#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r6e s GLY 74 N 0.00 -0.45 -0.29 0.62 0.00 -1.26 -5.16 107.32 100.78 1r6e s GLY 74 Ca 0.00 2.66 -0.13 0.00 0.00 0.00 0.00 44.72 47.24 1r6e s GLY 74 CO 0.00 2.66 0.73 -1.60 0.00 0.00 0.00 173.10 174.89 1r6e s ARG 75 N 1.88 0.59 -0.13 2.90 6.06 -1.26 -5.02 118.95 123.97 1r6e s ARG 75 Ca -0.08 1.23 0.06 0.00 -2.50 0.00 0.00 55.73 54.44 1r6e s ARG 75 Cb -0.06 0.48 0.39 0.00 0.06 0.00 0.00 34.95 35.82 1r6e s ARG 75 CO -0.18 -0.16 1.14 0.00 -2.50 0.00 0.00 175.30 173.60 1r6e n ALA 76 N 4.80 3.26 0.00 6.12 0.00 -1.26 -4.04 120.51 129.40 1r6e n ALA 76 Ca -0.15 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.31 1r6e n ALA 76 Cb 0.54 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1r6e n ALA 76 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1r6e n VAL 77 N 0.24 0.00 -2.83 0.00 0.31 -1.26 -5.08 118.33 109.71 1r6e n VAL 77 Ca 0.15 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.45 1r6e n VAL 77 Cb 0.75 -0.64 0.02 0.00 -0.91 0.00 0.00 33.84 33.06 1r6e n VAL 77 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1r6e n LEU 78 N -2.39 -5.72 -4.87 7.52 7.99 -1.26 -5.02 117.00 113.26 1r6e n LEU 78 Ca 0.00 -0.20 -0.29 0.00 -0.01 0.00 0.00 56.01 55.51 1r6e n LEU 78 Cb 0.24 -2.87 0.15 0.00 -0.11 0.00 0.00 43.42 40.84 1r6e n LEU 78 CO 0.00 -0.67 0.81 0.42 -1.51 0.00 0.00 177.39 176.44 1r6e s THR 79 N -3.08 1.97 0.55 -5.08 -4.23 -1.26 -4.91 115.64 99.59 1r6e s THR 79 Ca 0.10 0.00 0.24 0.00 -1.18 0.00 0.00 61.69 60.85 1r6e s THR 79 Cb -0.01 -2.92 0.35 0.00 1.34 0.00 0.00 72.50 71.25 1r6e s THR 79 CO 0.62 0.00 2.09 -1.28 -0.54 0.00 0.00 174.62 175.50 1r6e h SER 80 N -1.51 0.00 -0.99 3.99 0.87 -2.03 -2.06 113.55 111.81 1r6e h SER 80 Ca -0.46 0.00 -0.64 0.00 -1.23 0.00 0.00 61.79 59.46 1r6e h SER 80 Cb 1.28 0.00 -0.29 0.00 -0.44 0.00 0.00 62.40 62.95 1r6e h SER 80 CO 0.50 0.00 0.83 1.17 -0.53 0.00 0.00 176.83 178.80 1r6e n LYS 81 N -4.22 2.59 -0.13 2.24 3.00 -1.26 -3.82 118.16 116.56 1r6e n LYS 81 Ca 0.03 -3.21 -0.26 0.00 -0.00 0.00 0.00 58.31 54.86 1r6e n LYS 81 Cb 0.34 -2.26 -0.11 0.00 0.00 0.00 0.00 35.03 33.00 1r6e n LYS 81 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1r6e n THR 82 N -0.95 1.54 -0.07 3.15 -2.24 -0.77 -3.28 114.28 111.65 1r6e n THR 82 Ca 0.62 -0.37 -0.14 0.00 -2.27 0.00 0.00 64.05 61.89 1r6e n THR 82 Cb 0.86 -1.83 -0.12 0.00 -2.10 0.00 0.00 70.33 67.14 1r6e n THR 82 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1r6e h VAL 83 N -0.80 1.68 -1.32 2.28 2.07 -1.77 -1.76 116.25 116.64 1r6e h VAL 83 Ca -0.62 -2.29 0.39 0.00 0.82 0.00 0.00 66.70 65.01 1r6e h VAL 83 Cb 1.63 3.20 -0.09 0.00 -1.52 0.00 0.00 31.29 34.51 1r6e h VAL 83 CO -0.32 0.57 0.90 0.50 0.02 0.00 0.00 177.57 179.24 1r6e h LYS 84 N -1.00 0.12 0.11 1.57 3.64 -1.79 5.09 116.57 124.31 1r6e h LYS 84 Ca -0.02 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 1r6e h LYS 84 Cb 0.97 -0.03 0.02 0.00 -0.41 0.00 0.00 32.23 32.78 1r6e h LYS 84 CO -0.01 0.08 -0.63 0.22 -2.27 0.00 0.00 179.45 176.83 1r6e h ASP 85 N 0.12 0.37 0.60 4.20 3.58 -1.52 0.29 116.42 124.07 1r6e h ASP 85 Ca 0.71 -0.96 -0.10 0.00 0.42 0.00 0.00 57.03 57.10 1r6e h ASP 85 Cb 2.43 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 43.34 1r6e h ASP 85 CO -0.21 1.30 -0.49 0.15 -2.88 0.00 0.00 179.24 177.11 1r6e h PHE 86 N -0.50 0.00 -0.03 0.28 3.57 0.11 0.80 116.94 121.17 1r6e h PHE 86 Ca -0.11 0.00 -0.23 0.00 3.53 0.00 0.00 57.97 61.16 1r6e h PHE 86 Cb 1.50 0.00 0.01 0.00 2.79 0.00 0.00 35.95 40.24 1r6e h PHE 86 CO 0.21 0.49 -0.92 1.98 -2.23 0.00 0.00 178.31 177.85 1r6e h MET 87 N 0.00 0.52 -0.26 1.11 4.05 0.98 0.30 114.93 121.64 1r6e h MET 87 Ca -0.00 -0.53 -0.12 0.00 -0.28 0.00 0.00 59.70 58.77 1r6e h MET 87 Cb 0.93 0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.86 1r6e h MET 87 CO 0.06 1.16 -0.35 1.25 0.23 0.00 0.00 176.91 179.26 1r6e h LEU 88 N 0.31 0.59 -0.25 3.39 6.46 0.05 0.40 115.31 126.27 1r6e h LEU 88 Ca -0.08 -0.25 -0.21 0.00 -0.12 0.00 0.00 57.88 57.22 1r6e h LEU 88 Cb 1.55 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 41.32 1r6e h LEU 88 CO 0.17 0.90 -0.79 1.56 -0.62 0.00 0.00 178.44 179.65 1r6e h GLN 89 N 0.48 0.60 0.42 1.25 1.08 -0.70 -1.86 115.11 116.38 1r6e h GLN 89 Ca 0.05 -0.52 -0.02 0.00 -1.45 0.00 0.00 58.65 56.72 1r6e h GLN 89 Cb 0.84 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.39 1r6e h GLN 89 CO 0.07 1.14 -0.22 -0.22 -0.95 0.00 0.00 178.83 178.64 1r6e h LYS 90 N 0.40 -0.58 -0.80 1.46 3.64 -0.09 0.33 116.57 120.94 1r6e h LYS 90 Ca -0.05 0.04 0.16 0.00 -1.27 0.00 0.00 60.65 59.53 1r6e h LYS 90 Cb 1.40 0.13 -0.15 0.00 -0.41 0.00 0.00 32.23 33.21 1r6e h LYS 90 CO 0.15 -0.39 -0.17 1.25 -2.27 0.00 0.00 179.45 178.02 1r6e h LEU 91 N -0.60 -0.69 -0.38 5.20 5.85 -0.09 2.98 115.31 127.58 1r6e h LEU 91 Ca -0.05 0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 1r6e h LEU 91 Cb 0.47 0.48 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 1r6e h LEU 91 CO 0.08 -0.26 0.06 0.78 -0.34 0.00 0.00 178.44 178.76 1r6e h ASN 92 N 0.01 0.60 -0.04 1.25 2.35 -0.76 -2.76 115.58 116.23 1r6e h ASN 92 Ca 0.39 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1r6e h ASN 92 Cb 0.61 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1r6e h ASN 92 CO -0.81 0.71 0.00 -0.24 -1.65 0.00 0.00 177.43 175.45 1r6e n SER 93 N -4.54 1.35 0.09 5.81 2.88 0.11 -3.27 113.62 116.05 1r6e n SER 93 Ca -0.01 -1.48 0.04 0.00 -1.33 0.00 0.00 58.87 56.08 1r6e n SER 93 Cb 0.23 -0.02 -0.02 0.00 -0.75 0.00 0.00 64.21 63.66 1r6e n SER 93 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1r6e h LEU 94 N 2.04 0.00 -3.16 2.46 6.46 0.55 -3.49 115.31 120.18 1r6e h LEU 94 Ca 0.00 0.00 -0.28 0.00 -0.12 0.00 0.00 57.88 