.76 119.74 120.53 1rjh s LYS 68 Ca 0.22 -1.12 -0.12 0.00 0.00 0.00 0.00 55.97 54.95 1rjh s LYS 68 Cb -0.15 0.52 0.05 0.00 0.00 0.00 0.00 37.83 38.25 1rjh s LYS 68 CO 0.09 -0.83 1.11 0.95 0.00 0.00 0.00 175.35 176.66 1rjh s THR 69 N -2.49 3.13 0.28 3.79 -4.23 -1.25 -2.55 115.64 112.32 1rjh s THR 69 Ca 0.17 0.37 -0.02 0.00 -1.18 0.00 0.00 61.69 61.03 1rjh s THR 69 Cb -0.04 -3.24 0.20 0.00 1.34 0.00 0.00 72.50 70.75 1rjh s THR 69 CO 0.08 -0.48 1.88 0.15 -0.54 0.00 0.00 174.62 175.71 1rjh h PHE 70 N -0.91 0.95 -0.29 3.99 3.57 -1.61 0.35 116.94 123.00 1rjh h PHE 70 Ca -0.46 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 60.98 1rjh h PHE 70 Cb 1.27 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 1rjh h PHE 70 CO 0.46 0.71 0.12 1.25 -2.23 0.00 0.00 178.31 178.62 1rjh h HIS 71 N 0.94 0.43 -0.43 0.41 2.76 -1.93 -0.56 115.15 116.77 1rjh h HIS 71 Ca 0.23 -0.03 -0.13 0.00 -2.20 0.00 0.00 60.37 58.24 1rjh h HIS 71 Cb 0.13 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1rjh h HIS 71 CO 0.01 0.42 -0.24 0.93 -1.30 0.00 0.00 177.93 177.75 1rjh h GLU 72 N 0.32 0.89 -0.69 5.26 5.08 -1.86 -2.82 114.58 120.76 1rjh h GLU 72 Ca 0.10 -0.38 0.06 0.00 -1.00 0.00 0.00 59.36 58.14 1rjh h GLU 72 Cb 0.16 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1rjh h GLU 72 CO -0.01 1.03 0.45 0.00 -1.00 0.00 0.00 179.01 179.48 1rjh h ALA 73 N 0.96 1.72 0.68 3.43 0.00 0.05 0.28 119.26 126.38 1rjh h ALA 73 Ca 0.10 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1rjh h ALA 73 Cb 0.79 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1rjh h ALA 73 CO 0.07 0.17 -0.33 0.77 0.00 0.00 0.00 179.25 179.93 1rjh h SER 74 N 0.72 -0.77 -0.70 0.00 0.02 -0.87 -0.17 113.55 111.78 1rjh h SER 74 Ca 0.29 -0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.29 1rjh h SER 74 Cb 0.24 0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.93 1rjh h SER 74 CO -0.09 -0.42 0.42 -0.33 -1.14 0.00 0.00 176.83 175.26 1rjh h GLU 75 N -1.14 0.76 0.73 3.45 5.08 -1.24 -0.76 114.58 121.46 1rjh h GLU 75 Ca -0.09 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1rjh h GLU 75 Cb 0.73 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.81 1rjh h GLU 75 CO 0.15 0.51 -0.35 0.22 -1.00 0.00 0.00 179.01 178.54 1rjh h ASP 76 N 0.79 -0.83 0.07 1.42 3.58 -0.48 -3.05 116.42 117.92 1rjh h ASP 76 Ca 0.30 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.74 1rjh h ASP 76 Cb 0.11 0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.37 1rjh h ASP 76 CO -0.15 -0.48 -0.08 0.00 -2.88 0.00 0.00 179.24 175.65 1rjh h ILE 78 N 0.03 1.01 0.00 0.00 5.03 -1.10 0.16 117.51 122.64 1rjh h ILE 78 Ca 0.01 -0.14 -0.17 0.00 -0.12 0.00 0.00 64.86 64.44 1rjh h ILE 78 Cb 0.17 1.08 -0.03 0.00 -3.03 0.00 0.00 36.82 35.01 1rjh h ILE 78 CO 0.01 0.04 -2.08 -1.54 -0.68 0.00 0.00 178.15 173.90 1rjh n SER 79 N -4.47 0.11 0.12 1.72 3.41 0.08 -3.06 113.62 111.54 1rjh n SER 79 Ca -0.03 0.05 0.01 0.00 -0.26 0.00 0.00 58.87 58.64 1rjh n SER 79 Cb 0.12 1.36 -0.00 0.00 -0.26 0.00 0.00 64.21 65.43 1rjh n SER 79 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1rjh h ARG 80 N 0.00 0.00 0.00 4.33 2.47 -0.71 -3.44 114.38 117.03 1rjh h ARG 80 Ca -0.24 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.48 1rjh h ARG 80 Cb 1.58 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.90 1rjh h ARG 80 CO 0.02 0.57 0.00 0.41 0.56 0.00 0.00 179.97 181.52 1rjh n GLY 81 N 1.25 -0.41 0.00 0.04 0.00 -0.21 -4.91 105.19 100.95 1rjh n GLY 81 Ca 0.01 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 0.04 4.29 2.96 -0.02 0.00 0.39 -4.59 105.19 108.25 1rjh n GLY 82 Ca 0.00 