#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqh s VAL 103 N 0.00 5.34 -0.08 2.46 1.01 -1.26 -0.22 120.40 127.65 2qqh s VAL 103 Ca 0.00 0.25 -0.22 0.00 0.00 0.00 0.00 61.98 62.02 2qqh s VAL 103 Cb 0.00 -3.53 -0.17 0.00 0.00 0.00 0.00 36.38 32.67 2qqh s VAL 103 CO 0.00 0.34 0.80 0.03 0.00 0.00 0.00 175.10 176.27 2qqh h ARG 104 N 7.46 -0.10 0.00 2.72 2.47 -1.62 -3.50 114.38 121.81 2qqh h ARG 104 Ca -0.38 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.35 2qqh h ARG 104 Cb 1.17 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 2qqh h ARG 104 CO 0.67 0.44 0.00 0.00 0.56 0.00 0.00 179.97 181.64 2qqh n ALA 105 N -2.57 0.00 -2.40 0.04 0.00 -1.26 -4.87 120.51 109.45 2qqh n ALA 105 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.99 2qqh n ALA 105 Cb 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.72 2qqh n ALA 105 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2qqh s ILE 106 N -0.67 3.90 0.00 0.00 1.01 -1.26 -2.18 121.20 122.01 2qqh s ILE 106 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 60.65 59.19 2qqh s ILE 106 Cb 0.00 -4.95 0.00 0.00 0.01 0.00 0.00 42.46 37.52 2qqh s ILE 106 CO 0.00 -1.66 0.00 -0.90 0.00 0.00 0.00 174.94 172.38 2qqh n ASP 107 N 10.48 0.00 -4.75 3.58 5.75 -1.26 -5.09 116.55 125.27 2qqh n ASP 107 Ca 0.46 0.00 -0.37 0.00 -0.01 0.00 0.00 54.79 54.88 2qqh n ASP 107 Cb 0.47 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.49 2qqh n ASP 107 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2qqh s GLU 108 N 0.00 4.18 0.24 0.11 2.02 -0.93 -5.09 118.70 119.23 2qqh s GLU 108 Ca 0.00 0.11 -0.30 0.00 0.02 0.00 0.00 54.97 54.80 2qqh s GLU 108 Cb 0.00 -3.39 -0.09 0.00 0.10 0.00 0.00 34.13 30.75 2qqh s GLU 108 CO 0.00 0.31 0.99 0.16 0.02 0.00 0.00 175.26 176.74 2qqh s ASP 109 N 0.24 7.52 0.00 -0.19 -4.77 -1.26 -4.89 116.67 113.32 2qqh s ASP 109 Ca 0.17 2.04 0.18 0.00 -3.30 0.00 0.00 52.55 51.63 2qqh s ASP 109 Cb -0.13 -2.61 0.25 0.00 -1.09 0.00 0.00 42.92 39.34 2qqh s ASP 109 CO 0.05 0.04 1.17 0.00 0.70 0.00 0.00 175.17 177.13 2qqh h SER 111 N 3.42 0.94 0.00 0.00 4.64 -2.03 -2.79 113.55 117.72 2qqh h SER 111 Ca 0.00 -0.60 0.00 0.00 -0.47 0.00 0.00 61.79 60.72 2qqh h SER 111 Cb 0.78 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2qqh h SER 111 CO 0.00 1.37 0.00 1.67 -0.87 0.00 0.00 176.83 179.00 2qqh n GLN 112 N -3.99 0.00 -2.84 4.77 7.27 -1.26 -4.61 117.38 116.72 2qqh n GLN 112 Ca -0.06 0.00 -0.41 0.00 0.07 0.00 0.00 57.00 56.59 2qqh n GLN 112 Cb 0.69 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.31 2qqh n GLN 112 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 2qqh s TYR 113 N -3.15 3.60 0.54 3.69 2.02 -1.06 -5.00 117.35 118.00 2qqh s TYR 113 Ca 0.00 1.51 -0.19 0.00 -0.37 0.00 0.00 57.07 58.01 2qqh s TYR 113 Cb 0.00 -3.01 -0.06 0.00 -0.40 0.00 0.00 41.96 38.49 2qqh s TYR 113 CO 0.00 -0.01 1.12 -1.21 -1.57 0.00 0.00 175.55 173.88 2qqh s GLU 114 N 1.10 3.37 0.43 -0.62 0.41 -1.26 -4.50 118.70 117.62 2qqh s GLU 114 Ca 0.46 1.59 -0.24 0.00 -0.41 0.00 0.00 54.97 56.37 2qqh s GLU 114 Cb -0.19 -2.01 -0.08 0.00 -1.78 0.00 0.00 34.13 30.07 2qqh s GLU 114 CO 0.23 -0.83 1.13 -2.14 -0.49 0.00 0.00 175.26 173.16 2qqh s PRO 115 N -3.31 3.94 0.29 0.39 0.02 -1.26 0.51 135.00 135.57 2qqh s PRO 115 Ca 0.72 1.71 -0.29 0.00 0.02 0.00 0.00 61.00 63.16 2qqh s PRO 115 Cb -0.23 -2.50 -0.14 0.00 0.02 0.00 0.00 34.50 31.65 2qqh s PRO 115 CO 0.27 -0.38 1.16 0.44 -0.33 0.00 0.00 177.00 178.16 2qqh n ILE 116 N -0.25 1.78 -1.94 2.83 -5.35 0.28 -4.72 119.36 111.99 2qqh n ILE 116 Ca 0.06 -0.44 -0.40 0.00 -0.27 0.00 0.00 62.75 61.69 2qqh n ILE 116 Cb 0.48 -1.23 -0.00 0.00 -1.74 0.00 0.00 39.64 37.15 2qqh n ILE 116 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 2qqh s PRO 117 N -1.42 4.01 0.00 6.28 0.02 -1.26 -2.36 135.00 140.27 2qqh s PRO 117 Ca 0.60 2.34 0.00 0.00 0.02 0.00 0.00 61.00 63.96 2qqh s PRO 117 Cb -0.66 -2.85 0.00 0.00 0.02 0.00 0.00 34.50 31.01 2qqh s PRO 117 CO 0.59 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 177.14 2qqh n GLY 118 N 0.61 0.89 0.26 0.52 0.00 -1.26 -4.91 105.19 101.31 2qqh n GLY 118 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 2qqh n GLY 118 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qqh h SER 119 N 0.00 0.81 -0.36 1.61 4.64 -1.82 -1.36 113.55 117.07 2qqh h SER 119 Ca 0.00 -0.16 -0.08 0.00 -0.47 0.00 0.00 61.79 61.09 2qqh h SER 119 Cb 0.00 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 2qqh h SER 119 CO 0.00 0.74 -0.04 1.56 -0.87 0.00 0.00 176.83 178.22 2qqh h GLN 120 N 0.83 0.76 -0.22 4.77 1.08 -1.88 -3.08 115.11 117.37 2qqh h GLN 120 Ca 0.20 -0.22 -0.18 0.00 -1.45 0.00 0.00 58.65 57.00 2qqh h GLN 120 Cb 0.17 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.52 2qqh h GLN 120 CO -0.02 0.80 -0.59 0.87 -0.95 0.00 0.00 178.83 178.94 2qqh h LYS 121 N 0.70 0.71 0.00 1.46 1.57 -1.85 -2.85 116.57 116.32 2qqh h LYS 121 Ca 0.13 -0.48 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2qqh h LYS 121 Cb 0.49 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2qqh h LYS 121 CO 0.03 1.10 0.00 0.00 -0.57 0.00 0.00 179.45 180.01 2qqh h ALA 122 N 0.79 1.00 0.00 3.86 0.00 -1.22 -2.80 119.26 120.90 2qqh h ALA 122 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qqh h ALA 122 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2qqh h ALA 122 CO 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 179.25 178.99 2qqh h ALA 123 N 2.02 0.78 -2.50 0.00 0.00 -1.42 -3.43 119.26 114.72 2qqh h ALA 123 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 2qqh h ALA 123 Cb 0.42 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.23 2qqh h ALA 123 CO 0.00 0.00 0.42 -0.51 0.00 0.00 0.00 179.25 179.16 2qqh s LEU 124 N -5.09 4.06 0.96 0.00 1.43 -1.06 -0.33 118.68 118.65 2qqh s LEU 124 Ca 0.06 2.06 -0.12 0.00 -1.03 0.00 0.00 54.13 55.10 2qqh s LEU 124 Cb 0.10 -4.27 0.17 0.00 0.03 0.00 0.00 46.19 42.22 2qqh s LEU 124 CO 0.69 -0.62 1.11 -0.83 0.23 0.00 0.00 176.35 176.93 2qqh s GLY 125 N -1.62 1.57 0.03 -3.19 0.00 -0.30 -4.52 107.32 99.29 2qqh s GLY 125 Ca 0.61 -0.42 0.02 0.00 0.00 0.00 0.00 44.72 44.93 2qqh s GLY 125 CO 0.27 0.17 -0.07 -0.47 0.00 0.00 0.00 173.10 173.00 2qqh s TYR 126 N -3.09 0.61 -0.27 1.90 5.04 0.56 0.26 117.35 122.36 2qqh s TYR 126 Ca 0.65 -0.39 -0.04 0.00 -2.44 0.00 0.00 57.07 54.84 2qqh s TYR 126 Cb -0.17 -0.37 0.02 0.00 0.35 0.00 0.00 41.96 41.78 2qqh s TYR 126 CO 0.56 -0.06 0.02 1.21 -1.34 0.00 0.00 175.55 175.93 2qqh s ASN 127 N -1.18 4.77 0.49 4.32 3.84 0.04 -0.93 114.94 126.28 2qqh s ASN 127 Ca -0.07 -0.80 0.26 0.00 0.21 0.00 0.00 52.86 52.47 2qqh s ASN 127 Cb -0.08 -1.78 1.22 0.00 -0.55 0.00 0.00 41.25 40.06 2qqh s ASN 127 CO 0.00 -0.17 1.96 -0.29 -2.79 0.00 0.00 