57.48 1r6e h LEU 94 Cb 0.44 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.37 1r6e h LEU 94 CO 0.00 0.41 -0.81 -0.67 -0.62 0.00 0.00 178.44 176.75 1r6e n ASP 95 N -2.98 -6.19 -0.16 1.25 2.03 -1.14 -4.64 116.55 104.72 1r6e n ASP 95 Ca -0.03 -0.28 0.24 0.00 0.52 0.00 0.00 54.79 55.24 1r6e n ASP 95 Cb 0.74 -3.05 0.66 0.00 -0.72 0.00 0.00 41.12 38.74 1r6e n ASP 95 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1r6e h ILE 96 N 0.98 0.62 0.04 5.18 2.04 -1.88 -1.04 117.51 123.46 1r6e h ILE 96 Ca -0.38 -0.04 -0.34 0.00 1.00 0.00 0.00 64.86 65.10 1r6e h ILE 96 Cb 1.25 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 1r6e h ILE 96 CO 0.28 0.02 -2.02 2.29 0.00 0.00 0.00 178.15 178.72 1r6e n LYS 97 N -4.35 0.69 -0.34 2.37 2.85 -1.26 -3.21 118.16 114.91 1r6e n LYS 97 Ca 0.17 0.22 0.03 0.00 -1.05 0.00 0.00 58.31 57.68 1r6e n LYS 97 Cb 0.82 -1.68 0.18 0.00 -0.65 0.00 0.00 35.03 33.69 1r6e n LYS 97 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1r6e h GLY 98 N 2.57 1.44 1.04 2.58 0.00 -1.55 1.47 103.07 110.61 1r6e h GLY 98 Ca -0.42 -0.41 -0.13 0.00 0.00 0.00 0.00 47.33 46.38 1r6e h GLY 98 CO 0.05 0.23 -0.29 3.43 0.00 0.00 0.00 176.54 179.97 1r6e h ASN 99 N 1.00 0.86 0.20 0.19 2.35 -1.42 0.20 115.58 118.96 1r6e h ASN 99 Ca 0.42 -0.45 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1r6e h ASN 99 Cb 0.28 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 1r6e h ASN 99 CO -0.21 1.13 -0.04 0.00 -1.65 0.00 0.00 177.43 176.66 1r6e h ALA 100 N 0.76 1.29 0.22 -0.83 0.00 -0.65 1.99 119.26 122.04 1r6e h ALA 100 Ca 0.06 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.59 1r6e h ALA 100 Cb 0.87 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.67 1r6e h ALA 100 CO 0.08 0.05 -1.58 1.03 0.00 0.00 0.00 179.25 178.83 1r6e h SER 101 N 0.00 0.72 0.78 0.00 0.87 0.32 -3.34 113.55 112.90 1r6e h SER 101 Ca -0.00 -0.88 -0.25 0.00 -1.23 0.00 0.00 61.79 59.43 1r6e h SER 101 Cb 0.15 -0.23 -0.04 0.00 -0.44 0.00 0.00 62.40 61.84 1r6e h SER 101 CO 0.01 1.71 -1.30 0.50 -0.53 0.00 0.00 176.83 177.22 1r6e h LYS 102 N 0.13 0.01 -4.70 2.24 3.64 0.11 -3.42 116.57 114.57 1r6e h LYS 102 Ca -0.29 -0.01 -0.68 0.00 -1.27 0.00 0.00 60.65 58.40 1r6e h LYS 102 Cb 2.13 0.01 -0.36 0.00 -0.41 0.00 0.00 32.23 33.59 1r6e h LYS 102 CO 0.23 0.80 -0.69 -0.51 -2.27 0.00 0.00 179.45 177.01 1r6e s ASP 103 N -6.47 4.84 0.00 4.20 1.01 0.67 -4.93 116.67 115.99 1r6e s ASP 103 Ca -0.02 -1.72 0.16 0.00 0.71 0.00 0.00 52.55 51.68 1r6e s ASP 103 Cb 0.09 -1.68 0.75 0.00 1.01 0.00 0.00 42.92 43.09 1r6e s ASP 103 CO 0.82 -0.34 1.47 -0.81 0.21 0.00 0.00 175.17 176.52 1r6e n PRO 104 N 4.47 0.14 -0.06 8.23 -0.04 -1.26 -0.34 135.00 146.13 1r6e n PRO 104 Ca -0.06 0.18 -0.21 0.00 -0.04 0.00 0.00 63.50 63.36 1r6e n PRO 104 Cb 0.42 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.26 1r6e n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r6e n ALA 105 N -1.37 1.07 -0.24 0.55 0.00 -1.26 -3.24 120.51 116.02 1r6e n ALA 105 Ca 0.06 -0.79 -0.02 0.00 0.00 0.00 0.00 53.44 52.69 1r6e n ALA 105 Cb 0.15 -0.41 0.09 0.00 0.00 0.00 0.00 19.45 19.29 1r6e n ALA 105 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1r6e h TYR 106 N -0.19 0.74 -0.47 0.00 5.03 -1.63 1.11 116.97 121.55 1r6e h TYR 106 Ca -0.49 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 60.81 1r6e h TYR 106 Cb 1.86 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 39.88 1r6e h TYR 106 CO 0.05 0.38 0.14 0.00 -1.32 0.00 0.00 178.16 177.41 1r6e h ALA 107 N 1.34 1.37 0.15 1.82 0.00 -0.82 0.21 119.26 123.32 1r6e h ALA 107 Ca 0.30 -0.16 -0.31 0.00 0.00 0.00 0.00 54.91 54.74 1r6e h ALA 107 Cb 0.14 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1r6e h ALA 107 CO -0.16 0.46 -1.49 0.00 0.00 0.00 0.00 179.25 178.06 1r6e h ARG 108 N 0.68 0.31 -0.00 0.00 2.47 -1.02 -2.69 114.38 114.13 1r6e h ARG 108 Ca 0.16 -0.53 -0.00 0.00 -1.26 0.00 0.00 59.98 58.35 1r6e h ARG 108 Cb 0.21 0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 1r6e h ARG 108 CO -0.01 1.20 -0.01 0.37 0.56 0.00 0.00 179.97 182.09 1r6e h GLN 109 N 0.08 0.01 -0.02 0.04 4.15 0.14 -3.16 115.11 116.34 1r6e h GLN 109 Ca -0.23 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.18 1r6e h GLN 109 Cb 2.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.73 1r6e h GLN 109 CO 0.19 0.72 0.00 2.41 -1.93 0.00 0.00 178.83 180.22 1r6e n THR 110 N -4.74 0.03 0.00 2.39 -1.04 0.70 -0.09 114.28 111.54 1r6e n THR 110 Ca -0.09 -0.08 -0.17 0.00 -2.04 0.00 0.00 64.05 61.67 1r6e n THR 110 Cb 0.36 -0.17 -0.14 0.00 -1.82 0.00 0.00 70.33 68.56 1r6e n THR 110 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1r6e n GLU 112 N -3.34 0.70 0.30 0.00 4.71 -1.20 -4.15 120.64 117.66 1r6e n GLU 112 Ca -0.25 0.27 0.19 0.00 -0.01 0.00 0.00 57.16 57.35 1r6e n GLU 112 Cb 1.05 -1.64 0.94 0.00 -1.01 0.00 0.00 31.44 30.77 1r6e n GLU 112 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1r6e h ALA 113 N -0.08 1.07 0.13 0.62 0.00 -0.51 0.68 119.26 121.17 1r6e h ALA 113 Ca -0.48 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1r6e h ALA 113 Cb 1.89 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1r6e h ALA 113 CO -0.03 0.03 -0.06 0.97 0.00 0.00 0.00 179.25 180.16 1r6e h ILE 114 N 0.00 1.01 0.00 0.00 6.09 -1.70 2.05 117.51 124.96 1r6e h ILE 114 Ca -0.00 -0.61 0.00 0.00 -1.37 0.00 0.00 64.86 62.88 1r6e h ILE 114 Cb 0.24 1.39 0.00 0.00 0.47 0.00 0.00 36.82 38.92 1r6e h ILE 114 CO 0.00 0.14 0.00 -0.07 -3.07 0.00 0.00 178.15 175.16 1r6e h LEU 115 N -0.46 0.00 0.00 2.19 3.38 -1.63 -0.12 115.31 118.66 1r6e h LEU 115 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1r6e h LEU 115 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1r6e h LEU 115 CO 0.03 0.00 -0.12 