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.22 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 0.00 -0.00 0.40 2.61 -4.23 -1.22 -4.33 115.64 108.87 1rjh s THR 83 Ca 0.00 0.01 -0.23 0.00 -1.18 0.00 0.00 61.69 60.29 1rjh s THR 83 Cb 0.00 -0.13 -0.10 0.00 1.34 0.00 0.00 72.50 73.61 1rjh s THR 83 CO 0.00 0.00 1.00 -0.22 -0.54 0.00 0.00 174.62 174.87 1rjh s LEU 84 N 0.09 4.10 -0.29 4.79 0.20 -1.26 -0.85 118.68 125.46 1rjh s LEU 84 Ca -0.00 1.90 -0.28 0.00 0.69 0.00 0.00 54.13 56.44 1rjh s LEU 84 Cb -0.01 -4.28 -0.04 0.00 -0.43 0.00 0.00 46.19 41.43 1rjh s LEU 84 CO -0.00 -0.41 2.13 -0.44 -0.29 0.00 0.00 176.35 177.34 1rjh s SER 85 N -1.77 5.44 -0.35 3.68 0.01 -1.10 -4.74 113.70 114.87 1rjh s SER 85 Ca 0.58 1.62 -0.08 0.00 1.31 0.00 0.00 55.95 59.38 1rjh s SER 85 Cb -0.17 -2.51 0.03 0.00 0.21 0.00 0.00 66.02 63.57 1rjh s SER 85 CO 0.22 -2.01 0.14 0.42 0.41 0.00 0.00 173.24 172.42 1rjh s THR 86 N 8.42 4.08 0.25 1.44 -4.23 -1.26 -4.29 115.64 120.05 1rjh s THR 86 Ca 0.94 -0.99 -0.28 0.00 -1.18 0.00 0.00 61.69 60.18 1rjh s THR 86 Cb -0.28 -3.28 -0.09 0.00 1.34 0.00 0.00 72.50 70.19 1rjh s THR 86 CO 0.33 -0.17 0.92 -2.16 -0.54 0.00 0.00 174.62 173.00 1rjh s PRO 87 N 1.47 4.76 0.00 3.99 0.04 -1.26 -4.95 135.00 139.05 1rjh s PRO 87 Ca 0.00 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.45 1rjh s PRO 87 Cb -0.19 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.17 1rjh s PRO 87 CO 0.04 0.48 0.00 0.00 0.04 0.00 0.00 177.00 177.56 1rjh n GLN 88 N 1.31 3.65 -4.22 4.56 10.64 -1.26 -4.92 117.38 127.12 1rjh n GLN 88 Ca -0.02 0.00 -0.17 0.00 -1.83 0.00 0.00 57.00 54.98 1rjh n GLN 88 Cb 0.48 -0.27 -0.08 0.00 -0.86 0.00 0.00 30.24 29.51 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 -0.54 0.00 0.35 -0.39 -4.23 -1.26 -3.00 115.64 106.58 1rjh s THR 89 Ca 0.00 -1.91 0.36 0.00 -1.18 0.00 0.00 61.69 58.97 1rjh s THR 89 Cb 0.00 -2.52 0.39 0.00 1.34 0.00 0.00 72.50 71.71 1rjh s THR 89 CO 0.00 0.00 2.13 1.23 -0.54 0.00 0.00 174.62 177.44 1rjh h GLY 90 N 2.21 0.00 0.92 3.99 0.00 -1.98 -2.99 103.07 105.23 1rjh h GLY 90 Ca -0.27 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 1rjh h GLY 90 CO 0.40 0.00 0.05 1.76 0.00 0.00 0.00 176.54 178.75 1rjh h SER 91 N 0.00 0.12 -0.25 0.19 0.02 -1.99 0.34 113.55 111.98 1rjh h SER 91 Ca -0.00 -0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 60.72 1rjh h SER 91 Cb 0.31 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1rjh h SER 91 CO 0.00 0.18 -0.32 -0.33 -1.14 0.00 0.00 176.83 175.23 1rjh h GLU 92 N 0.05 0.77 -0.96 3.45 3.07 -1.94 0.63 114.58 119.65 1rjh h GLU 92 Ca 0.03 -0.36 0.00 0.00 -0.50 0.00 0.00 59.36 58.54 1rjh h GLU 92 Cb 0.09 -0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 27.94 1rjh h GLU 92 CO -0.01 0.98 0.61 -0.91 -1.40 0.00 0.00 179.01 178.29 1rjh h ASN 93 N 0.65 1.12 -0.01 1.42 2.35 -1.44 0.20 115.58 119.87 1rjh h ASN 93 Ca 0.07 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1rjh h ASN 93 Cb 0.85 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.94 1rjh h ASN 93 CO 0.07 0.84 -0.01 -0.78 -1.65 0.00 0.00 177.43 175.90 1rjh h ASP 94 N 1.31 0.03 -0.69 5.81 3.58 -0.59 -1.30 116.42 124.57 1rjh h ASP 94 Ca 0.35 -0.42 0.07 0.00 0.42 0.00 0.00 57.03 57.45 1rjh h ASP 94 Cb -0.11 -0.01 -0.06 0.00 1.72 0.00 0.00 39.33 40.87 1rjh h ASP 94 CO -0.07 0.44 0.37 0.00 -2.88 0.00 0.00 179.24 177.10 1rjh h ALA 95 N 0.59 0.94 -0.47 -0.78 0.00 -0.52 0.17 119.26 119.19 1rjh h ALA 95 Ca 0.00 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1rjh h ALA 95 Cb 0.43 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1rjh h ALA 95 CO 0.00 0.01 0.05 -0.07 0.00 0.00 0.00 179.25 179.24 1rjh h LEU 96 N 0.66 0.77 -1.29 0.00 -0.00 -0.63 -0.25 115.31 114.57 1rjh h LEU 96 Ca 0.32 -0.28 -0.01 0.00 -0.00 0.00 0.00 57.88 57.91 1rjh h LEU 96 Cb 0.27 -0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 40.69 1rjh h LEU 96 CO -0.22 0.86 0.32 0.22 -0.00 0.00 0.00 178.44 179.61 1rjh h TYR 97 N 0.66 0.78 -0.13 1.13 5.03 -0.16 0.33 116.97 124.60 1rjh h TYR 97 Ca 0.14 -0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.38 1rjh h TYR 97 Cb 0.43 -0.25 -0.00 0.00 1.55 0.00 0.00 36.73 38.46 1rjh h TYR 97 CO 0.03 0.55 -0.15 0.93 -1.32 0.00 0.00 178.16 178.20 1rjh h GLU 98 N 0.81 0.34 -0.36 1.82 4.39 -0.43 -2.98 114.58 118.17 1rjh h GLU 98 Ca 0.21 -0.19 -0.16 0.00 0.34 0.00 0.00 59.36 59.56 1rjh h GLU 98 Cb 0.03 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1rjh h GLU 98 CO -0.03 0.74 -0.41 -0.92 -1.16 0.00 0.00 179.01 177.23 1rjh h TYR 99 N -0.05 1.10 -0.29 4.33 3.20 -0.55 -3.10 116.97 121.61 1rjh h TYR 99 Ca 0.02 -0.34 -0.07 0.00 3.14 0.00 0.00 58.73 61.48 1rjh h TYR 99 Cb 0.69 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 1rjh h TYR 99 CO 0.09 1.16 -0.12 1.37 -1.64 0.00 0.00 178.16 179.02 1rjh h LEU 100 N 0.74 0.48 0.00 2.82 8.10 -0.43 -0.00 115.31 127.02 1rjh h LEU 100 Ca 0.05 -0.12 0.00 0.00 0.11 0.00 0.00 57.88 57.92 1rjh h LEU 100 Cb 1.01 -0.13 0.00 0.00 -0.44 0.00 0.00 40.66 41.10 1rjh h LEU 100 CO 0.10 0.64 0.00 0.54 -4.11 0.00 0.00 178.44 175.61 1rjh n ARG 101 N -4.20 0.03 -0.22 0.17 1.74 -1.12 0.64 116.66 113.68 1rjh n ARG 101 Ca 0.01 0.19 0.06 0.00 -0.77 0.00 0.00 57.85 57.34 1rjh n ARG 101 Cb 0.32 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.43 1rjh n ARG 101 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1rjh n GLN 102 N -1.48 2.88 0.21 5.56 6.02 -0.05 -4.46 117.38 126.06 1rjh n GLN 102 Ca 0.05 -2.19 0.00 0.00 -0.01 0.00 0.00 57.00 54.84 1rjh n GLN 102 Cb 0.20 -1.38 0.00 0.00 1.02 0.00 0.00 30.24 30.08 1rjh n GLN 102 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1rjh n SER 103 N 0.25 -2.88 0.09 1.08 7.64 -0.99 -4.93 113.62 113.88 1rjh n SER 103 Ca 0.13 0.77 -0.11 0.00 1.01 0.00 0.00 58.87 60.67 1rjh n SER 103 Cb 0.52 2.75 -0.07 0.00 -1.01 0.00 0.00 64.21 66.40 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 1.52 0.00 0.44 2.07 -0.72 -3.49 116.25 116.07 1rjh h VAL 104 Ca 0.00 -2.88 0.00 0.00 0.82 0.00 0.00 66.70 64.64 1rjh h VAL 104 Cb 0.00 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 1rjh h VAL 104 CO 0.00 0.84 0.00 0.61 0.02 0.00 0.00 177.57 179.04 1rjh n GLY 105 N 1.17 1.88 0.00 2.17 0.00 0.21 -4.84 105.19 105.78 1rjh n GLY 105 Ca -0.05 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1rjh n GLY 105 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rjh n ASN 106 N 0.00 0.00 -1.34 1.61 4.05 -1.25 -4.05 115.26 114.27 1rjh n ASN 106 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1rjh n ASN 106 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1rjh n ASN 106 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1rjh n GLU 107 N 0.00 0.95 -2.69 1.20 1.02 -1.26 -3.59 120.64 116.26 1rjh n GLU 107 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1rjh n GLU 107 Cb 0.00 -1.03 -0.03 0.00 -0.02 0.00 0.00 31.44 30.36 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 0.09 3.18 -0.24 0.62 0.00 -1.26 -4.66 121.76 119.49 1rjh s ALA 108 Ca 0.00 0.56 -0.08 0.00 0.00 0.00 0.00 51.96 52.45 1rjh s ALA 108 Cb 0.00 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1rjh s ALA 108 CO 0.00 -0.23 0.08 -1.21 0.00 0.00 0.00 175.76 174.41 1rjh s GLU 109 N 0.93 3.74 0.00 0.00 2.02 -1.26 -1.12 118.70 