#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y3i s LEU 8 N 0.00 0.44 -0.04 7.52 0.20 -0.92 -4.89 118.68 120.99 1y3i s LEU 8 Ca 0.00 -0.04 0.04 0.00 0.69 0.00 0.00 54.13 54.81 1y3i s LEU 8 Cb 0.00 1.72 -0.00 0.00 -0.43 0.00 0.00 46.19 47.48 1y3i s LEU 8 CO 0.00 -0.68 -0.14 -0.22 -0.29 0.00 0.00 176.35 175.02 1y3i s LEU 9 N -2.08 1.86 -0.08 -0.68 2.96 -1.26 -0.65 118.68 118.76 1y3i s LEU 9 Ca -0.05 -0.29 0.04 0.00 -0.22 0.00 0.00 54.13 53.61 1y3i s LEU 9 Cb -0.01 -0.82 -0.01 0.00 0.50 0.00 0.00 46.19 45.85 1y3i s LEU 9 CO -0.03 0.12 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.22 1y3i s VAL 10 N 0.12 2.43 -0.02 1.68 1.01 -1.04 -5.02 120.40 119.56 1y3i s VAL 10 Ca -0.04 -0.92 -0.14 0.00 0.00 0.00 0.00 61.98 60.88 1y3i s VAL 10 Cb -0.11 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.36 1y3i s VAL 10 CO 0.02 0.56 0.28 -0.69 0.00 0.00 0.00 175.10 175.27 1y3i s VAL 11 N -0.07 0.06 0.00 2.92 1.01 -1.26 -2.25 120.40 120.81 1y3i s VAL 11 Ca -0.05 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1y3i s VAL 11 Cb -0.14 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1y3i s VAL 11 CO 0.04 -0.27 0.00 1.57 0.00 0.00 0.00 175.10 176.45 1y3i n HIS 12 N 1.36 0.00 0.00 5.22 -0.00 -1.01 -5.02 115.22 115.77 1y3i n HIS 12 Ca -0.21 0.00 0.00 0.00 0.46 0.00 0.00 57.72 57.97 1y3i n HIS 12 Cb 0.56 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.43 1y3i n HIS 12 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1y3i n LEU 78 N 0.00 0.00 -4.75 0.27 7.94 -1.26 -5.14 117.00 114.06 1y3i n LEU 78 Ca 0.00 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 54.53 1y3i n LEU 78 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 1y3i n LEU 78 CO 0.00 0.00 0.10 -0.69 -1.11 0.00 0.00 177.39 175.69 1y3i s VAL 79 N 0.00 5.19 0.02 1.96 1.01 0.70 -2.18 120.40 127.09 1y3i s VAL 79 Ca 0.00 0.80 0.08 0.00 0.00 0.00 0.00 61.98 62.85 1y3i s VAL 79 Cb 0.00 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 1y3i s VAL 79 CO 0.00 0.41 -0.22 -0.76 0.00 0.00 0.00 175.10 174.53 1y3i s LEU 80 N 0.13 2.35 -0.01 3.92 2.01 0.18 0.19 118.68 127.44 1y3i s LEU 80 Ca 0.22 -0.46 0.00 0.00 0.01 0.00 0.00 54.13 53.91 1y3i s LEU 80 Cb -0.15 -1.40 0.01 0.00 0.01 0.00 0.00 46.19 44.66 1y3i s LEU 80 CO 0.09 0.28 -0.00 0.54 1.01 0.00 0.00 176.35 178.27 1y3i s VAL 81 N -0.79 0.11 -0.45 -1.59 0.11 0.28 -2.49 120.40 115.57 1y3i s VAL 81 Ca 0.12 0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.22 1y3i s VAL 81 Cb -0.10 -0.15 0.13 0.00 -1.53 0.00 0.00 36.38 34.73 1y3i s VAL 81 CO 0.02 0.07 0.21 -0.76 -3.33 0.00 0.00 175.10 171.32 1y3i s LEU 82 N 0.41 3.59 0.00 2.54 2.01 -0.95 0.12 118.68 126.40 1y3i s LEU 82 Ca -0.04 -2.66 0.00 0.00 0.01 0.00 0.00 54.13 51.44 1y3i s LEU 82 Cb -0.06 -1.35 0.00 0.00 0.01 0.00 0.00 46.19 44.79 1y3i s LEU 82 CO -0.01 -0.28 0.00 0.61 1.01 0.00 0.00 176.35 177.68 1y3i n GLY 83 N 3.54 -0.81 3.78 -3.19 0.00 -0.82 -2.40 105.19 105.30 1y3i n GLY 83 Ca 0.06 0.59 -0.09 0.00 0.00 0.00 0.00 46.02 46.57 1y3i n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1y3i s GLY 84 N 0.00 0.44 0.33 -0.02 0.00 -1.26 0.58 107.32 107.39 1y3i s GLY 84 Ca 0.00 -0.79 0.18 0.00 0.00 0.00 0.00 44.72 44.10 1y3i s GLY 84 CO 0.00 -0.36 1.44 1.22 0.00 0.00 0.00 173.10 175.41 1y3i n ASP 85 N -1.36 0.28 -0.20 1.64 10.43 -1.26 0.18 116.55 126.27 1y3i n ASP 85 Ca -0.07 1.52 -0.04 0.00 2.57 0.00 0.00 54.79 58.77 1y3i n ASP 85 Cb 0.60 -0.72 0.14 0.00 1.84 0.00 0.00 41.12 42.97 1y3i n ASP 85 CO 0.00 0.00 0.00 1.23 -1.07 0.00 0.00 177.20 177.36 1y3i h GLY 86 N 0.00 1.07 1.92 0.44 0.00 -1.96 -2.60 103.07 101.93 1y3i h GLY 86 Ca 0.76 -0.60 -0.15 0.00 0.00 0.00 0.00 47.33 47.34 1y3i h GLY 86 CO -0.72 0.56 -0.77 -0.84 0.00 0.00 0.00 176.54 174.78 1y3i h THR 87 N 0.96 1.15 0.21 4.70 2.02 0.16 -3.15 112.91 118.97 1y3i h THR 87 Ca 0.22 -2.66 -0.01 0.00 0.77 0.00 0.00 66.41 64.73 1y3i h THR 87 Cb 0.26 2.56 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 1y3i h THR 87 CO -0.01 0.66 -0.10 0.15 0.37 0.00 0.00 175.52 176.59 1y3i h PHE 88 N 0.00 -0.26 0.00 3.16 3.57 -0.44 0.97 116.94 123.94 1y3i h PHE 88 Ca -0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1y3i h PHE 88 Cb 1.55 0.09 0.00 0.00 2.79 0.00 0.00 35.95 40.38 1y3i h PHE 88 CO 0.00 -0.03 0.00 -0.07 -2.23 0.00 0.00 178.31 175.98 1y3i h LEU 89 N -0.47 0.00 0.00 0.59 3.38 -1.55 1.48 115.31 118.74 1y3i h LEU 89 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1y3i h LEU 89 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1y3i h LEU 89 CO 0.05 0.00 -0.00 -0.09 0.09 0.00 0.00 178.44 178.49 1y3i h ARG 90 N 0.00 -0.00 0.00 1.13 9.65 -1.45 -3.20 114.38 120.51 1y3i h ARG 90 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1y3i h ARG 90 Cb 0.42 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 1y3i h ARG 90 CO 0.00 0.87 0.00 0.00 2.80 0.00 0.00 179.97 183.64 1y3i n ALA 91 N -2.57 -0.18 -0.43 2.80 0.00 0.33 -2.98 120.51 117.49 1y3i n ALA 91 Ca -0.09 0.00 0.37 0.00 0.00 0.00 0.00 53.44 53.72 1y3i n ALA 91 Cb 0.43 0.29 0.63 0.00 0.00 0.00 0.00 19.45 20.79 1y3i n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y3i n ALA 92 N -2.45 1.25 0.04 0.00 0.00 0.50 -1.76 120.51 118.09 1y3i n ALA 92 Ca 0.00 0.84 -0.13 0.00 0.00 0.00 0.00 53.44 54.15 1y3i n ALA 92 Cb 0.00 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.38 1y3i n ALA 92 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1y3i h GLU 93 N 0.00 -0.55 -0.03 0.00 4.81 -1.52 0.93 114.58 118.21 1y3i h GLU 93 Ca 0.83 0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.98 1y3i h GLU 93 Cb 2.61 0.12 0.01 0.00 0.63 0.00 0.00 28.75 32.12 1y3i h GLU 93 CO -0.48 -0.36 -0.45 1.37 -0.73 0.00 0.00 179.01 178.35 1y3i h LEU 94 N -0.57 0.46 -0.94 1.64 8.10 -1.50 -1.32 115.31 121.18 1y3i h LEU 94 Ca 0.05 -0.71 0.21 0.00 0.11 0.00 0.00 57.88 57.53 1y3i h LEU 94 Cb 0.66 -0.14 -0.12 0.00 -0.44 0.00 0.00 40.66 40.62 1y3i h LEU 94 CO -0.34 1.11 0.51 0.00 -4.11 0.00 0.00 178.44 175.60 1y3i h ALA 95 N 0.36 1.56 0.41 0.17 0.00 -1.41 1.77 119.26 122.13 1y3i h ALA 95 Ca -0.05 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1y3i h ALA 95 Cb 1.14 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1y3i h ALA 95 CO 0.09 -0.22 -0.20 -0.09 0.00 0.00 0.00 179.25 178.84 1y3i h ARG 96 N 0.57 -0.53 -1.03 0.00 1.12 -0.82 0.32 114.38 114.01 1y3i h ARG 96 Ca 0.57 0.04 0.26 0.00 -1.11 0.00 0.00 59.98 59.74 1y3i h ARG 96 Cb 1.01 0.12 -0.09 0.00 -0.01 0.00 0.00 29.97 30.99 1y3i h ARG 96 CO -0.45 -0.28 0.66 -0.97 -3.11 0.00 0.00 179.97 175.82 1y3i h ASN 97 N -0.71 0.47 -0.48 -3.80 -0.00 0.31 0.40 115.58 111.77 1y3i h ASN 97 Ca -0.06 0.08 -0.06 0.00 -0.00 0.00 0.00 56.30 56.27 1y3i h ASN 97 Cb 0.50 0.01 -0.03 0.00 -0.00 0.00 0.00 38.32 38.80 1y3i h ASN 97 CO 0.09 0.10 0.05 0.00 -0.00 0.00 0.00 177.43 177.68 1y3i n ALA 98 N -2.46 3.72 -3.91 1.57 0.00 0.49 -4.96 120.51 114.96 1y3i n ALA 98 Ca 0.25 -2.24 -0.34 0.00 0.00 0.00 0.00 53.44 51.11 1y3i n ALA 98 Cb 0.84 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 19.26 1y3i n ALA 98 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1y3i n SER 99 N -0.08 -1.47 -4.14 0.00 7.64 0.14 -4.89 113.62 110.82 1y3i n SER 99 Ca 0.28 -0.95 -0.34 0.00 1.01 0.00 0.00 58.87 58.87 1y3i n SER 99 Cb 1.12 -1.29 -0.14 0.00 -1.01 0.00 0.00 64.21 62.89 1y3i n SER 99 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1y3i s ILE 100 N -2.79 2.74 -0.32 0.44 2.07 0.11 -5.01 121.20 118.45 1y3i s ILE 100 Ca 0.66 -1.48 -0.44 0.00 -1.41 0.00 0.00 60.65 57.97 1y3i s ILE 100 Cb -0.38 -2.59 -0.20 0.00 0.13 0.00 0.00 42.46 39.42 1y3i s ILE 100 CO 0.80 -0.10 1.44 -2.65 -1.91 0.00 0.00 174.94 172.53 1y3i n PRO 101 N 4.56 0.12 -2.73 3.50 -0.02 -1.26 -4.38 135.00 134.78 1y3i n PRO 101 Ca -0.13 0.04 -0.34 0.00 -2.02 0.00 0.00 63.50 61.05 1y3i n PRO 101 Cb 0.43 -1.56 -0.06 0.00 -0.02 0.00 0.00 33.50 32.29 1y3i n PRO 101 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1y3i s VAL 102 N 2.06 4.18 -0.02 -1.45 0.11 -1.08 -0.22 120.40 123.98 1y3i s VAL 102 Ca 1.00 1.44 -0.04 0.00 -2.93 0.00 0.00 61.98 61.45 1y3i s VAL 102 Cb -1.38 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 29.85 1y3i s VAL 102 CO 0.72 -0.22 0.09 -0.22 -3.33 0.00 0.00 175.10 172.15 1y3i s LEU 103 N -3.06 1.69 -0.04 2.54 2.96 0.49 -3.00 118.68 120.26 1y3i s LEU 103 Ca 0.61 0.05 -0.08 0.00 -0.22 0.00 0.00 54.13 54.50 1y3i s LEU 103 Cb -0.13 0.36 0.01 0.00 0.50 0.00 0.00 46.19 46.93 1y3i s LEU 103 CO 0.17 -0.12 0.18 -0.83 -1.32 0.00 0.00 176.35 174.43 1y3i s GLY 104 N -0.35 -0.07 -0.04 7.98 0.00 -1.26 1.00 107.32 114.57 1y3i s GLY 104 Ca -0.04 0.26 0.02 0.00 0.00 0.00 0.00 44.72 44.96 1y3i s GLY 104 CO 0.00 0.16 -0.07 0.14 0.00 0.00 0.00 173.10 173.33 1y3i s VAL 105 N -0.58 0.69 0.42 1.40 1.01 0.32 -2.22 120.40 121.44 1y3i s VAL 105 Ca -0.07 -0.23 -0.24 0.00 0.00 0.00 0.00 61.98 61.45 1y3i s VAL 105 Cb -0.04 -0.67 -0.11 0.00 0.00 0.00 0.00 36.38 35.56 1y3i s VAL 105 CO 0.01 0.25 0.88 -3.20 0.00 0.00 0.00 175.10 173.04 1y3i n ASN 106 N 3.87 0.64 -3.18 3.32 2.85 0.50 -1.94 115.26 121.32 1y3i n ASN 106 Ca -0.24 1.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.94 1y3i n ASN 106 Cb 0.52 -1.28 -0.04 0.00 1.24 0.00 0.00 39.78 40.22 1y3i n ASN 106 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1y3i n LEU 107 N 0.72 4.82 0.00 1.20 4.32 0.19 -0.44 117.00 127.82 1y3i n LEU 107 Ca 0.10 -5.58 0.00 0.00 -0.02 0.00 0.00 56.01 50.51 1y3i n LEU 107 Cb 0.39 -0.70 0.00 0.00 -1.62 0.00 0.00 43.42 41.49 1y3i n LEU 107 CO 0.56 2.23 0.00 0.61 -1.22 0.00 0.00 177.39 179.57 1y3i n GLY 108 N 0.06 1.90 3.65 -0.72 0.00 -1.26 -4.90 105.19 103.92 1y3i n GLY 108 Ca 0.33 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1y3i n GLY 108 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y3i s ARG 109 N 0.00 4.08 0.19 1.61 3.00 -1.26 -4.94 118.95 121.63 1y3i s ARG 109 Ca 0.00 2.03 -0.32 0.00 -1.00 0.00 0.00 55.73 56.44 1y3i s ARG 109 Cb 0.00 -3.98 -0.12 0.00 0.00 0.00 0.00 34.95 30.85 1y3i s ARG 109 CO 0.00 -0.96 1.72 0.42 0.00 0.00 0.00 175.30 176.49 1y3i s ILE 110 N 4.33 2.14 0.01 4.11 1.01 -1.26 -4.81 121.20 126.72 1y3i s ILE 110 Ca 0.72 0.06 -0.29 0.00 0.00 0.00 0.00 60.65 61.14 1y3i s ILE 110 Cb -0.30 -3.04 0.07 0.00 0.01 0.00 0.00 42.46 39.20 1y3i s ILE 110 CO 0.28 0.00 0.65 -0.83 0.00 0.00 0.00 174.94 175.05 1y3i s GLY 111 N 1.38 -0.59 -0.00 6.18 0.00 -1.26 -4.97 107.32 108.06 1y3i s GLY 111 Ca 0.75 1.08 -0.00 0.00 0.00 0.00 0.00 44.72 46.55 1y3i s GLY 111 CO 0.32 0.73 0.38 -2.75 0.00 0.00 0.00 173.10 171.78 1y3i h PHE 112 N 2.73 -0.01 0.00 1.90 3.57 -1.98 -3.36 116.94 119.78 1y3i h PHE 112 Ca -0.29 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.21 1y3i h PHE 112 Cb 1.19 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.93 1y3i h PHE 112 CO 0.34 -0.01 0.41 -0.07 -2.23 0.00 0.00 178.31 176.76 1y3i h LEU 113 N -0.03 0.00 -9.02 0.59 3.38 -1.97 -3.42 115.31 104.84 1y3i h LEU 113 Ca -0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 1y3i h LEU 113 Cb 0.01 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.69 1y3i h LEU 113 CO 0.00 0.00 0.74 0.00 0.09 0.00 0.00 178.44 179.27 1y3i s ALA 114 N -3.73 3.62 0.63 1.53 0.00 -1.26 -4.92 121.76 117.62 1y3i s ALA 114 Ca -0.02 0.03 0.36 0.00 0.00 0.00 0.00 51.96 52.32 1y3i s ALA 114 Cb 0.05 -3.54 2.03 0.00 0.00 0.00 0.00 23.12 21.67 1y3i s ALA 114 CO 0.17 -1.17 2.26 1.49 0.00 0.00 0.00 175.76 178.50 1y3i h GLU 115 N 7.72 0.00 -3.96 0.00 4.57 -1.71 -3.44 114.58 117.75 1y3i h GLU 115 Ca -0.20 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 57.82 1y3i h GLU 115 Cb 1.07 0.00 -0.10 0.00 -0.16 0.00 0.00 28.75 29.56 1y3i h GLU 115 CO 0.98 0.00 -0.23 0.00 -1.18 0.00 0.00 179.01 178.57 1y3i s ALA 116 N -4.41 0.32 0.34 2.92 0.00 -1.23 -4.93 121.76 114.77 1y3i s ALA 116 Ca -0.05 -1.22 0.07 0.00 0.00 0.00 0.00 51.96 50.76 1y3i s ALA 116 Cb 0.14 1.15 -0.02 0.00 0.00 0.00 0.00 23.12 24.39 1y3i s ALA 116 CO 0.47 -0.79 0.36 -2.00 0.00 0.00 0.00 175.76 173.81 1y3i s GLU 117 N -3.75 2.87 -0.00 0.00 2.56 -1.26 0.19 118.70 119.30 1y3i s GLU 117 Ca 0.28 -1.19 0.00 0.00 0.00 0.00 0.00 54.97 54.06 1y3i s GLU 117 Cb 0.01 -2.60 0.01 0.00 2.00 0.00 0.00 34.13 33.55 1y3i s GLU 117 CO 0.13 0.08 0.76 0.00 -0.56 0.00 0.00 175.26 175.67 1y3i n ALA 118 N -1.47 2.53 -0.05 6.30 0.00 0.41 -3.63 120.51 124.60 1y3i n ALA 118 Ca -0.01 -0.03 -0.07 0.00 0.00 0.00 0.00 53.44 53.32 1y3i n ALA 118 Cb 0.59 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.99 1y3i n ALA 118 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1y3i n GLU 119 N 0.24 0.34 -2.95 0.00 4.71 -1.26 -4.72 120.64 117.01 1y3i n GLU 119 Ca 0.01 0.06 -0.43 0.00 -0.01 0.00 0.00 57.16 56.79 1y3i n GLU 119 Cb 0.39 -1.21 0.01 0.00 -1.01 0.00 0.00 31.44 29.62 1y3i n GLU 119 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1y3i n ALA 120 N -2.79 5.32 -0.04 0.62 0.00 -1.24 -4.85 120.51 117.53 1y3i n ALA 120 Ca -0.19 -4.78 -0.01 0.00 0.00 0.00 0.00 53.44 48.47 1y3i n ALA 120 Cb 0.70 -2.32 -0.00 0.00 0.00 0.00 0.00 19.45 17.83 1y3i n ALA 120 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1y3i h ILE 121 N 3.24 0.00 -0.66 0.00 -0.00 -1.84 -3.32 117.51 114.93 1y3i h ILE 121 Ca 0.25 -0.76 0.13 0.00 -0.00 0.00 0.00 64.86 64.48 1y3i h ILE 121 Cb 0.57 0.00 -0.13 0.00 -0.00 0.00 0.00 36.82 37.26 1y3i h ILE 121 CO 1.31 0.00 -0.22 -0.78 -0.00 0.00 0.00 178.15 178.46 1y3i h ASP 122 N -0.76 -0.80 -0.77 2.16 3.58 -1.98 1.12 116.42 118.96 1y3i h ASP 122 Ca 0.00 0.21 0.14 0.00 0.42 0.00 0.00 57.03 57.80 1y3i h ASP 122 Cb 0.10 0.47 -0.09 0.00 1.72 0.00 0.00 39.33 41.53 1y3i h ASP 122 CO 0.00 -0.25 0.34 0.00 -2.88 0.00 0.00 179.24 176.45 1y3i h ALA 123 N 1.49 1.10 -0.29 -0.78 0.00 -1.98 0.30 119.26 119.10 1y3i h ALA 123 Ca 0.30 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1y3i h ALA 123 Cb 0.52 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1y3i h ALA 123 CO -0.70 -0.16 0.00 0.28 0.00 0.00 0.00 179.25 178.66 1y3i n VAL 124 N -4.96 0.00 -0.09 0.00 0.31 0.38 0.18 118.33 114.15 1y3i n VAL 124 Ca 0.15 1.45 -0.09 0.00 -0.01 0.00 0.00 64.34 65.83 1y3i n VAL 124 Cb 0.40 -2.24 -0.03 0.00 -0.91 0.00 0.00 33.84 31.06 1y3i n VAL 124 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1y3i h LEU 125 N 0.00 -1.22 -0.53 7.52 4.07 -1.22 -0.20 115.31 123.73 1y3i h LEU 125 Ca 0.00 0.19 0.10 0.00 0.08 0.00 0.00 57.88 58.25 1y3i h LEU 125 Cb 0.00 0.54 -0.11 0.00 1.08 0.00 0.00 40.66 42.17 1y3i h LEU 125 CO 0.00 -0.36 -0.27 -0.08 -1.08 0.00 0.00 178.44 176.66 1y3i h GLU 126 N -0.33 -0.14 -0.04 1.13 4.22 -0.22 0.21 114.58 119.42 1y3i h GLU 126 Ca 0.14 0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.58 1y3i h GLU 126 Cb 0.57 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 1y3i h GLU 126 CO -0.51 -0.09 -0.01 0.45 -2.18 0.00 0.00 179.01 176.67 1y3i h HIS 127 N -0.14 0.06 0.00 0.92 3.86 0.36 1.56 115.15 121.77 1y3i h HIS 127 Ca 0.23 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1y3i h HIS 127 Cb 0.51 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1y3i h HIS 127 CO -0.55 0.07 0.00 -0.39 0.86 0.00 0.00 177.93 177.91 1y3i h VAL 128 N 0.06 0.00 0.07 2.45 -1.51 0.59 1.54 116.25 119.45 1y3i h VAL 128 Ca 0.02 -0.61 -0.36 0.00 -1.23 0.00 0.00 66.70 64.51 1y3i h VAL 128 Cb 0.05 1.58 -0.04 0.00 -2.13 0.00 0.00 31.29 30.76 1y3i h VAL 128 CO 0.00 0.00 -2.12 1.33 -1.23 0.00 0.00 177.57 175.55 1y3i n VAL 129 N -2.92 1.66 0.83 7.19 0.24 0.13 -3.96 118.33 121.50 1y3i n VAL 129 Ca 0.02 -0.66 0.11 0.00 -2.04 0.00 0.00 64.34 61.77 1y3i n VAL 129 Cb 0.37 -1.49 0.50 