0.77 0.09 0.00 0.00 178.44 179.21 1r6e h SER 116 N 0.00 0.00 -0.00 -0.43 4.64 0.93 0.17 113.55 118.86 1r6e h SER 116 Ca 0.00 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.16 1r6e h SER 116 Cb 0.81 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.91 1r6e h SER 116 CO 0.00 0.01 -0.56 0.00 -0.87 0.00 0.00 176.83 175.41 1r6e h ALA 117 N 2.30 0.07 -0.40 5.18 0.00 0.51 0.38 119.26 127.29 1r6e h ALA 117 Ca 0.00 -0.56 -0.10 0.00 0.00 0.00 0.00 54.91 54.25 1r6e h ALA 117 Cb 0.85 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1r6e h ALA 117 CO 0.00 0.32 -0.16 -0.39 0.00 0.00 0.00 179.25 179.02 1r6e h VAL 118 N -0.15 1.26 0.40 0.00 -1.51 -1.29 2.65 116.25 117.61 1r6e h VAL 118 Ca -0.07 -1.24 -0.01 0.00 -1.23 0.00 0.00 66.70 64.16 1r6e h VAL 118 Cb 1.28 1.13 -0.02 0.00 -2.13 0.00 0.00 31.29 31.55 1r6e h VAL 118 CO 0.11 0.42 -0.35 0.22 -1.23 0.00 0.00 177.57 176.74 1r6e h TYR 119 N 0.67 -0.94 -0.54 5.19 3.20 -0.82 1.42 116.97 125.15 1r6e h TYR 119 Ca 0.11 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.86 1r6e h TYR 119 Cb 0.65 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.26 1r6e h TYR 119 CO 0.03 -0.50 -0.14 1.03 -1.64 0.00 0.00 178.16 176.95 1r6e h SER 120 N -0.76 1.05 -0.91 -2.11 0.87 0.44 -0.27 113.55 111.87 1r6e h SER 120 Ca -0.03 -0.36 0.03 0.00 -1.23 0.00 0.00 61.79 60.20 1r6e h SER 120 Cb 0.66 -0.29 -0.05 0.00 -0.44 0.00 0.00 62.40 62.29 1r6e h SER 120 CO -0.03 1.17 0.60 0.78 -0.53 0.00 0.00 176.83 178.81 1r6e h ASN 121 N 0.91 0.99 -0.71 6.23 -0.26 0.51 0.60 115.58 123.84 1r6e h ASN 121 Ca 0.13 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 1r6e h ASN 121 Cb 0.71 -0.23 -0.04 0.00 -1.06 0.00 0.00 38.32 37.71 1r6e h ASN 121 CO 0.05 0.68 0.46 0.78 -1.06 0.00 0.00 177.43 178.34 1r6e h ASN 122 N 1.15 0.83 1.03 5.81 -0.26 0.27 3.88 115.58 128.30 1r6e h ASN 122 Ca 0.36 -0.04 0.00 0.00 -0.56 0.00 0.00 56.30 56.06 1r6e h ASN 122 Cb -0.00 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.05 1r6e h ASN 122 CO -0.10 0.62 0.00 0.50 -1.06 0.00 0.00 177.43 177.39 1r6e h LYS 123 N 0.97 0.00 0.03 0.81 3.11 0.10 0.37 116.57 121.96 1r6e h LYS 123 Ca 0.26 0.00 -0.34 0.00 -2.81 0.00 0.00 60.65 57.76 1r6e h LYS 123 Cb -0.08 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 31.10 1r6e h LYS 123 CO -0.05 0.00 -1.87 -3.47 -2.81 0.00 0.00 179.45 171.25 1r6e n ASP 124 N -2.55 1.96 -0.08 4.20 -0.08 0.18 -2.67 116.55 117.51 1r6e n ASP 124 Ca 0.02 0.29 -0.13 0.00 -1.51 0.00 0.00 54.79 53.47 1r6e n ASP 124 Cb 0.31 -0.85 -0.05 0.00 2.34 0.00 0.00 41.12 42.86 1r6e n ASP 124 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1r6e h GLN 125 N -0.64 0.51 0.20 -0.67 5.75 0.73 0.40 115.11 121.39 1r6e h GLN 125 Ca -0.48 -0.25 -0.01 0.00 -0.15 0.00 0.00 58.65 57.76 1r6e h GLN 125 Cb 1.62 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.17 1r6e h GLN 125 CO -0.18 0.82 -0.10 0.00 -2.65 0.00 0.00 178.83 176.72 1r6e h LYS 128 N 0.00 0.15 0.00 0.00 3.11 -0.08 0.44 116.57 120.20 1r6e h LYS 128 Ca 0.07 -0.01 -0.22 0.00 -2.81 0.00 0.00 60.65 57.69 1r6e h LYS 128 Cb 0.36 -0.03 -0.04 0.00 -1.00 0.00 0.00 32.23 31.52 1r6e h LYS 128 CO -0.00 0.10 -1.33 1.37 -2.81 0.00 0.00 179.45 176.78 1r6e h LEU 129 N 0.16 0.00 -1.55 5.20 -0.00 -1.49 -3.30 115.31 114.33 1r6e h LEU 129 Ca 0.16 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.99 1r6e h LEU 129 Cb 0.19 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.84 1r6e h LEU 129 CO -0.22 0.81 -0.23 -0.07 -0.00 0.00 0.00 178.44 178.73 1r6e h LEU 130 N 0.00 0.00 -1.11 0.17 3.38 -0.32 0.92 115.31 118.35 1r6e h LEU 130 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1r6e h LEU 130 Cb 1.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.51 1r6e h LEU 130 CO 0.08 0.23 0.00 0.00 0.09 0.00 0.00 178.44 178.84 1r6e n ILE 131 N -4.17 0.94 0.02 1.22 0.13 0.15 -0.27 119.36 117.39 1r6e n ILE 131 Ca -0.02 0.51 -0.10 0.00 -1.10 0.00 0.00 62.75 62.03 1r6e n ILE 131 Cb 0.29 -1.48 -0.13 0.00 -0.84 0.00 0.00 39.64 37.48 1r6e n ILE 131 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 1r6e h SER 132 N 0.00 0.10 1.15 9.51 0.87 -0.99 -3.28 113.55 120.90 1r6e h SER 132 Ca 0.00 -0.15 -0.16 0.00 -1.23 0.00 0.00 61.79 60.26 1r6e h SER 132 Cb 0.17 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 1r6e h SER 132 CO 0.00 1.12 -0.88 0.11 -0.53 0.00 0.00 176.83 176.65 1r6e h LYS 133 N 0.02 0.00 -0.17 2.24 1.79 -1.06 -3.47 116.57 115.91 1r6e h LYS 133 Ca -0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.28 1r6e h LYS 133 Cb 1.94 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.59 1r6e h LYS 133 CO 0.11 0.60 0.00 0.41 -1.08 0.00 0.00 179.45 179.49 1r6e n GLY 134 N 1.31 0.96 0.00 3.86 0.00 0.63 -5.07 105.19 106.88 1r6e n GLY 134 Ca -0.02 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1r6e n GLY 134 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1r6e n VAL 135 N -2.56 0.00 0.00 1.61 3.14 -0.93 -5.03 118.33 114.56 1r6e n VAL 135 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1r6e n VAL 135 Cb 0.32 -1.46 0.00 0.00 -1.06 0.00 0.00 33.84 31.64 1r6e n VAL 135 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1r6e n SER 136 N 0.00 2.91 0.00 6.55 2.88 -1.26 -4.92 113.62 119.78 1r6e n SER 136 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1r6e n SER 136 Cb 0.00 0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 1r6e n SER 136 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1r6e n ILE 137 N -1.25 0.00 -0.00 2.46 -5.35 -1.26 -4.78 119.36 109.18 1r6e n ILE 137 Ca 0.00 0.00 -0.13 0.00 -0.27 0.00 0.00 62.75 62.35 1r6e n ILE 137 Cb 0.22 -0.54 -0.09 0.00 -1.74 0.00 0.00 39.64 37.49 1r6e n ILE 137 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1r6e h THR 