#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 0.84 -1.68 4.37 -1.04 -1.26 -1.45 114.28 114.06 1rjh n THR 65 Ca 0.00 0.21 -0.50 0.00 -2.04 0.00 0.00 64.05 61.72 1rjh n THR 65 Cb 0.00 -0.97 -0.05 0.00 -1.82 0.00 0.00 70.33 67.49 1rjh n THR 65 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rjh n GLN 66 N -1.41 1.95 -3.37 -2.82 6.02 -1.26 -4.49 117.38 112.00 1rjh n GLN 66 Ca 0.05 0.71 -0.41 0.00 -0.01 0.00 0.00 57.00 57.34 1rjh n GLN 66 Cb 0.14 -2.51 -0.09 0.00 1.02 0.00 0.00 30.24 28.80 1rjh n GLN 66 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1rjh s THR 67 N 3.36 5.14 0.25 5.09 -4.23 -1.26 -3.75 115.64 120.24 1rjh s THR 67 Ca 0.91 -0.09 -0.06 0.00 -1.18 0.00 0.00 61.69 61.27 1rjh s THR 67 Cb -0.77 -3.90 0.02 0.00 1.34 0.00 0.00 72.50 69.20 1rjh s THR 67 CO 0.52 -0.20 0.44 2.29 -0.54 0.00 0.00 174.62 177.12 1rjh n LYS 68 N 5.45 0.63 -1.76 3.99 0.00 -1.02 -4.65 118.16 120.80 1rjh n LYS 68 Ca -0.08 -1.67 -0.30 0.00 -0.00 0.00 0.00 58.31 56.25 1rjh n LYS 68 Cb 0.49 1.84 0.07 0.00 -0.00 0.00 0.00 35.03 37.43 1rjh n LYS 68 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1rjh s THR 69 N -2.53 3.01 0.24 0.58 -4.23 -1.25 -3.02 115.64 108.44 1rjh s THR 69 Ca 0.15 0.33 -0.05 0.00 -1.18 0.00 0.00 61.69 60.94 1rjh s THR 69 Cb -0.02 -3.23 0.16 0.00 1.34 0.00 0.00 72.50 70.75 1rjh s THR 69 CO 0.11 -0.43 1.80 0.15 -0.54 0.00 0.00 174.62 175.71 1rjh h PHE 70 N -0.91 1.08 -0.33 3.99 3.57 -1.39 0.21 116.94 123.16 1rjh h PHE 70 Ca -0.46 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 60.93 1rjh h PHE 70 Cb 1.28 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 1rjh h PHE 70 CO 0.44 0.84 0.13 1.25 -2.23 0.00 0.00 178.31 178.74 1rjh h HIS 71 N 1.03 0.50 -0.66 0.41 2.76 -1.93 0.13 115.15 117.38 1rjh h HIS 71 Ca 0.23 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.32 1rjh h HIS 71 Cb 0.24 -0.15 -0.03 0.00 1.55 0.00 0.00 27.41 29.02 1rjh h HIS 71 CO 0.02 0.48 0.24 0.93 -1.30 0.00 0.00 177.93 178.29 1rjh h GLU 72 N 0.38 1.01 -0.75 5.26 5.08 -1.88 -2.49 114.58 121.19 1rjh h GLU 72 Ca 0.11 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1rjh h GLU 72 Cb 0.19 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1rjh h GLU 72 CO -0.01 0.86 0.49 0.00 -1.00 0.00 0.00 179.01 179.35 1rjh h ALA 73 N 1.10 1.56 0.86 3.43 0.00 -0.02 0.24 119.26 126.42 1rjh h ALA 73 Ca 0.22 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1rjh h ALA 73 Cb 0.25 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.79 1rjh h ALA 73 CO -0.01 0.37 -0.41 1.03 0.00 0.00 0.00 179.25 180.23 1rjh h SER 74 N 0.92 -0.97 0.81 0.00 0.87 -0.38 -3.03 113.55 111.76 1rjh h SER 74 Ca 0.30 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1rjh h SER 74 Cb 0.04 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 1rjh h SER 74 CO -0.08 -0.62 0.00 1.05 -0.53 0.00 0.00 176.83 176.65 1rjh h GLU 75 N -1.30 0.00 0.69 2.24 4.11 -1.23 -2.23 114.58 116.86 1rjh h GLU 75 Ca -0.12 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.28 1rjh h GLU 75 Cb 0.88 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.14 1rjh h GLU 75 CO 0.19 0.00 -0.33 0.22 0.07 0.00 0.00 179.01 179.16 1rjh h ASP 76 N 0.00 -0.78 -0.71 3.06 1.82 -0.46 -0.17 116.42 119.18 1rjh h ASP 76 Ca 0.00 0.00 0.02 0.00 -0.39 0.00 0.00 57.03 56.67 1rjh h ASP 76 Cb 0.41 0.20 -0.04 0.00 0.68 0.00 0.00 39.33 40.58 1rjh h ASP 76 CO 0.00 -0.42 0.47 0.00 -1.61 0.00 0.00 179.24 177.68 1rjh h ILE 78 N 0.90 0.81 0.00 0.00 1.08 -1.28 -0.23 117.51 118.78 1rjh h ILE 78 Ca 0.27 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 64.56 1rjh h ILE 78 Cb -0.01 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 33.97 1rjh h ILE 78 CO -0.07 0.10 -0.31 -1.54 -0.69 0.00 0.00 178.15 