177.10 175.82 2qqh h ILE 128 N 6.00 0.55 0.14 -5.21 6.09 -1.93 0.11 117.51 123.26 2qqh h ILE 128 Ca -0.32 -0.80 -0.34 0.00 -1.37 0.00 0.00 64.86 62.03 2qqh h ILE 128 Cb 1.12 1.53 -0.01 0.00 0.47 0.00 0.00 36.82 39.93 2qqh h ILE 128 CO 0.59 0.16 -1.81 -0.07 -3.07 0.00 0.00 178.15 173.95 2qqh h LEU 129 N 0.00 0.47 0.00 2.19 3.38 -1.95 -3.36 115.31 116.04 2qqh h LEU 129 Ca -0.00 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.05 2qqh h LEU 129 Cb 0.52 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2qqh h LEU 129 CO 0.02 1.79 -0.85 0.35 0.09 0.00 0.00 178.44 179.85 2qqh n THR 130 N -3.62 0.16 -1.69 0.22 -2.24 -1.20 -4.92 114.28 100.99 2qqh n THR 130 Ca -0.29 -0.18 -0.18 0.00 -2.27 0.00 0.00 64.05 61.13 2qqh n THR 130 Cb 1.02 0.21 -0.07 0.00 -2.10 0.00 0.00 70.33 69.40 2qqh n THR 130 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qqh n GLN 131 N -1.86 -1.48 -3.44 -0.78 6.02 0.36 -1.41 117.38 114.79 2qqh n GLN 131 Ca 0.03 1.05 -0.29 0.00 -0.01 0.00 0.00 57.00 57.78 2qqh n GLN 131 Cb 0.41 -5.44 -0.04 0.00 1.02 0.00 0.00 30.24 26.19 2qqh n GLN 131 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2qqh s GLU 132 N -3.81 3.64 0.79 -1.09 2.02 -1.22 -3.63 118.70 115.39 2qqh s GLU 132 Ca 0.00 -0.02 -0.11 0.00 0.02 0.00 0.00 54.97 54.86 2qqh s GLU 132 Cb 0.00 -2.70 0.06 0.00 0.10 0.00 0.00 34.13 31.59 2qqh s GLU 132 CO 0.00 0.29 1.09 -0.51 0.02 0.00 0.00 175.26 176.14 2qqh s ASP 133 N -2.96 4.49 0.21 -0.19 1.01 -1.26 -0.78 116.67 117.19 2qqh s ASP 133 Ca 0.43 1.54 0.01 0.00 0.71 0.00 0.00 52.55 55.24 2qqh s ASP 133 Cb -0.11 -2.29 -0.00 0.00 1.01 0.00 0.00 42.92 41.53 2qqh s ASP 133 CO 0.28 -2.00 0.04 0.00 0.21 0.00 0.00 175.17 173.70 2qqh n ALA 134 N -3.48 0.23 -0.63 5.23 0.00 0.14 -4.76 120.51 117.24 2qqh n ALA 134 Ca 0.08 -0.98 -0.29 0.00 0.00 0.00 0.00 53.44 52.24 2qqh n ALA 134 Cb 0.55 0.61 0.25 0.00 0.00 0.00 0.00 19.45 20.85 2qqh n ALA 134 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2qqh s GLN 135 N -2.76 -1.29 0.32 0.00 -0.21 0.44 -3.88 119.66 112.27 2qqh s GLN 135 Ca 0.05 0.54 -0.29 0.00 0.02 0.00 0.00 55.36 55.68 2qqh s GLN 135 Cb 0.00 -1.53 -0.11 0.00 1.00 0.00 0.00 33.01 32.37 2qqh s GLN 135 CO 0.04 -3.89 1.45 -1.12 -2.12 0.00 0.00 175.29 169.65 2qqh s SER 136 N -2.89 6.52 -0.15 5.90 0.01 -1.26 -1.15 113.70 120.68 2qqh s SER 136 Ca 0.68 2.86 -0.09 0.00 1.31 0.00 0.00 55.95 60.71 2qqh s SER 136 Cb -0.20 -2.65 -0.06 0.00 0.21 0.00 0.00 66.02 63.31 2qqh s SER 136 CO 0.62 -0.76 -0.21 0.52 0.41 0.00 0.00 173.24 173.82 2qqh n VAL 137 N 1.29 0.98 -2.20 3.43 0.31 0.56 -4.62 118.33 118.08 2qqh n VAL 137 Ca 0.03 -0.15 -0.32 0.00 -0.01 0.00 0.00 64.34 63.90 2qqh n VAL 137 Cb 0.40 -1.78 -0.01 0.00 -0.91 0.00 0.00 33.84 31.54 2qqh n VAL 137 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2qqh s TYR 138 N -2.34 3.40 -0.58 3.52 2.02 -0.98 -0.45 117.35 121.93 2qqh s TYR 138 Ca -0.22 1.44 -0.28 0.00 -0.37 0.00 0.00 57.07 57.64 2qqh s TYR 138 Cb 0.08 -2.81 0.03 0.00 -0.40 0.00 0.00 41.96 38.85 2qqh s TYR 138 CO 0.28 -0.59 1.17 0.34 -1.57 0.00 0.00 175.55 175.18 2qqh s ASP 139 N -3.29 6.43 0.61 2.29 -1.08 -0.03 -3.90 116.67 117.70 2qqh s ASP 139 Ca 0.59 0.04 0.39 0.00 -0.52 0.00 0.00 52.55 53.05 2qqh s ASP 139 Cb -0.11 -2.54 1.89 0.00 -1.46 0.00 0.00 42.92 40.70 2qqh s ASP 139 CO 0.38 -1.47 2.18 0.00 0.52 0.00 0.00 175.17 176.78 2qqh h ALA 140 N 9.53 1.00 -0.02 3.66 0.00 -1.90 -3.22 119.26 128.32 2qqh h ALA 140 Ca -0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2qqh h ALA 140 Cb 1.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2qqh h ALA 140 CO 1.18 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 179.30 2qqh n SER 141 N -3.09 2.23 -4.71 0.00 3.41 -1.26 -4.78 113.62 105.42 2qqh n SER 141 Ca -0.01 -2.45 -0.41 0.00 -0.26 0.00 0.00 58.87 55.73 2qqh n SER 141 Cb 0.19 -0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 2qqh n SER 141 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2qqh s TYR 142 N -1.78 3.63 -1.41 7.33 5.04 -1.22 -4.93 117.35 124.02 2qqh s TYR 142 Ca 0.15 1.57 0.12 0.00 -2.44 0.00 0.00 57.07 56.46 2qqh s TYR 142 Cb 0.12 -3.04 0.07 0.00 0.35 0.00 0.00 41.96 39.47 2qqh s TYR 142 CO 0.02 0.01 0.84 0.66 -1.34 0.00 0.00 175.55 175.74 2qqh n TYR 143 N 3.92 0.00 -2.53 4.97 4.01 -1.26 -1.14 117.16 125.13 2qqh n TYR 143 Ca 0.04 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.60 2qqh n TYR 143 Cb 0.51 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.54 2qqh n TYR 143 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qqh n GLY 144 N 0.73 -0.35 2.33 2.72 0.00 -1.26 -2.46 105.19 106.90 2qqh n GLY 144 Ca 0.07 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2qqh n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqh n GLY 145 N -1.15 0.90 3.49 -0.02 0.00 -1.26 -4.98 105.19 102.17 2qqh n GLY 145 Ca -0.17 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.34 2qqh n GLY 145 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2qqh s GLN 146 N -3.54 1.39 -0.42 1.61 -2.07 -1.03 -5.02 119.66 110.57 2qqh s GLN 146 Ca 0.00 -1.16 -0.02 0.00 -1.82 0.00 0.00 55.36 52.36 2qqh s GLN 146 Cb 0.00 0.45 0.11 0.00 -1.09 0.00 0.00 33.01 32.48 2qqh s GLN 146 CO 0.00 -0.56 0.21 0.00 -1.32 0.00 0.00 175.29 173.62 2qqh s GLU 148 N 1.03 3.68 0.21 0.00 2.02 -1.26 -1.35 118.70 123.03 2qqh s GLU 148 Ca 0.09 -0.49 0.10 0.00 0.02 0.00 0.00 54.97 54.69 2qqh s GLU 148 Cb -0.22 -3.10 -0.04 0.00 0.10 0.00 0.00 34.13 30.86 2qqh s GLU 148 CO -0.04 0.06 -0.20 0.95 0.02 0.00 0.00 175.26 176.05 2qqh s THR 149 N 0.89 2.14 -0.05 3.63 -4.23 0.70 -0.88 115.64 117.84 2qqh s THR 149 Ca 0.01 -2.10 0.03 0.00 -1.18 0.00 0.00 61.69 58.46 2qqh s THR 149 Cb -0.14 -2.06 0.00 0.00 1.34 0.00 0.00 72.50 71.64 2qqh s THR 149 CO 0.02 -0.30 -0.15 -0.69 -0.54 0.00 0.00 174.62 172.96 2qqh s VAL 150 N -2.14 1.27 0.01 2.29 1.01 -0.04 -0.84 120.40 121.97 2qqh s VAL 150 Ca 0.21 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 2qqh s VAL 150 Cb -0.06 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 2qqh s VAL 150 CO 0.10 0.38 0.97 -0.47 0.00 0.00 0.00 175.10 176.07 2qqh s TYR 151 N 0.23 3.68 -0.68 5.22 5.04 -1.26 -0.78 117.35 128.79 2qqh s TYR 151 Ca -0.07 1.70 -0.08 0.00 -2.44 0.00 0.00 57.07 56.18 2qqh s TYR 151 Cb -0.12 -3.10 0.18 0.00 0.35 0.00 0.00 41.96 39.26 2qqh s TYR 151 CO 0.03 0.02 0.55 1.21 -1.34 0.00 0.00 175.55 176.02 2qqh s ASN 152 N 0.87 5.90 0.66 4.32 2.47 0.14 -4.70 114.94 124.60 2qqh s ASN 152 Ca 0.51 -2.64 0.35 0.00 0.42 0.00 0.00 52.86 51.51 2qqh s ASN 152 Cb -0.21 -2.02 1.93 0.00 -1.45 0.00 0.00 41.25 39.50 2qqh s ASN 152 CO 0.28 -0.50 2.10 1.23 -3.72 0.00 0.00 177.10 176.49 2qqh h GLY 153 N 7.55 0.00 -2.46 1.21 0.00 -1.95 -2.14 103.07 105.27 2qqh