138 N 0.00 1.28 -0.65 7.28 2.02 -1.97 1.80 112.91 122.68 1r6e h THR 138 Ca 0.00 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.30 1r6e h THR 138 Cb 0.12 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 1r6e h THR 138 CO 0.00 0.22 0.24 1.55 0.37 0.00 0.00 175.52 177.90 1r6e h PRO 139 N -0.32 0.96 -0.25 6.66 0.13 -1.93 0.63 132.00 137.88 1r6e h PRO 139 Ca 0.00 -0.17 -0.13 0.00 -0.87 0.00 0.00 66.00 64.83 1r6e h PRO 139 Cb 0.36 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.33 1r6e h PRO 139 CO 0.00 0.80 -0.36 0.35 -0.23 0.00 0.00 178.00 178.56 1r6e h PHE 140 N 0.94 0.85 -0.77 1.56 3.57 -1.88 -1.95 116.94 119.27 1r6e h PHE 140 Ca 0.22 -0.28 0.06 0.00 3.53 0.00 0.00 57.97 61.49 1r6e h PHE 140 Cb 0.21 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 38.72 1r6e h PHE 140 CO 0.02 1.04 0.46 1.25 -2.23 0.00 0.00 178.31 178.85 1r6e h LEU 141 N 0.42 0.71 -1.04 0.59 6.46 0.36 0.30 115.31 123.10 1r6e h LEU 141 Ca 0.03 0.02 0.16 0.00 -0.12 0.00 0.00 57.88 57.97 1r6e h LEU 141 Cb 0.95 -0.12 -0.10 0.00 -0.73 0.00 0.00 40.66 40.66 1r6e h LEU 141 CO 0.08 0.46 0.62 0.50 -0.62 0.00 0.00 178.44 179.48 1r6e h LYS 142 N 0.84 0.81 0.13 1.25 3.11 0.62 0.52 116.57 123.86 1r6e h LYS 142 Ca 0.34 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 58.12 1r6e h LYS 142 Cb 0.17 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.22 1r6e h LYS 142 CO -0.17 0.54 -0.06 0.93 -2.81 0.00 0.00 179.45 177.87 1r6e h GLU 143 N 0.84 -0.17 0.00 1.90 5.08 0.27 -2.29 114.58 120.20 1r6e h GLU 143 Ca 0.54 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.90 1r6e h GLU 143 Cb 0.75 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1r6e h GLU 143 CO -0.32 0.29 -0.07 -0.84 -1.00 0.00 0.00 179.01 177.07 1r6e h ILE 144 N -0.79 0.79 0.00 3.13 3.07 -0.61 0.34 117.51 123.44 1r6e h ILE 144 Ca -0.02 -0.26 -0.02 0.00 1.55 0.00 0.00 64.86 66.11 1r6e h ILE 144 Cb 0.54 1.15 -0.00 0.00 -0.27 0.00 0.00 36.82 38.24 1r6e h ILE 144 CO 0.03 0.07 -0.11 1.23 -1.05 0.00 0.00 178.15 178.32 1r6e h GLY 145 N 0.30 0.00 0.70 0.16 0.00 0.16 0.76 103.07 105.16 1r6e h GLY 145 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1r6e h GLY 145 CO 0.01 0.00 -0.33 -2.09 0.00 0.00 0.00 176.54 174.13 1r6e h GLU 146 N 0.00 -0.90 -0.93 4.80 4.57 0.27 1.26 114.58 123.65 1r6e h GLU 146 Ca -0.00 0.06 0.14 0.00 -1.18 0.00 0.00 59.36 58.38 1r6e h GLU 146 Cb 0.30 0.20 -0.08 0.00 -0.16 0.00 0.00 28.75 29.02 1r6e h GLU 146 CO 0.01 -0.60 0.59 0.00 -1.18 0.00 0.00 179.01 177.84 1r6e h ALA 147 N -1.23 1.72 0.00 2.92 0.00 -1.26 1.23 119.26 122.63 1r6e h ALA 147 Ca -0.10 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1r6e h ALA 147 Cb 0.72 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1r6e h ALA 147 CO 0.16 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.44 1r6e h ALA 148 N 1.58 1.00 0.06 0.00 0.00 0.12 0.93 119.26 122.95 1r6e h ALA 148 Ca 0.47 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 55.01 1r6e h ALA 148 Cb 0.64 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1r6e h ALA 148 CO -0.23 0.00 -2.21 0.94 0.00 0.00 0.00 179.25 177.75 1r6e n GLN 149 N -3.04 0.70 0.15 0.00 -0.06 0.43 0.78 117.38 116.35 1r6e n GLN 149 Ca 0.00 0.20 0.03 0.00 -2.00 0.00 0.00 57.00 55.23 1r6e n GLN 149 Cb 0.27 -1.62 0.15 0.00 -4.06 0.00 0.00 30.24 24.97 1r6e n GLN 149 CO 0.00 0.00 0.00 -2.95 -0.20 0.00 0.00 177.06 173.91 1r6e h ASN 150 N 0.03 0.00 1.73 1.69 7.08 0.10 -3.02 115.58 123.21 1r6e h ASN 150 Ca -0.49 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.73 1r6e h ASN 150 Cb 1.99 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.23 1r6e h ASN 150 CO 0.01 0.49 -0.01 0.00 -2.08 0.00 0.00 177.43 175.83 1r6e h ALA 151 N 1.51 0.99 0.00 4.14 0.00 0.74 -3.47 119.26 123.17 1r6e h ALA 151 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r6e h ALA 151 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1r6e h ALA 151 CO 0.06 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1r6e n GLY 152 N 1.20 1.60 2.80 0.00 0.00 -1.14 -4.73 105.19 104.93 1r6e n GLY 152 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1r6e n GLY 152 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1r6e n LEU 153 N 0.00 3.53 -4.95 0.99 4.77 0.23 -4.96 117.00 116.62 1r6e n LEU 153 Ca 0.00 -5.27 -0.24 0.00 -0.03 0.00 0.00 56.01 50.47 1r6e n LEU 153 Cb 0.00 -0.80 -0.03 0.00 -2.33 0.00 0.00 43.42 40.26 1r6e n LEU 153 CO 0.00 1.81 -0.08 -2.16 -1.33 0.00 0.00 177.39 175.63 1r6e s PRO 154 N -1.80 3.41 0.00 3.23 0.04 -1.25 -3.55 135.00 135.08 1r6e s PRO 154 Ca 0.30 -0.68 0.00 0.00 0.04 0.00 0.00 61.00 60.65 1r6e s PRO 154 Cb 0.01 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1r6e s PRO 154 CO -0.11 0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.82 1r6e n GLY 155 N -0.91 0.07 2.99 0.56 0.00 -1.22 -1.12 105.19 105.54 1r6e n GLY 155 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 1r6e n GLY 155 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r6e s GLU 156 N 0.00 0.33 -0.14 1.61 0.41 0.51 -4.71 118.70 116.71 1r6e s GLU 156 Ca 0.00 -0.55 -0.29 0.00 -0.41 0.00 0.00 54.97 53.71 1r6e s GLU 156 Cb 0.00 -0.02 0.10 0.00 -1.78 0.00 0.00 34.13 32.43 1r6e s GLU 156 CO 0.00 -0.01 0.88 -1.50 -0.49 0.00 0.00 175.26 174.14 1r6e s ILE 157 N -1.20 0.00 0.00 -1.63 2.07 -1.26 -0.21 121.20 118.97 1r6e s ILE 157 Ca -0.12 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.12 1r6e s ILE 157 Cb -0.08 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.51 1r6e s ILE 157 CO -0.01 0.00 0.00 0.29 -1.91 0.00 0.00 174.94 173.31 1r6e n LYS 158 N 1.09 0.00 -1.36 3.50 4.76 0.15 -4.92 118.16 121.38 1r6e n LYS 158 Ca -0.14 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 54.91 1r6e n LYS 158 Cb 0.57 