175.64 1rjh n SER 79 N -4.91 0.68 0.20 1.72 3.41 -0.09 -2.52 113.62 112.11 1rjh n SER 79 Ca 0.11 0.31 0.08 0.00 -0.26 0.00 0.00 58.87 59.11 1rjh n SER 79 Cb 0.29 -0.28 0.33 0.00 -0.26 0.00 0.00 64.21 64.28 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 -0.31 -3.47 114.38 117.40 1rjh h ARG 80 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1rjh h ARG 80 Cb 0.70 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.02 1rjh h ARG 80 CO 0.00 0.27 0.00 0.41 0.56 0.00 0.00 179.97 181.21 1rjh n GLY 81 N 0.52 1.38 0.09 0.04 0.00 -0.87 -5.09 105.19 101.26 1rjh n GLY 81 Ca 0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.51 3.51 3.64 -0.02 0.00 -0.18 -5.04 105.19 105.60 1rjh n GLY 82 Ca 0.00 -1.51 -0.25 0.00 0.00 0.00 0.00 46.02 44.26 1rjh n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rjh s THR 83 N -2.26 2.54 0.37 2.61 -4.23 -1.26 -3.38 115.64 110.03 1rjh s THR 83 Ca 0.01 -1.94 -0.20 0.00 -1.18 0.00 0.00 61.69 58.37 1rjh s THR 83 Cb 0.00 -2.83 -0.10 0.00 1.34 0.00 0.00 72.50 70.91 1rjh s THR 83 CO 0.01 -0.16 0.88 -0.22 -0.54 0.00 0.00 174.62 174.59 1rjh s LEU 84 N -3.74 4.06 -0.33 4.79 2.96 -1.26 0.48 118.68 125.64 1rjh s LEU 84 Ca 0.35 1.59 -0.28 0.00 -0.22 0.00 0.00 54.13 55.58 1rjh s LEU 84 Cb 0.01 -4.28 -0.02 0.00 0.50 0.00 0.00 46.19 42.40 1rjh s LEU 84 CO 0.20 -0.25 1.88 -0.44 -1.32 0.00 0.00 176.35 176.42 1rjh s SER 85 N -2.08 5.76 -0.21 3.68 0.01 -0.24 -4.71 113.70 115.92 1rjh s SER 85 Ca 0.57 1.34 -0.00 0.00 1.31 0.00 0.00 55.95 59.17 1rjh s SER 85 Cb -0.11 -2.52 0.02 0.00 0.21 0.00 0.00 66.02 63.61 1rjh s SER 85 CO 0.16 -1.81 -0.14 0.28 0.41 0.00 0.00 173.24 172.15 1rjh s THR 86 N 7.33 2.48 -0.22 1.44 -1.32 -1.25 -4.21 115.64 119.90 1rjh s THR 86 Ca 0.83 -0.91 -0.28 0.00 -1.21 0.00 0.00 61.69 60.12 1rjh s THR 86 Cb -0.23 -2.13 0.00 0.00 -1.51 0.00 0.00 72.50 68.63 1rjh s THR 86 CO 0.33 0.42 0.96 -2.16 -2.21 0.00 0.00 174.62 171.96 1rjh s PRO 87 N 1.32 4.25 -0.16 7.08 0.05 -1.26 -4.91 135.00 141.38 1rjh s PRO 87 Ca 0.03 1.22 0.14 0.00 0.05 0.00 0.00 61.00 62.44 1rjh s PRO 87 Cb -0.14 -3.63 -0.19 0.00 0.05 0.00 0.00 34.50 30.58 1rjh s PRO 87 CO -0.09 -0.55 0.04 1.04 0.05 0.00 0.00 177.00 177.49 1rjh n GLN 88 N 6.06 1.36 -2.26 4.56 6.02 -1.26 -4.70 117.38 127.15 1rjh n GLN 88 Ca 0.09 -0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 57.05 1rjh n GLN 88 Cb 0.47 -1.41 -0.01 0.00 1.02 0.00 0.00 30.24 30.31 1rjh n GLN 88 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1rjh n THR 89 N -2.61 0.00 0.03 5.09 -2.24 -1.26 -1.82 114.28 111.47 1rjh n THR 89 Ca -0.26 -0.25 -0.03 0.00 -2.27 0.00 0.00 64.05 61.23 1rjh n THR 89 Cb 1.01 0.08 0.20 0.00 -2.10 0.00 0.00 70.33 69.52 1rjh n THR 89 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1rjh h GLY 90 N 0.16 0.48 0.54 3.38 0.00 -1.95 -3.24 103.07 102.43 1rjh h GLY 90 Ca -0.04 -0.40 0.05 0.00 0.00 0.00 0.00 47.33 46.94 1rjh h GLY 90 CO 0.06 0.37 -0.04 1.76 0.00 0.00 0.00 176.54 178.68 1rjh h SER 91 N 0.38 -0.19 0.30 0.19 0.02 -1.98 0.61 113.55 112.88 1rjh h SER 91 Ca 0.05 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1rjh h SER 91 Cb 0.71 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.39 1rjh h SER 91 CO 0.05 -0.06 -0.14 -0.33 -1.14 0.00 0.00 176.83 175.20 1rjh h GLU 92 N 0.02 -0.39 -0.56 3.45 3.07 -1.95 -1.17 114.58 117.06 1rjh h GLU 92 Ca 0.12 0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 58.94 1rjh h GLU 92 Cb 0.17 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.15 1rjh h GLU 92 CO -0.24 -0.20 0.09 -0.97 -1.40 0.00 0.00 179.01 176.29 1rjh h ASN 93 N -0.49 0.85 -0.45 1.42 -1.24 -1.58 0.32 115.58 114.41 1rjh h ASN 93 Ca -0.04 -0.18 -0.03 0.00 0.71 0.00 0.00 56.30 56.75 1rjh h ASN 93 Cb 0.37 