0.00 -1.47 0.00 0.00 33.84 31.75 1y3i n VAL 129 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1y3i n ALA 130 N -3.01 2.06 -2.75 2.33 0.00 0.49 -4.92 120.51 114.71 1y3i n ALA 130 Ca -0.34 -0.08 -0.02 0.00 0.00 0.00 0.00 53.44 52.99 1y3i n ALA 130 Cb 1.04 -1.37 0.01 0.00 0.00 0.00 0.00 19.45 19.13 1y3i n ALA 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1y3i n GLN 131 N -1.46 -1.17 -3.97 0.00 3.00 0.17 -5.01 117.38 108.94 1y3i n GLN 131 Ca 0.06 1.16 -0.33 0.00 -0.01 0.00 0.00 57.00 57.89 1y3i n GLN 131 Cb 0.25 -4.84 -0.14 0.00 0.00 0.00 0.00 30.24 25.51 1y3i n GLN 131 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1y3i s ASP 132 N -2.88 4.80 0.00 1.08 -0.00 0.47 -4.99 116.67 115.15 1y3i s ASP 132 Ca 0.07 -1.76 0.00 0.00 -0.00 0.00 0.00 52.55 50.86 1y3i s ASP 132 Cb -0.01 -1.66 0.00 0.00 -0.00 0.00 0.00 42.92 41.25 1y3i s ASP 132 CO 0.58 -0.34 0.00 0.00 -0.00 0.00 0.00 175.17 175.42 1y3i n TYR 133 N 4.43 0.00 -4.02 4.23 0.18 -1.25 -4.56 117.16 116.17 1y3i n TYR 133 Ca -0.05 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.63 1y3i n TYR 133 Cb 0.42 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.33 1y3i n TYR 133 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1y3i s ARG 134 N -1.02 1.56 -0.24 -3.48 0.52 -0.56 -4.85 118.95 110.87 1y3i s ARG 134 Ca 0.00 -1.32 0.01 0.00 -0.52 0.00 0.00 55.73 53.90 1y3i s ARG 134 Cb 0.00 0.46 0.06 0.00 0.52 0.00 0.00 34.95 35.99 1y3i s ARG 134 CO 0.00 -0.64 -0.04 0.14 0.02 0.00 0.00 175.30 174.78 1y3i s VAL 135 N -3.93 1.49 -0.09 3.52 -7.23 -1.24 -1.54 120.40 111.38 1y3i s VAL 135 Ca 0.24 -1.27 -0.02 0.00 -1.81 0.00 0.00 61.98 59.13 1y3i s VAL 135 Cb -0.00 -1.81 -0.03 0.00 0.56 0.00 0.00 36.38 35.10 1y3i s VAL 135 CO 0.10 -0.17 -0.01 -1.61 -0.31 0.00 0.00 175.10 173.11 1y3i s GLU 136 N 1.40 3.00 -1.05 4.82 2.02 -0.97 -4.80 118.70 123.13 1y3i s GLU 136 Ca -0.04 -0.43 -0.24 0.00 0.02 0.00 0.00 54.97 54.29 1y3i s GLU 136 Cb -0.19 -2.78 -0.06 0.00 0.10 0.00 0.00 34.13 31.20 1y3i s GLU 136 CO -0.07 0.67 1.93 0.16 0.02 0.00 0.00 175.26 177.97 1y3i s ASP 137 N -0.79 5.12 0.04 -0.19 3.84 -1.26 -2.93 116.67 120.50 1y3i s ASP 137 Ca 0.12 -1.18 -0.30 0.00 -0.00 0.00 0.00 52.55 51.18 1y3i s ASP 137 Cb -0.11 -2.57 -0.06 0.00 -1.38 0.00 0.00 42.92 38.79 1y3i s ASP 137 CO 0.02 -2.88 1.30 -0.13 -0.00 0.00 0.00 175.17 173.48 1y3i s ARG 138 N 6.70 4.35 0.24 2.11 1.81 -1.20 -4.96 118.95 128.01 1y3i s ARG 138 Ca 0.69 1.89 -0.31 0.00 -1.72 0.00 0.00 55.73 56.27 1y3i s ARG 138 Cb -0.04 -3.42 -0.11 0.00 -0.45 0.00 0.00 34.95 30.93 1y3i s ARG 138 CO 0.06 -0.42 1.65 -1.17 -0.68 0.00 0.00 175.30 174.74 1y3i s LEU 139 N 1.62 4.36 0.06 2.53 0.20 -1.26 -3.53 118.68 122.66 1y3i s LEU 139 Ca 0.61 2.87 0.04 0.00 0.69 0.00 0.00 54.13 58.35 1y3i s LEU 139 Cb -0.31 -3.61 -0.03 0.00 -0.43 0.00 0.00 46.19 41.81 1y3i s LEU 139 CO 0.28 -0.93 -0.11 0.42 -0.29 0.00 0.00 176.35 175.71 1y3i s THR 140 N 0.66 0.87 0.08 3.68 -4.23 -1.26 -4.59 115.64 110.85 1y3i s THR 140 Ca 0.69 -1.22 0.06 0.00 -1.18 0.00 0.00 61.69 60.05 1y3i s THR 140 Cb -0.48 -0.88 -0.04 0.00 1.34 0.00 0.00 72.50 72.44 1y3i s THR 140 CO 0.39 -0.30 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.33 1y3i s LEU 141 N -1.68 3.11 -0.16 4.79 1.43 -0.66 -2.48 118.68 123.03 1y3i s LEU 141 Ca -0.05 -0.31 -0.05 0.00 -1.03 0.00 0.00 54.13 52.69 1y3i s LEU 141 Cb -0.10 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 1y3i s LEU 141 CO 0.01 0.20 0.02 -0.62 0.23 0.00 0.00 176.35 176.19 1y3i s ASP 142 N -2.03 5.28 -0.06 2.29 -1.08 0.91 -1.00 116.67 120.98 1y3i s ASP 142 Ca 0.21 0.01 0.06 0.00 -0.52 0.00 0.00 52.55 52.30 1y3i s ASP 142 Cb -0.11 -1.86 -0.01 0.00 -1.46 0.00 0.00 42.92 39.48 1y3i s ASP 142 CO 0.13 0.19 -0.23 0.54 0.52 0.00 0.00 175.17 176.32 1y3i s VAL 143 N 0.25 2.22 -0.02 1.11 0.11 -0.61 -1.83 120.40 121.64 1y3i s VAL 143 Ca 0.01 -1.01 0.03 0.00 -2.93 0.00 0.00 61.98 58.08 1y3i s VAL 143 Cb -0.13 -1.81 -0.00 0.00 -1.53 0.00 0.00 36.38 32.90 1y3i s VAL 143 CO 0.01 0.57 -0.10 0.68 -3.33 0.00 0.00 175.10 172.93 1y3i s VAL 144 N -0.26 0.84 -0.13 2.04 -7.23 -0.54 0.19 120.40 115.30 1y3i s VAL 144 Ca -0.00 -0.43 -0.04 0.00 -1.81 0.00 0.00 61.98 59.70 1y3i s VAL 144 Cb -0.13 -0.72 -0.03 0.00 0.56 0.00 0.00 36.38 36.06 1y3i s VAL 144 CO 0.03 0.25 -0.01 0.54 -0.31 0.00 0.00 175.10 175.60 1y3i s VAL 145 N -0.09 4.20 -0.01 1.32 0.11 0.49 -0.88 120.40 125.53 1y3i s VAL 145 Ca 0.01 -0.27 0.02 0.00 -2.93 0.00 0.00 61.98 58.82 1y3i s VAL 145 Cb -0.06 -2.82 -0.00 0.00 -1.53 0.00 0.00 36.38 31.97 1y3i s VAL 145 CO -0.00 0.53 -0.08 0.00 -3.33 0.00 0.00 175.10 172.22 1y3i s ARG 146 N -0.13 0.74 -0.53 1.54 1.70 -1.11 0.69 118.95 121.85 1y3i s ARG 146 Ca 0.04 -0.29 -0.14 0.00 -0.47 0.00 0.00 55.73 54.87 1y3i s ARG 146 Cb -0.13 -0.71 0.13 0.00 -0.57 0.00 0.00 34.95 33.67 1y3i s ARG 146 CO 0.02 0.15 0.46 -0.65 -1.08 0.00 0.00 175.30 174.21 1y3i s GLN 147 N -0.07 2.86 -0.08 3.89 -0.21 0.49 -3.34 119.66 123.20 1y3i s GLN 147 Ca 0.01 -1.76 -0.00 0.00 0.02 0.00 0.00 55.36 53.63 1y3i s GLN 147 Cb -0.05 -4.19 0.00 0.00 1.00 0.00 0.00 33.01 29.77 1y3i s GLN 147 CO -0.00 -1.29 0.00 0.41 -2.12 0.00 0.00 175.29 172.29 1y3i n GLY 148 N 5.10 -1.19 4.33 3.09 0.00 -1.26 -2.56 105.19 112.70 1y3i n GLY 148 Ca -0.11 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1y3i n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y3i n GLY 149 N 1.19 1.01 3.43 -0.02 0.00 -1.26 -4.88 105.19 104.66 1y3i n GLY 149 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1y3i n GLY 149 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y3i s ARG 150 N 0.00 3.20 -0.32 1.61 3.52 -1.06 -5.02 118.95 120.89 1y3i s ARG 150 Ca 0.00 -1.16 -0.39 0.00 -0.13 0.00 0.00 55.73 54.05 1y3i s ARG 150 Cb 0.00 -4.39 -0.15 0.00 -1.56 0.00 0.00 34.95 28.86 1y3i s ARG 150 CO 0.00 -1.74 1.89 -0.89 -0.81 0.00 0.00 175.30 173.75 1y3i n ILE 151 N 5.73 0.26 0.53 4.11 5.41 -1.26 0.19 119.36 134.32 1y3i n ILE 151 Ca 0.01 -0.10 0.06 0.00 1.00 0.00 0.00 62.75 63.72 1y3i n ILE 151 Cb 0.45 -1.27 0.01 0.00 -0.71 0.00 0.00 39.64 38.13 1y3i n ILE 151 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 1y3i n VAL 152 N 5.40 0.00 -3.61 1.39 0.24 0.14 -4.77 118.33 117.11 1y3i n VAL 152 Ca 0.32 -0.41 -0.07 0.00 -2.04 0.00 0.00 64.34 62.15 1y3i n VAL 152 Cb 0.14 1.17 -0.05 0.00 -1.47 0.00 0.00 33.84 33.63 1y3i n VAL 152 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1y3i s ASN 153 N -1.40 -0.25 0.15 -1.34 3.04 0.22 -4.93 114.94 110.43 1y3i s ASN 153 Ca 0.11 0.33 0.08 0.00 0.04 0.00 0.00 52.86 53.42 1y3i s ASN 153 Cb 0.10 0.29 -0.04 0.00 -1.54 0.00 0.00 41.25 40.06 1y3i s ASN 153 CO 0.26 -0.18 -0.17 -0.60 -3.04 0.00 0.00 177.10 173.37 1y3i s ARG 154 N -0.72 1.19 0.12 0.43 3.52 -1.26 0.19 118.95 122.41 1y3i s ARG 154 Ca 0.03 -1.34 -0.04 0.00 -0.13 0.00 0.00 55.73 54.26 1y3i s ARG 154 Cb -0.02 -1.21 0.02 0.00 -1.56 0.00 0.00 34.95 32.18 1y3i s ARG 154 CO -0.05 0.24 0.23 0.41 -0.81 0.00 0.00 175.30 175.33 1y3i n GLY 155 N 0.42 1.92 3.60 8.12 0.00 0.50 -4.94 105.19 114.81 1y3i n GLY 155 Ca -0.14 -1.17 -0.11 0.00 0.00 0.00 0.00 46.02 44.60 1y3i n GLY 155 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1y3i s TRP 156 N -6.33 0.56 -0.28 1.61 1.48 -1.26 -1.58 118.94 113.14 1y3i s TRP 156 Ca 0.06 -0.93 -0.26 0.00 -1.06 0.00 0.00 56.10 53.91 1y3i s TRP 156 Cb -0.01 0.22 0.17 0.00 -1.16 0.00 0.00 33.47 32.68 1y3i s TRP 156 CO 0.04 -1.15 1.28 0.00 -4.06 0.00 0.00 176.95 173.06 1y3i s ALA 157 N -3.37 -2.11 -0.03 2.67 0.00 -0.17 -4.82 121.76 113.93 1y3i s ALA 157 Ca 0.24 1.75 -0.21 0.00 0.00 0.00 0.00 51.96 53.74 1y3i s ALA 157 Cb -0.01 -1.55 -0.28 0.00 0.00 0.00 0.00 23.12 21.27 1y3i s ALA 157 CO 0.13 -0.18 0.98 1.25 0.00 0.00 0.00 175.76 177.95 1y3i h LEU 158 N 3.23 0.48 0.00 0.00 