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.70 1r6e n LYS 158 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1r6e n ASN 159 N 0.00 2.58 -0.57 4.39 4.13 -1.26 -3.64 115.26 120.89 1r6e n ASN 159 Ca 0.00 -2.67 -0.04 0.00 1.68 0.00 0.00 54.58 53.54 1r6e n ASN 159 Cb 0.00 -1.25 0.00 0.00 -1.54 0.00 0.00 39.78 36.99 1r6e n ASN 159 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1r6e n GLY 160 N 4.90 0.24 3.13 7.41 0.00 -1.26 -5.04 105.19 114.58 1r6e n GLY 160 Ca 0.48 -0.68 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 1r6e n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r6e s VAL 161 N -2.31 0.18 0.05 1.61 0.11 -1.24 -4.89 120.40 113.90 1r6e s VAL 161 Ca 0.01 -1.73 -0.13 0.00 -2.93 0.00 0.00 61.98 57.21 1r6e s VAL 161 Cb -0.01 -1.63 0.02 0.00 -1.53 0.00 0.00 36.38 33.23 1r6e s VAL 161 CO 0.02 -0.80 0.28 0.12 -3.33 0.00 0.00 175.10 171.39 1r6e s PHE 162 N -3.94 -0.06 0.04 1.54 2.19 -1.26 0.34 117.98 116.83 1r6e s PHE 162 Ca 0.11 -0.13 0.01 0.00 0.33 0.00 0.00 56.93 57.25 1r6e s PHE 162 Cb 0.07 0.07 -0.03 0.00 -1.31 0.00 0.00 43.02 41.83 1r6e s PHE 162 CO -0.07 -0.52 -0.05 0.99 1.83 0.00 0.00 175.22 177.40 1r6e s THR 163 N -2.81 0.35 0.41 0.12 2.01 0.71 -4.42 115.64 112.01 1r6e s THR 163 Ca -0.03 -1.20 -0.25 0.00 0.31 0.00 0.00 61.69 60.52 1r6e s THR 163 Cb 0.00 -0.70 -0.08 0.00 0.01 0.00 0.00 72.50 71.72 1r6e s THR 163 CO -0.05 -0.56 1.24 -2.16 -0.69 0.00 0.00 174.62 172.40 1r6e s PRO 164 N -2.07 3.97 -0.07 4.92 0.04 -1.24 -0.36 135.00 140.18 1r6e s PRO 164 Ca -0.08 2.01 -0.11 0.00 0.04 0.00 0.00 61.00 62.86 1r6e s PRO 164 Cb -0.06 -2.70 -0.07 0.00 0.04 0.00 0.00 34.50 31.71 1r6e s PRO 164 CO -0.02 -0.44 0.42 0.78 0.04 0.00 0.00 177.00 177.78 1r6e h GLY 165 N 2.61 -0.25 -4.83 0.56 0.00 -1.17 -3.33 103.07 96.66 1r6e h GLY 165 Ca -0.49 0.09 -0.40 0.00 0.00 0.00 0.00 47.33 46.53 1r6e h GLY 165 CO 0.62 -0.09 2.02 0.61 0.00 0.00 0.00 176.54 179.70 1r6e n GLY 166 N 1.07 3.32 3.39 4.60 0.00 -1.26 -4.82 105.19 111.49 1r6e n GLY 166 Ca -0.04 -1.12 -0.44 0.00 0.00 0.00 0.00 46.02 44.41 1r6e n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r6e s ALA 167 N 2.24 3.36 -1.80 4.61 0.00 -1.25 -3.38 121.76 125.54 1r6e s ALA 167 Ca 0.55 -2.18 0.07 0.00 0.00 0.00 0.00 51.96 50.40 1r6e s ALA 167 Cb 0.19 -3.61 0.23 0.00 0.00 0.00 0.00 23.12 19.92 1r6e s ALA 167 CO -0.03 -2.46 1.14 0.41 0.00 0.00 0.00 175.76 174.82 1r6e n GLY 168 N 5.28 0.45 3.60 0.00 0.00 -1.26 -4.93 105.19 108.33 1r6e n GLY 168 Ca -0.07 -0.27 -0.26 0.00 0.00 0.00 0.00 46.02 45.42 1r6e n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r6e n ALA 169 N 0.22 -2.59 -3.02 4.61 0.00 -1.26 -3.51 120.51 114.96 1r6e n ALA 169 Ca 0.08 -0.21 -0.06 0.00 0.00 0.00 0.00 53.44 53.26 1r6e n ALA 169 Cb 0.27 -3.18 0.03 0.00 0.00 0.00 0.00 19.45 16.56 1r6e n ALA 169 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1r6e n ASN 170 N -2.52 -6.96 0.24 0.00 4.05 -1.26 -4.58 115.26 104.23 1r6e n ASN 170 Ca -0.11 -0.30 0.10 0.00 0.45 0.00 0.00 54.58 54.71 1r6e n ASN 170 Cb 0.59 -4.95 0.62 0.00 1.23 0.00 0.00 39.78 37.27 1r6e n ASN 170 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1r6e h PRO 171 N -0.15 0.00 0.00 1.20 0.13 -1.79 0.85 132.00 132.24 1r6e h PRO 171 Ca -0.23 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.76 1r6e h PRO 171 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1r6e h PRO 171 CO 0.33 0.17 -0.82 0.74 -0.23 0.00 0.00 178.00 178.19 1r6e h PHE 172 N 0.00 0.00 0.01 1.56 0.04 -1.91 -3.36 116.94 113.28 1r6e h PHE 172 Ca -0.00 0.00 -0.36 0.00 2.80 0.00 0.00 57.97 60.41 1r6e h PHE 172 Cb 0.41 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.50 1r6e h PHE 172 CO 0.00 0.64 -2.26 0.28 -0.60 0.00 0.00 178.31 176.37 1r6e n VAL 173 N -3.18 1.49 -0.06 -0.55 0.31 -0.82 -3.76 118.33 111.75 1r6e n VAL 173 Ca -0.01 -0.76 -0.13 0.00 -0.01 0.00 0.00 64.34 63.43 1r6e n VAL 173 Cb 0.81 -0.89 -0.09 0.00 -0.91 0.00 0.00 33.84 32.76 1r6e n VAL 173 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1r6e h VAL 174 N 0.01 0.00 0.00 2.52 2.07 0.56 1.57 116.25 122.98 1r6e h VAL 174 Ca -0.50 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 66.93 1r6e h VAL 174 Cb 2.11 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1r6e h VAL 174 CO 0.02 0.00 -0.44 1.55 0.02 0.00 0.00 177.57 178.71 1r6e h PRO 175 N -0.43 0.00 -0.08 1.57 0.13 -1.80 1.08 132.00 132.47 1r6e h PRO 175 Ca 0.05 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 1r6e h PRO 175 Cb 0.56 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 1r6e h PRO 175 CO -0.45 0.44 0.01 1.25 -0.23 0.00 0.00 178.00 179.02 1r6e h LEU 176 N 0.00 0.13 -0.49 1.56 6.46 -1.44 0.67 115.31 122.19 1r6e h LEU 176 Ca -0.00 -0.26 -0.17 0.00 -0.12 0.00 0.00 57.88 57.32 1r6e h LEU 176 Cb 1.13 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 41.01 1r6e h LEU 176 CO 0.06 0.36 -0.73 0.40 -0.62 0.00 0.00 178.44 177.91 1r6e h ILE 177 N -0.11 1.45 -0.59 4.05 1.08 0.24 -2.56 117.51 121.07 1r6e h ILE 177 Ca 0.02 -2.31 -0.07 0.00 -0.39 0.00 0.00 64.86 62.11 1r6e h ILE 177 Cb 0.29 2.24 -0.02 0.00 -3.07 0.00 0.00 36.82 36.25 1r6e h ILE 177 CO 0.00 0.67 0.07 0.00 -0.69 0.00 0.00 178.15 178.21 1r6e h ALA 178 N 1.12 1.01 0.69 1.87 0.00 0.17 0.70 119.26 124.82 1r6e h ALA 178 Ca -0.02 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1r6e h ALA 178 Cb 1.29 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.86 1r6e h ALA 178 CO 0.11 0.62 -0.33 0.77 0.00 0.00 0.00 179.25 180.42 1r6e h SER 179 N 0.91 -0.78 0.13 0.00 0.02 0.49 0.36 113.55 114.67 1r6e h SER 179 Ca 0.18 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1r6e h SER 179 Cb 0.43 0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.17 1r6e h SER 179 