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.17 1rjh h ASN 93 CO 0.07 0.86 0.14 -0.78 -1.29 0.00 0.00 177.43 176.43 1rjh h ASP 94 N 0.85 0.65 0.59 1.15 3.58 -0.76 -2.18 116.42 120.30 1rjh h ASP 94 Ca 0.18 -0.20 -0.20 0.00 0.42 0.00 0.00 57.03 57.22 1rjh h ASP 94 Cb 0.38 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 1rjh h ASP 94 CO 0.01 0.68 -0.91 0.00 -2.88 0.00 0.00 179.24 176.13 1rjh h ALA 95 N 1.00 0.47 -0.19 -0.78 0.00 -0.87 -3.21 119.26 115.68 1rjh h ALA 95 Ca 0.14 -0.74 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1rjh h ALA 95 Cb 0.26 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1rjh h ALA 95 CO -0.01 0.93 0.08 1.25 0.00 0.00 0.00 179.25 181.50 1rjh h LEU 96 N 0.11 0.26 -0.96 0.00 5.85 -0.20 0.11 115.31 120.48 1rjh h LEU 96 Ca -0.05 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.52 1rjh h LEU 96 Cb 1.55 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 42.47 1rjh h LEU 96 CO 0.14 0.34 0.63 0.22 -0.34 0.00 0.00 178.44 179.44 1rjh h TYR 97 N 0.16 1.21 -0.37 1.25 3.20 -1.48 -0.52 116.97 120.41 1rjh h TYR 97 Ca 0.06 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.83 1rjh h TYR 97 Cb 0.16 -0.41 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 1rjh h TYR 97 CO -0.01 0.77 -0.28 0.93 -1.64 0.00 0.00 178.16 177.92 1rjh h GLU 98 N 1.30 0.79 -0.25 1.82 4.39 -1.50 -2.84 114.58 118.30 1rjh h GLU 98 Ca 0.35 -0.35 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 1rjh h GLU 98 Cb -0.14 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 1rjh h GLU 98 CO -0.08 0.98 -0.06 -0.92 -1.16 0.00 0.00 179.01 177.78 1rjh h TYR 99 N 0.68 0.40 -0.60 4.33 3.20 0.05 -2.03 116.97 123.01 1rjh h TYR 99 Ca 0.08 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.96 1rjh h TYR 99 Cb 0.82 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.92 1rjh h TYR 99 CO 0.04 0.45 0.33 -0.07 -1.64 0.00 0.00 178.16 177.27 1rjh h LEU 100 N 0.37 0.49 0.00 2.82 3.38 -0.88 -2.02 115.31 119.47 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 0.34 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1rjh h LEU 100 CO 0.02 0.32 0.00 0.54 0.09 0.00 0.00 178.44 179.41 1rjh n ARG 101 N -4.82 0.03 -0.13 1.13 1.74 -0.77 0.66 116.66 114.50 1rjh n ARG 101 Ca 0.07 0.26 0.04 0.00 -0.77 0.00 0.00 57.85 57.44 1rjh n ARG 101 Cb 0.15 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.14 1rjh n ARG 101 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1rjh n GLN 102 N -1.47 1.28 0.04 5.56 10.64 -0.86 -4.70 117.38 127.86 1rjh n GLN 102 Ca 0.04 -1.61 0.00 0.00 -1.83 0.00 0.00 57.00 53.60 1rjh n GLN 102 Cb 0.15 -0.99 0.00 0.00 -0.86 0.00 0.00 30.24 28.54 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 -0.64 -0.49 -0.06 2.61 2.88 -0.82 -4.98 113.62 112.12 1rjh n SER 103 Ca 0.06 0.14 -0.06 0.00 -1.33 0.00 0.00 58.87 57.68 1rjh n SER 103 Cb 0.52 0.70 -0.11 0.00 -0.75 0.00 0.00 64.21 64.57 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 -2.69 0.89 0.00 2.46 0.31 -0.44 -5.00 118.33 113.87 1rjh n VAL 104 Ca 0.00 -0.58 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1rjh n VAL 104 Cb 0.00 -0.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.39 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 2.07 3.34 0.33 2.92 0.00 0.21 -4.73 105.19 109.33 1rjh n GLY 105 Ca -0.21 -1.34 0.14 0.00 0.00 0.00 0.00 46.02 44.61 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 0.08 -0.01 1.61 -0.00 -1.84 -1.19 115.58 114.24 1rjh h ASN 106 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 1rjh h ASN 106 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 38.32 38.30 1rjh h ASN 106 CO 0.00 0.05 0.00 -0.62 -0.00 0.00 0.00 177.43 176.86 1rjh n GLU 107 N -4.45 1.03 -2.93 6.67 -0.58 -1.26 -1.19 120.64 