5.85 -1.91 -1.75 115.31 121.21 1y3i h LEU 158 Ca -0.24 -0.87 0.00 0.00 0.84 0.00 0.00 57.88 57.61 1y3i h LEU 158 Cb 1.19 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.06 1y3i h LEU 158 CO 0.18 1.31 0.00 0.59 -0.34 0.00 0.00 178.44 180.17 1y3i n ASN 159 N -4.18 0.00 -3.62 1.25 4.13 -1.26 -4.39 115.26 107.19 1y3i n ASN 159 Ca -0.12 0.46 -0.01 0.00 1.68 0.00 0.00 54.58 56.59 1y3i n ASN 159 Cb 0.75 -0.33 0.00 0.00 -1.54 0.00 0.00 39.78 38.66 1y3i n ASN 159 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 1y3i s GLU 160 N -1.10 0.88 -0.39 3.52 1.03 -1.26 -2.11 118.70 119.26 1y3i s GLU 160 Ca 0.00 -0.52 -0.07 0.00 0.03 0.00 0.00 54.97 54.41 1y3i s GLU 160 Cb 0.00 0.27 0.07 0.00 -0.80 0.00 0.00 34.13 33.68 1y3i s GLU 160 CO 0.00 -0.41 0.20 0.08 -1.33 0.00 0.00 175.26 173.81 1y3i s VAL 161 N -2.57 3.89 -0.43 1.83 1.01 -1.11 -2.79 120.40 120.23 1y3i s VAL 161 Ca 0.18 -1.47 -0.19 0.00 0.00 0.00 0.00 61.98 60.50 1y3i s VAL 161 Cb 0.00 -3.39 0.02 0.00 0.00 0.00 0.00 36.38 33.02 1y3i s VAL 161 CO 0.01 -0.45 0.55 -0.55 0.00 0.00 0.00 175.10 174.66 1y3i s SER 162 N 1.88 6.26 0.06 3.32 0.15 0.39 -3.25 113.70 122.51 1y3i s SER 162 Ca 0.02 -0.50 -0.28 0.00 0.70 0.00 0.00 55.95 55.89 1y3i s SER 162 Cb -0.22 -2.28 -0.05 0.00 -1.71 0.00 0.00 66.02 61.76 1y3i s SER 162 CO 0.01 -0.69 0.89 -0.22 1.20 0.00 0.00 173.24 174.43 1y3i s LEU 163 N 2.51 4.44 -0.09 3.45 0.20 0.14 -2.65 118.68 126.68 1y3i s LEU 163 Ca 0.18 1.62 -0.14 0.00 0.69 0.00 0.00 54.13 56.48 1y3i s LEU 163 Cb -0.15 -3.45 0.03 0.00 -0.43 0.00 0.00 46.19 42.19 1y3i s LEU 163 CO 0.16 -0.09 0.37 -1.61 -0.29 0.00 0.00 176.35 174.89 1y3i s GLU 164 N 0.26 0.55 0.55 1.98 2.02 -0.81 0.03 118.70 123.29 1y3i s GLU 164 Ca 0.45 0.26 -0.11 0.00 0.02 0.00 0.00 54.97 55.59 1y3i s GLU 164 Cb -0.22 0.26 -0.05 0.00 0.10 0.00 0.00 34.13 34.22 1y3i s GLU 164 CO 0.27 -0.11 0.95 -1.59 0.02 0.00 0.00 175.26 174.80 1y3i s LYS 165 N -0.40 3.67 1.16 1.61 -2.85 0.81 -0.57 119.74 123.17 1y3i s LYS 165 Ca -0.05 0.65 -0.17 0.00 -1.00 0.00 0.00 55.97 55.40 1y3i s LYS 165 Cb -0.03 -2.18 0.18 0.00 -2.06 0.00 0.00 37.83 33.74 1y3i s LYS 165 CO 0.02 -0.40 0.34 0.41 0.10 0.00 0.00 175.35 175.82 1y3i n GLY 166 N -2.32 -2.53 0.13 0.59 0.00 -1.26 -4.88 105.19 94.93 1y3i n GLY 166 Ca 0.05 -0.97 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 1y3i n GLY 166 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1y3i n PRO 167 N -3.07 0.70 -0.72 1.61 -0.04 -1.26 -3.93 135.00 128.30 1y3i n PRO 167 Ca 0.02 0.23 -0.07 0.00 -0.04 0.00 0.00 63.50 63.64 1y3i n PRO 167 Cb 0.58 -1.63 0.18 0.00 -0.04 0.00 0.00 33.50 32.59 1y3i n PRO 167 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1y3i n ARG 168 N -3.47 2.56 -3.84 0.54 1.74 -1.26 -4.86 116.66 108.06 1y3i n ARG 168 Ca -0.38 -2.02 -0.25 0.00 -0.77 0.00 0.00 57.85 54.43 1y3i n ARG 168 Cb 1.00 -1.87 -0.02 0.00 -1.02 0.00 0.00 32.46 30.55 1y3i n ARG 168 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1y3i n LEU 169 N -0.17 0.00 0.00 0.55 4.32 -1.25 -5.17 117.00 115.28 1y3i n LEU 169 Ca 0.31 -2.59 -0.17 0.00 -0.02 0.00 0.00 56.01 53.54 1y3i n LEU 169 Cb 1.11 0.10 -0.01 0.00 -1.62 0.00 0.00 43.42 43.00 1y3i n LEU 169 CO 0.32 -0.48 -0.01 0.61 -1.22 0.00 0.00 177.39 176.61 1y3i n GLY 170 N -0.53 3.12 3.47 -0.72 0.00 -1.26 -4.97 105.19 104.28 1y3i n GLY 170 Ca -0.08 -2.26 -0.51 0.00 0.00 0.00 0.00 46.02 43.16 1y3i n GLY 170 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1y3i n VAL 171 N -1.14 1.21 -4.29 1.61 3.14 -1.26 -4.87 118.33 112.72 1y3i n VAL 171 Ca -0.04 -0.30 -0.34 0.00 -2.96 0.00 0.00 64.34 60.69 1y3i n VAL 171 Cb 0.38 -0.17 -0.13 0.00 -1.06 0.00 0.00 33.84 32.86 1y3i n VAL 171 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1y3i s LEU 172 N 1.58 3.18 0.12 6.55 2.96 -0.85 -4.75 118.68 127.48 1y3i s LEU 172 Ca 0.74 -0.19 -0.30 0.00 -0.22 0.00 0.00 54.13 54.16 1y3i s LEU 172 Cb -1.01 -1.78 -0.06 0.00 0.50 0.00 0.00 46.19 43.83 1y3i s LEU 172 CO 0.56 0.12 1.07 -0.83 -1.32 0.00 0.00 176.35 175.95 1y3i s GLY 173 N 0.64 2.82 -0.23 7.98 0.00 -1.26 0.02 107.32 117.29 1y3i s GLY 173 Ca -0.02 0.73 -0.25 0.00 0.00 0.00 0.00 44.72 45.18 1y3i s GLY 173 CO 0.02 1.67 0.69 0.14 0.00 0.00 0.00 173.10 175.62 1y3i s VAL 174 N 0.15 0.00 -0.13 1.40 1.01 -0.71 -3.14 120.40 118.98 1y3i s VAL 174 Ca 0.50 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.50 1y3i s VAL 174 Cb -0.27 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1y3i s VAL 174 CO 0.32 -0.00 -0.18 -0.69 0.00 0.00 0.00 175.10 174.54 1y3i s VAL 175 N 0.16 1.77 -0.31 2.92 1.01 -0.11 -1.83 120.40 124.01 1y3i s VAL 175 Ca -0.01 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 1y3i s VAL 175 Cb -0.04 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 1y3i s VAL 175 CO 0.02 0.49 0.29 -0.69 0.00 0.00 0.00 175.10 175.21 1y3i s VAL 176 N 0.95 5.24 -0.12 2.92 1.01 0.27 0.12 120.40 130.78 1y3i s VAL 176 Ca -0.06 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1y3i s VAL 176 Cb -0.15 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 1y3i s VAL 176 CO -0.03 0.06 -0.15 -1.61 0.00 0.00 0.00 175.10 173.38 1y3i s GLU 177 N 1.88 3.25 -0.12 2.72 2.02 0.31 0.11 118.70 128.87 1y3i s GLU 177 Ca 0.10 -0.71 0.01 0.00 0.02 0.00 0.00 54.97 54.38 1y3i s GLU 177 Cb -0.16 -2.56 -0.01 0.00 0.10 0.00 0.00 34.13 31.49 1y3i s GLU 177 CO 0.11 0.25 -0.15 0.42 0.02 0.00 0.00 175.26 175.90 1y3i s ILE 178 N 0.24 2.83 -1.48 -1.63 1.01 0.68 0.11 121.20 122.96 1y3i s ILE 178 Ca -0.10 -0.74 -0.04 0.00 0.00 0.00 0.00 60.65 59.77 1y3i s ILE 178 Cb -0.16 -2.17 0.03 0.00 0.01 0.00 0.00 42.46 40.18 1y3i s ILE 178 CO 0.06 0.53 0.47 0.47 0.00 0.00 0.00 174.94 176.47 1y3i n ASP 179 N 3.53 -0.91 0.00 3.58 8.00 0.42 -1.08 116.55 130.10 1y3i n ASP 179 Ca -0.18 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.29 1y3i n ASP 179 Cb 0.53 -2.89 0.00 0.00 -0.02 0.00 0.00 41.12 38.73 1y3i n ASP 179 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1y3i n GLY 180 N -1.91 0.50 3.42 0.44 0.00 -1.26 -5.00 105.19 101.39 1y3i n GLY 180 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 1y3i n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y3i s ARG 181 N -0.46 3.52 -0.41 1.61 1.81 -0.24 -5.06 118.95 119.72 1y3i s ARG 181 Ca 0.00 -0.60 -0.29 0.00 -1.72 0.00 0.00 55.73 53.12 1y3i s ARG 181 Cb 0.00 -2.83 0.01 0.00 -0.45 0.00 0.00 34.95 31.68 1y3i s ARG 181 CO 0.00 0.16 1.41 -1.25 -0.68 0.00 0.00 175.30 174.94 1y3i s PRO 182 N 0.55 3.57 0.21 3.54 0.04 -1.26 -0.23 135.00 141.42 1y3i s PRO 182 Ca -0.05 0.93 0.19 0.00 0.04 0.00 0.00 61.00 62.11 1y3i s PRO 182 Cb -0.15 -4.03 0.03 0.00 0.04 0.00 0.00 34.50 30.39 1y3i s PRO 182 CO 0.03 -1.57 1.16 -0.24 0.04 0.00 0.00 177.00 176.42 1y3i h VAL 183 N 6.47 0.37 -1.68 -0.36 3.04 0.48 -3.46 116.25 121.10 1y3i h VAL 183 Ca -0.28 -1.62 0.04 0.00 -1.01 0.00 0.00 66.70 63.84 1y3i h VAL 183 Cb 1.11 1.98 -0.25 0.00 -2.01 0.00 0.00 31.29 32.11 1y3i h VAL 183 CO 1.09 0.21 0.38 -0.94 -1.01 0.00 0.00 177.57 177.30 1y3i s SER 184 N -5.90 -0.52 0.00 3.17 1.04 0.21 -5.01 113.70 106.69 1y3i s SER 184 Ca 0.01 0.99 0.05 0.00 0.48 0.00 0.00 55.95 57.49 1y3i s SER 184 Cb 0.08 1.02 -0.01 0.00 0.10 0.00 0.00 66.02 67.21 1y3i s SER 184 CO 0.77 -0.17 -0.16 0.00 0.98 0.00 0.00 173.24 174.65 1y3i s ALA 185 N 0.33 1.36 0.10 5.32 0.00 -1.26 0.93 121.76 128.55 1y3i s ALA 185 Ca 0.02 -0.75 -0.26 0.00 0.00 0.00 0.00 51.96 50.96 1y3i s ALA 185 Cb -0.05 -0.32 0.09 0.00 0.00 0.00 0.00 23.12 22.83 1y3i s ALA 185 CO -0.05 0.32 1.09 -0.59 0.00 0.00 0.00 175.76 176.53 1y3i s PHE 186 N -0.48 -0.06 0.02 0.00 -0.12 -0.76 -4.98 117.98 111.60 1y3i s PHE 186 Ca 0.06 -0.19 -0.21 0.00 -0.05 0.00 0.00 56.93 56.54 1y3i s PHE 186 Cb -0.07 0.62 -0.06 0.00 -0.63 0.00 0.00 43.02 42.88 1y3i s PHE 186 CO -0.00 -0.64 0.62 0.20 -0.05 0.00 0.00 175.22 175.34 1y3i s GLY 187 N -3.08 2.65 0.10 1.99 0.00 -1.26 -1.74 107.32 105.99 1y3i s GLY 187 Ca 0.15 0.07 -0.26 0.00 0.00 0.00 0.00 44.72 44.69 1y3i s GLY 187 CO 0.01 0.74 0.92 0.00 0.00 0.00 0.00 173.10 174.77 1y3i h ASP 189 N 2.00 0.41 -0.29 0.00 3.45 0.11 -2.26 116.42 119.83 1y3i h ASP 189 Ca -0.24 -0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.12 1y3i h ASP 189 Cb 1.24 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 39.90 1y3i h ASP 189 CO 0.28 0.57 0.00 0.61 -1.57 0.00 0.00 179.24 179.13 1y3i n GLY 190 N -0.68 -1.68 3.12 2.75 0.00 -0.81 -0.13 105.19 107.75 1y3i n GLY 190 Ca 0.00 -1.31 -0.26 0.00 0.00 0.00 0.00 46.02 44.45 1y3i n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y3i s VAL 191 N -2.60 1.42 -0.27 1.61 1.01 0.10 0.19 120.40 121.85 1y3i s VAL 191 Ca 0.00 -0.70 -0.07 0.00 0.00 0.00 0.00 61.98 61.21 1y3i s VAL 191 Cb 0.00 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 1y3i s VAL 191 CO 0.00 0.41 0.06 -0.76 0.00 0.00 0.00 175.10 174.81 1y3i s LEU 192 N 0.12 3.57 -0.31 3.92 1.43 0.10 0.26 118.68 127.77 1y3i s LEU 192 Ca -0.06 -0.47 -0.05 0.00 -1.03 0.00 0.00 54.13 52.52 1y3i s LEU 192 Cb -0.12 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.25 1y3i s LEU 192 CO 0.03 -0.11 0.06 -0.69 0.23 0.00 0.00 176.35 175.86 1y3i s VAL 193 N 1.54 3.54 0.10 -1.59 1.01 -1.20 0.56 120.40 124.36 1y3i s VAL 193 Ca 0.05 -1.07 0.07 0.00 0.00 0.00 0.00 61.98 61.03 1y3i s VAL 193 Cb -0.16 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 1y3i s VAL 193 CO 0.02 -0.06 -0.19 -0.55 0.00 0.00 0.00 175.10 174.32 1y3i s SER 194 N 1.38 2.31 0.59 3.32 0.15 0.15 -2.77 113.70 118.84 1y3i s SER 194 Ca -0.01 -0.67 -0.16 0.00 0.70 0.00 0.00 55.95 55.80 1y3i s SER 194 Cb -0.19 -0.11 -0.04 0.00 -1.71 0.00 0.00 66.02 63.97 1y3i s SER 194 CO 0.01 0.02 1.07 0.42 1.20 0.00 0.00 173.24 175.96 1y3i s THR 195 N -1.23 3.62 0.35 6.45 -4.23 -0.90 -0.83 115.64 118.88 1y3i s THR 195 Ca 0.04 0.81 0.10 0.00 -1.18 0.00 0.00 61.69 61.47 1y3i s THR 195 Cb -0.10 -3.32 0.33 0.00 1.34 0.00 0.00 72.50 70.75 1y3i s THR 195 CO 0.04 -0.41 1.83 -0.65 -0.54 0.00 0.00 174.62 174.88 1y3i h PRO 196 N 0.54 0.64 -0.61 3.99 0.11 -1.86 0.59 132.00 135.40 1y3i h PRO 196 Ca -0.47 -0.04 0.15 0.00 0.11 0.00 0.00 66.00 65.75 1y3i h PRO 196 Cb 1.23 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 1y3i h PRO 196 CO 0.57 0.42 0.43 1.79 -0.21 0.00 0.00 178.00 181.00 1y3i h THR 197 N 0.65 0.75 -0.17 -1.15 1.35 -1.81 -0.46 112.91 112.08 1y3i h THR 197 Ca 0.51 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 66.32 1y3i h THR 197 Cb 0.91 0.60 0.00 0.00 -1.73 0.00 0.00 68.15 67.93 1y3i h THR 197 CO -0.26 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.64 1y3i n GLY 198 N -1.60 4.16 0.32 5.82 0.00 0.05 -4.74 105.19 109.20 1y3i n GLY 198 Ca 0.11 -0.96 0.17 0.00 0.00 0.00 0.00 46.02 45.34 1y3i n GLY 198 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1y3i h SER 199 N 1.13 0.00 -0.77 1.61 4.64 0.47 -2.30 113.55 118.34 1y3i h SER 199 Ca 0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.01 1y3i h SER 199 Cb 1.19 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.10 1y3i h SER 199 CO 0.12 0.00 0.39 0.35 -0.87 0.00 0.00 176.83 176.82 1y3i n THR 200 N -3.80 2.82 0.00 2.95 -2.24 -1.26 -3.10 114.28 109.65 1y3i n THR 200 Ca 0.00 -1.57 0.00 0.00 -2.27 0.00 0.00 64.05 60.22 1y3i n THR 200 Cb 0.25 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.03 1y3i n THR 200 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y3i n ALA 201 N -0.46 0.00 -0.20 6.98 0.00 -0.86 -4.73 120.51 121.24 1y3i n ALA 201 Ca 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.88 1y3i n ALA 201 Cb 1.41 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.93 1y3i n ALA 201 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1y3i h TYR 202 N 0.00 -0.21 -0.94 0.00 -0.00 -1.89 1.63 116.97 115.56 1y3i h TYR 202 Ca 0.00 0.05 0.14 0.00 -0.00 0.00 0.00 58.73 58.92 1y3i h TYR 202 Cb 0.00 0.19 -0.08 0.00 -0.00 0.00 0.00 36.73 36.84 1y3i h TYR 202 CO 0.00 -0.23 0.60 0.00 -0.00 0.00 0.00 178.16 178.53 1y3i h ALA 203 N 1.59 1.72 -0.15 1.82 0.00 -1.84 1.39 119.26 123.79 1y3i h ALA 203 Ca 0.30 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1y3i h ALA 203 Cb 0.48 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1y3i h ALA 203 CO -0.59 0.03 0.08 0.35 0.00 0.00 0.00 179.25 179.12 1y3i h PHE 204 N 0.80 0.21 -0.85 0.00 3.57 0.21 0.76 116.94 121.64 1y3i h PHE 204 Ca 0.47 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.16 1y3i h PHE 204 Cb 0.65 -0.07 -0.12 0.00 2.79 0.00 0.00 35.95 39.21 1y3i h PHE 204 CO -0.00 0.23 0.34 0.77 -2.23 0.00 0.00 178.31 177.42 1y3i h SER 205 N 0.14 0.27 -0.16 0.41 0.02 0.38 -1.53 113.55 113.06 1y3i h SER 205 Ca 0.05 0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1y3i h SER 205 Cb 0.09 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 1y3i h SER 205 CO -0.01 0.02 0.02 0.00 -1.14 0.00 0.00 176.83 175.72 1y3i n ALA 206 N -2.54 2.92 0.00 3.77 0.00 0.44 -4.78 120.51 120.33 1y3i n ALA 206 Ca 0.19 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1y3i n ALA 206 Cb 0.57 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.98 1y3i n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y3i n GLY 207 N 0.16 0.28 3.38 0.00 0.00 -0.58 -4.89 105.19 103.55 1y3i n GLY 207 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1y3i n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y3i n GLY 208 N -1.95 -2.11 3.89 -0.02 0.00 0.26 -4.98 105.19 100.28 1y3i n GLY 208 Ca 0.00 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 1y3i n GLY 208 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y3i s PRO 209 N -2.26 3.57 -0.09 1.61 0.04 -1.26 -4.64 135.00 131.97 1y3i s PRO 209 Ca 0.62 0.48 -0.28 0.00 0.04 0.00 0.00 61.00 61.86 1y3i s PRO 209 Cb -0.38 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 1y3i s PRO 209 CO 0.61 -0.39 0.92 0.08 0.04 0.00 0.00 177.00 178.26 1y3i s VAL 210 N -2.97 4.87 -0.14 -0.36 1.01 -1.26 -4.70 120.40 116.84 1y3i s VAL 210 Ca 0.51 1.87 -0.05 0.00 0.00 0.00 0.00 61.98 64.31 1y3i s VAL 210 Cb -0.11 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 1y3i s VAL 210 CO 0.50 0.09 0.04 -0.76 0.00 0.00 0.00 175.10 174.97 1y3i s LEU 211 N 1.60 3.76 -0.03 3.92 1.43 -1.26 -5.04 118.68 123.06 1y3i s LEU 211 Ca 0.46 0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 53.38 1y3i s LEU 211 Cb -0.19 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 1y3i s LEU 211 CO 0.19 0.26 1.37 0.26 0.23 0.00 0.00 176.35 178.67 1y3i s TRP 212 N -0.18 2.86 0.50 0.29 0.23 -1.26 -4.62 118.94 116.75 1y3i s TRP 212 Ca 0.07 0.87 0.33 0.00 -2.03 0.00 0.00 56.10 55.34 1y3i s TRP 212 Cb -0.12 -3.62 1.46 0.00 0.03 0.00 0.00 33.47 31.22 1y3i s TRP 212 CO 0.02 -2.27 1.75 -1.00 0.96 0.00 0.00 176.95 176.41 1y3i h PRO 213 N 7.90 0.09 -0.00 4.98 0.13 -1.92 0.86 132.00 144.04 1y3i h PRO 213 Ca -0.36 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1y3i h PRO 213 Cb 1.17 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1y3i h PRO 213 CO 0.91 0.06 -0.07 -0.40 -0.23 0.00 0.00 178.00 178.27 1y3i n ASP 214 N -4.31 0.11 -4.44 1.44 5.68 -1.26 -4.20 116.55 109.58 1y3i n ASP 214 Ca 0.29 0.14 -0.31 0.00 -0.50 0.00 0.00 54.79 54.41 1y3i n ASP 214 Cb 1.27 -0.31 0.20 0.00 -1.14 0.00 0.00 41.12 41.14 1y3i n ASP 214 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1y3i n LEU 215 N -1.39 -0.75 -4.00 -2.12 4.32 0.29 -4.99 117.00 108.35 1y3i n LEU 215 Ca 0.09 0.02 -0.31 0.00 -0.02 0.00 0.00 56.01 55.79 1y3i n LEU 215 Cb 0.31 -1.20 -0.15 0.00 -1.62 0.00 0.00 43.42 40.76 1y3i n LEU 215 CO 0.27 -3.11 -0.38 -0.70 -1.22 0.00 0.00 177.39 172.25 1y3i s GLU 216 N -4.04 1.66 -0.02 3.23 2.56 -1.26 -4.64 118.70 116.19 1y3i s GLU 216 Ca 0.63 -1.57 -0.30 0.00 0.00 0.00 0.00 54.97 53.73 1y3i s GLU 216 Cb -0.20 -2.96 0.11 0.00 2.00 0.00 0.00 34.13 33.07 1y3i s GLU 216 CO 0.65 -0.80 1.04 0.00 -0.56 0.00 0.00 175.26 175.59 1y3i s ALA 217 N 1.07 -1.91 -0.07 6.30 0.00 -1.26 -3.79 121.76 122.10 1y3i s ALA 217 Ca 0.03 0.94 0.04 0.00 0.00 0.00 0.00 51.96 52.97 1y3i s ALA 217 Cb -0.19 0.32 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 1y3i s ALA 217 CO -0.08 -0.79 -0.19 0.42 0.00 0.00 0.00 175.76 175.12 1y3i s ILE 218 N -2.88 2.57 -0.20 0.00 1.01 0.15 -4.33 121.20 117.52 1y3i s ILE 218 Ca 0.09 -0.88 -0.15 0.00 0.00 0.00 0.00 60.65 59.71 1y3i s ILE 218 Cb -0.00 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 1y3i s ILE 218 CO -0.05 0.57 0.36 -0.22 0.00 0.00 0.00 174.94 175.60 1y3i s LEU 219 N -0.26 4.16 -0.28 2.97 0.20 -0.01 -1.46 118.68 124.00 1y3i s LEU 219 Ca 0.00 0.47 0.01 0.00 0.69 0.00 0.00 54.13 55.30 1y3i s LEU 219 Cb -0.13 -2.46 0.05 0.00 -0.43 0.00 0.00 46.19 43.23 1y3i s LEU 219 CO 0.03 -0.05 -0.06 -0.69 -0.29 0.00 0.00 176.35 175.29 1y3i s VAL 220 N 1.21 2.56 -0.15 1.68 1.01 -0.23 0.35 120.40 126.83 1y3i s VAL 220 Ca 0.18 -1.51 -0.01 0.00 0.00 0.00 0.00 61.98 60.63 1y3i s VAL 220 Cb -0.14 -2.49 0.04 0.00 0.00 0.00 0.00 36.38 33.79 1y3i s VAL 220 CO 0.07 -0.06 -0.02 -0.69 0.00 0.00 0.00 175.10 174.40 1y3i s VAL 221 N 1.18 0.80 0.66 2.92 1.01 0.19 -2.23 120.40 124.92 1y3i s VAL 221 Ca -0.07 -0.44 -0.17 0.00 0.00 0.00 0.00 61.98 61.31 1y3i s VAL 221 Cb -0.20 -1.05 -0.00 0.00 0.00 0.00 0.00 36.38 35.13 1y3i s VAL 221 CO -0.03 0.08 1.18 -2.16 0.00 0.00 0.00 175.10 174.16 1y3i s PRO 222 N 1.77 2.64 -0.38 2.72 0.04 -1.26 0.00 135.00 140.53 1y3i s PRO 222 Ca 0.01 1.69 -0.09 0.00 0.04 0.00 0.00 61.00 62.65 1y3i s PRO 222 Cb -0.15 -1.90 0.05 0.00 0.04 0.00 0.00 34.50 32.54 1y3i s PRO 222 CO -0.07 -1.43 0.19 1.21 0.04 0.00 0.00 177.00 176.94 1y3i s ASN 223 N -1.99 5.58 -0.42 6.66 3.04 0.49 -4.74 114.94 123.56 1y3i s ASN 223 Ca 0.74 -1.21 -0.37 0.00 0.04 0.00 0.00 52.86 52.06 1y3i s ASN 223 Cb -0.27 -1.96 0.06 0.00 -1.54 0.00 0.00 41.25 37.53 1y3i s ASN 223 CO 0.39 -0.42 0.62 0.59 -3.04 0.00 0.00 177.10 175.24 1y3i n ASN 224 N 4.91 -5.16 -4.63 -4.21 3.02 -1.26 0.80 115.26 108.74 1y3i n ASN 224 Ca -0.11 -0.15 -0.39 0.00 -0.03 0.00 0.00 54.58 53.90 1y3i n ASN 224 Cb 0.45 -1.50 -0.08 0.00 -0.61 0.00 0.00 39.78 38.03 1y3i n ASN 224 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y3i s ALA 225 N -1.36 3.57 -1.17 5.41 0.00 -1.26 -1.93 121.76 125.02 1y3i s ALA 225 Ca 0.36 -0.69 -0.19 0.00 0.00 0.00 0.00 51.96 51.44 1y3i s ALA 225 Cb -0.04 -2.71 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 1y3i s ALA 225 CO 0.82 -0.55 1.98 1.58 0.00 0.00 0.00 175.76 179.58 1y3i n HIS 226 N 5.07 3.14 -3.76 0.00 -0.00 0.93 -4.82 115.22 115.79 1y3i n HIS 226 Ca -0.08 -2.31 -0.12 0.00 0.46 0.00 0.00 57.72 55.68 1y3i n HIS 226 Cb 0.51 -2.34 -0.07 0.00 -0.12 0.00 0.00 29.99 27.97 1y3i n HIS 226 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1y3i s ALA 227 N 5.48 -0.68 0.32 1.57 0.00 -1.26 -4.38 121.76 122.81 1y3i s ALA 227 Ca 0.56 0.01 0.10 0.00 0.00 0.00 0.00 51.96 52.63 1y3i s ALA 227 Cb 0.09 0.31 0.53 0.00 0.00 0.00 0.00 23.12 24.05 1y3i s ALA 227 CO 0.05 -0.41 1.73 -0.07 0.00 0.00 0.00 175.76 177.06 1y3i h LEU 228 N 3.25 0.09 -7.49 0.00 -0.00 -1.96 -3.42 115.31 105.78 1y3i h LEU 228 Ca -0.32 -0.04 -0.49 0.00 -0.00 0.00 0.00 57.88 57.03 1y3i h LEU 228 Cb 1.20 -0.03 -0.38 0.00 -0.00 0.00 0.00 40.66 41.45 1y3i h LEU 228 CO 0.46 0.53 -0.78 0.12 -0.00 0.00 0.00 178.44 178.77 1y3i s PHE 229 N -4.02 1.09 0.00 1.13 5.36 -1.26 -4.95 117.98 115.33 1y3i s PHE 229 Ca -0.03 -0.61 0.08 0.00 -0.96 0.00 0.00 56.93 55.41 1y3i s PHE 229 Cb 0.14 -1.03 0.13 0.00 -0.34 0.00 0.00 43.02 41.92 1y3i s PHE 229 CO 0.75 -0.48 1.03 0.41 -1.46 0.00 0.00 175.22 175.46 1y3i n GLY 230 N 5.04 0.67 3.65 13.12 0.00 -1.26 -4.98 105.19 121.42 1y3i n GLY 230 Ca -0.09 -0.25 -0.46 0.00 0.00 0.00 0.00 46.02 45.21 1y3i n GLY 230 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1y3i n ARG 231 N 0.15 1.81 -1.76 1.61 3.00 -1.26 -4.61 116.66 115.60 1y3i n ARG 231 Ca 0.01 0.65 -0.40 0.00 -0.00 0.00 0.00 57.85 58.11 1y3i n ARG 231 Cb 0.82 -2.28 0.02 0.00 0.00 0.00 0.00 32.46 31.03 1y3i n ARG 231 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1y3i n PRO 232 N 2.13 2.15 -4.75 -0.14 -0.02 -1.26 -4.95 135.00 128.16 1y3i n PRO 232 Ca 0.13 0.77 -0.33 0.00 -2.02 0.00 0.00 63.50 62.05 1y3i n PRO 232 Cb 0.29 -2.61 -0.16 0.00 -0.02 0.00 0.00 33.50 31.00 1y3i n PRO 232 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1y3i s MET 233 N -2.51 3.15 -0.35 -0.52 -1.94 -0.95 -5.00 119.30 111.18 1y3i s MET 233 Ca 0.63 -0.80 -0.06 0.00 -1.71 0.00 0.00 55.69 53.75 1y3i s MET 233 Cb -0.45 -2.50 0.05 0.00 2.01 0.00 0.00 34.83 33.94 1y3i s MET 233 CO 0.56 0.07 0.13 0.08 -0.01 0.00 0.00 175.02 175.85 1y3i s VAL 234 N 0.65 3.76 0.43 -6.03 1.01 -1.26 -1.07 120.40 117.89 1y3i s VAL 234 Ca -0.09 -1.25 0.05 0.00 0.00 0.00 0.00 61.98 60.68 1y3i s VAL 234 Cb -0.16 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.04 1y3i s VAL 234 CO 0.02 -0.26 0.61 0.42 0.00 0.00 0.00 175.10 175.89 1y3i s THR 235 N 1.38 3.38 0.51 3.92 -4.23 -0.54 -4.89 115.64 115.17 1y3i s THR 235 Ca -0.01 -0.84 -0.22 0.00 -1.18 0.00 0.00 61.69 59.45 1y3i s THR 235 Cb -0.20 -3.19 -0.06 0.00 1.34 0.00 0.00 72.50 70.39 1y3i s THR 235 CO 0.02 -0.10 1.25 -0.94 -0.54 0.00 0.00 174.62 174.31 1y3i s SER 236 N -4.30 5.70 0.61 3.99 1.04 -1.26 -0.68 113.70 118.80 1y3i s SER 236 Ca 0.52 2.51 0.27 0.00 0.48 0.00 0.00 55.95 59.72 1y3i s SER 236 Cb -0.10 -2.62 1.28 0.00 0.10 0.00 0.00 66.02 64.69 1y3i s SER 236 CO 0.35 -1.26 1.70 -0.65 0.98 0.00 0.00 173.24 174.36 1y3i h PRO 237 N 1.69 0.00 -0.64 4.02 0.10 -1.85 -2.32 132.00 132.99 1y3i h PRO 237 Ca -0.50 0.00 -0.04 0.00 0.10 0.00 0.00 66.00 65.55 1y3i h PRO 237 Cb 1.27 0.00 -0.03 0.00 0.10 0.00 0.00 31.00 32.35 1y3i h PRO 237 CO 0.58 0.00 0.06 -0.85 0.10 0.00 0.00 178.00 177.89 1y3i n GLU 238 N -3.40 4.52 -2.90 1.05 0.28 -1.26 -4.47 120.64 114.47 1y3i n GLU 238 Ca 0.10 -3.01 -0.19 0.00 -0.16 0.00 0.00 57.16 53.91 1y3i n GLU 238 Cb 0.86 -2.23 0.03 0.00 1.43 0.00 0.00 31.44 31.52 1y3i n GLU 238 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1y3i s ALA 239 N -2.73 4.36 -0.42 -1.84 0.00 -0.87 -5.03 121.76 115.22 1y3i s ALA 239 Ca 0.52 -1.64 -0.08 0.00 0.00 0.00 0.00 51.96 50.77 1y3i s ALA 239 Cb 0.40 -1.74 0.09 0.00 0.00 0.00 0.00 23.12 21.88 1y3i s ALA 239 CO 0.15 -0.52 0.25 0.99 0.00 0.00 0.00 175.76 176.63 1y3i s THR 240 N -2.53 3.97 -0.12 0.00 2.01 -1.26 -4.67 115.64 113.05 1y3i s THR 240 Ca 0.57 -1.60 -0.20 0.00 0.31 0.00 0.00 61.69 60.77 1y3i s THR 240 Cb -0.09 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 1y3i s THR 240 CO 0.36 -0.57 0.55 -0.63 -0.69 0.00 0.00 174.62 173.63 1y3i s ILE 241 N 1.35 5.14 -0.07 1.82 1.09 -0.68 -0.43 121.20 129.41 1y3i s ILE 241 Ca 0.04 1.09 0.01 0.00 -1.10 0.00 0.00 60.65 60.68 1y3i s ILE 241 Cb -0.23 -3.88 0.02 0.00 -1.06 0.00 0.00 42.46 37.31 1y3i s ILE 241 CO 0.00 0.28 -0.06 0.00 -0.10 0.00 0.00 174.94 175.06 1y3i s ALA 242 N 0.86 0.99 -0.33 9.38 0.00 0.12 0.50 121.76 133.27 1y3i s ALA 242 Ca 0.29 -0.28 -0.10 0.00 0.00 0.00 0.00 51.96 51.87 1y3i s ALA 242 Cb -0.16 -0.63 0.00 0.00 0.00 0.00 0.00 23.12 22.33 1y3i s ALA 242 CO 0.12 -0.16 0.17 0.42 0.00 0.00 0.00 175.76 176.31 1y3i s ILE 243 N 1.22 4.60 -0.29 0.00 1.09 -0.97 -0.53 121.20 126.32 1y3i s ILE 243 Ca -0.05 -0.53 -0.16 0.00 -1.10 0.00 0.00 60.65 58.80 1y3i s ILE 243 Cb -0.14 -3.40 -0.02 0.00 -1.06 0.00 0.00 42.46 37.83 1y3i s ILE 243 CO -0.02 -0.01 0.44 -0.70 -0.10 0.00 0.00 174.94 174.55 1y3i s GLU 244 N 1.60 3.90 -0.17 2.79 2.56 0.32 