CO 0.01 -0.53 -0.03 0.00 -1.14 0.00 0.00 176.83 175.15 1r6e h ALA 180 N -0.68 1.32 0.04 3.77 0.00 -1.22 1.76 119.26 124.24 1r6e h ALA 180 Ca -0.09 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.55 1r6e h ALA 180 Cb 0.72 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1r6e h ALA 180 CO 0.16 0.04 -1.03 0.77 0.00 0.00 0.00 179.25 179.18 1r6e h SER 181 N 0.00 0.44 0.44 0.00 0.02 0.12 1.78 113.55 116.35 1r6e h SER 181 Ca -0.00 -0.39 -0.22 0.00 -0.84 0.00 0.00 61.79 60.34 1r6e h SER 181 Cb 0.10 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 1r6e h SER 181 CO 0.00 1.23 -0.96 0.40 -1.14 0.00 0.00 176.83 176.36 1r6e h ILE 182 N 0.15 1.44 0.00 3.27 2.04 0.17 -3.34 117.51 121.24 1r6e h ILE 182 Ca -0.09 -2.57 -0.05 0.00 1.00 0.00 0.00 64.86 63.15 1r6e h ILE 182 Cb 1.70 2.50 -0.01 0.00 -0.74 0.00 0.00 36.82 40.27 1r6e h ILE 182 CO 0.17 0.76 -0.34 0.50 0.00 0.00 0.00 178.15 179.24 1r6e h LYS 183 N 0.18 0.00 -3.61 2.37 3.64 0.27 -3.42 116.57 115.99 1r6e h LYS 183 Ca -0.08 0.00 -0.77 0.00 -1.27 0.00 0.00 60.65 58.54 1r6e h LYS 183 Cb 1.61 0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 33.13 1r6e h LYS 183 CO 0.16 0.53 0.12 0.71 -2.27 0.00 0.00 179.45 178.70 1r6e s TYR 184 N -2.05 3.91 0.20 1.91 2.02 0.60 -4.83 117.35 119.11 1r6e s TYR 184 Ca -0.15 -2.52 -0.03 0.00 -0.37 0.00 0.00 57.07 54.00 1r6e s TYR 184 Cb 0.01 -3.64 0.15 0.00 -0.40 0.00 0.00 41.96 38.07 1r6e s TYR 184 CO 0.38 -0.91 1.55 -1.00 -1.57 0.00 0.00 175.55 174.00 1r6e h PRO 185 N 6.98 0.62 -0.12 -1.71 0.13 -1.74 -2.59 132.00 133.57 1r6e h PRO 185 Ca 0.13 -0.34 -0.01 0.00 -0.87 0.00 0.00 66.00 64.91 1r6e h PRO 185 Cb 0.93 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.07 1r6e h PRO 185 CO 0.85 0.94 0.05 1.25 -0.23 0.00 0.00 178.00 180.86 1r6e h HIS 186 N 0.51 0.18 0.00 1.56 2.76 -1.92 -1.17 115.15 117.06 1r6e h HIS 186 Ca 0.04 -0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.07 1r6e h HIS 186 Cb 0.97 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.86 1r6e h HIS 186 CO 0.04 0.27 -0.58 0.52 -1.30 0.00 0.00 177.93 176.88 1r6e h MET 187 N 0.03 0.00 -0.00 5.26 2.86 -1.94 -3.18 114.93 117.96 1r6e h MET 187 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1r6e h MET 187 Cb 0.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.83 1r6e h MET 187 CO -0.00 0.58 -0.34 1.19 1.06 0.00 0.00 176.91 179.40 1r6e n PHE 188 N -3.43 0.00 -0.21 -0.22 3.01 -0.98 -3.99 117.46 111.64 1r6e n PHE 188 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.48 1r6e n PHE 188 Cb 0.69 -0.22 0.11 0.00 -0.01 0.00 0.00 39.48 40.05 1r6e n PHE 188 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1r6e h ILE 189 N 0.47 0.47 -3.38 4.37 2.04 -1.18 -3.40 117.51 116.89 1r6e h ILE 189 Ca 0.00 -0.04 -0.55 0.00 1.00 0.00 0.00 64.86 65.27 1r6e h ILE 189 Cb 0.49 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 1r6e h ILE 189 CO 0.00 0.02 0.10 0.20 0.00 0.00 0.00 178.15 178.47 1r6e s ASN 190 N -5.23 7.10 0.10 1.72 0.01 -1.26 -4.96 114.94 112.42 1r6e s ASN 190 Ca -0.13 1.32 -0.23 0.00 -0.71 0.00 0.00 52.86 53.10 1r6e s ASN 190 Cb 0.19 -2.43 -0.13 0.00 0.41 0.00 0.00 41.25 39.29 1r6e s ASN 190 CO 0.74 0.00 1.73 0.45 -1.51 0.00 0.00 177.10 178.51 1r6e h HIS 191 N 5.93 -0.07 -0.96 2.20 3.86 -1.94 0.31 115.15 124.49 1r6e h HIS 191 Ca -0.43 0.00 0.22 0.00 -1.16 0.00 0.00 60.37 59.00 1r6e h HIS 191 Cb 1.20 0.03 -0.08 0.00 1.06 0.00 0.00 27.41 29.63 1r6e h HIS 191 CO 0.65 -0.05 0.63 -0.97 0.86 0.00 0.00 177.93 179.05 1r6e h ASN 192 N -0.05 0.45 0.00 2.45 -0.00 -1.94 0.93 115.58 117.42 1r6e h ASN 192 Ca 0.01 0.06 -0.01 0.00 -0.00 0.00 0.00 56.30 56.36 1r6e h ASN 192 Cb 0.07 -0.02 -0.00 0.00 -0.00 0.00 0.00 38.32 38.36 1r6e h ASN 192 CO -0.03 0.15 -0.03 1.56 -0.00 0.00 0.00 177.43 179.08 1r6e h GLN 193 N 0.44 0.00 -0.35 6.67 4.20 -1.64 -1.96 115.11 122.47 1r6e h GLN 193 Ca 0.52 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.20 1r6e h GLN 193 Cb 1.25 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.01 1r6e h GLN 193 CO -0.23 0.80 0.09 -0.56 -0.67 0.00 0.00 178.83 178.27 1r6e h GLN 194 N -1.00 0.51 -0.00 1.46 3.07 0.20 -0.04 115.11 119.32 1r6e h GLN 194 Ca -0.01 -0.08 -0.16 0.00 0.09 0.00 0.00 58.65 58.49 1r6e h GLN 194 Cb 0.81 -0.09 -0.02 0.00 0.08 0.00 0.00 27.48 28.26 1r6e h GLN 194 CO -0.01 0.47 -0.76 0.28 0.09 0.00 0.00 178.83 178.90 1r6e h VAL 195 N 0.50 1.54 -0.26 1.86 2.07 0.77 -2.96 116.25 119.78 1r6e h VAL 195 Ca 0.12 -2.59 -0.15 0.00 0.82 0.00 0.00 66.70 64.90 1r6e h VAL 195 Cb 0.18 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 1r6e h VAL 195 CO -0.01 0.74 -0.45 0.28 0.02 0.00 0.00 177.57 178.15 1r6e h SER 196 N 0.00 0.71 -0.87 0.57 0.02 -0.44 -2.98 113.55 110.56 1r6e h SER 196 Ca -0.01 -0.34 0.11 0.00 -0.84 0.00 0.00 61.79 60.71 1r6e h SER 196 Cb 1.34 -0.20 -0.08 0.00 0.14 0.00 0.00 62.40 63.60 1r6e h SER 196 CO 0.10 1.06 0.50 -0.26 -1.14 0.00 0.00 176.83 177.09 1r6e h PHE 197 N 0.53 0.89 0.00 3.45 0.04 -0.88 0.32 116.94 121.30 1r6e h PHE 197 Ca 0.03 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.83 1r6e h PHE 197 Cb 1.00 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.88 1r6e h PHE 197 CO 0.05 0.33 0.00 0.36 -0.60 0.00 0.00 178.31 178.44 1r6e n LYS 198 N -4.75 0.27 0.01 1.51 -0.00 -1.14 -1.05 118.16 113.01 1r6e n LYS 198 Ca 0.16 0.05 -0.21 0.00 -0.00 0.00 0.00 58.31 58.31 1r6e n LYS 198 Cb 0.33 -1.50 -0.14 0.00 -0.00 0.00 0.00 35.03 33.73 1r6e n LYS 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1r6e h ALA 199 N 3.12 0.14 -0.03 0.58 0.00 -0.27 -2.18 119.26 120.61 1r6e h ALA 199 Ca 0.00 -1.02 -0.18 0.00 0.00 0.00 0.00 54.91 53.71 1r6e h ALA 199 Cb 0.29 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1r6e h ALA 199 CO 