117.93 1rjh n GLU 107 Ca 0.05 -0.05 -0.25 0.00 -0.42 0.00 0.00 57.16 56.49 1rjh n GLU 107 Cb 0.38 -1.17 0.00 0.00 -0.57 0.00 0.00 31.44 30.08 1rjh n GLU 107 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1rjh s ALA 108 N -1.99 3.56 -0.14 0.62 0.00 -0.45 -4.42 121.76 118.94 1rjh s ALA 108 Ca 0.16 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.37 1rjh s ALA 108 Cb 0.07 -2.34 0.01 0.00 0.00 0.00 0.00 23.12 20.87 1rjh s ALA 108 CO 0.12 -0.29 -0.20 -1.21 0.00 0.00 0.00 175.76 174.19 1rjh s GLU 109 N -4.59 2.83 -0.03 0.00 2.02 -1.26 -1.24 118.70 116.44 1rjh s GLU 109 Ca 0.46 -0.78 0.06 0.00 0.02 0.00 0.00 54.97 54.73 1rjh s GLU 109 Cb -0.10 -2.35 -0.01 0.00 0.10 0.00 0.00 34.13 31.76 1rjh s GLU 109 CO 0.41 -0.08 -0.22 0.42 0.02 0.00 0.00 175.26 175.80 1rjh s ILE 110 N 1.00 1.75 0.43 -1.63 1.09 -0.37 -2.74 121.20 120.73 1rjh s ILE 110 Ca -0.03 -0.93 -0.24 0.00 -1.10 0.00 0.00 60.65 58.34 1rjh s ILE 110 Cb -0.15 -1.46 -0.08 0.00 -1.06 0.00 0.00 42.46 39.71 1rjh s ILE 110 CO -0.05 0.49 1.16 0.26 -0.10 0.00 0.00 174.94 176.70 1rjh s TRP 111 N -0.40 2.98 -2.15 3.97 0.52 -1.25 0.07 118.94 122.67 1rjh s TRP 111 Ca 0.05 1.55 0.27 0.00 0.02 0.00 0.00 56.10 58.00 1rjh s TRP 111 Cb -0.10 -3.37 0.93 0.00 -1.15 0.00 0.00 33.47 29.79 1rjh s TRP 111 CO 0.00 -1.37 1.67 1.28 0.02 0.00 0.00 176.95 178.55 1rjh n LEU 112 N -0.25 1.25 0.00 2.99 4.77 -1.16 -4.67 117.00 119.94 1rjh n LEU 112 Ca 0.06 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 1rjh n LEU 112 Cb 0.48 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1rjh n LEU 112 CO 0.49 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1rjh n GLY 113 N 1.25 0.72 3.67 -0.72 0.00 -1.26 -3.77 105.19 105.08 1rjh n GLY 113 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 4.17 0.10 0.99 1.02 -1.26 -1.82 118.68 121.87 1rjh s LEU 114 Ca 0.00 0.60 -0.10 0.00 0.02 0.00 0.00 54.13 54.65 1rjh s LEU 114 Cb 0.00 -2.59 -0.06 0.00 0.02 0.00 0.00 46.19 43.56 1rjh s LEU 114 CO 0.00 -0.10 0.41 0.20 0.02 0.00 0.00 176.35 176.89 1rjh s ASN 115 N 1.03 6.64 -1.23 2.29 0.01 0.68 -4.50 114.94 119.85 1rjh s ASN 115 Ca 0.21 0.80 -0.14 0.00 -0.71 0.00 0.00 52.86 53.02 1rjh s ASN 115 Cb -0.15 -2.18 -0.05 0.00 0.41 0.00 0.00 41.25 39.28 1rjh s ASN 115 CO 0.09 0.15 2.27 -0.67 -1.51 0.00 0.00 177.10 177.42 1rjh n ASP 116 N 0.78 4.57 0.07 -1.22 2.03 -1.26 -3.87 116.55 117.65 1rjh n ASP 116 Ca -0.07 -2.67 0.00 0.00 0.52 0.00 0.00 54.79 52.57 1rjh n ASP 116 Cb 0.52 -1.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 1rjh n ASP 116 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 1rjh n MET 117 N 5.61 0.00 -4.34 -0.67 1.56 -1.26 -4.92 117.12 113.10 1rjh n MET 117 Ca 0.55 0.00 -0.34 0.00 -0.27 0.00 0.00 57.70 57.65 1rjh n MET 117 Cb 0.33 -0.29 -0.15 0.00 2.15 0.00 0.00 33.22 35.26 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 -2.00 2.57 0.00 -5.12 0.00 -1.25 -4.97 121.76 110.99 1rjh s ALA 118 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.88 1rjh s ALA 118 Cb 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 23.12 21.78 1rjh s ALA 118 CO 0.00 -0.14 0.18 0.00 0.00 0.00 0.00 175.76 175.80 1rjh n ALA 119 N 4.26 1.06 -2.45 0.00 0.00 -1.26 -3.46 120.51 118.65 1rjh n ALA 119 Ca -0.19 -0.18 -0.38 0.00 0.00 0.00 0.00 53.44 52.69 1rjh n ALA 119 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 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 -0.08 3.41 0.00 0.00 1.03 -1.26 -4.59 118.70 117.20 1rjh s GLU 120 Ca 0.00 -1.06 0.00 0.00 0.03 0.00 0.00 54.97 53.94 1rjh s GLU 120 Cb 0.00 -5.32 0.00 0.00 -0.80 0.00 0.00 34.13 28.01 1rjh s GLU 120 CO 0.00 -2.48 0.00 0.41 -1.33 0.00 0.00 175.26 171.86 1rjh n GLY 121 N 6.70 2.19 3.33 -3.83 0.00 -1.26 -4.75 105.19 107.57 