123.01 1rjh s GLU 109 Ca 0.52 -0.44 0.06 0.00 0.02 0.00 0.00 54.97 55.13 1rjh s GLU 109 Cb -0.22 -3.35 -0.02 0.00 0.10 0.00 0.00 34.13 30.65 1rjh s GLU 109 CO 0.28 -0.12 -0.17 0.42 0.02 0.00 0.00 175.26 175.69 1rjh s ILE 110 N 1.44 1.38 0.51 -1.63 1.09 -0.37 -3.40 121.20 120.22 1rjh s ILE 110 Ca 0.06 -0.84 -0.21 0.00 -1.10 0.00 0.00 60.65 58.56 1rjh s ILE 110 Cb -0.15 -1.17 -0.07 0.00 -1.06 0.00 0.00 42.46 40.02 1rjh s ILE 110 CO 0.04 0.31 1.13 0.26 -0.10 0.00 0.00 174.94 176.58 1rjh s TRP 111 N -0.52 2.78 -2.38 3.97 0.52 -1.26 0.42 118.94 122.47 1rjh s TRP 111 Ca 0.06 1.55 0.23 0.00 0.02 0.00 0.00 56.10 57.96 1rjh s TRP 111 Cb -0.07 -3.28 0.49 0.00 -1.15 0.00 0.00 33.47 29.45 1rjh s TRP 111 CO -0.00 -1.45 1.44 1.28 0.02 0.00 0.00 176.95 178.24 1rjh n LEU 112 N -1.02 3.40 0.00 2.99 4.77 -1.02 -4.80 117.00 121.33 1rjh n LEU 112 Ca 0.10 -1.51 0.00 0.00 -0.03 0.00 0.00 56.01 54.57 1rjh n LEU 112 Cb 0.50 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1rjh n LEU 112 CO 0.43 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.86 1rjh n GLY 113 N 1.51 0.15 3.82 -0.72 0.00 -1.26 -4.30 105.19 104.38 1rjh n GLY 113 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 1rjh n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rjh s LEU 114 N 0.00 4.29 -0.03 0.99 1.02 -1.26 -1.83 118.68 121.86 1rjh s LEU 114 Ca 0.00 0.38 0.02 0.00 0.02 0.00 0.00 54.13 54.54 1rjh s LEU 114 Cb 0.00 -2.06 0.01 0.00 0.02 0.00 0.00 46.19 44.16 1rjh s LEU 114 CO 0.00 0.33 -0.07 0.21 0.02 0.00 0.00 176.35 176.84 1rjh s ASN 115 N -0.57 1.09 -0.20 2.29 3.84 -0.81 -3.47 114.94 117.11 1rjh s ASN 115 Ca 0.12 -0.16 -0.00 0.00 0.21 0.00 0.00 52.86 53.03 1rjh s ASN 115 Cb -0.12 -0.39 0.01 0.00 -0.55 0.00 0.00 41.25 40.21 1rjh s ASN 115 CO 0.02 0.02 -0.14 -0.62 -2.79 0.00 0.00 177.10 173.59 1rjh s ASP 116 N 0.48 3.60 -0.04 -4.21 2.15 -1.26 -3.82 116.67 113.57 1rjh s ASP 116 Ca -0.07 -0.63 0.01 0.00 0.43 0.00 0.00 52.55 52.29 1rjh s ASP 116 Cb -0.11 -1.57 -0.03 0.00 -0.30 0.00 0.00 42.92 40.91 1rjh s ASP 116 CO 0.01 -0.02 -0.02 0.80 -0.17 0.00 0.00 175.17 175.76 1rjh n MET 117 N 4.67 0.92 -0.54 4.34 0.00 -1.26 -4.74 117.12 120.50 1rjh n MET 117 Ca -0.20 0.02 0.05 0.00 -0.00 0.00 0.00 57.70 57.57 1rjh n MET 117 Cb 0.50 -1.08 0.25 0.00 0.00 0.00 0.00 33.22 32.88 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 -2.49 3.35 -2.71 -5.12 0.00 -1.26 -4.96 120.51 107.32 1rjh n ALA 118 Ca -0.07 -2.50 -0.07 0.00 0.00 0.00 0.00 53.44 50.80 1rjh n ALA 118 Cb 0.58 -0.74 0.03 0.00 0.00 0.00 0.00 19.45 19.32 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 -0.66 -2.02 -2.79 0.00 0.00 -1.26 -5.03 120.51 108.75 1rjh n ALA 119 Ca 0.25 0.07 -0.35 0.00 0.00 0.00 0.00 53.44 53.41 1rjh n ALA 119 Cb 0.95 -3.24 -0.09 0.00 0.00 0.00 0.00 19.45 17.07 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 -3.67 4.03 0.20 0.00 0.41 -1.26 -4.98 118.70 113.43 1rjh s GLU 120 Ca 0.22 -0.31 0.02 0.00 -0.41 0.00 0.00 54.97 54.49 1rjh s GLU 120 Cb -0.03 -3.30 0.12 0.00 -1.78 0.00 0.00 34.13 29.15 1rjh s GLU 120 CO 0.53 0.24 1.48 0.78 -0.49 0.00 0.00 175.26 177.80 1rjh h GLY 121 N 6.82 0.32 -7.68 -1.39 0.00 -2.02 -3.34 103.07 95.79 1rjh h GLY 121 Ca -0.38 -0.45 -0.77 0.00 0.00 0.00 0.00 47.33 45.72 1rjh h GLY 121 CO 0.71 0.40 0.45 -1.59 0.00 0.00 0.00 176.54 176.52 1rjh s THR 122 N -3.60 5.53 0.36 4.70 2.01 -1.26 -5.03 115.64 118.35 1rjh s THR 122 Ca -0.04 -2.63 -0.26 0.00 0.31 0.00 0.00 61.69 59.06 1rjh s THR 122 Cb 0.11 -4.61 -0.12 0.00 0.01 0.00 0.00 72.50 67.89 1rjh s THR 122 CO 0.82 -1.21 1.05 0.79 -0.69 0.00 0.00 174.62 175.38 1rjh n TRP 123 N 4.18 