0.00 0.73 -0.77 0.10 0.00 0.00 0.00 179.25 179.31 1r6e h TYR 200 N -0.36 0.35 -0.69 0.00 -0.00 -1.38 -2.90 116.97 112.00 1r6e h TYR 200 Ca -0.27 -0.17 -0.03 0.00 -0.00 0.00 0.00 58.73 58.25 1r6e h TYR 200 Cb 1.71 -0.05 -0.03 0.00 -0.00 0.00 0.00 36.73 38.35 1r6e h TYR 200 CO 0.14 0.93 0.30 0.00 -0.00 0.00 0.00 178.16 179.53 1r6e h ALA 201 N 1.02 1.24 -0.14 0.10 0.00 -1.18 -0.99 119.26 119.32 1r6e h ALA 201 Ca -0.03 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1r6e h ALA 201 Cb 1.35 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1r6e h ALA 201 CO 0.12 0.57 -0.35 1.49 0.00 0.00 0.00 179.25 181.09 1r6e h GLU 202 N 0.98 0.27 0.00 0.00 4.57 -1.28 -2.57 114.58 116.55 1r6e h GLU 202 Ca 0.23 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.22 1r6e h GLU 202 Cb 0.14 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1r6e h GLU 202 CO -0.03 0.59 -0.40 -0.22 -1.18 0.00 0.00 179.01 177.77 1r6e h LYS 203 N 0.24 0.00 0.11 1.92 1.63 -1.07 -3.19 116.57 116.21 1r6e h LYS 203 Ca 0.03 0.00 -0.19 0.00 -0.85 0.00 0.00 60.65 59.64 1r6e h LYS 203 Cb 0.73 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.37 1r6e h LYS 203 CO 0.06 0.40 -0.92 -0.84 -3.45 0.00 0.00 179.45 174.70 1r6e h ILE 204 N 0.00 1.37 -0.51 2.00 3.07 -0.93 -3.22 117.51 119.29 1r6e h ILE 204 Ca -0.00 -2.45 0.15 0.00 1.55 0.00 0.00 64.86 64.10 1r6e h ILE 204 Cb 1.00 3.02 -0.02 0.00 -0.27 0.00 0.00 36.82 40.56 1r6e h ILE 204 CO 0.05 0.68 0.43 -0.37 -1.05 0.00 0.00 178.15 177.89 1r6e h VAL 205 N -0.46 0.56 0.00 0.16 -1.51 -1.55 0.36 116.25 113.80 1r6e h VAL 205 Ca -0.19 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.28 1r6e h VAL 205 Cb 1.58 0.69 0.00 0.00 -2.13 0.00 0.00 31.29 31.43 1r6e h VAL 205 CO 0.08 0.00 0.15 0.80 -1.23 0.00 0.00 177.57 177.38 1r6e n MET 206 N -4.07 0.11 -0.02 5.19 0.00 -1.20 0.28 117.12 117.39 1r6e n MET 206 Ca 0.09 0.59 0.01 0.00 -0.00 0.00 0.00 57.70 58.40 1r6e n MET 206 Cb 0.64 -2.01 -0.14 0.00 0.00 0.00 0.00 33.22 31.71 1r6e n MET 206 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1r6e n LYS 207 N -2.12 0.66 0.01 2.12 2.85 0.12 -2.83 118.16 118.97 1r6e n LYS 207 Ca -0.01 -0.02 -0.22 0.00 -1.05 0.00 0.00 58.31 57.01 1r6e n LYS 207 Cb 0.18 -1.60 -0.14 0.00 -0.65 0.00 0.00 35.03 32.82 1r6e n LYS 207 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1r6e h GLU 208 N 0.00 0.27 0.00 -1.58 4.39 0.37 -3.36 114.58 114.67 1r6e h GLU 208 Ca -0.22 -0.47 -0.13 0.00 0.34 0.00 0.00 59.36 58.88 1r6e h GLU 208 Cb 1.56 0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 30.36 1r6e h GLU 208 CO 0.02 1.22 -0.62 -0.39 -1.16 0.00 0.00 179.01 178.09 1r6e h VAL 209 N 0.07 1.41 -0.95 3.13 -1.51 0.38 -3.32 116.25 115.45 1r6e h VAL 209 Ca -0.42 -2.14 0.17 0.00 -1.23 0.00 0.00 66.70 63.08 1r6e h VAL 209 Cb 2.04 2.17 -0.17 0.00 -2.13 0.00 0.00 31.29 33.20 1r6e h VAL 209 CO 0.09 0.61 -0.30 0.35 -1.23 0.00 0.00 177.57 177.09 1r6e n THR 210 N -3.75 -0.45 0.26 7.19 -2.24 -1.13 -0.09 114.28 114.08 1r6e n THR 210 Ca -0.01 2.20 0.13 0.00 -2.27 0.00 0.00 64.05 64.10 1r6e n THR 210 Cb 0.63 -2.98 0.73 0.00 -2.10 0.00 0.00 70.33 66.61 1r6e n THR 210 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1r6e h PRO 211 N 0.00 0.00 0.00 -0.78 0.13 -1.79 -2.00 132.00 127.56 1r6e h PRO 211 Ca 0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.53 1r6e h PRO 211 Cb 0.63 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.76 1r6e h PRO 211 CO -0.96 0.11 0.00 -0.07 -0.23 0.00 0.00 178.00 176.85 1r6e h LEU 212 N 0.00 0.00 -2.37 1.56 3.38 -0.70 -1.68 115.31 115.50 1r6e h LEU 212 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r6e h LEU 212 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1r6e h LEU 212 CO 0.01 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.03 1r6e n PHE 213 N -2.89 0.81 0.48 1.13 3.72 -0.76 -4.04 117.46 115.92 1r6e n PHE 213 Ca 0.02 -0.41 0.10 0.00 -0.05 0.00 0.00 57.45 57.11 1r6e n PHE 213 Cb 0.33 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.73 1r6e n PHE 213 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1r6e n ASN 214 N 1.40 0.61 -0.32 4.37 5.15 -0.63 -4.07 115.26 121.76 1r6e n ASN 214 Ca 0.22 -0.50 0.14 0.00 -0.60 0.00 0.00 54.58 53.84 1r6e n ASN 214 Cb 0.55 1.46 0.59 0.00 -0.53 0.00 0.00 39.78 41.86 1r6e n ASN 214 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 1r6e n LYS 215 N -1.84 1.33 0.00 1.20 -0.00 -1.24 -4.93 118.16 112.68 1r6e n LYS 215 Ca 0.00 -0.65 0.00 0.00 -0.00 0.00 0.00 58.31 57.66 1r6e n LYS 215 Cb 0.43 -1.49 0.00 0.00 -0.00 0.00 0.00 35.03 33.97 1r6e n LYS 215 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1r6e n GLY 216 N 1.18 4.89 0.68 2.58 0.00 -1.26 -5.05 105.19 108.21 1r6e n GLY 216 Ca 0.19 -0.60 0.04 0.00 0.00 0.00 0.00 46.02 45.65 1r6e n GLY 216 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r6e n THR 217 N 0.00 2.26 -2.85 2.61 -2.24 -1.26 -5.04 114.28 107.76 1r6e n THR 217 Ca 0.00 -3.08 -0.32 0.00 -2.27 0.00 0.00 64.05 58.38 1r6e n THR 217 Cb 0.00 -0.26 -0.05 0.00 -2.10 0.00 0.00 70.33 67.92 1r6e n THR 217 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1r6e s MET 218 N -3.22 4.00 0.62 -0.78 0.00 -1.26 -5.03 119.30 113.63 1r6e s MET 218 Ca 0.39 0.79 -0.14 0.00 0.00 0.00 0.00 55.69 56.73 1r6e s MET 218 Cb 0.37 -2.30 -0.03 0.00 0.00 0.00 0.00 34.83 32.87 1r6e s MET 218 CO -0.05 -0.02 1.05 -1.25 0.00 0.00 0.00 175.02 174.76 1r6e s PRO 219 N -3.44 3.25 0.66 4.11 0.04 -1.26 -4.75 135.00 133.61 1r6e s PRO 219 Ca 0.56 1.13 -0.09 0.00 0.04 0.00 0.00 61.00 62.64 1r6e s PRO 219 Cb -0.10 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.44 1r6e s PRO 219 CO 0.22 -0.86 1.01 0.95 0.04 0.00 0.00 177.00 178.36 1r6e s THR 220 N -2.62 3.31 0.17 1.26 -4.23 -1.26 -4.80 