1rjh n GLY 121 Ca 0.36 -0.01 -0.46 0.00 0.00 0.00 0.00 46.02 45.92 1rjh n GLY 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rjh s THR 122 N 0.00 5.21 0.47 2.61 -4.23 -1.26 -5.02 115.64 113.41 1rjh s THR 122 Ca 0.00 -1.41 -0.22 0.00 -1.18 0.00 0.00 61.69 58.88 1rjh s THR 122 Cb 0.00 -4.30 -0.08 0.00 1.34 0.00 0.00 72.50 69.46 1rjh s THR 122 CO 0.00 -0.82 1.08 0.26 -0.54 0.00 0.00 174.62 174.60 1rjh s TRP 123 N 1.63 2.98 -0.19 3.99 0.52 -1.26 -4.54 118.94 122.08 1rjh s TRP 123 Ca 0.03 1.58 -0.12 0.00 0.02 0.00 0.00 56.10 57.61 1rjh s TRP 123 Cb -0.29 -3.19 -0.05 0.00 -1.15 0.00 0.00 33.47 28.79 1rjh s TRP 123 CO 0.04 -1.06 0.22 0.14 0.02 0.00 0.00 176.95 176.31 1rjh s VAL 124 N -1.76 5.35 0.64 4.03 -7.23 -1.22 -3.82 120.40 116.38 1rjh s VAL 124 Ca 0.65 0.37 -0.09 0.00 -1.81 0.00 0.00 61.98 61.10 1rjh s VAL 124 Cb -0.22 -3.55 0.01 0.00 0.56 0.00 0.00 36.38 33.18 1rjh s VAL 124 CO 0.26 0.40 0.99 -0.62 -0.31 0.00 0.00 175.10 175.82 1rjh s ASP 125 N 0.52 5.58 0.17 4.85 2.15 -0.81 -0.23 116.67 128.89 1rjh s ASP 125 Ca 0.12 0.93 -0.13 0.00 0.43 0.00 0.00 52.55 53.90 1rjh s ASP 125 Cb -0.12 -1.85 0.07 0.00 -0.30 0.00 0.00 42.92 40.72 1rjh s ASP 125 CO 0.02 -1.16 1.77 0.00 -0.17 0.00 0.00 175.17 175.63 1rjh h MET 126 N -0.38 0.81 -0.01 4.34 -0.00 -1.68 -2.96 114.93 115.05 1rjh h MET 126 Ca -0.45 -0.10 0.00 0.00 -0.00 0.00 0.00 59.70 59.14 1rjh h MET 126 Cb 1.25 -0.15 0.00 0.00 -0.00 0.00 0.00 31.60 32.70 1rjh h MET 126 CO 0.62 0.64 -0.30 -2.37 -0.00 0.00 0.00 176.91 175.50 1rjh n THR 127 N -4.57 0.00 0.00 -0.10 5.66 -1.26 -4.91 114.28 109.10 1rjh n THR 127 Ca 0.03 -0.16 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 1rjh n THR 127 Cb 0.10 0.61 0.00 0.00 -1.55 0.00 0.00 70.33 69.49 1rjh n THR 127 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rjh n GLY 128 N 1.35 1.48 3.70 1.09 0.00 -1.12 -5.09 105.19 106.61 1rjh n GLY 128 Ca 0.12 0.00 -0.42 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 3.32 -0.36 4.61 0.00 -1.26 -4.84 121.76 121.22 1rjh s ALA 129 Ca 0.00 0.59 -0.15 0.00 0.00 0.00 0.00 51.96 52.41 1rjh s ALA 129 Cb 0.00 -3.41 -0.00 0.00 0.00 0.00 0.00 23.12 19.70 1rjh s ALA 129 CO 0.00 -0.44 0.33 0.50 0.00 0.00 0.00 175.76 176.15 1rjh s ARG 130 N 1.42 3.38 0.28 0.00 3.52 -1.26 -1.93 118.95 124.36 1rjh s ARG 130 Ca 0.54 -0.63 -0.30 0.00 -0.13 0.00 0.00 55.73 55.21 1rjh s ARG 130 Cb -0.23 -3.86 -0.11 0.00 -1.56 0.00 0.00 34.95 29.19 1rjh s ARG 130 CO 0.25 -0.59 1.54 0.96 -0.81 0.00 0.00 175.30 176.66 1rjh s ILE 131 N 1.90 2.25 -0.79 4.11 -4.36 -1.25 -4.89 121.20 118.17 1rjh s ILE 131 Ca 0.09 0.21 0.09 0.00 -0.26 0.00 0.00 60.65 60.78 1rjh s ILE 131 Cb -0.17 -3.14 0.23 0.00 1.25 0.00 0.00 42.46 40.63 1rjh s ILE 131 CO 0.11 0.03 1.16 0.00 0.24 0.00 0.00 174.94 176.49 1rjh n ALA 132 N 2.18 2.18 -3.33 2.27 0.00 -1.00 -4.82 120.51 117.99 1rjh n ALA 132 Ca 0.08 -1.06 -0.41 0.00 0.00 0.00 0.00 53.44 52.04 1rjh n ALA 132 Cb 0.38 -0.35 -0.09 0.00 0.00 0.00 0.00 19.45 19.40 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 -0.97 3.35 -0.57 0.00 5.04 -0.75 -4.89 117.35 118.56 1rjh s TYR 133 Ca 0.18 -1.56 -0.10 0.00 -2.44 0.00 0.00 57.07 53.15 1rjh s TYR 133 Cb 0.10 -3.22 0.15 0.00 0.35 0.00 0.00 41.96 39.33 1rjh s TYR 133 CO 0.13 -0.90 0.46 0.21 -1.34 0.00 0.00 175.55 174.10 1rjh s LYS 134 N 1.44 2.76 -0.28 4.97 2.47 -1.26 -4.99 119.74 124.85 1rjh s LYS 134 Ca 0.04 -2.00 -0.03 0.00 -1.56 0.00 0.00 55.97 52.42 1rjh s LYS 134 Cb -0.25 -4.04 0.16 0.00 -1.46 0.00 0.00 37.83 32.25 1rjh s LYS 134 CO 0.02 -1.23 0.55 1.21 0.16 0.00 0.00 175.35 176.06 1rjh s ASN 135 N 2.40 -0.93 0.06 1.43 2.47 -1.26 -5.17 114.94 113.94 1rjh s ASN 135 Ca 0.09 0.82 0.01 0.00 0.42 0.00 0.00 52.86 54.20 1rjh s ASN 135 Cb -0.23 