1.39 -4.09 4.92 7.02 -1.26 -4.80 117.44 124.80 1rjh n TRP 123 Ca 0.21 0.61 -0.36 0.00 -1.02 0.00 0.00 57.50 56.94 1rjh n TRP 123 Cb 0.45 -2.27 -0.08 0.00 -2.42 0.00 0.00 31.31 26.99 1rjh n TRP 123 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1rjh s VAL 124 N -1.16 4.95 0.81 -0.99 1.01 -1.25 -3.24 120.40 120.53 1rjh s VAL 124 Ca 0.60 0.00 -0.06 0.00 0.00 0.00 0.00 61.98 62.52 1rjh s VAL 124 Cb -0.61 -3.14 0.16 0.00 0.00 0.00 0.00 36.38 32.79 1rjh s VAL 124 CO 0.59 0.59 1.11 1.51 0.00 0.00 0.00 175.10 178.91 1rjh s ASP 125 N -0.79 3.86 0.37 3.32 -4.77 0.37 -1.92 116.67 117.10 1rjh s ASP 125 Ca 0.13 -0.22 0.08 0.00 -3.30 0.00 0.00 52.55 49.24 1rjh s ASP 125 Cb -0.12 -0.00 0.72 0.00 -1.09 0.00 0.00 42.92 42.43 1rjh s ASP 125 CO 0.03 -2.21 1.89 0.00 0.70 0.00 0.00 175.17 175.58 1rjh h MET 126 N -0.93 0.30 0.00 2.11 -0.00 -1.69 -2.79 114.93 111.94 1rjh h MET 126 Ca -0.38 -0.07 -0.05 0.00 -0.00 0.00 0.00 59.70 59.20 1rjh h MET 126 Cb 1.25 -0.04 -0.01 0.00 -0.00 0.00 0.00 31.60 32.80 1rjh h MET 126 CO 0.38 0.43 -0.23 1.79 -0.00 0.00 0.00 176.91 179.28 1rjh h THR 127 N 0.29 0.44 0.00 -0.10 1.35 -1.94 -3.46 112.91 109.49 1rjh h THR 127 Ca 0.06 -1.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 1rjh h THR 127 Cb 0.39 2.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 1rjh h THR 127 CO 0.02 0.22 0.00 0.61 -0.25 0.00 0.00 175.52 176.13 1rjh n GLY 128 N 0.76 1.68 3.68 5.82 0.00 -1.05 -5.13 105.19 110.95 1rjh n GLY 128 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 3.26 0.16 4.61 0.00 -1.26 -4.89 121.76 121.64 1rjh s ALA 129 Ca 0.00 -1.64 0.07 0.00 0.00 0.00 0.00 51.96 50.39 1rjh s ALA 129 Cb 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 1rjh s ALA 129 CO 0.00 0.24 0.02 -0.98 0.00 0.00 0.00 175.76 175.04 1rjh s ARG 130 N -3.72 2.50 0.16 0.00 3.03 -1.26 -0.48 118.95 119.18 1rjh s ARG 130 Ca 0.32 -1.04 -0.18 0.00 2.03 0.00 0.00 55.73 56.86 1rjh s ARG 130 Cb -0.06 -2.42 -0.07 0.00 -1.03 0.00 0.00 34.95 31.36 1rjh s ARG 130 CO 0.21 0.47 0.63 0.96 -1.13 0.00 0.00 175.30 176.44 1rjh s ILE 131 N -1.69 4.70 -0.25 4.99 -0.00 -1.20 -4.97 121.20 122.79 1rjh s ILE 131 Ca 0.28 1.11 0.22 0.00 -0.00 0.00 0.00 60.65 62.26 1rjh s ILE 131 Cb -0.10 -3.83 -0.20 0.00 -0.00 0.00 0.00 42.46 38.34 1rjh s ILE 131 CO 0.19 0.30 0.76 0.00 -0.00 0.00 0.00 174.94 176.19 1rjh n ALA 132 N 0.98 2.95 -4.02 2.27 0.00 -1.26 -4.85 120.51 116.58 1rjh n ALA 132 Ca -0.05 -0.42 -0.33 0.00 0.00 0.00 0.00 53.44 52.64 1rjh n ALA 132 Cb 0.51 -0.89 -0.16 0.00 0.00 0.00 0.00 19.45 18.91 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 -3.39 2.78 -0.07 0.00 6.14 -1.16 -5.09 117.35 116.55 1rjh s TYR 133 Ca -0.03 -1.57 -0.04 0.00 0.64 0.00 0.00 57.07 56.08 1rjh s TYR 133 Cb 0.13 -1.92 0.04 0.00 0.42 0.00 0.00 41.96 40.63 1rjh s TYR 133 CO 0.85 -0.77 0.17 -1.59 0.64 0.00 0.00 175.55 174.86 1rjh s LYS 134 N 1.23 0.13 -0.11 4.97 -2.85 -1.26 -4.70 119.74 117.15 1rjh s LYS 134 Ca 0.03 0.39 -0.09 0.00 -1.00 0.00 0.00 55.97 55.31 1rjh s LYS 134 Cb -0.13 -0.13 0.04 0.00 -2.06 0.00 0.00 37.83 35.54 1rjh s LYS 134 CO -0.11 -0.15 0.29 0.54 0.10 0.00 0.00 175.35 176.03 1rjh s ASN 135 N 1.04 -0.31 -0.09 0.03 2.20 -1.26 -5.13 114.94 111.42 1rjh s ASN 135 Ca -0.08 0.60 0.00 0.00 -0.94 0.00 0.00 52.86 52.44 1rjh s ASN 135 Cb -0.10 0.56 0.02 0.00 -2.00 0.00 0.00 41.25 39.73 1rjh s ASN 135 CO -0.06 -0.13 -0.08 0.26 -2.94 0.00 0.00 177.10 174.15 1rjh s TRP 136 N 0.60 1.38 0.12 1.54 0.52 -1.26 -2.16 118.94 119.67 1rjh s TRP 136 Ca -0.04 -0.62 0.15 0.00 0.02 0.00 0.00 56.10 55.62 1rjh s TRP 136 Cb -0.05 -1.13 0.39 0.00 -1.15 0.00 0.00 33.47 31.54 1rjh s TRP 136 CO -0.04 -0.42 1.60 0.93 0.02 0.00 0.00 176.95 179.04 1rjh h GLU 137 N 7.80 0.00 -0.56 4.98 4.39 -1.91 -2.93 114.58 126.34 1rjh h GLU 137 Ca -0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.40 1rjh h GLU 137 Cb 1.