0.75 118.70 130.45 1y3i s GLU 244 Ca 0.04 0.03 -0.28 0.00 0.00 0.00 0.00 54.97 54.76 1y3i s GLU 244 Cb -0.18 -3.70 -0.00 0.00 2.00 0.00 0.00 34.13 32.25 1y3i s GLU 244 CO 0.06 -0.40 0.98 0.42 -0.56 0.00 0.00 175.26 175.76 1y3i s ILE 245 N 2.20 4.77 0.39 -3.70 -1.09 -1.18 -0.94 121.20 121.65 1y3i s ILE 245 Ca 0.17 1.94 -0.28 0.00 -2.23 0.00 0.00 60.65 60.26 1y3i s ILE 245 Cb -0.16 -4.27 -0.11 0.00 -1.58 0.00 0.00 42.46 36.35 1y3i s ILE 245 CO 0.11 -0.06 1.49 -1.83 -1.23 0.00 0.00 174.94 173.41 1y3i s GLU 246 N 2.52 4.03 0.06 2.79 -1.05 -1.19 -0.98 118.70 124.88 1y3i s GLU 246 Ca 0.44 2.57 -0.27 0.00 -0.15 0.00 0.00 54.97 57.56 1y3i s GLU 246 Cb -0.17 -2.92 -0.17 0.00 -0.44 0.00 0.00 34.13 30.43 1y3i s GLU 246 CO 0.12 -0.59 1.54 0.00 0.95 0.00 0.00 175.26 177.28 1y3i h ALA 247 N 2.88 -0.44 0.00 -0.84 0.00 -1.89 -2.41 119.26 116.57 1y3i h ALA 247 Ca -0.51 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1y3i h ALA 247 Cb 1.24 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1y3i h ALA 247 CO 0.64 -0.69 0.00 -0.25 0.00 0.00 0.00 179.25 178.94 1y3i n ASP 248 N -5.23 0.00 -1.70 0.00 9.92 -1.26 -4.26 116.55 114.02 1y3i n ASP 248 Ca -0.10 0.50 0.00 0.00 -0.53 0.00 0.00 54.79 54.65 1y3i n ASP 248 Cb 0.23 -0.50 0.00 0.00 -0.64 0.00 0.00 41.12 40.21 1y3i n ASP 248 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1y3i n GLY 249 N -0.68 1.18 3.59 0.44 0.00 -1.13 -5.11 105.19 103.47 1y3i n GLY 249 Ca 0.02 -1.57 -0.25 0.00 0.00 0.00 0.00 46.02 44.22 1y3i n GLY 249 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1y3i s HIS 250 N 0.95 2.60 0.23 1.61 3.76 -1.26 -4.83 115.29 118.34 1y3i s HIS 250 Ca 0.00 -0.24 -0.30 0.00 -0.15 0.00 0.00 55.06 54.36 1y3i s HIS 250 Cb 0.00 -1.19 -0.10 0.00 1.11 0.00 0.00 32.58 32.40 1y3i s HIS 250 CO 0.00 0.60 1.47 -0.51 -0.85 0.00 0.00 174.74 175.45 1y3i s ASP 251 N -3.33 6.63 0.33 1.40 -0.00 -1.26 -4.04 116.67 116.40 1y3i s ASP 251 Ca 0.29 2.66 0.05 0.00 -0.00 0.00 0.00 52.55 55.55 1y3i s ASP 251 Cb -0.07 -2.62 0.05 0.00 -0.00 0.00 0.00 42.92 40.29 1y3i s ASP 251 CO 0.17 -0.73 0.45 0.00 -0.00 0.00 0.00 175.17 175.06 1y3i n ALA 252 N 2.68 0.70 -2.46 5.23 0.00 0.51 -4.49 120.51 122.69 1y3i n ALA 252 Ca 0.08 -1.20 -0.15 0.00 0.00 0.00 0.00 53.44 52.18 1y3i n ALA 252 Cb 0.40 0.33 -0.11 0.00 0.00 0.00 0.00 19.45 20.07 1y3i n ALA 252 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1y3i s LEU 253 N 0.00 2.42 -0.03 0.00 1.02 0.26 0.10 118.68 122.44 1y3i s LEU 253 Ca 0.34 -0.83 0.01 0.00 0.02 0.00 0.00 54.13 53.68 1y3i s LEU 253 Cb -0.03 -0.35 0.02 0.00 0.02 0.00 0.00 46.19 45.85 1y3i s LEU 253 CO 0.22 -0.25 -0.04 -0.69 0.02 0.00 0.00 176.35 175.61 1y3i s VAL 254 N -2.48 0.47 0.07 -1.59 1.01 -0.63 -1.92 120.40 115.34 1y3i s VAL 254 Ca 0.07 -0.12 0.07 0.00 0.00 0.00 0.00 61.98 61.99 1y3i s VAL 254 Cb -0.03 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 1y3i s VAL 254 CO 0.01 0.20 -0.18 -0.36 0.00 0.00 0.00 175.10 174.76 1y3i s PHE 255 N 0.70 1.53 -0.17 5.22 0.40 -1.08 -1.25 117.98 123.33 1y3i s PHE 255 Ca -0.09 -0.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.84 1y3i s PHE 255 Cb -0.12 -0.87 0.03 0.00 0.51 0.00 0.00 43.02 42.57 1y3i s PHE 255 CO -0.00 0.11 -0.09 0.00 0.70 0.00 0.00 175.22 175.93 1y3i n ASP 257 N 4.80 -5.28 0.00 0.00 8.00 -1.12 -1.23 116.55 121.72 1y3i n ASP 257 Ca -0.14 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1y3i n ASP 257 Cb 0.48 -4.53 0.00 0.00 -0.02 0.00 0.00 41.12 37.05 1y3i n ASP 257 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1y3i n GLY 258 N -0.71 3.31 0.00 0.44 0.00 -1.26 -4.92 105.19 102.04 1y3i n GLY 258 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1y3i n GLY 258 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3i n ARG 259 N -1.46 3.83 -3.88 1.61 5.12 -0.37 -4.91 116.66 116.61 1y3i n ARG 259 Ca 0.00 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.60 1y3i n ARG 259 Cb 0.00 0.00 0.01 0.00 -1.16 0.00 0.00 32.46 31.31 1y3i n ARG 259 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1y3i n ARG 260 N 0.00 -1.72 -1.49 5.56 1.74 -1.26 0.10 116.66 119.59 1y3i n ARG 260 Ca 0.00 0.35 -0.36 0.00 -0.77 0.00 0.00 57.85 57.07 1y3i n ARG 260 Cb 0.00 -3.93 0.09 0.00 -1.02 0.00 0.00 32.46 27.60 1y3i n ARG 260 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1y3i s GLU 261 N -6.53 2.18 0.06 5.56 2.12 -1.25 -4.20 118.70 116.65 1y3i s GLU 261 Ca 0.29 1.94 -0.07 0.00 0.36 0.00 0.00 54.97 57.49 1y3i s GLU 261 Cb -0.12 -1.82 -0.01 0.00 0.26 0.00 0.00 34.13 32.44 1y3i s GLU 261 CO 0.90 -1.85 0.14 -1.64 -0.54 0.00 0.00 175.26 172.27 1y3i s MET 262 N -3.68 0.74 -0.13 4.30 -1.94 -0.38 -4.97 119.30 113.23 1y3i s MET 262 Ca 0.79 -0.89 -0.13 0.00 -1.71 0.00 0.00 55.69 53.75 1y3i s MET 262 Cb -0.34 0.29 -0.05 0.00 2.01 0.00 0.00 34.83 36.75 1y3i s MET 262 CO 0.44 -0.21 0.27 -1.17 -0.01 0.00 0.00 175.02 174.34 1y3i s LEU 263 N -2.59 4.30 -0.63 -0.03 1.98 -1.26 -1.60 118.68 118.85 1y3i s LEU 263 Ca 0.02 0.55 -0.06 0.00 -2.89 0.00 0.00 54.13 51.75 1y3i s LEU 263 Cb 0.03 -2.33 0.16 0.00 0.66 0.00 0.00 46.19 44.71 1y3i s LEU 263 CO -0.08 0.19 0.48 -0.63 -1.89 0.00 0.00 176.35 174.42 1y3i s ILE 264 N -0.03 4.12 0.48 6.68 -1.09 0.11 -4.95 121.20 126.52 1y3i s ILE 264 Ca 0.17 -2.66 -0.24 0.00 -2.23 0.00 0.00 60.65 55.68 1y3i s ILE 264 Cb -0.13 -3.66 -0.07 0.00 -1.58 0.00 0.00 42.46 37.01 1y3i s ILE 264 CO 0.05 -0.88 1.39 -2.84 -1.23 0.00 0.00 174.94 171.43 1y3i s PRO 265 N 0.23 3.55 0.58 2.79 0.02 -1.26 0.19 135.00 141.11 1y3i s PRO 265 Ca 0.15 2.34 -0.20 0.00 0.02 0.00 0.00 61.00 63.31 1y3i s PRO 265 Cb -0.19 -2.54 -0.03 0.00 0.02 0.00 0.00 34.50 31.75 1y3i s PRO 265 CO -0.04 -0.90 1.33 0.00 -0.33 0.00 0.00 177.00 177.05 1y3i s ALA 266 N -1.24 2.65 0.00 -1.55 0.00 -1.26 -0.82 121.76 119.54 1y3i s ALA 266 Ca 0.64 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.87 1y3i s ALA 266 Cb -0.42 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.14 1y3i s ALA 266 CO 0.53 -1.44 0.00 0.41 0.00 0.00 0.00 175.76 175.26 1y3i n GLY 267 N 0.77 3.10 0.00 0.00 0.00 -0.15 -4.74 105.19 104.17 1y3i n GLY 267 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1y3i n GLY 267 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1y3i n SER 268 N 0.09 -0.75 -3.35 1.61 7.64 0.00 -4.83 113.62 114.02 1y3i n SER 268 Ca 0.00 -0.11 0.02 0.00 1.01 0.00 0.00 58.87 59.80 1y3i n SER 268 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1y3i n SER 268 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1y3i s ARG 269 N -1.45 0.43 0.70 1.43 3.52 -1.21 -3.10 118.95 119.28 1y3i s ARG 269 Ca 0.00 0.95 -0.14 0.00 -0.13 0.00 0.00 55.73 56.41 1y3i s ARG 269 Cb 0.00 0.55 0.02 0.00 -1.56 0.00 0.00 34.95 33.96 1y3i s ARG 269 CO 0.00 -0.30 1.12 -1.17 -0.81 0.00 0.00 175.30 174.14 1y3i s LEU 270 N 2.78 3.28 -0.27 -0.88 0.20 0.23 -2.73 118.68 121.29 1y3i s LEU 270 Ca 0.04 2.00 -0.03 0.00 0.69 0.00 0.00 54.13 56.82 1y3i s LEU 270 Cb -0.11 -4.55 0.15 0.00 -0.43 0.00 0.00 46.19 41.26 1y3i s LEU 270 CO -0.18 -1.82 0.51 -0.70 -0.29 0.00 0.00 176.35 173.87 1y3i s GLU 271 N -4.28 0.47 -0.05 1.98 2.12 -0.06 -2.28 118.70 116.60 1y3i s GLU 271 Ca 0.66 0.89 0.03 0.00 0.36 0.00 0.00 54.97 56.92 1y3i s GLU 271 Cb -0.21 0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.36 1y3i s GLU 271 CO 0.46 -0.54 -0.13 0.08 -0.54 0.00 0.00 175.26 174.58 1y3i s VAL 272 N 2.73 3.15 0.21 3.70 1.01 0.18 -1.47 120.40 129.91 1y3i s VAL 272 Ca 0.13 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.26 1y3i s VAL 272 Cb -0.15 -2.24 0.01 0.00 0.00 0.00 0.00 36.38 34.00 1y3i s VAL 272 CO -0.18 0.58 0.47 0.42 0.00 0.00 0.00 175.10 176.39 1y3i s THR 273 N -0.75 0.02 0.14 3.92 -4.23 -0.76 -1.69 115.64 112.29 1y3i s THR 273 Ca 0.12 -1.13 -0.30 0.00 -1.18 0.00 0.00 61.69 59.20 1y3i