1.90 -0.03 0.00 -1.45 0.00 0.00 41.25 41.44 1rjh s ASN 135 CO -0.02 -0.26 -0.05 0.26 -3.72 0.00 0.00 177.10 173.31 1rjh s TRP 136 N 2.78 0.61 -0.26 0.43 0.52 -1.26 -3.76 118.94 118.00 1rjh s TRP 136 Ca 0.15 -0.81 -0.16 0.00 0.02 0.00 0.00 56.10 55.29 1rjh s TRP 136 Cb -0.15 -0.39 -0.14 0.00 -1.15 0.00 0.00 33.47 31.64 1rjh s TRP 136 CO -0.19 -0.22 -0.19 -1.91 0.02 0.00 0.00 176.95 174.46 1rjh n GLU 137 N 0.60 0.58 -1.02 4.98 0.00 -1.17 -4.61 120.64 120.01 1rjh n GLU 137 Ca -0.17 0.35 -0.14 0.00 0.00 0.00 0.00 57.16 57.20 1rjh n GLU 137 Cb 0.59 -1.56 0.19 0.00 0.00 0.00 0.00 31.44 30.66 1rjh n GLU 137 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1rjh n THR 138 N -4.30 2.88 -1.95 6.31 5.66 -1.26 -5.00 114.28 116.62 1rjh n THR 138 Ca -0.48 -2.32 -0.35 0.00 -3.05 0.00 0.00 64.05 57.85 1rjh n THR 138 Cb 0.83 -0.39 0.03 0.00 -1.55 0.00 0.00 70.33 69.25 1rjh n THR 138 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1rjh s GLU 139 N -3.26 2.94 0.15 1.09 -1.05 -1.26 -4.93 118.70 112.38 1rjh s GLU 139 Ca 0.51 1.64 -0.30 0.00 -0.15 0.00 0.00 54.97 56.67 1rjh s GLU 139 Cb 0.44 -1.95 -0.07 0.00 -0.44 0.00 0.00 34.13 32.11 1rjh s GLU 139 CO 0.06 -1.19 1.21 0.96 0.95 0.00 0.00 175.26 177.24 1rjh s ILE 140 N -1.88 3.66 -0.09 1.83 -4.36 -1.26 -4.90 121.20 114.20 1rjh s ILE 140 Ca 0.73 1.34 0.04 0.00 -0.26 0.00 0.00 60.65 62.50 1rjh s ILE 140 Cb -0.26 -3.86 -0.05 0.00 1.25 0.00 0.00 42.46 39.54 1rjh s ILE 140 CO 0.35 0.18 0.13 0.35 0.24 0.00 0.00 174.94 176.19 1rjh n THR 141 N 2.89 0.00 -3.97 8.37 -2.24 -1.26 -4.99 114.28 113.08 1rjh n THR 141 Ca 0.06 -0.24 -0.35 0.00 -2.27 0.00 0.00 64.05 61.25 1rjh n THR 141 Cb 0.45 0.69 -0.09 0.00 -2.10 0.00 0.00 70.33 69.27 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 -1.85 3.44 -0.35 6.98 0.00 -1.26 -5.07 121.76 123.65 1rjh s ALA 142 Ca -0.00 -0.74 0.03 0.00 0.00 0.00 0.00 51.96 51.25 1rjh s ALA 142 Cb 0.03 -1.95 0.10 0.00 0.00 0.00 0.00 23.12 21.30 1rjh s ALA 142 CO 0.17 0.18 0.08 -0.65 0.00 0.00 0.00 175.76 175.53 1rjh s GLN 143 N 0.36 1.61 0.38 0.00 -0.21 -1.26 -4.92 119.66 115.61 1rjh s GLN 143 Ca 0.04 -1.85 0.20 0.00 0.02 0.00 0.00 55.36 53.76 1rjh s GLN 143 Cb -0.12 -3.28 0.27 0.00 1.00 0.00 0.00 33.01 30.88 1rjh s GLN 143 CO -0.00 -0.96 1.56 -1.00 -2.12 0.00 0.00 175.29 172.77 1rjh h PRO 144 N 7.70 0.00 -0.20 2.91 0.13 -1.97 -3.39 132.00 137.18 1rjh h PRO 144 Ca -0.06 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.83 1rjh h PRO 144 Cb 1.03 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 31.95 1rjh h PRO 144 CO 0.55 0.21 -0.53 -3.47 -0.23 0.00 0.00 178.00 174.54 1rjh n ASP 145 N -3.16 -0.99 0.00 1.44 2.03 -1.26 -4.98 116.55 109.62 1rjh n ASP 145 Ca 0.03 -2.41 0.00 0.00 0.52 0.00 0.00 54.79 52.93 1rjh n ASP 145 Cb 0.61 0.57 0.00 0.00 -0.72 0.00 0.00 41.12 41.58 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 -0.73 2.08 0.00 0.27 0.00 -1.26 -3.57 105.19 101.98 1rjh n GLY 146 Ca -0.04 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1rjh n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rjh n GLY 147 N 0.00 0.00 3.55 -0.02 0.00 -1.26 -4.94 105.19 102.52 1rjh n GLY 147 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 2.16 -0.03 1.61 2.20 -1.23 -4.91 119.74 119.54 1rjh s LYS 148 Ca 0.00 1.39 0.00 0.00 -0.36 0.00 0.00 55.97 57.00 1rjh s LYS 148 Cb 0.00 -4.57 0.03 0.00 -1.51 0.00 0.00 37.83 31.78 1rjh s LYS 148 CO 0.00 -3.21 0.01 0.95 -0.36 0.00 0.00 175.35 172.74 1rjh s THR 149 N 11.92 0.10 -0.30 3.43 -4.23 -1.26 -5.00 115.64 120.31 1rjh s THR 149 Ca 0.96 0.14 0.01 0.00 -1.18 0.00 0.00 61.69 61.62 1rjh s THR 149 Cb -0.17 -0.22 0.09 0.00 1.34 0.00 0.00 72.50 73.54 1rjh s THR 149 CO 0.26 0.13 0.04 -1.61 -0.54 0.00 0.00 174.62 