h GLY 153 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qqh h GLY 153 CO 0.76 0.00 0.00 1.18 0.00 0.00 0.00 176.54 178.48 2qqh n GLU 154 N -3.04 3.24 0.21 4.80 1.02 -1.26 -4.64 120.64 120.97 2qqh n GLU 154 Ca -0.02 -1.89 0.15 0.00 -0.02 0.00 0.00 57.16 55.38 2qqh n GLU 154 Cb 0.27 -1.90 0.78 0.00 -0.02 0.00 0.00 31.44 30.57 2qqh n GLU 154 CO 0.00 0.00 0.00 0.11 1.18 0.00 0.00 177.13 178.42 2qqh h TRP 155 N 2.46 0.00 -0.84 -0.32 5.08 -1.72 -1.49 115.95 119.11 2qqh h TRP 155 Ca 0.00 0.00 0.05 0.00 1.08 0.00 0.00 58.89 60.02 2qqh h TRP 155 Cb 1.32 0.00 -0.05 0.00 -3.00 0.00 0.00 29.16 27.43 2qqh h TRP 155 CO 0.63 0.00 0.55 0.00 -1.28 0.00 0.00 178.44 178.34 2qqh h ARG 156 N 0.00 0.96 -6.12 0.12 2.47 -1.89 -3.33 114.38 106.60 2qqh h ARG 156 Ca 0.07 -0.06 -0.58 0.00 -1.26 0.00 0.00 59.98 58.16 2qqh h ARG 156 Cb 0.36 -0.22 -0.10 0.00 -1.65 0.00 0.00 29.97 28.37 2qqh h ARG 156 CO -0.00 0.64 1.15 -1.21 0.56 0.00 0.00 179.97 181.10 2qqh s GLU 157 N -5.86 3.34 0.00 0.04 0.41 -0.56 -5.27 118.70 110.80 2qqh s GLU 157 Ca -0.11 -0.68 0.00 0.00 -0.41 0.00 0.00 54.97 53.77 2qqh s GLU 157 Cb 0.19 -4.62 0.00 0.00 -1.78 0.00 0.00 34.13 27.92 2qqh s GLU 157 CO 0.79 -2.12 0.00 1.28 -0.49 0.00 0.00 175.26 174.72 2qqh n LEU 158 N 8.90 0.00 0.00 1.80 4.77 -1.25 -5.00 117.00 126.22 2qqh n LEU 158 Ca 0.14 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.04 2qqh n LEU 158 Cb 0.49 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.65 2qqh n LEU 158 CO 0.68 0.00 0.08 0.47 -1.33 0.00 0.00 177.39 177.29 2qqh n ASP 171 N 0.00 -2.20 0.00 -1.43 8.00 -1.26 -5.18 116.55 114.49 2qqh n ASP 171 Ca 0.00 -0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.29 2qqh n ASP 171 Cb 0.00 -0.28 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 2qqh n ASP 171 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2qqh n ASP 172 N -2.72 0.00 0.04 -2.24 2.03 -1.26 -4.59 116.55 107.82 2qqh n ASP 172 Ca 0.03 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.27 2qqh n ASP 172 Cb 0.15 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.43 2qqh n ASP 172 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2qqh h GLU 173 N 0.00 0.00 -0.22 -0.67 4.39 -2.01 -3.38 114.58 112.69 2qqh h GLU 173 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2qqh h GLU 173 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2qqh h GLU 173 CO 0.00 0.86 0.00 0.36 -1.16 0.00 0.00 179.01 179.07 2qqh n LYS 174 N -3.27 2.39 -4.28 2.33 2.85 -1.26 -4.88 118.16 112.04 2qqh n LYS 174 Ca -0.04 -2.07 -0.18 0.00 -1.05 0.00 0.00 58.31 54.98 2qqh n LYS 174 Cb 0.96 -1.49 -0.15 0.00 -0.65 0.00 0.00 35.03 33.70 2qqh n LYS 174 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2qqh s TYR 175 N -1.73 0.67 0.19 5.58 1.51 -1.26 0.27 117.35 122.58 2qqh s TYR 175 Ca 0.34 -0.13 0.08 0.00 -1.01 0.00 0.00 57.07 56.35 2qqh s TYR 175 Cb 0.21 -0.44 -0.04 0.00 -0.11 0.00 0.00 41.96 41.58 2qqh s TYR 175 CO 0.31 -0.02 -0.02 -0.06 -1.11 0.00 0.00 175.55 174.64 2qqh s PHE 176 N -0.12 2.76 -0.02 2.71 0.40 0.04 -4.47 117.98 119.28 2qqh s PHE 176 Ca 0.02 -0.17 -0.21 0.00 -0.60 0.00 0.00 56.93 55.96 2qqh s PHE 176 Cb -0.03 -1.32 -0.05 0.00 0.51 0.00 0.00 43.02 42.13 2qqh s PHE 176 CO -0.00 0.53 0.62 0.50 0.70 0.00 0.00 175.22 177.57 2qqh s ARG 177 N -3.06 4.35 -0.38 0.44 3.52 0.18 -0.86 118.95 123.15 2qqh s ARG 177 Ca 0.28 0.77 -0.12 0.00 -0.13 0.00 0.00 55.73 56.53 2qqh s ARG 177 Cb -0.09 -3.37 0.02 0.00 -1.56 0.00 0.00 34.95 29.96 2qqh s ARG 177 CO 0.18 0.30 0.23 0.21 -0.81 0.00 0.00 175.30 175.41 2qqh s LYS 178 N 0.02 2.96 0.74 5.12 2.20 -0.06 -0.55 119.74 130.17 2qqh s LYS 178 Ca 0.32 -1.00 -0.15 0.00 -0.36 0.00 0.00 55.97 54.78 2qqh s LYS 178 Cb -0.18 -3.79 0.04 0.00 -1.51 0.00 0.00 37.83 32.39 2qqh s LYS 178 CO 0.17 -0.67 1.25 -2.14 -0.36 0.00 0.00 175.35 173.60 2qqh s PRO 179 N 1.60 2.02 0.26 4.03 0.02 -1.26 -4.61 135.00 137.07 2qqh s PRO 179 Ca 0.03 1.90 -0.02 0.00 0.02 0.00 0.00 61.00 62.93 2qqh s PRO 179 Cb -0.19 -1.80 0.42 0.00 0.02 0.00 0.00 34.50 32.95 2qqh s PRO 179 CO 0.08 -1.96 1.86 -0.92 -0.33 0.00 0.00 177.00 175.73 2qqh h TYR 180 N -0.27 1.12 0.00 6.54 5.03 -1.36 -1.47 116.97 126.56 2qqh h TYR 180 Ca -0.48 0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.86 2qqh h TYR 180 Cb 1.32 -0.36 0.00 0.00 1.55 0.00 0.00 36.73 39.23 2qqh h TYR 180 CO 0.44 0.54 0.00 0.09 -1.32 0.00 0.00 178.16 177.91 2qqh n ASN 181 N -4.57 0.00 -4.45 -2.11 3.02 -1.26 -4.17 115.26 101.72 2qqh n ASN 181 Ca 0.15 0.44 -0.44 0.00 -0.03 0.00 0.00 54.58 54.71 2qqh n ASN 181 Cb 0.23 -0.45 -0.06 0.00 -0.61 0.00 0.00 39.78 38.89 2qqh n ASN 181 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2qqh s PHE 182 N -2.90 3.03 0.34 3.10 0.40 -0.56 -0.68 117.98 120.71 2qqh s PHE 182 Ca 0.02 -0.52 0.07 0.00 -0.60 0.00 0.00 56.93 55.91 2qqh s PHE 182 Cb 0.02 -3.58 0.62 0.00 0.51 0.00 0.00 43.02 40.59 2qqh s PHE 182 CO 0.05 -1.06 1.82 1.25 0.70 0.00 0.00 175.22 177.99 2qqh h LEU 183 N 9.79 0.28 -7.40 -0.37 5.85 -1.02 -3.45 115.31 119.00 2qqh h LEU 183 Ca -0.27 -0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.24 2qqh h LEU 183 Cb 1.09 -0.08 -0.23 0.00 0.37 0.00 0.00 40.66 41.81 2qqh h LEU 183 CO 0.98 0.52 -0.29 -0.54 -0.34 0.00 0.00 178.44 178.76 2qqh s LYS 184 N -4.54 0.48 -0.28 1.25 -0.14 -0.80 -4.96 119.74 110.75 2qqh s LYS 184 Ca -0.05 0.34 -0.16 0.00 -1.36 0.00 0.00 55.97 54.73 2qqh s LYS 184 Cb 0.15 0.23 0.08 0.00 -1.68 0.00 0.00 37.83 36.61 2qqh s LYS 184 CO 0.75 -0.08 0.70 -0.47 -0.76 0.00 0.00 175.35 175.49 2qqh s TYR 185 N -0.17 -1.04 0.05 3.18 6.14 -1.26 -1.39 117.35 122.86 2qqh s TYR 185 Ca -0.03 2.09 -0.13 0.00 0.64 0.00 0.00 57.07 59.64 2qqh s TYR 185 Cb -0.03 0.62 0.02 0.00 0.42 0.00 0.00 41.96 42.99 2qqh s TYR 185 CO 0.01 -0.52 0.29 -3.38 0.64 0.00 0.00 175.55 172.60 2qqh s HIS 186 N 1.62 -0.08 0.46 4.97 -3.43 -0.86 -4.96 115.29 113.02 2qqh s HIS 186 Ca -0.10 -0.10 -0.12 0.00 -0.80 0.00 0.00 55.06 53.93 2qqh s HIS 186 Cb -0.05 0.08 -0.07 0.00 -1.43 0.00 0.00 32.58 31.12 2qqh s HIS 186 CO -0.20 -0.52 0.86 -0.06 -2.00 0.00 0.00 174.74 172.83 2qqh s PHE 187 N -2.76 3.48 0.22 0.38 0.08 -1.26 -1.32 117.98 116.79 2qqh s PHE 187 Ca -0.03 1.19 -0.04 0.00 0.12 0.00 0.00 56.93 58.17 2qqh s PHE 187 Cb -0.00 -2.57 -0.03 0.00 -0.57 0.00 0.00 43.02 39.85 2qqh s PHE 187 CO -0.05 -0.25 0.22 -1.21 -0.10 0.00 0.00 175.22 173.84 2qqh s GLU 188 N -4.07 1.30 -0.37 0.44 0.41 0.52 -4.78 118.70 112.15 2qqh s GLU 188 Ca 0.54 -1.55 0.02 0.00 -0.41 0.00 0.00 54.97 53.56 2qqh s GLU 188 Cb -0.10 0.32 0.15 0.00 -1.78 0.00 0.00 34.13 32.72 2qqh s GLU 188 CO 0.34 -0.46 0.27 0.00 -0.49 0.00 0.00 175.26 174.91 2qqh s ALA 189 N -4.10 0.97 -0.14 5.21 0.00 -1.21 -4.09 121.76 118.40 2qqh s ALA 189 