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1rjh h GLU 137 CO 0.42 0.52 0.00 0.25 -1.16 0.00 0.00 179.01 179.04 1rjh n THR 138 N -3.50 0.45 -1.54 1.13 -2.24 -1.26 -4.84 114.28 102.48 1rjh n THR 138 Ca 0.00 -0.28 -0.41 0.00 -2.27 0.00 0.00 64.05 61.09 1rjh n THR 138 Cb 0.62 -0.19 -0.05 0.00 -2.10 0.00 0.00 70.33 68.62 1rjh n THR 138 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1rjh n GLU 139 N 0.08 1.20 -3.56 -0.78 2.13 -1.11 -4.91 120.64 113.69 1rjh n GLU 139 Ca 0.06 0.20 -0.38 0.00 0.66 0.00 0.00 57.16 57.71 1rjh n GLU 139 Cb 0.32 -3.00 -0.10 0.00 0.27 0.00 0.00 31.44 28.92 1rjh n GLU 139 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 1rjh s ILE 140 N 9.86 5.29 -0.09 6.31 2.07 -1.26 -4.92 121.20 138.46 1rjh s ILE 140 Ca 1.05 0.27 0.15 0.00 -1.41 0.00 0.00 60.65 60.71 1rjh s ILE 140 Cb -0.46 -3.56 -0.22 0.00 0.13 0.00 0.00 42.46 38.35 1rjh s ILE 140 CO 0.35 0.25 0.20 0.35 -1.91 0.00 0.00 174.94 174.18 1rjh n THR 141 N 4.91 0.54 -3.95 4.00 -2.24 -1.26 -4.85 114.28 111.42 1rjh n THR 141 Ca -0.13 -0.51 -0.33 0.00 -2.27 0.00 0.00 64.05 60.81 1rjh n THR 141 Cb 0.52 -0.25 -0.14 0.00 -2.10 0.00 0.00 70.33 68.35 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 -2.72 2.92 -0.45 6.98 0.00 -1.26 -5.07 121.76 122.16 1rjh s ALA 142 Ca -0.07 -2.38 -0.29 0.00 0.00 0.00 0.00 51.96 49.23 1rjh s ALA 142 Cb 0.07 -2.05 0.02 0.00 0.00 0.00 0.00 23.12 21.16 1rjh s ALA 142 CO 0.64 -1.63 1.34 -0.65 0.00 0.00 0.00 175.76 175.47 1rjh s GLN 143 N 1.02 3.57 -0.03 0.00 -0.21 -1.26 -4.93 119.66 117.82 1rjh s GLN 143 Ca 0.06 0.77 -0.12 0.00 0.02 0.00 0.00 55.36 56.10 1rjh s GLN 143 Cb -0.20 -4.01 -0.06 0.00 1.00 0.00 0.00 33.01 29.73 1rjh s GLN 143 CO -0.06 -1.58 0.55 -1.35 -2.12 0.00 0.00 175.29 170.73 1rjh h PRO 144 N 10.40 -0.40 -0.16 2.91 0.11 -1.97 -3.32 132.00 139.57 1rjh h PRO 144 Ca -0.26 0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.78 1rjh h PRO 144 Cb 1.09 0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1rjh h PRO 144 CO 1.11 -0.27 -0.33 0.38 -0.21 0.00 0.00 178.00 178.69 1rjh h ASP 145 N -0.93 0.32 0.00 -2.05 3.04 -1.94 -3.46 116.42 111.40 1rjh h ASP 145 Ca -0.04 -0.12 0.00 0.00 -3.24 0.00 0.00 57.03 53.63 1rjh h ASP 145 Cb 0.32 -0.09 0.00 0.00 -1.04 0.00 0.00 39.33 38.52 1rjh h ASP 145 CO 0.07 0.64 0.00 0.61 -2.04 0.00 0.00 179.24 178.52 1rjh n GLY 146 N -0.33 0.94 0.00 7.15 0.00 -1.25 -4.92 105.19 106.78 1rjh n GLY 146 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.05 3.58 -0.02 0.00 -1.26 -4.95 105.19 102.49 1rjh n GLY 147 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1rjh n GLY 147 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rjh s LYS 148 N 0.00 3.03 0.26 1.61 2.36 -1.26 -4.95 119.74 120.79 1rjh s LYS 148 Ca 0.00 1.32 0.07 0.00 -2.55 0.00 0.00 55.97 54.81 1rjh s LYS 148 Cb 0.00 -4.30 -0.05 0.00 -1.05 0.00 0.00 37.83 32.43 1rjh s LYS 148 CO 0.00 -2.22 -0.08 0.95 1.55 0.00 0.00 175.35 175.54 1rjh s THR 149 N 8.08 1.68 0.82 3.43 -4.23 -1.26 -5.00 115.64 119.17 1rjh s THR 149 Ca 0.81 -2.15 -0.07 0.00 -1.18 0.00 0.00 61.69 59.10 1rjh s THR 149 Cb -0.21 -2.34 0.16 0.00 1.34 0.00 0.00 72.50 71.45 1rjh s THR 149 CO 0.30 -0.38 1.13 -1.61 -0.54 0.00 0.00 174.62 173.52 1rjh s GLU 150 N -3.70 1.23 -0.04 3.99 0.41 -1.26 -5.06 118.70 114.27 1rjh s GLU 150 Ca 0.28 -0.87 0.02 0.00 -0.41 0.00 0.00 54.97 53.98 1rjh s GLU 150 Cb 