172.90 1rjh s GLU 150 N 1.10 1.23 0.12 3.99 2.02 -1.26 -4.93 118.70 120.98 1rjh s GLU 150 Ca -0.09 -1.34 -0.25 0.00 0.02 0.00 0.00 54.97 53.31 1rjh s GLU 150 Cb -0.13 -2.60 0.08 0.00 0.10 0.00 0.00 34.13 31.58 1rjh s GLU 150 CO -0.02 -0.86 1.07 0.54 0.02 0.00 0.00 175.26 176.00 1rjh s ASN 151 N 1.30 -0.09 -0.06 -0.19 4.22 -1.26 -4.96 114.94 113.90 1rjh s ASN 151 Ca 0.06 -0.42 0.03 0.00 -2.14 0.00 0.00 52.86 50.39 1rjh s ASN 151 Cb -0.18 0.41 0.01 0.00 1.28 0.00 0.00 41.25 42.76 1rjh s ASN 151 CO -0.14 -0.78 -0.15 0.00 -2.04 0.00 0.00 177.10 173.99 1rjh s ALA 153 N 0.38 3.35 0.04 0.00 0.00 -1.26 -1.73 121.76 122.54 1rjh s ALA 153 Ca -0.11 0.69 0.02 0.00 0.00 0.00 0.00 51.96 52.57 1rjh s ALA 153 Cb -0.14 -3.24 -0.02 0.00 0.00 0.00 0.00 23.12 19.71 1rjh s ALA 153 CO 0.04 0.11 -0.08 0.54 0.00 0.00 0.00 175.76 176.37 1rjh s VAL 154 N -1.19 0.53 -0.54 0.00 0.11 0.40 -2.98 120.40 116.73 1rjh s VAL 154 Ca 0.42 -1.02 -0.17 0.00 -2.93 0.00 0.00 61.98 58.29 1rjh s VAL 154 Cb -0.27 -0.59 0.11 0.00 -1.53 0.00 0.00 36.38 34.10 1rjh s VAL 154 CO 0.34 -0.35 0.53 -0.22 -3.33 0.00 0.00 175.10 172.07 1rjh s LEU 155 N -1.48 5.87 -0.42 2.54 1.98 0.11 -0.02 118.68 127.27 1rjh s LEU 155 Ca -0.09 -1.60 -0.15 0.00 -2.89 0.00 0.00 54.13 49.40 1rjh s LEU 155 Cb -0.09 -2.24 0.03 0.00 0.66 0.00 0.00 46.19 44.55 1rjh s LEU 155 CO 0.00 -0.88 0.32 -0.44 -1.89 0.00 0.00 176.35 173.47 1rjh s SER 156 N 3.39 6.12 0.14 3.68 0.01 -1.26 -1.23 113.70 124.55 1rjh s SER 156 Ca 0.05 -0.94 -0.11 0.00 1.31 0.00 0.00 55.95 56.27 1rjh s SER 156 Cb -0.27 -2.17 -0.05 0.00 0.21 0.00 0.00 66.02 63.73 1rjh s SER 156 CO 0.05 -0.49 1.46 1.23 0.41 0.00 0.00 173.24 175.90 1rjh h GLY 157 N 8.69 1.01 2.00 3.44 0.00 -1.19 -2.70 103.07 114.32 1rjh h GLY 157 Ca -0.27 -1.05 0.00 0.00 0.00 0.00 0.00 47.33 46.01 1rjh h GLY 157 CO 0.76 0.95 0.00 0.00 0.00 0.00 0.00 176.54 178.25 1rjh n ALA 158 N -2.55 1.58 -0.07 3.60 0.00 -0.33 -3.35 120.51 119.39 1rjh n ALA 158 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.34 1rjh n ALA 158 Cb 0.56 -1.26 -0.05 0.00 0.00 0.00 0.00 19.45 18.70 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 2.37 0.05 0.00 0.00 0.00 -1.79 -3.48 119.26 116.40 1rjh h ALA 159 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1rjh h ALA 159 Cb 0.25 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1rjh h ALA 159 CO 0.00 0.29 0.00 -1.71 0.00 0.00 0.00 179.25 177.83 1rjh n ASN 160 N -4.64 0.00 0.00 0.00 2.85 -1.18 -5.00 115.26 107.29 1rjh n ASN 160 Ca -0.10 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.37 1rjh n ASN 160 Cb 0.29 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.31 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 -0.35 0.64 4.01 8.20 0.00 -1.18 -5.03 105.19 111.47 1rjh n GLY 161 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.69 1.64 -0.14 1.61 -0.14 -1.26 -4.95 119.74 115.80 1rjh s LYS 162 Ca 0.00 -1.31 -0.29 0.00 -1.36 0.00 0.00 55.97 53.01 1rjh s LYS 162 Cb 0.00 -2.37 -0.01 0.00 -1.68 0.00 0.00 37.83 33.77 1rjh s LYS 162 CO 0.00 -1.47 1.05 -1.58 -0.76 0.00 0.00 175.35 172.60 1rjh s TRP 163 N -3.11 3.39 0.00 3.18 0.52 -1.25 -4.19 118.94 117.48 1rjh s TRP 163 Ca 0.67 1.49 0.00 0.00 0.02 0.00 0.00 56.10 58.28 1rjh s TRP 163 Cb -0.04 -3.25 0.00 0.00 -1.15 0.00 0.00 33.47 29.02 1rjh s TRP 163 CO 0.44 -0.49 0.00 1.19 0.02 0.00 0.00 176.95 178.11 1rjh n PHE 164 N 5.53 -0.46 -4.26 -1.98 3.01 0.97 -3.03 117.46 117.24 1rjh n PHE 164 Ca 0.10 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.39 1rjh n PHE 164 Cb 0.47 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.80 1rjh n PHE 164 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1rjh s ASP 165 N -0.81 0.87 0.02 4.37 2.15 -1.26 -0.45 116.67 121.56 