Ca 0.35 -1.99 0.01 0.00 0.00 0.00 0.00 51.96 50.33 2qqh s ALA 189 Cb 0.05 -1.63 -0.01 0.00 0.00 0.00 0.00 23.12 21.53 2qqh s ALA 189 CO 0.12 -2.07 -0.15 -0.51 0.00 0.00 0.00 175.76 173.15 2qqh s LEU 190 N 0.76 2.54 -0.14 0.00 1.43 -0.64 -4.96 118.68 117.68 2qqh s LEU 190 Ca 0.23 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 2qqh s LEU 190 Cb -0.14 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.52 2qqh s LEU 190 CO -0.06 0.13 -0.19 0.00 0.23 0.00 0.00 176.35 176.46 2qqh s ALA 191 N 0.55 2.37 -0.26 4.21 0.00 -1.26 -0.63 121.76 126.74 2qqh s ALA 191 Ca -0.10 -1.02 -0.02 0.00 0.00 0.00 0.00 51.96 50.82 2qqh s ALA 191 Cb -0.16 -1.07 0.03 0.00 0.00 0.00 0.00 23.12 21.92 2qqh s ALA 191 CO 0.04 0.08 -0.05 -0.51 0.00 0.00 0.00 175.76 175.32 2qqh s ASP 192 N 0.65 4.43 -0.39 0.00 1.01 0.15 -4.97 116.67 117.55 2qqh s ASP 192 Ca -0.10 -0.90 -0.16 0.00 0.71 0.00 0.00 52.55 52.10 2qqh s ASP 192 Cb -0.16 -1.68 0.01 0.00 1.01 0.00 0.00 42.92 42.10 2qqh s ASP 192 CO 0.02 -0.14 0.39 0.42 0.21 0.00 0.00 175.17 176.07 2qqh s THR 193 N 1.33 5.14 -1.22 -1.27 -4.23 -1.26 -0.30 115.64 113.83 2qqh s THR 193 Ca -0.00 -0.27 -0.09 0.00 -1.18 0.00 0.00 61.69 60.15 2qqh s THR 193 Cb -0.17 -3.95 0.21 0.00 1.34 0.00 0.00 72.50 69.92 2qqh s THR 193 CO -0.04 -0.30 1.70 0.61 -0.54 0.00 0.00 174.62 176.05 2qqh n GLY 194 N 5.07 4.67 0.00 3.99 0.00 0.32 -4.87 105.19 114.38 2qqh n GLY 194 Ca -0.08 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.70 2qqh n GLY 194 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2qqh n ILE 195 N 2.99 0.00 -1.49 -0.61 -5.35 -1.26 -3.04 119.36 110.60 2qqh n ILE 195 Ca 0.36 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.84 2qqh n ILE 195 Cb 0.36 -0.33 0.00 0.00 -1.74 0.00 0.00 39.64 37.94 2qqh n ILE 195 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2qqh n SER 196 N -0.53 0.00 0.00 7.28 2.88 -1.20 -4.53 113.62 117.52 2qqh n SER 196 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2qqh n SER 196 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2qqh n SER 196 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2qqh n SER 197 N 2.77 0.00 0.00 -3.46 7.64 -1.26 -5.10 113.62 114.21 2qqh n SER 197 Ca 0.00 -0.47 0.00 0.00 1.01 0.00 0.00 58.87 59.41 2qqh n SER 197 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2qqh n SER 197 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qqh n GLU 198 N 0.00 0.00 -1.44 1.43 4.71 -1.26 -5.02 120.64 119.06 2qqh n GLU 198 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.84 2qqh n GLU 198 Cb 0.12 0.00 0.08 0.00 -1.01 0.00 0.00 31.44 30.63 2qqh n GLU 198 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 2qqh s PHE 199 N 0.00 2.84 -0.30 -0.32 2.99 -1.26 -3.91 117.98 118.02 2qqh s PHE 199 Ca 0.00 1.40 -0.18 0.00 0.00 0.00 0.00 56.93 58.16 2qqh s PHE 199 Cb 0.00 -2.99 0.19 0.00 0.00 0.00 0.00 43.02 40.22 2qqh s PHE 199 CO 0.00 -1.58 1.21 0.71 -0.00 0.00 0.00 175.22 175.55 2qqh s TYR 200 N -3.01 -0.22 0.26 0.36 2.02 -1.15 -4.89 117.35 110.72 2qqh s TYR 200 Ca 0.60 0.40 -0.03 0.00 -0.37 0.00 0.00 57.07 57.66 2qqh s TYR 200 Cb -0.15 0.13 0.33 0.00 -0.40 0.00 0.00 41.96 41.87 2qqh s TYR 200 CO 0.55 -0.11 1.82 -0.44 -1.57 0.00 0.00 175.55 175.80 2qqh h ASP 201 N 6.59 0.88 -4.51 2.29 5.19 -1.88 -1.88 116.42 123.09 2qqh h ASP 201 Ca -0.18 -0.15 -0.26 0.00 -0.62 0.00 0.00 57.03 55.82 2qqh h ASP 201 Cb 1.14 -0.23 -0.15 0.00 0.18 0.00 0.00 39.33 40.27 2qqh h ASP 201 CO 0.12 0.83 -0.68 0.21 -3.12 0.00 0.00 179.24 176.59 2qqh s ASN 202 N -6.51 1.23 -0.13 6.45 2.47 -1.26 -3.50 114.94 113.69 2qqh s ASN 202 Ca -0.11 -1.08 -0.28 0.00 0.42 0.00 0.00 52.86 51.82 2qqh s ASN 202 Cb 0.16 0.10 -0.25 0.00 -1.45 0.00 0.00 41.25 39.81 2qqh s ASN 202 CO 0.81 -0.50 0.76 0.00 -3.72 0.00 0.00 177.10 174.45 2qqh h ALA 203 N 2.83 -0.00 -0.65 1.71 0.00 -1.96 -2.61 119.26 118.58 2qqh h ALA 203 Ca -0.36 -0.47 0.04 0.00 0.00 0.00 0.00 54.91 54.12 2qqh h ALA 203 Cb 1.18 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2qqh h ALA 203 CO 0.64 -0.01 0.38 -0.91 0.00 0.00 0.00 179.25 179.34 2qqh h ASN 204 N -0.98 0.59 -0.61 0.00 2.35 -1.98 -0.14 115.58 114.81 2qqh h ASN 204 Ca -0.00 0.02 0.08 0.00 -0.55 0.00 0.00 56.30 55.85 2qqh h ASN 204 Cb 0.94 -0.11 -0.07 0.00 0.05 0.00 0.00 38.32 39.14 2qqh h ASN 204 CO 0.00 0.40 0.27 0.44 -1.65 0.00 0.00 177.43 176.89 2qqh h ASP 205 N 0.73 0.32 -0.40 5.81 3.32 -1.99 0.20 116.42 124.41 2qqh h ASP 205 Ca 0.27 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 2qqh h ASP 205 Cb 0.10 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2qqh h ASP 205 CO -0.14 0.20 0.21 0.25 -1.72 0.00 0.00 179.24 178.03 2qqh h LEU 206 N 0.48 0.50 -0.33 1.55 5.85 -0.87 0.10 115.31 122.60 2qqh h LEU 206 Ca 0.30 -0.10 -0.19 0.00 0.84 0.00 0.00 57.88 58.72 2qqh h LEU 206 Cb 0.32 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2qqh h LEU 206 CO -0.26 0.46 -0.83 -0.07 -0.34 0.00 0.00 178.44 177.40 2qqh h LEU 207 N 0.51 0.28 -0.12 2.25 3.38 -0.70 -1.71 115.31 119.19 2qqh h LEU 207 Ca 0.14 -0.22 -0.21 0.00 0.09 0.00 0.00 57.88 57.68 2qqh h LEU 207 Cb 0.08 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.75 2qqh h LEU 207 CO -0.02 1.00 -0.74 0.77 0.09 0.00 0.00 178.44 179.54 2qqh h SER 208 N 0.13 0.87 0.83 -0.43 4.64 -0.59 -3.19 113.55 115.81 2qqh h SER 208 Ca -0.04 -0.65 0.00 0.00 -0.47 0.00 0.00 61.79 60.63 2qqh h SER 208 Cb 1.44 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2qqh h SER 208 CO 0.13 1.38 0.00 0.29 -0.87 0.00 0.00 176.83 177.76 2qqh n LYS 209 N -4.00 0.02 0.03 4.77 5.02 0.35 -2.02 118.16 122.33 2qqh n LYS 209 Ca -0.08 0.11 -0.11 0.00 -2.02 0.00 0.00 58.31 56.22 2qqh n LYS 209 Cb 0.73 -1.52 0.02 0.00 -0.02 0.00 0.00 35.03 34.23 2qqh n LYS 209 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2qqh h VAL 210 N 0.00 1.35 0.00 -0.18 2.07 -1.29 -2.28 116.25 115.92 2qqh h VAL 210 Ca 0.00 -2.03 -0.00 0.00 0.82 0.00 0.00 66.70 65.49 2qqh h VAL 210 Cb 0.41 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 2qqh h VAL 210 CO 0.00 0.62 -0.00 0.11 0.02 0.00 0.00 177.57 178.32 2qqh h LYS 211 N 0.35 -0.00 -0.08 1.57 1.57 -1.44 -3.28 116.57 115.26 2qqh h LYS 211 Ca -0.02 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 2qqh h LYS 211 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 2qqh h LYS 211 CO 0.12 0.58 -0.34 0.87 -0.57 0.00 0.00 179.45 180.12 2qqh h LYS 212 N -1.00 0.36 0.00 3.15 1.79 -1.56 -3.39 116.57 115.92 2qqh h LYS 212 Ca -0.00 -0.29 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 2qqh h LYS 212 Cb 0.59 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2qqh h LYS 212 CO 0.00 0.93 -1.17 -0.25 -1.08 0.00 0.00 179.45 177.88 2qqh n ASP 213 N -4.40 0.63 -4.78 0.86 9.92 -0.86 -5.00 