115.64 107.48 1r6e s THR 220 Ca 0.62 0.15 -0.13 0.00 -1.18 0.00 0.00 61.69 61.15 1r6e s THR 220 Cb -0.15 -3.38 0.07 0.00 1.34 0.00 0.00 72.50 70.38 1r6e s THR 220 CO 0.41 -0.44 1.79 1.55 -0.54 0.00 0.00 174.62 177.39 1r6e h PRO 221 N -0.47 0.76 -0.28 3.99 0.13 -1.89 0.36 132.00 134.60 1r6e h PRO 221 Ca -0.45 -0.08 -0.14 0.00 -0.87 0.00 0.00 66.00 64.46 1r6e h PRO 221 Cb 1.27 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1r6e h PRO 221 CO 0.62 0.58 -0.36 0.37 -0.23 0.00 0.00 178.00 178.98 1r6e h GLN 222 N 0.74 0.73 -0.36 0.86 4.15 -1.93 2.03 115.11 121.35 1r6e h GLN 222 Ca 0.20 -0.42 -0.09 0.00 0.77 0.00 0.00 58.65 59.11 1r6e h GLN 222 Cb 0.03 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 1r6e h GLN 222 CO -0.03 1.04 -0.13 -0.56 -1.93 0.00 0.00 178.83 177.21 1r6e h GLN 223 N 0.48 0.72 -0.03 1.69 3.07 -1.90 -0.89 115.11 118.24 1r6e h GLN 223 Ca 0.03 -0.30 -0.11 0.00 0.09 0.00 0.00 58.65 58.37 1r6e h GLN 223 Cb 0.94 -0.03 0.01 0.00 0.08 0.00 0.00 27.48 28.48 1r6e h GLN 223 CO 0.08 0.90 -0.41 0.35 0.09 0.00 0.00 178.83 179.84 1r6e h PHE 224 N 0.51 0.48 -0.06 0.06 3.57 -0.23 -2.44 116.94 118.82 1r6e h PHE 224 Ca 0.08 -0.24 0.02 0.00 3.53 0.00 0.00 57.97 61.37 1r6e h PHE 224 Cb 0.66 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1r6e h PHE 224 CO 0.05 1.02 -0.06 0.37 -2.23 0.00 0.00 178.31 177.47 1r6e h GLN 225 N -0.20 -0.07 0.02 1.11 4.15 0.33 0.32 115.11 120.77 1r6e h GLN 225 Ca -0.04 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.40 1r6e h GLN 225 Cb 1.11 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.79 1r6e h GLN 225 CO 0.08 -0.05 -0.13 -0.07 -1.93 0.00 0.00 178.83 176.74 1r6e h LEU 226 N -0.07 -0.37 -1.90 -2.39 -0.00 -1.25 2.74 115.31 112.07 1r6e h LEU 226 Ca 0.04 0.05 0.06 0.00 -0.00 0.00 0.00 57.88 58.04 1r6e h LEU 226 Cb 0.13 0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 40.94 1r6e h LEU 226 CO -0.10 -0.18 0.19 0.74 -0.00 0.00 0.00 178.44 179.09 1r6e h THR 227 N -0.23 0.92 0.00 0.22 2.02 -0.99 1.51 112.91 116.37 1r6e h THR 227 Ca 0.04 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1r6e h THR 227 Cb 0.28 0.79 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 1r6e h THR 227 CO -0.12 0.02 -0.01 -0.29 0.37 0.00 0.00 175.52 175.49 1r6e h ILE 228 N 0.12 1.03 -0.98 3.11 2.10 0.13 -3.24 117.51 119.77 1r6e h ILE 228 Ca 0.13 -1.77 0.19 0.00 1.08 0.00 0.00 64.86 64.48 1r6e h ILE 228 Cb 0.36 1.94 -0.09 0.00 -1.09 0.00 0.00 36.82 37.94 1r6e h ILE 228 CO -0.02 0.35 0.61 -0.33 -1.08 0.00 0.00 178.15 177.69 1r6e h GLU 229 N -1.00 0.66 -0.19 2.19 5.08 0.53 1.23 114.58 123.08 1r6e h GLU 229 Ca -0.00 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1r6e h GLU 229 Cb 0.58 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1r6e h GLU 229 CO -0.00 0.44 0.26 -0.91 -1.00 0.00 0.00 179.01 177.80 1r6e h ASN 230 N 0.68 0.00 0.43 1.42 2.35 0.21 2.61 115.58 123.29 1r6e h ASN 230 Ca 0.54 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.29 1r6e h ASN 230 Cb 0.95 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.32 1r6e h ASN 230 CO -0.31 0.00 -1.57 -0.38 -1.65 0.00 0.00 177.43 173.52 1r6e n ILE 231 N -3.56 0.28 0.08 2.81 5.41 0.41 -1.71 119.36 123.08 1r6e n ILE 231 Ca 0.02 -0.52 -0.22 0.00 1.00 0.00 0.00 62.75 63.03 1r6e n ILE 231 Cb 0.38 -0.15 -0.15 0.00 -0.71 0.00 0.00 39.64 39.01 1r6e n ILE 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1r6e h ALA 232 N 1.99 -0.10 -0.02 -1.39 0.00 0.86 -2.29 119.26 118.31 1r6e h ALA 232 Ca -0.00 -0.75 -0.09 0.00 0.00 0.00 0.00 54.91 54.07 1r6e h ALA 232 Cb 1.01 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1r6e h ALA 232 CO 0.00 0.51 -0.39 -0.91 0.00 0.00 0.00 179.25 178.45 1r6e h ASN 233 N -0.12 0.04 -0.18 0.00 2.35 0.42 1.62 115.58 119.70 1r6e h ASN 233 Ca -0.18 -0.01 -0.16 0.00 -0.55 0.00 0.00 56.30 55.39 1r6e h ASN 233 Cb 1.82 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 40.19 1r6e h ASN 233 CO 0.20 0.43 -0.51 0.50 -1.65 0.00 0.00 177.43 176.40 1r6e h LYS 234 N 0.03 0.67 0.00 0.81 3.64 -1.29 -2.65 116.57 117.78 1r6e h LYS 234 Ca 0.00 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1r6e h LYS 234 Cb 0.71 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1r6e h LYS 234 CO 0.05 1.10 -0.20 1.88 -2.27 0.00 0.00 179.45 180.01 1r6e h TYR 235 N 0.36 0.00 0.94 1.91 0.05 -1.17 -3.35 116.97 115.71 1r6e h TYR 235 Ca -0.01 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.72 1r6e h TYR 235 Cb 1.13 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.88 1r6e h TYR 235 CO 0.09 0.00 -0.45 1.25 -1.05 0.00 0.00 178.16 178.00 1r6e h LEU 236 N 0.00 -1.07 0.00 3.88 5.85 0.27 -3.36 115.31 120.87 1r6e h LEU 236 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1r6e h LEU 236 Cb 0.90 0.28 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1r6e h LEU 236 CO 0.00 -0.76 0.00 0.00 -0.34 0.00 0.00 178.44 177.34 1r6e n GLN 237 N -5.44 0.00 -3.87 1.25 10.64 -1.03 -4.80 117.38 114.13 1r6e n GLN 237 Ca -0.16 0.14 -0.32 0.00 -1.83 0.00 0.00 57.00 54.83 1r6e n GLN 237 Cb 0.50 -0.91 0.01 0.00 -0.86 0.00 0.00 30.24 28.98 1r6e n GLN 237 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1r6e n ASN 238 N -0.55 -3.15 0.00 2.61 3.02 -1.26 -2.19 115.26 113.73 1r6e n ASN 238 Ca 0.00 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.47 1r6e n ASN 238 Cb 0.00 -2.87 0.00 0.00 -0.61 0.00 0.00 39.78 36.30 1r6e n ASN 238 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1r6e n ALA 239 N -4.44 0.00 0.00 5.41 0.00 -1.26 -5.14 120.51 115.08 1r6e n ALA 239 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1r6e n ALA 239 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1r6e n ALA 239 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93