1rjh s ASP 165 Ca 0.00 -0.13 0.01 0.00 0.43 0.00 0.00 52.55 52.86 1rjh s ASP 165 Cb 0.00 -0.16 -0.01 0.00 -0.30 0.00 0.00 42.92 42.45 1rjh s ASP 165 CO 0.00 0.06 -0.04 -0.54 -0.17 0.00 0.00 175.17 174.48 1rjh s LYS 166 N 0.02 0.35 0.31 4.34 -0.14 -0.71 -4.88 119.74 119.03 1rjh s LYS 166 Ca 0.00 -0.47 -0.29 0.00 -1.36 0.00 0.00 55.97 53.85 1rjh s LYS 166 Cb -0.05 -0.14 -0.11 0.00 -1.68 0.00 0.00 37.83 35.85 1rjh s LYS 166 CO -0.00 0.02 1.57 1.03 -0.76 0.00 0.00 175.35 177.21 1rjh s ARG 167 N -0.99 4.12 0.00 1.68 3.00 -1.26 -3.20 118.95 122.29 1rjh s ARG 167 Ca -0.08 2.58 0.08 0.00 0.00 0.00 0.00 55.73 58.30 1rjh s ARG 167 Cb -0.07 -3.01 0.36 0.00 0.00 0.00 0.00 34.95 32.24 1rjh s ARG 167 CO -0.00 -0.61 1.15 0.00 0.00 0.00 0.00 175.30 175.84 1rjh n ARG 169 N -1.36 3.18 -3.23 0.00 0.63 -1.26 -1.18 116.66 113.44 1rjh n ARG 169 Ca 0.03 -2.93 -0.38 0.00 -0.92 0.00 0.00 57.85 53.65 1rjh n ARG 169 Cb 0.07 -1.93 -0.06 0.00 0.45 0.00 0.00 32.46 30.99 1rjh n ARG 169 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1rjh s ASP 170 N -1.77 7.07 -0.81 6.15 2.15 0.04 -4.83 116.67 124.68 1rjh s ASP 170 Ca 0.45 1.30 -0.18 0.00 0.43 0.00 0.00 52.55 54.55 1rjh s ASP 170 Cb 0.36 -2.37 0.14 0.00 -0.30 0.00 0.00 42.92 40.75 1rjh s ASP 170 CO 0.09 0.22 0.93 -1.10 -0.17 0.00 0.00 175.17 175.14 1rjh s GLN 171 N -1.33 3.44 0.25 4.34 1.11 -1.26 -3.89 119.66 122.32 1rjh s GLN 171 Ca 0.33 -1.77 0.06 0.00 0.01 0.00 0.00 55.36 53.98 1rjh s GLN 171 Cb -0.19 -4.60 -0.05 0.00 -1.01 0.00 0.00 33.01 27.16 1rjh s GLN 171 CO 0.20 -1.60 -0.05 -0.48 0.01 0.00 0.00 175.29 173.37 1rjh s LEU 172 N 2.15 2.39 0.00 2.90 0.05 -1.17 -4.53 118.68 120.47 1rjh s LEU 172 Ca 0.23 -1.18 -0.20 0.00 0.05 0.00 0.00 54.13 53.03 1rjh s LEU 172 Cb -0.12 -0.50 0.30 0.00 -2.05 0.00 0.00 46.19 43.83 1rjh s LEU 172 CO -0.04 -0.39 0.81 -2.65 -0.55 0.00 0.00 176.35 173.53 1rjh n PRO 173 N -0.50 -3.92 -3.94 1.48 -0.02 -1.11 -2.42 135.00 124.57 1rjh n PRO 173 Ca -0.06 -1.33 -0.11 0.00 -2.02 0.00 0.00 63.50 59.98 1rjh n PRO 173 Cb 0.63 -1.54 -0.01 0.00 -0.02 0.00 0.00 33.50 32.55 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 -2.20 0.47 -0.10 6.00 1.13 -0.53 -3.87 117.35 118.26 1rjh s TYR 174 Ca 0.58 -0.93 -0.04 0.00 -1.41 0.00 0.00 57.07 55.27 1rjh s TYR 174 Cb -0.09 0.41 0.05 0.00 -1.10 0.00 0.00 41.96 41.23 1rjh s TYR 174 CO 0.47 -1.32 0.22 0.42 -2.51 0.00 0.00 175.55 172.84 1rjh s ILE 175 N -2.92 -0.11 0.26 -3.49 1.01 -1.26 -4.52 121.20 110.18 1rjh s ILE 175 Ca 0.21 0.19 0.05 0.00 0.00 0.00 0.00 60.65 61.11 1rjh s ILE 175 Cb -0.03 -0.35 -0.02 0.00 0.01 0.00 0.00 42.46 42.07 1rjh s ILE 175 CO 0.14 0.08 0.39 0.00 0.00 0.00 0.00 174.94 175.55 1rjh s GLN 177 N -4.03 3.41 -0.20 0.00 -0.44 0.18 -4.72 119.66 113.86 1rjh s GLN 177 Ca 0.37 -0.13 0.00 0.00 -2.50 0.00 0.00 55.36 53.10 1rjh s GLN 177 Cb -0.09 -3.93 0.05 0.00 -1.64 0.00 0.00 33.01 27.40 1rjh s GLN 177 CO 0.30 -1.07 -0.06 -0.06 0.50 0.00 0.00 175.29 174.89 1rjh s PHE 178 N 3.17 2.05 0.00 1.67 0.40 -1.26 -4.32 117.98 119.69 1rjh s PHE 178 Ca 0.28 -1.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.21 1rjh s PHE 178 Cb -0.13 -1.46 0.00 0.00 0.51 0.00 0.00 43.02 41.94 1rjh s PHE 178 CO 0.21 -0.70 0.00 0.41 0.70 0.00 0.00 175.22 175.85 1rjh n GLY 179 N 4.78 -0.10 0.08 4.36 0.00 -1.26 -4.88 105.19 108.17 1rjh n GLY 179 Ca -0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 1rjh n GLY 179 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1rjh h ILE 180 N 0.00 1.30 0.00 -0.61 -2.65 -2.06 -3.57 117.51 109.92 1rjh h ILE 180 Ca 0.00 -3.03 0.00 0.00 1.03 0.00 0.00 64.86 62.86 1rjh h ILE 180 Cb 0.00 2.70 0.00 0.00 -2.05 0.00 0.00 36.82 37.47 1rjh h ILE 180 CO 0.00 0.79 0.00 0.52 0.03 0.00 0.00 178.15 179.49