s THR 273 Cb -0.11 -1.87 -0.06 0.00 1.34 0.00 0.00 72.50 71.80 1y3i s THR 273 CO 0.01 -0.11 0.95 -0.60 -0.54 0.00 0.00 174.62 174.33 1y3i s ARG 274 N -3.94 4.73 0.11 3.99 3.52 -1.26 -0.06 118.95 126.03 1y3i s ARG 274 Ca 0.15 1.46 -0.28 0.00 -0.13 0.00 0.00 55.73 56.93 1y3i s ARG 274 Cb -0.00 -3.36 -0.06 0.00 -1.56 0.00 0.00 34.95 29.97 1y3i s ARG 274 CO 0.02 0.28 0.89 0.00 -0.81 0.00 0.00 175.30 175.68 1y3i h VAL 276 N 3.90 0.36 -3.48 0.00 2.07 -1.95 -3.29 116.25 113.86 1y3i h VAL 276 Ca -0.44 -0.09 -0.71 0.00 0.82 0.00 0.00 66.70 66.28 1y3i h VAL 276 Cb 1.21 0.06 -0.33 0.00 -1.52 0.00 0.00 31.29 30.70 1y3i h VAL 276 CO 0.71 0.05 -0.41 -0.89 0.02 0.00 0.00 177.57 177.04 1y3i s THR 277 N -5.43 3.76 0.94 2.57 2.01 -1.26 -5.08 115.64 113.14 1y3i s THR 277 Ca -0.08 -2.35 -0.12 0.00 0.31 0.00 0.00 61.69 59.45 1y3i s THR 277 Cb 0.27 -3.49 0.08 0.00 0.01 0.00 0.00 72.50 69.38 1y3i s THR 277 CO 0.81 -0.79 0.72 -1.20 -0.69 0.00 0.00 174.62 173.46 1y3i n SER 278 N 4.23 -1.05 -4.65 3.53 7.64 -1.24 -4.91 113.62 117.17 1y3i n SER 278 Ca 0.01 0.37 -0.27 0.00 1.01 0.00 0.00 58.87 59.99 1y3i n SER 278 Cb 0.40 -1.32 0.11 0.00 -1.01 0.00 0.00 64.21 62.39 1y3i n SER 278 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1y3i s VAL 279 N -2.50 2.12 -0.13 0.44 0.11 -1.23 -4.95 120.40 114.26 1y3i s VAL 279 Ca 0.61 -0.19 0.02 0.00 -2.93 0.00 0.00 61.98 59.49 1y3i s VAL 279 Cb -0.22 -2.93 0.00 0.00 -1.53 0.00 0.00 36.38 31.70 1y3i s VAL 279 CO 0.63 0.00 -0.20 -0.54 -3.33 0.00 0.00 175.10 171.67 1y3i s LYS 280 N -5.48 3.12 -0.21 1.54 3.01 -1.26 -3.21 119.74 117.25 1y3i s LYS 280 Ca 0.65 -0.81 -0.01 0.00 -1.01 0.00 0.00 55.97 54.79 1y3i s LYS 280 Cb -0.08 -2.48 0.01 0.00 -1.01 0.00 0.00 37.83 34.27 1y3i s LYS 280 CO 0.48 0.06 -0.12 -1.58 0.51 0.00 0.00 175.35 174.69 1y3i s TRP 281 N 0.67 2.90 -0.88 3.18 0.52 -1.15 -2.62 118.94 121.56 1y3i s TRP 281 Ca -0.09 -1.43 -0.20 0.00 0.02 0.00 0.00 56.10 54.40 1y3i s TRP 281 Cb -0.16 -2.00 0.11 0.00 -1.15 0.00 0.00 33.47 30.27 1y3i s TRP 281 CO 0.02 -0.72 1.12 0.00 0.02 0.00 0.00 176.95 177.39 1y3i s ALA 282 N 1.35 3.27 -0.36 0.98 0.00 -1.16 -2.28 121.76 123.55 1y3i s ALA 282 Ca 0.04 -2.55 -0.27 0.00 0.00 0.00 0.00 51.96 49.18 1y3i s ALA 282 Cb -0.14 -4.04 0.02 0.00 0.00 0.00 0.00 23.12 18.95 1y3i s ALA 282 CO -0.08 -2.98 0.97 1.03 0.00 0.00 0.00 175.76 174.69 1y3i s ARG 283 N 3.12 3.89 -0.10 0.00 0.52 -0.59 -4.71 118.95 121.08 1y3i s ARG 283 Ca 0.31 0.69 -0.09 0.00 -0.52 0.00 0.00 55.73 56.12 1y3i s ARG 283 Cb -0.07 -3.79 -0.08 0.00 0.52 0.00 0.00 34.95 31.53 1y3i s ARG 283 CO -0.06 -0.95 0.28 -0.07 0.02 0.00 0.00 175.30 174.52 1y3i h LEU 284 N 10.12 -0.03 -8.56 2.53 3.38 -1.90 -1.50 115.31 119.35 1y3i h LEU 284 Ca -0.23 -0.27 -0.66 0.00 0.09 0.00 0.00 57.88 56.81 1y3i h LEU 284 Cb 1.07 0.01 -0.16 0.00 0.09 0.00 0.00 40.66 41.68 1y3i h LEU 284 CO 1.00 0.59 0.11 -0.62 0.09 0.00 0.00 178.44 179.61 1y3i s ASP 285 N -5.68 6.30 -1.47 -0.43 3.68 -1.26 -4.68 116.67 113.13 1y3i s ASP 285 Ca -0.06 -0.44 -0.10 0.00 2.13 0.00 0.00 52.55 54.08 1y3i s ASP 285 Cb -0.01 -2.31 0.03 0.00 -1.45 0.00 0.00 42.92 39.18 1y3i s ASP 285 CO 0.22 -0.79 2.46 -1.20 0.13 0.00 0.00 175.17 175.98 1y3i n SER 286 N 6.24 6.50 -4.89 -0.34 7.64 -1.26 -4.89 113.62 122.61 1y3i n SER 286 Ca -0.03 -2.84 -0.21 0.00 1.01 0.00 0.00 58.87 56.80 1y3i n SER 286 Cb 0.47 -1.55 -0.02 0.00 -1.01 0.00 0.00 64.21 62.11 1y3i n SER 286 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y3i s ALA 287 N 1.66 4.18 0.48 -0.43 0.00 -1.26 -5.12 121.76 121.26 1y3i s ALA 287 Ca 0.55 -1.81 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 1y3i s ALA 287 Cb 0.15 -1.01 -0.08 0.00 0.00 0.00 0.00 23.12 22.19 1y3i s ALA 287 CO -0.06 -0.31 0.92 -1.25 0.00 0.00 0.00 175.76 175.06 1y3i s PRO 288 N -4.20 3.92 0.44 0.00 0.04 -1.26 -4.93 135.00 129.02 1y3i s PRO 288 Ca 0.47 0.83 0.16 0.00 0.04 0.00 0.00 61.00 62.50 1y3i s PRO 288 Cb -0.03 -2.21 1.08 0.00 0.04 0.00 0.00 34.50 33.38 1y3i s PRO 288 CO 0.28 -0.19 1.96 0.35 0.04 0.00 0.00 177.00 179.44 1y3i h PHE 289 N 1.08 0.40 -0.40 0.56 3.57 -1.99 -1.57 116.94 118.59 1y3i h PHE 289 Ca -0.47 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.16 1y3i h PHE 289 Cb 1.18 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.78 1y3i h PHE 289 CO 0.63 0.17 0.44 1.15 -2.23 0.00 0.00 178.31 178.47 1y3i h THR 290 N 0.36 0.37 0.17 4.41 2.02 -1.99 -0.50 112.91 117.76 1y3i h THR 290 Ca 0.30 0.00 -0.23 0.00 0.77 0.00 0.00 66.41 67.25 1y3i h THR 290 Cb 0.70 0.65 0.03 0.00 -1.74 0.00 0.00 68.15 67.78 1y3i h THR 290 CO -0.08 0.00 -1.02 0.44 0.37 0.00 0.00 175.52 175.23 1y3i h ASP 291 N 0.00 0.57 0.66 4.18 3.32 -1.66 -2.94 116.42 120.54 1y3i h ASP 291 Ca 0.19 -0.94 -0.03 0.00 0.02 0.00 0.00 57.03 56.27 1y3i h ASP 291 Cb 1.07 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 40.44 1y3i h ASP 291 CO -0.00 1.49 -0.31 -0.09 -1.72 0.00 0.00 179.24 178.60 1y3i h ARG 292 N -0.23 -0.85 -0.93 3.56 2.43 -1.24 -3.16 114.38 113.96 1y3i h ARG 292 Ca -0.18 0.06 0.27 0.00 -0.81 0.00 0.00 59.98 59.31 1y3i h ARG 292 Cb 1.79 0.19 -0.14 0.00 -0.42 0.00 0.00 29.97 31.39 1y3i h ARG 292 CO 0.18 -0.57 0.38 1.25 -1.51 0.00 0.00 179.97 179.71 1y3i h LEU 293 N -0.95 0.23 -0.00 3.80 5.85 -1.31 -0.79 115.31 122.13 1y3i h LEU 293 Ca -0.09 0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1y3i h LEU 293 Cb 0.67 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1y3i h LEU 293 CO 0.15 -0.13 -0.16 1.62 -0.34 0.00 0.00 178.44 179.58 1y3i h VAL 294 N 0.28 1.57 0.05 1.05 3.04 -1.63 -2.98 116.25 117.62 1y3i h VAL 294 Ca 0.62 -1.88 0.01 0.00 -1.01 0.00 0.00 66.70 64.44 1y3i h VAL 294 Cb 1.32 2.77 -0.01 0.00 -2.01 0.00 0.00 31.29 33.36 1y3i h VAL 294 CO -0.63 0.51 -0.09 -0.09 -1.01 0.00 0.00 177.57 176.26 1y3i h ARG 295 N -0.59 -0.17 0.00 4.17 9.65 -1.17 0.22 114.38 126.50 1y3i h ARG 295 Ca -0.02 0.01 -0.14 0.00 -1.10 0.00 0.00 59.98 58.74 1y3i h ARG 295 Cb 0.91 0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.51 1y3i h ARG 295 CO 0.03 -0.11 -0.65 0.87 2.80 0.00 0.00 179.97 182.91 1y3i h LYS 296 N -0.18 0.00 0.00 0.20 1.79 -1.36 -3.10 116.57 113.92 1y3i h LYS 296 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1y3i h LYS 296 Cb 0.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 1y3i h LYS 296 CO -0.05 0.65 -0.74 0.74 -1.08 0.00 0.00 179.45 178.97 1y3i h PHE 297 N 0.00 0.00 -4.28 -1.35 -1.00 -1.35 -3.48 116.94 105.48 1y3i h PHE 297 Ca -0.01 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.61 1y3i h PHE 297 Cb 1.29 0.00 0.11 0.00 3.61 0.00 0.00 35.95 40.95 1y3i h PHE 297 CO 0.00 0.00 -0.47 0.54 -1.61 0.00 0.00 178.31 176.77 1y3i n ARG 298 N -2.32 -2.49 -2.47 1.51 1.74 0.74 -4.98 116.66 108.40 1y3i n ARG 298 Ca 0.02 0.50 -0.43 0.00 -0.77 0.00 0.00 57.85 57.17 1y3i n ARG 298 Cb 0.48 -4.22 -0.02 0.00 -1.02 0.00 0.00 32.46 27.67 1y3i n ARG 298 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1y3i s LEU 299 N -4.45 4.19 -0.87 0.55 1.43 -0.99 -4.95 118.68 113.60 1y3i s LEU 299 Ca 0.14 1.67 -0.25 0.00 -1.03 0.00 0.00 54.13 54.66 1y3i s LEU 299 Cb -0.02 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.63 1y3i s LEU 299 CO 0.43 -0.71 1.83 -2.84 0.23 0.00 0.00 176.35 175.29 1y3i s PRO 300 N 3.18 2.74 0.00 1.29 0.02 -1.26 -4.68 135.00 136.29 1y3i s PRO 300 Ca 0.53 -0.26 0.14 0.00 0.02 0.00 0.00 61.00 61.44 1y3i s PRO 300 Cb -0.21 -4.96 0.42 0.00 0.02 0.00 0.00 34.50 29.76 1y3i s PRO 300 CO 0.15 -3.05 1.35 1.33 -0.33 0.00 0.00 177.00 176.44 1y3i n VAL 301 N 7.57 0.59 0.00 3.83 0.24 -1.26 -5.27 118.33 124.03 1y3i n VAL 301 Ca 0.34 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1y3i n VAL 301 Cb 0.48 0.32 0.00 0.00 -1.47 0.00 0.00 33.84 33.17 1y3i n VAL 301 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04