116.55 112.90 2qqh n ASP 213 Ca -0.08 -0.44 -0.22 0.00 -0.53 0.00 0.00 54.79 53.52 2qqh n ASP 213 Cb 0.51 1.06 -0.05 0.00 -0.64 0.00 0.00 41.12 42.00 2qqh n ASP 213 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2qqh s LYS 214 N -3.18 2.64 0.94 -1.24 3.01 -1.20 -5.03 119.74 115.68 2qqh s LYS 214 Ca 0.03 -1.30 -0.12 0.00 -1.01 0.00 0.00 55.97 53.58 2qqh s LYS 214 Cb 0.15 -2.38 0.15 0.00 -1.01 0.00 0.00 37.83 34.74 2qqh s LYS 214 CO 0.84 0.24 1.10 -1.54 0.51 0.00 0.00 175.35 176.50 2qqh s SER 215 N -3.86 3.15 0.57 2.83 1.04 -1.26 -4.91 113.70 111.26 2qqh s SER 215 Ca 0.36 1.22 0.34 0.00 0.48 0.00 0.00 55.95 58.35 2qqh s SER 215 Cb -0.06 -1.88 1.73 0.00 0.10 0.00 0.00 66.02 65.91 2qqh s SER 215 CO 0.24 -2.80 2.14 0.44 0.98 0.00 0.00 173.24 174.24 2qqh h ASP 216 N -1.67 0.00 0.00 7.02 5.19 -1.97 -1.47 116.42 123.53 2qqh h ASP 216 Ca -0.52 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.89 2qqh h ASP 216 Cb 1.31 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.82 2qqh h ASP 216 CO 0.58 0.05 0.00 -1.54 -3.12 0.00 0.00 179.24 175.21 2qqh n SER 217 N -3.33 0.00 -0.96 6.45 3.41 -1.26 -3.05 113.62 114.87 2qqh n SER 217 Ca -0.02 -1.33 0.10 0.00 -0.26 0.00 0.00 58.87 57.37 2qqh n SER 217 Cb 0.20 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.42 2qqh n SER 217 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2qqh n PHE 218 N -0.82 0.52 -3.12 7.33 3.01 -0.55 -3.68 117.46 120.15 2qqh n PHE 218 Ca 0.15 -0.26 0.00 0.00 1.01 0.00 0.00 57.45 58.35 2qqh n PHE 218 Cb 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 2qqh n PHE 218 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qqh n GLY 219 N 1.37 -0.70 3.75 1.37 0.00 -1.17 -4.90 105.19 104.91 2qqh n GLY 219 Ca 0.18 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.22 2qqh n GLY 219 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qqh s VAL 220 N -3.00 4.36 0.17 1.61 1.01 0.25 -4.95 120.40 119.85 2qqh s VAL 220 Ca 0.00 -0.92 0.11 0.00 0.00 0.00 0.00 61.98 61.18 2qqh s VAL 220 Cb 0.00 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 2qqh s VAL 220 CO 0.00 0.06 -0.25 0.42 0.00 0.00 0.00 175.10 175.33 2qqh s THR 221 N -1.46 2.30 0.03 3.92 -4.23 -1.26 0.62 115.64 115.56 2qqh s THR 221 Ca 0.29 -1.92 0.05 0.00 -1.18 0.00 0.00 61.69 58.93 2qqh s THR 221 Cb -0.11 -2.06 -0.02 0.00 1.34 0.00 0.00 72.50 71.64 2qqh s THR 221 CO 0.21 -0.04 -0.14 0.27 -0.54 0.00 0.00 174.62 174.39 2qqh s ILE 222 N -1.43 1.07 0.01 2.99 -4.36 -0.17 -2.40 121.20 116.91 2qqh s ILE 222 Ca 0.18 -0.90 -0.03 0.00 -0.26 0.00 0.00 60.65 59.63 2qqh s ILE 222 Cb -0.09 -0.96 -0.01 0.00 1.25 0.00 0.00 42.46 42.66 2qqh s ILE 222 CO 0.08 0.05 0.06 -0.83 0.24 0.00 0.00 174.94 174.54 2qqh s GLY 223 N -0.97 0.12 -0.29 6.27 0.00 -0.84 0.14 107.32 111.75 2qqh s GLY 223 Ca 0.02 -0.29 -0.08 0.00 0.00 0.00 0.00 44.72 44.37 2qqh s GLY 223 CO 0.01 -0.38 0.10 -0.42 0.00 0.00 0.00 173.10 172.41 2qqh s ILE 224 N -1.22 4.26 0.00 0.90 1.01 -1.25 -1.00 121.20 123.90 2qqh s ILE 224 Ca -0.13 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.07 2qqh s ILE 224 Cb -0.08 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.27 2qqh s ILE 224 CO 0.00 0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.71 2qqh n GLY 225 N 4.92 -0.62 0.00 6.18 0.00 0.06 -3.24 105.19 112.49 2qqh n GLY 225 Ca -0.15 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.71 2qqh n GLY 225 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qqh n PRO 226 N 0.00 0.00 0.00 1.61 -0.05 -1.26 -4.28 135.00 131.02 2qqh n PRO 226 Ca 0.00 0.13 0.00 0.00 -0.05 0.00 0.00 63.50 63.58 2qqh n PRO 226 Cb 0.00 -0.51 0.00 0.00 -0.05 0.00 0.00 33.50 32.94 2qqh n PRO 226 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2qqh n ALA 227 N -1.51 2.18 -2.15 0.55 0.00 -1.26 -4.72 120.51 113.60 2qqh n ALA 227 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.07 2qqh n ALA 227 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 2qqh n ALA 227 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2qqh s GLY 228 N -1.20 0.35 0.09 0.00 0.00 -1.20 -4.94 107.32 100.42 2qqh s GLY 228 Ca 0.00 -0.95 -0.35 0.00 0.00 0.00 0.00 44.72 43.42 2qqh s GLY 228 CO 0.00 3.27 1.50 -1.14 0.00 0.00 0.00 173.10 176.73 2qqh n SER 229 N 12.22 2.45 -4.77 1.64 3.41 -1.26 -3.93 113.62 123.38 2qqh n SER 229 Ca 0.21 1.09 -0.39 0.00 -0.26 0.00 0.00 58.87 59.52 2qqh n SER 229 Cb 0.51 -1.31 -0.00 0.00 -0.26 0.00 0.00 64.21 63.15 2qqh n SER 229 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 2qqh s PRO 230 N 1.03 3.84 -0.20 4.33 0.02 -1.26 -4.66 135.00 138.10 2qqh s PRO 230 Ca 0.83 2.09 -0.09 0.00 0.02 0.00 0.00 61.00 63.85 2qqh s PRO 230 Cb -0.82 -2.64 -0.05 0.00 0.02 0.00 0.00 34.50 31.02 2qqh s PRO 230 CO 0.44 -0.57 0.10 -1.17 -0.33 0.00 0.00 177.00 175.47 2qqh s LEU 231 N -2.65 4.00 -0.20 -5.54 2.96 0.38 -4.93 118.68 112.70 2qqh s LEU 231 Ca 0.60 0.13 -0.28 0.00 -0.22 0.00 0.00 54.13 54.35 2qqh s LEU 231 Cb -0.36 -2.03 0.00 0.00 0.50 0.00 0.00 46.19 44.30 2qqh s LEU 231 CO 0.46 0.15 1.00 -0.22 -1.32 0.00 0.00 176.35 176.42 2qqh s LEU 232 N 0.50 4.14 -0.39 -0.68 2.96 -1.26 -1.00 118.68 122.95 2qqh s LEU 232 Ca 0.06 1.37 0.05 0.00 -0.22 0.00 0.00 54.13 55.39 2qqh s LEU 232 Cb -0.12 -3.49 0.45 0.00 0.50 0.00 0.00 46.19 43.52 2qqh s LEU 232 CO 0.00 -0.59 1.30 1.33 -1.32 0.00 0.00 176.35 177.07 2qqh n VAL 233 N 5.10 2.66 0.00 1.68 0.24 0.20 -4.82 118.33 123.40 2qqh n VAL 233 Ca 0.10 -4.23 0.00 0.00 -2.04 0.00 0.00 64.34 58.17 2qqh n VAL 233 Cb 0.47 -1.17 0.00 0.00 -1.47 0.00 0.00 33.84 31.67 2qqh n VAL 233 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qqh n GLY 234 N -0.68 3.38 0.15 7.63 0.00 -1.26 -1.91 105.19 112.50 2qqh n GLY 234 Ca 0.45 0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.56 2qqh n GLY 234 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2qqh h VAL 235 N 0.00 0.54 0.00 1.61 2.07 -1.91 0.73 116.25 119.28 2qqh h VAL 235 Ca 0.00 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.72 2qqh h VAL 235 Cb 0.00 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2qqh h VAL 235 CO 0.00 0.31 0.00 0.61 0.02 0.00 0.00 177.57 178.51 2qqh n GLY 236 N 1.22 0.89 3.97 2.17 0.00 -0.80 -4.72 105.19 107.91 2qqh n GLY 236 Ca 0.01 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 2qqh n GLY 236 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qqh s VAL 237 N -2.00 2.02 0.82 1.61 -7.23 -1.26 -5.02 120.40 109.33 2qqh s VAL 237 Ca 0.00 -0.31 -0.11 0.00 -1.81 0.00 0.00 61.98 59.75 2qqh s VAL 237 Cb 0.00 -2.71 0.08 0.00 0.56 0.00 0.00 36.38 34.31 2qqh s VAL 237 CO 0.00 0.00 1.09 -0.94 -0.31 0.00 0.00 175.10 174.94 2qqh s SER 238 N -4.87 4.21 0.54 4.85 1.04 -1.24 -4.80 113.70 113.42 2qqh s SER 238 Ca 0.72 1.54 