0.02 -2.14 0.01 0.00 -1.78 0.00 0.00 34.13 30.25 1rjh s GLU 150 CO 0.11 -1.85 -0.07 -0.80 -0.49 0.00 0.00 175.26 172.15 1rjh s ASN 151 N -4.81 1.11 0.12 -0.19 0.02 0.63 -4.84 114.94 106.98 1rjh s ASN 151 Ca 0.70 -0.17 0.00 0.00 -1.02 0.00 0.00 52.86 52.37 1rjh s ASN 151 Cb -0.04 -0.44 0.00 0.00 0.02 0.00 0.00 41.25 40.79 1rjh s ASN 151 CO 0.48 0.00 0.00 0.00 0.02 0.00 0.00 177.10 177.60 1rjh s ALA 153 N -2.54 3.65 0.00 0.00 0.00 -1.23 -3.21 121.76 118.44 1rjh s ALA 153 Ca 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.85 1rjh s ALA 153 Cb 0.00 -2.49 -0.01 0.00 0.00 0.00 0.00 23.12 20.62 1rjh s ALA 153 CO 0.00 0.42 -0.09 0.54 0.00 0.00 0.00 175.76 176.63 1rjh s VAL 154 N -0.95 0.70 -0.21 0.00 0.11 0.17 -2.44 120.40 117.78 1rjh s VAL 154 Ca 0.26 -0.48 -0.19 0.00 -2.93 0.00 0.00 61.98 58.63 1rjh s VAL 154 Cb -0.17 -0.61 -0.03 0.00 -1.53 0.00 0.00 36.38 34.04 1rjh s VAL 154 CO 0.15 0.12 0.54 -0.22 -3.33 0.00 0.00 175.10 172.36 1rjh s LEU 155 N -0.41 4.13 -0.39 2.54 0.20 0.17 -0.54 118.68 124.39 1rjh s LEU 155 Ca 0.02 0.69 -0.07 0.00 0.69 0.00 0.00 54.13 55.46 1rjh s LEU 155 Cb -0.04 -2.74 0.07 0.00 -0.43 0.00 0.00 46.19 43.04 1rjh s LEU 155 CO -0.00 -0.21 0.20 -0.55 -0.29 0.00 0.00 176.35 175.49 1rjh s SER 156 N 1.21 5.48 0.00 3.68 0.15 -1.25 -1.23 113.70 121.74 1rjh s SER 156 Ca 0.25 -1.43 0.27 0.00 0.70 0.00 0.00 55.95 55.74 1rjh s SER 156 Cb -0.16 -1.93 1.52 0.00 -1.71 0.00 0.00 66.02 63.75 1rjh s SER 156 CO 0.10 -0.46 1.99 0.61 1.20 0.00 0.00 173.24 176.67 1rjh n GLY 157 N 4.84 -0.87 1.11 9.45 0.00 -0.27 -2.62 105.19 116.83 1rjh n GLY 157 Ca -0.10 -0.20 0.11 0.00 0.00 0.00 0.00 46.02 45.83 1rjh n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rjh n ALA 158 N -0.78 2.41 0.01 4.61 0.00 -1.24 -4.54 120.51 120.98 1rjh n ALA 158 Ca 0.20 -1.01 -0.00 0.00 0.00 0.00 0.00 53.44 52.63 1rjh n ALA 158 Cb 0.12 -0.82 -0.00 0.00 0.00 0.00 0.00 19.45 18.75 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 1.42 2.98 0.00 0.00 0.00 -1.13 -5.03 120.51 118.75 1rjh n ALA 159 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1rjh n ALA 159 Cb 0.59 0.42 0.00 0.00 0.00 0.00 0.00 19.45 20.45 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 -3.17 0.00 0.00 0.00 2.85 -1.20 -5.00 115.26 108.74 1rjh n ASN 160 Ca -0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1rjh n ASN 160 Cb 0.35 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.37 1rjh n ASN 160 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1rjh n GLY 161 N -0.36 0.82 3.44 8.20 0.00 -1.08 -5.01 105.19 111.20 1rjh n GLY 161 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.83 -1.85 -3.49 1.61 4.76 -1.26 -4.85 118.16 112.25 1rjh n LYS 162 Ca 0.00 -1.80 -0.37 0.00 -2.87 0.00 0.00 58.31 53.27 1rjh n LYS 162 Cb 0.00 -1.35 -0.06 0.00 -1.84 0.00 0.00 35.03 31.77 1rjh n LYS 162 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1rjh s TRP 163 N -3.37 3.57 0.28 2.13 0.51 -0.92 -3.84 118.94 117.30 1rjh s TRP 163 Ca 0.68 0.80 0.06 0.00 -2.12 0.00 0.00 56.10 55.52 1rjh s TRP 163 Cb -0.03 -2.35 -0.06 0.00 -0.81 0.00 0.00 33.47 30.22 1rjh s TRP 163 CO 0.49 0.39 -0.05 -0.06 -0.51 0.00 0.00 176.95 177.22 1rjh s PHE 164 N -0.11 1.94 0.03 -1.98 0.40 0.30 -3.28 117.98 115.29 1rjh s PHE 164 Ca 0.21 -0.73 0.07 0.00 -0.60 0.00 0.00 56.93 55.88 1rjh s PHE 164 Cb -0.15 -1.13 -0.03 0.00 0.51 0.00 0.00 43.02 42.22 1rjh s PHE 164 CO 0.09 0.25 -0.19 0.16 0.70 0.00 0.00 175.22 176.22 1rjh s ASP 165 N -3.44 3.72 0.07 1.36 -4.77 -1.26 0.42 116.67 112.76 1rjh s ASP 165 Ca 0.30 -0.42 0.00 0.00 -3.30 0.00 0.00 52.55 49.13 1rjh s ASP 165 Cb 0.04 -0.59 -0.00 0.00 -1.09 0.00 0.00 42.92 41.28 1rjh s ASP 165 CO 0.12 0.27 0.08 1.17 0.70 0.00 0.00 175.17 177.51 1rjh n LYS 166 N 1.70 0.11 -2.32 2.11 4.81 -1.20 -4.85 118.16 118.54 1rjh n LYS 166 Ca -0.16 -0.59 -0.42 0.00 -0.87 0.00 0.00 58.31 56.26 1rjh n LYS 166 Cb 0.52 0.53 -0.03 0.00 0.02 0.00 0.00 35.03 36.07 1rjh n LYS 166 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1rjh s ARG 167 N -2.20 4.32 0.55 1.64 1.81 -1.26 -0.27 118.95 123.53 1rjh s ARG 167 Ca 0.07 1.85 0.34 0.00 -1.72 0.00 0.00 55.73 56.27 1rjh s ARG 167 Cb 0.00 -3.55 1.43 0.00 -0.45 0.00 0.00 34.95 32.38 1rjh s ARG 167 CO 0.05 -0.51 2.00 0.00 -0.68 0.00 0.00 175.30 176.16 1rjh n ARG 169 N -3.06 2.65 -2.77 0.00 1.74 -1.26 -1.95 116.66 112.02 1rjh n ARG 169 Ca 0.00 -2.07 -0.41 0.00 -0.77 0.00 0.00 57.85 54.61 1rjh n ARG 169 Cb 0.29 -1.58 -0.05 0.00 -1.02 0.00 0.00 32.46 30.10 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 -0.90 7.50 -0.79 0.55 2.15 -0.02 -4.74 116.67 120.42 1rjh s ASP 170 Ca 0.38 1.79 -0.18 0.00 0.43 0.00 0.00 52.55 54.97 1rjh s ASP 170 Cb 0.22 -2.58 0.14 0.00 -0.30 0.00 0.00 42.92 40.40 1rjh s ASP 170 CO 0.22 0.01 0.90 -1.10 -0.17 0.00 0.00 175.17 175.02 1rjh s GLN 171 N -0.33 3.41 0.38 4.34 -0.21 -1.26 -3.95 119.66 122.04 1rjh s GLN 171 Ca 0.44 -1.78 0.06 0.00 0.02 0.00 0.00 55.36 54.11 1rjh s GLN 171 Cb -0.24 -4.56 -0.07 0.00 1.00 0.00 0.00 33.01 29.14 1rjh s GLN 171 CO 0.30 -1.58 0.02 -0.48 -2.12 0.00 0.00 175.29 171.43 1rjh s LEU 172 N 2.07 2.66 0.00 2.90 0.05 -1.06 -4.38 118.68 120.92 1rjh s LEU 172 Ca 0.22 -1.36 -0.20 0.00 0.05 0.00 0.00 54.13 52.84 1rjh s LEU 172 Cb -0.12 -0.74 0.29 0.00 -2.05 0.00 0.00 46.19 43.56 1rjh s LEU 172 CO -0.04 -0.49 0.99 -2.65 -0.55 0.00 0.00 176.35 173.62 1rjh n PRO 173 N -0.87 -3.18 -3.91 1.48 -0.02 -1.22 -2.34 135.00 124.94 1rjh n PRO 173 Ca -0.04 -1.59 -0.08 0.00 -2.02 0.00 0.00 63.50 59.76 1rjh n PRO 173 Cb 0.67 -1.55 -0.03 0.00 -0.02 0.00 0.00 33.50 32.57 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 -2.75 0.10 -0.10 6.00 1.13 -0.62 -4.07 117.35 117.04 1rjh s TYR 174 Ca 0.65 -0.55 0.02 0.00 -1.41 0.00 0.00 57.07 55.78 1rjh s TYR 174 Cb -0.07 0.51 0.02 0.00 -1.10 0.00 0.00 41.96 41.31 1rjh s TYR 174 CO 0.51 -1.19 -0.13 0.42 -2.51 0.00 0.00 175.55 172.65 1rjh s ILE 175 N -3.71 1.29 -0.16 -3.49 1.09 -1.26 -4.35 121.20 110.62 1rjh s ILE 175 Ca 0.16 -0.53 -0.07 0.00 -1.10 0.00 0.00 60.65 59.12 1rjh s ILE 175 Cb -0.04 -1.20 -0.04 0.00 -1.06 0.00 0.00 42.46 40.12 1rjh s ILE 175 CO 0.09 0.40 0.09 0.00 -0.10 0.00 0.00 174.94 175.42 1rjh s GLN 177 N -0.17 3.35 0.48 0.00 2.00 -0.03 -4.86 119.66 120.43 1rjh s GLN 177 Ca 0.09 -0.33 0.06 0.00 -2.00 0.00 0.00 55.36 53.18 1rjh s GLN 177 Cb -0.12 -3.92 -0.00 0.00 0.80 0.00 0.00 33.01 29.77 1rjh s GLN 177 CO 0.01 -0.93 0.32 -0.59 -0.50 0.00 0.00 175.29 173.60 1rjh s PHE 178 N 2.72 2.15 0.00 1.67 -0.71 -1.26 -3.41 117.98 119.14 1rjh s PHE 178 Ca 0.22 -0.70 0.00 0.00 -1.04 0.00 0.00 56.93 55.41 1rjh s PHE 178 Cb -0.14 -1.97 0.00 0.00 -1.21 0.00 0.00 43.02 39.69 1rjh s PHE 178 CO 0.18 -0.18 0.00 0.41 -1.34 0.00 0.00 175.22 174.28 1rjh n GLY 179 N -1.55 3.04 4.93 1.99 0.00 -1.26 -4.99 105.19 107.35 1rjh n GLY 179 Ca -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1rjh n GLY 179 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1rjh n ILE 180 N 0.00 0.00 0.56 -0.61 -0.00 -1.26 -5.17 119.36 112.88 1rjh n ILE 180 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 62.75 62.82 1rjh n ILE 180 Cb 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 39.64 39.70 1rjh n ILE 180 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10