0.26 0.00 0.48 0.00 0.00 55.95 58.96 2qqh s SER 238 Cb -0.03 -2.27 1.52 0.00 0.10 0.00 0.00 66.02 65.34 2qqh s SER 238 CO 0.49 -2.18 2.13 0.45 0.98 0.00 0.00 173.24 175.11 2qqh h HIS 239 N -1.23 0.00 0.04 5.02 -0.00 -1.49 0.69 115.15 118.18 2qqh h HIS 239 Ca -0.47 0.00 -0.24 0.00 -0.00 0.00 0.00 60.37 59.67 2qqh h HIS 239 Cb 1.26 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.65 2qqh h HIS 239 CO 0.50 0.09 -1.12 0.66 -0.00 0.00 0.00 177.93 178.05 2qqh h SER 240 N 0.00 0.14 -0.10 2.45 4.64 -1.92 -2.82 113.55 115.94 2qqh h SER 240 Ca -0.00 -0.16 -0.18 0.00 -0.47 0.00 0.00 61.79 60.98 2qqh h SER 240 Cb 0.22 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2qqh h SER 240 CO 0.01 1.12 -0.59 1.56 -0.87 0.00 0.00 176.83 178.07 2qqh h GLN 241 N 0.02 0.70 -0.88 4.77 4.20 -1.72 -2.73 115.11 119.47 2qqh h GLN 241 Ca -0.07 -0.47 0.03 0.00 0.06 0.00 0.00 58.65 58.21 2qqh h GLN 241 Cb 1.85 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 29.64 2qqh h GLN 241 CO 0.15 1.09 0.58 -0.44 -0.67 0.00 0.00 178.83 179.54 2qqh h ASP 242 N 0.53 0.96 -0.27 1.46 3.32 -0.94 -1.45 116.42 120.02 2qqh h ASP 242 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2qqh h ASP 242 Cb 1.17 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.50 2qqh h ASP 242 CO 0.12 0.66 0.00 0.35 -1.72 0.00 0.00 179.24 178.65 2qqh n THR 243 N -4.44 1.22 -0.01 0.35 -2.24 -1.07 -2.16 114.28 105.93 2qqh n THR 243 Ca 0.12 -0.63 -0.02 0.00 -2.27 0.00 0.00 64.05 61.25 2qqh n THR 243 Cb 0.10 -0.37 -0.02 0.00 -2.10 0.00 0.00 70.33 67.95 2qqh n THR 243 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2qqh n SER 244 N 0.30 3.96 0.26 3.42 7.64 -0.85 -3.92 113.62 124.43 2qqh n SER 244 Ca 0.13 -0.01 0.14 0.00 1.01 0.00 0.00 58.87 60.14 2qqh n SER 244 Cb 0.66 0.14 0.69 0.00 -1.01 0.00 0.00 64.21 64.69 2qqh n SER 244 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 2qqh h PHE 245 N 0.00 0.00 0.00 1.43 3.04 -1.35 -1.68 116.94 118.38 2qqh h PHE 245 Ca -0.07 0.00 -0.18 0.00 3.98 0.00 0.00 57.97 61.70 2qqh h PHE 245 Cb 1.12 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.60 2qqh h PHE 245 CO 0.00 0.11 -1.00 1.25 -2.02 0.00 0.00 178.31 176.65 2qqh h LEU 246 N 0.00 0.01 -0.34 0.59 7.12 -1.67 -2.66 115.31 118.37 2qqh h LEU 246 Ca -0.00 -0.63 -0.06 0.00 0.13 0.00 0.00 57.88 57.32 2qqh h LEU 246 Cb 0.47 -0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.59 2qqh h LEU 246 CO 0.01 1.39 -0.03 0.78 -0.13 0.00 0.00 178.44 180.46 2qqh h ASN 247 N -0.97 0.62 1.33 1.25 -0.26 -1.68 0.50 115.58 116.37 2qqh h ASN 247 Ca -0.27 -0.33 -0.01 0.00 -0.56 0.00 0.00 56.30 55.12 2qqh h ASN 247 Cb 1.26 -0.17 -0.00 0.00 -1.06 0.00 0.00 38.32 38.35 2qqh h ASN 247 CO -0.16 0.80 -0.05 -0.33 -1.06 0.00 0.00 177.43 176.64 2qqh h GLU 248 N 0.42 0.00 0.00 0.81 3.07 -1.49 -3.29 114.58 114.10 2qqh h GLU 248 Ca 0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 2qqh h GLU 248 Cb 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.42 2qqh h GLU 248 CO 0.02 0.05 -0.11 1.25 -1.40 0.00 0.00 179.01 178.82 2qqh h LEU 249 N 0.00 0.00 -0.83 1.33 6.46 -1.28 -3.40 115.31 117.58 2qqh h LEU 249 Ca -0.00 0.00 0.11 0.00 -0.12 0.00 0.00 57.88 57.87 2qqh h LEU 249 Cb 0.72 0.00 -0.12 0.00 -0.73 0.00 0.00 40.66 40.53 2qqh h LEU 249 CO 0.01 0.54 -0.38 0.59 -0.62 0.00 0.00 178.44 178.57 2qqh n ASN 250 N -4.64 -0.65 -4.49 1.25 3.02 0.18 -4.03 115.26 105.90 2qqh n ASN 250 Ca -0.02 1.46 -0.43 0.00 -0.03 0.00 0.00 54.58 55.57 2qqh n ASN 250 Cb 0.06 -0.29 -0.10 0.00 -0.61 0.00 0.00 39.78 38.84 2qqh n ASN 250 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2qqh n LYS 251 N -5.17 0.51 0.00 3.52 2.85 -1.24 -3.83 118.16 114.80 2qqh n LYS 251 Ca 0.06 0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.37 2qqh n LYS 251 Cb 0.30 -2.26 0.00 0.00 -0.65 0.00 0.00 35.03 32.41 2qqh n LYS 251 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2qqh n TYR 252 N 11.84 0.00 -3.95 5.58 4.01 -1.26 -5.03 117.16 128.35 2qqh n TYR 252 Ca 0.52 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.99 2qqh n TYR 252 Cb 0.22 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.21 2qqh n TYR 252 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2qqh s ASN 253 N 0.00 6.28 0.00 7.72 3.84 -1.25 -5.09 114.94 126.44 2qqh s ASN 253 Ca 0.00 0.16 0.00 0.00 0.21 0.00 0.00 52.86 53.23 2qqh s ASN 253 Cb 0.00 -1.88 0.00 0.00 -0.55 0.00 0.00 41.25 38.82 2qqh s ASN 253 CO 0.00 0.07 0.00 -0.62 -2.79 0.00 0.00 177.10 173.76 2qqh n GLU 254 N -0.40 0.00 -3.94 0.43 1.02 -1.26 -4.85 120.64 111.63 2qqh n GLU 254 Ca -0.07 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.77 2qqh n GLU 254 Cb 0.54 -0.17 -0.15 0.00 -0.02 0.00 0.00 31.44 31.64 2qqh n GLU 254 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2qqh s LYS 255 N 0.00 1.55 0.00 3.49 1.02 -1.26 -5.02 119.74 119.53 2qqh s LYS 255 Ca 0.00 -1.18 0.00 0.00 0.02 0.00 0.00 55.97 54.81 2qqh s LYS 255 Cb 0.00 -2.65 0.00 0.00 -0.52 0.00 0.00 37.83 34.66 2qqh s LYS 255 CO 0.00 -0.70 0.00 0.36 -0.92 0.00 0.00 175.35 174.09 2qqh n LYS 256 N 4.60 0.00 0.00 1.68 -0.00 -1.26 -5.01 118.16 118.16 2qqh n LYS 256 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.23 2qqh n LYS 256 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.46 2qqh n LYS 256 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 2qqh n PHE 257 N 0.00 0.00 -4.07 5.58 1.16 -1.23 -4.81 117.46 114.09 2qqh n PHE 257 Ca 0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 57.45 55.38 2qqh n PHE 257 Cb 0.00 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 37.71 2qqh n PHE 257 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2qqh s ILE 258 N 0.85 0.44 -0.07 1.97 -1.09 -1.21 -4.18 121.20 117.92 2qqh s ILE 258 Ca 0.00 -0.05 0.01 0.00 -2.23 0.00 0.00 60.65 58.38 2qqh s ILE 258 Cb 0.00 -0.50 0.02 0.00 -1.58 0.00 0.00 42.46 40.40 2qqh s ILE 258 CO 0.00 0.21 -0.08 -0.36 -1.23 0.00 0.00 174.94 173.49 2qqh s PHE 259 N 1.04 1.14 0.27 3.97 0.40 -0.71 -1.32 117.98 122.77 2qqh s PHE 259 Ca -0.09 -0.42 0.09 0.00 -0.60 0.00 0.00 56.93 55.91 2qqh s PHE 259 Cb -0.14 -0.93 -0.04 0.00 0.51 0.00 0.00 43.02 42.42 2qqh s PHE 259 CO -0.01 -0.29 0.02 0.95 0.70 0.00 0.00 175.22 176.59 2qqh s THR 260 N 1.05 3.49 -0.02 0.64 -4.23 -1.10 -2.95 115.64 112.52 2qqh s THR 260 Ca -0.08 -1.87 0.02 0.00 -1.18 0.00 0.00 61.69 58.58 2qqh s THR 260 Cb -0.14 -2.89 0.00 0.00 1.34 0.00 0.00 72.50 70.81 2qqh s THR 260 CO -0.00 -0.36 -0.08 -0.60 -0.54 0.00 0.00 174.62 173.03 2qqh s ARG 261 N -3.69 0.85 -0.09 3.99 3.52 -1.26 -1.68 118.95 120.59 2qqh s ARG 261 Ca 0.32 -0.27 0.02 0.00 -0.13 0.00 0.00 55.73 55.67 2qqh s ARG 261 Cb -0.06 -0.81 -0.02 0.00 -1.56 0.00 0.00 34.95 32.50 2qqh s ARG 261 CO 0.20 0.11 -0.16 0.42 -0.81 0.00 0.00 175.30 175.06 2qqh s ILE 262 N 0.17 2.85 -0.03 4.11 1.01 -0.19 -3.26 121.20 125.86 2qqh s ILE 262 Ca -0.02 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.86 2qqh s ILE 262 Cb -0.08 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.28 2qqh s ILE 262 CO 0.00 0.56 0.00 0.12 0.00 0.00 0.00 174.94 175.62 2qqh s PHE 263 N -0.09 0.30 -0.05 3.97 2.19 -1.17 0.76 117.98 123.90 2qqh s PHE 263 Ca -0.03 0.01 0.06 0.00 0.33 0.00 0.00 56.93 57.30 2qqh s PHE 263 Cb -0.14 -0.41 -0.01 0.00 -1.31 0.00 0.00 43.02 41.15 2qqh s PHE 263 CO 0.04 -0.13 -0.23 0.99 1.83 0.00 0.00 175.22 177.71 2qqh s THR 264 N 1.07 1.89 -0.13 0.12 2.01 -0.42 0.12 115.64 120.30 2qqh s THR 264 Ca -0.09 -0.99 0.02 0.00 0.31 0.00 0.00 61.69 60.94 2qqh s THR 264 Cb -0.13 -1.60 0.01 0.00 0.01 0.00 0.00 72.50 70.79 2qqh s THR 264 CO -0.02 0.53 -0.19 -0.75 -0.69 0.00 0.00 174.62 173.50 2qqh s LYS 265 N -0.21 2.67 -0.11 4.92 2.20 0.58 -1.23 119.74 128.57 2qqh s LYS 265 Ca -0.01 -0.73 0.03 0.00 -0.36 0.00 0.00 55.97 54.91 2qqh s LYS 265 Cb -0.12 -2.20 0.00 0.00 -1.51 0.00 0.00 37.83 34.00 2qqh s LYS 265 CO 0.02 -0.04 -0.22 0.08 -0.36 0.00 0.00 175.35 174.83 2qqh s VAL 266 N 0.91 1.93 -0.31 4.02 1.01 -0.57 0.32 120.40 127.71 2qqh s VAL 266 Ca -0.06 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 60.87 2qqh s VAL 266 Cb -0.15 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 2qqh s VAL 266 CO -0.02 0.53 0.19 -1.10 0.00 0.00 0.00 175.10 174.70 2qqh s GLN 267 N 0.51 3.56 0.02 2.72 -0.21 0.19 -1.27 119.66 125.19 2qqh s GLN 267 Ca -0.15 -0.58 0.22 0.00 0.02 0.00 0.00 55.36 54.87 2qqh s GLN 267 Cb -0.17 -3.68 -0.03 0.00 1.00 0.00 0.00 33.01 30.13 2qqh s GLN 267 CO 0.06 -0.36 0.97 0.25 -2.12 0.00 0.00 175.29 174.08 2qqh n THR 268 N 5.05 0.08 -3.52 -0.19 -2.24 0.59 -1.61 114.28 112.44 2qqh n THR 268 Ca -0.13 -0.17 -0.16 0.00 -2.27 0.00 0.00 64.05 61.31 2qqh n THR 268 Cb 0.50 0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 69.11 2qqh n THR 268 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qqh s ALA 269 N -3.15 -1.78 -0.07 6.98 0.00 -1.08 -0.35 121.76 122.31 2qqh s ALA 269 Ca 0.04 1.26 -0.00 0.00 0.00 0.00 0.00 51.96 53.26 2qqh s ALA 269 Cb 0.15 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 2qqh s ALA 269 CO 0.82 -0.41 -0.03 -1.01 0.00 0.00 0.00 175.76 175.13 2qqh s HIS 270 N -1.52 3.06 0.07 0.00 0.09 -0.44 -0.09 115.29 116.47 2qqh s HIS 270 Ca -0.08 0.12 -0.06 0.00 -0.00 0.00 0.00 55.06 55.04 2qqh s HIS 270 Cb -0.00 -1.75 -0.01 0.00 -0.00 0.00 0.00 32.58 30.82 2qqh s HIS 270 CO 0.06 0.41 0.11 -0.59 -0.00 0.00 0.00 174.74 174.73 2qqh s PHE 271 N -0.87 0.26 -0.04 1.40 -0.71 -0.05 -2.03 117.98 115.93 2qqh s PHE 271 Ca 0.13 -0.69 -0.02 0.00 -1.04 0.00 0.00 56.93 55.31 2qqh s PHE 271 Cb -0.11 -0.16 0.03 0.00 -1.21 0.00 0.00 43.02 41.57 2qqh s PHE 271 CO 0.03 -0.46 0.08 0.21 -1.34 0.00 0.00 175.22 173.73 2qqh s LYS 272 N -3.62 -0.01 0.45 1.99 2.20 -0.49 -1.59 119.74 118.67 2qqh s LYS 272 Ca 0.04 0.34 -0.16 0.00 -0.36 0.00 0.00 55.97 55.83 2qqh s LYS 272 Cb 0.05 -0.31 -0.08 0.00 -1.51 0.00 0.00 37.83 35.98 2qqh s LYS 272 CO -0.09 -0.23 0.89 -1.64 -0.36 0.00 0.00 175.35 173.92 2qqh s MET 273 N 1.58 3.96 0.45 4.03 -1.94 0.11 -0.60 119.30 126.88 2qqh s MET 273 Ca -0.03 0.82 -0.25 0.00 -1.71 0.00 0.00 55.69 54.52 2qqh s MET 273 Cb -0.12 -2.24 -0.08 0.00 2.01 0.00 0.00 34.83 34.40 2qqh s MET 273 CO -0.04 -0.12 1.32 1.03 -0.01 0.00 0.00 175.02 177.20 2qqh s ARG 274 N -3.73 3.73 -0.22 2.03 0.52 0.14 -4.54 118.95 116.88 2qqh s ARG 274 Ca 0.57 2.16 0.03 0.00 -0.52 0.00 0.00 55.73 57.97 2qqh s ARG 274 Cb -0.10 -2.59 -0.20 0.00 0.52 0.00 0.00 34.95 32.58 2qqh s ARG 274 CO 0.27 -0.69 -0.04 1.17 0.02 0.00 0.00 175.30 176.02 2qqh n LYS 275 N -0.24 0.68 -3.93 3.54 4.81 -1.26 -4.83 118.16 116.93 2qqh n LYS 275 Ca 0.06 0.16 -0.31 0.00 -0.87 0.00 0.00 58.31 57.35 2qqh n LYS 275 Cb 0.44 -1.57 -0.04 0.00 0.02 0.00 0.00 35.03 33.88 2qqh n LYS 275 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2qqh s ASP 276 N -6.46 6.32 -1.53 3.14 1.01 -1.26 -4.55 116.67 113.33 2qqh s ASP 276 Ca -0.28 0.25 -0.14 0.00 0.71 0.00 0.00 52.55 53.09 2qqh s ASP 276 Cb 0.08 -1.93 0.09 0.00 1.01 0.00 0.00 42.92 42.17 2qqh s ASP 276 CO 0.67 0.16 0.95 -0.67 0.21 0.00 0.00 175.17 176.49 2qqh n ASP 277 N 0.25 -4.77 -4.75 0.27 2.03 -1.26 -4.93 116.55 103.38 2qqh n ASP 277 Ca -0.05 -0.76 -0.38 0.00 0.52 0.00 0.00 54.79 54.12 2qqh n ASP 277 Cb 0.51 -3.82 0.04 0.00 -0.72 0.00 0.00 41.12 37.14 2qqh n ASP 277 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2qqh s ILE 278 N -3.27 2.03 -0.37 5.18 1.01 -1.26 -5.00 121.20 119.51 2qqh s ILE 278 Ca 0.65 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 61.21 2qqh s ILE 278 Cb -0.33 -3.01 0.02 0.00 0.01 0.00 0.00 42.46 39.15 2qqh s ILE 278 CO 0.81 -0.00 0.22 -0.32 0.00 0.00 0.00 174.94 175.65 2qqh s MET 279 N -2.92 2.98 0.46 2.79 -2.45 -1.26 -4.94 119.30 113.96 2qqh s MET 279 Ca 0.72 -0.99 -0.20 0.00 -1.25 0.00 0.00 55.69 53.97 2qqh s MET 279 Cb -0.41 -3.77 -0.10 0.00 1.25 0.00 0.00 34.83 31.80 2qqh s MET 279 CO 0.48 -0.65 0.98 -0.51 1.05 0.00 0.00 175.02 176.37 2qqh s LEU 280 N 1.60 3.87 0.33 4.11 1.43 -1.26 -0.85 118.68 127.91 2qqh s LEU 280 Ca 0.03 1.73 -0.29 0.00 -1.03 0.00 0.00 54.13 54.58 2qqh s LEU 280 Cb -0.19 -4.54 -0.12 0.00 0.03 0.00 0.00 46.19 41.37 2qqh s LEU 280 CO 0.08 -0.51 1.45 -0.67 0.23 0.00 0.00 176.35 176.93 2qqh n ASP 281 N -0.87 3.40 -0.29 2.29 -0.08 0.40 -4.13 116.55 117.26 2qqh n ASP 281 Ca 0.08 1.19 0.04 0.00 -1.51 0.00 0.00 54.79 54.58 2qqh n ASP 281 Cb 0.54 -1.55 0.18 0.00 2.34 0.00 0.00 41.12 42.62 2qqh n ASP 281 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2qqh h GLU 282 N 3.41 0.73 -0.19 -0.67 4.81 -1.91 -1.89 114.58 118.87 2qqh h GLU 282 Ca -0.48 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 58.63 2qqh h GLU 282 Cb 1.25 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 2qqh h GLU 282 CO 0.68 0.48 -0.20 0.78 -0.73 0.00 0.00 179.01 180.03 2qqh h GLY 283 N 0.75 0.50 0.76 1.92 0.00 -1.93 -1.91 103.07 103.17 2qqh h GLY 283 Ca 0.41 -0.52 0.05 0.00 0.00 0.00 0.00 47.33 47.27 2qqh h GLY 283 CO -0.27 0.47 0.53 1.98 0.00 0.00 0.00 176.54 179.25 2qqh h MET 284 N 0.12 0.96 -0.72 4.80 1.85 -1.76 0.61 114.93 120.79 2qqh h MET 284 Ca 0.03 -0.06 -0.05 0.00 -0.61 0.00 0.00 59.70 59.01 2qqh h MET 284 Cb 0.74 -0.22 -0.03 0.00 0.43 0.00 0.00 31.60 32.53 2qqh h MET 284 CO 0.05 0.63 0.27 1.25 -0.40 0.00 0.00 176.91 178.71 2qqh h LEU 285 N 0.99 1.01 -0.52 3.39 5.85 -1.23 0.17 115.31 124.96 2qqh h LEU 285 Ca 0.36 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2qqh h LEU 285 Cb 0.12 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 2qqh h LEU 285 CO -0.16 0.92 0.32 -0.61 -0.34 0.00 0.00 178.44 178.57 2qqh h GLN 286 N 1.04 0.71 -0.65 1.25 5.75 -0.85 -1.50 115.11 120.85 2qqh h GLN 286 Ca 0.24 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.65 2qqh h GLN 286 Cb 0.24 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.61 2qqh h GLN 286 CO -0.02 0.51 0.31 0.77 -2.65 0.00 0.00 178.83 177.76 2qqh h SER 287 N 0.70 0.85 -0.34 -0.69 0.02 -0.15 -2.29 113.55 111.66 2qqh h SER 287 Ca 0.19 -0.13 0.03 0.00 -0.84 0.00 0.00 61.79 61.04 2qqh h SER 287 Cb -0.02 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 2qqh h SER 287 CO -0.04 0.75 0.14 -0.07 -1.14 0.00 0.00 176.83 176.48 2qqh h LEU 288 N 0.90 0.19 -1.76 5.07 3.38 -0.57 -2.31 115.31 120.21 2qqh h LEU 288 Ca 0.22 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2qqh h LEU 288 Cb 0.12 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2qqh h LEU 288 CO -0.03 0.15 0.00 0.24 0.09 0.00 0.00 178.44 178.89 2qqh h MET 289 N 0.31 0.00 -0.02 1.13 2.86 -0.92 -2.28 114.93 116.01 2qqh h MET 289 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2qqh h MET 289 Cb 0.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.76 2qqh h MET 289 CO -0.13 0.00 -0.21 0.39 1.06 0.00 0.00 176.91 178.02 2qqh n GLU 290 N -2.79 1.82 -2.35 1.72 1.02 -0.89 -4.91 120.64 114.26 2qqh n GLU 290 Ca -0.00 -1.49 -0.32 0.00 -0.02 0.00 0.00 57.16 55.32 2qqh n GLU 290 Cb 0.18 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 2qqh n GLU 290 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2qqh s LEU 291 N -2.21 3.61 0.47 -4.62 1.43 -0.86 -5.03 118.68 111.47 2qqh s LEU 291 Ca 0.24 1.60 -0.10 0.00 -1.03 0.00 0.00 54.13 54.84 2qqh s LEU 291 Cb 0.19 -4.51 -0.06 0.00 0.03 0.00 0.00 46.19 41.84 2qqh s LEU 291 CO 0.42 -0.66 0.85 -2.16 0.23 0.00 0.00 176.35 175.03 2qqh s PRO 292 N -4.08 3.72 0.27 1.29 0.04 -1.26 -4.97 135.00 130.02 2qqh s PRO 292 Ca 0.59 0.53 0.00 0.00 0.04 0.00 0.00 61.00 62.17 2qqh s PRO 292 Cb -0.11 -2.30 0.37 0.00 0.04 0.00 0.00 34.50 32.51 2qqh s PRO 292 CO 0.32 -0.20 1.74 -0.44 0.04 0.00 0.00 177.00 178.46 2qqh h ASP 293 N 0.72 0.62 -3.70 6.66 3.32 -1.96 -3.43 116.42 118.64 2qqh h ASP 293 Ca -0.47 -0.18 -0.50 0.00 0.02 0.00 0.00 57.03 55.91 2qqh h ASP 293 Cb 1.19 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.55 2qqh h ASP 293 CO 0.63 0.78 0.20 0.00 -1.72 0.00 0.00 179.24 179.13 2qqh s GLN 294 N -4.72 4.38 0.03 3.56 0.00 -1.26 -4.82 119.66 116.83 2qqh s GLN 294 Ca -0.08 1.05 -0.30 0.00 -0.00 0.00 0.00 55.36 56.03 2qqh s GLN 294 Cb 0.14 -2.83 -0.06 0.00 0.00 0.00 0.00 33.01 30.25 2qqh s GLN 294 CO 0.80 0.34 1.45 -0.47 0.00 0.00 0.00 175.29 177.41 2qqh s TYR 295 N -1.57 2.84 -0.20 9.60 5.04 -1.26 -5.00 117.35 126.80 2qqh s TYR 295 Ca 0.46 0.75 -0.04 0.00 -2.44 0.00 0.00 57.07 55.81 2qqh s TYR 295 Cb -0.17 -3.72 0.07 0.00 0.35 0.00 0.00 41.96 38.48 2qqh s TYR 295 CO 0.22 -2.70 0.07 1.21 -1.34 0.00 0.00 175.55 173.00 2qqh s ASN 296 N 1.83 2.86 0.09 4.32 3.84 -1.26 -5.07 114.94 121.56 2qqh s ASN 296 Ca 0.66 -0.85 -0.33 0.00 0.21 0.00 0.00 52.86 52.54 2qqh s ASN 296 Cb -0.34 -0.47 -0.15 0.00 -0.55 0.00 0.00 41.25 39.75 2qqh s ASN 296 CO 0.28 -0.34 1.52 0.22 -2.79 0.00 0.00 177.10 175.99 2qqh h TYR 297 N 8.31 -1.41 -0.92 0.43 3.20 -1.97 -2.43 116.97 122.17 2qqh h TYR 297 Ca -0.16 0.03 0.22 0.00 3.14 0.00 0.00 58.73 61.96 2qqh h TYR 297 Cb 1.11 0.59 -0.12 0.00 1.54 0.00 0.00 36.73 39.85 2qqh h TYR 297 CO 0.24 -0.59 0.46 0.78 -1.64 0.00 0.00 178.16 177.42 2qqh h GLY 298 N -0.79 1.62 1.41 1.82 0.00 -1.98 0.39 103.07 105.55 2qqh h GLY 298 Ca -0.02 -0.22 -0.14 0.00 0.00 0.00 0.00 47.33 46.94 2qqh h GLY 298 CO -0.20 -0.22 -0.43 -0.33 0.00 0.00 0.00 176.54 175.35 2qqh h MET 299 N 0.49 0.64 0.00 4.80 2.86 -1.91 -0.57 114.93 121.24 2qqh h MET 299 Ca 0.57 -0.34 -0.17 0.00 -2.06 0.00 0.00 59.70 57.70 2qqh h MET 299 Cb 1.05 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 2qqh h MET 299 CO -0.49 0.95 -0.81 1.88 1.06 0.00 0.00 176.91 179.50 2qqh h TYR 300 N 0.52 0.00 -0.51 -0.22 0.05 -0.47 -2.56 116.97 113.78 2qqh h TYR 300 Ca 0.04 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.72 2qqh h TYR 300 Cb 0.96 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.68 2qqh h TYR 300 CO 0.04 0.81 -0.09 0.00 -1.05 0.00 0.00 178.16 177.88 2qqh h ALA 301 N 1.19 0.89 -0.67 3.88 0.00 -0.08 -0.29 119.26 124.18 2qqh h ALA 301 Ca -0.01 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2qqh h ALA 301 Cb 1.47 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 2qqh h ALA 301 CO 0.11 0.64 0.42 -0.22 0.00 0.00 0.00 179.25 180.20 2qqh h LYS 302 N 0.83 0.82 -0.64 0.00 1.63 -1.03 0.77 116.57 118.94 2qqh h LYS 302 Ca 0.14 -0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.93 2qqh h LYS 302 Cb 0.61 -0.18 -0.05 0.00 -0.60 0.00 0.00 32.23 32.01 2qqh h LYS 302 CO 0.04 0.54 0.37 0.35 -3.45 0.00 0.00 179.45 177.30 2qqh h PHE 303 N 0.84 0.69 -0.39 1.91 3.57 -1.00 -1.79 116.94 120.77 2qqh h PHE 303 Ca 0.26 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.71 2qqh h PHE 303 Cb -0.02 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.49 2qqh h PHE 303 CO -0.04 0.36 -0.05 0.82 -2.23 0.00 0.00 178.31 177.17 2qqh h ILE 304 N 0.71 1.23 -0.23 1.41 2.04 -0.23 -1.13 117.51 121.31 2qqh h ILE 304 Ca 0.28 -0.99 -0.12 0.00 1.00 0.00 0.00 64.86 65.03 2qqh h ILE 304 Cb 0.11 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2qqh h ILE 304 CO -0.15 0.34 -0.36 0.78 0.00 0.00 0.00 178.15 178.76 2qqh h ASN 305 N 0.61 0.53 0.07 1.72 -0.26 -0.36 0.69 115.58 118.58 2qqh h ASN 305 Ca 0.12 -0.22 -0.19 0.00 -0.56 0.00 0.00 56.30 55.44 2qqh h ASN 305 Cb 0.46 -0.15 0.02 0.00 -1.06 0.00 0.00 38.32 37.59 2qqh h ASN 305 CO 0.02 0.85 -0.80 0.44 -1.06 0.00 0.00 177.43 176.88 2qqh h ASP 306 N 0.43 0.58 0.00 5.81 3.32 -1.09 -3.40 116.42 122.07 2qqh h ASP 306 Ca 0.04 -0.84 0.00 0.00 0.02 0.00 0.00 57.03 56.25 2qqh h ASP 306 Cb 0.83 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2qqh h ASP 306 CO 0.07 1.36 -1.40 -1.22 -1.72 0.00 0.00 179.24 176.33 2qqh n TYR 307 N -4.10 0.00 0.00 4.55 4.01 -0.45 -0.42 117.16 120.75 2qqh n TYR 307 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 2qqh n TYR 307 Cb 0.79 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 2qqh n TYR 307 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qqh n GLY 308 N 1.59 2.89 0.10 2.72 0.00 0.23 -3.92 105.19 108.80 2qqh n GLY 308 Ca -0.01 -2.03 -0.03 0.00 0.00 0.00 0.00 46.02 43.95 2qqh n GLY 308 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2qqh h THR 309 N 0.00 1.47 -3.56 2.61 2.02 -1.17 -3.43 112.91 110.85 2qqh h THR 309 Ca 0.00 -2.82 -0.07 0.00 0.77 0.00 0.00 66.41 64.30 2qqh h THR 309 Cb 0.00 2.56 -0.13 0.00 -1.74 0.00 0.00 68.15 68.84 2qqh h THR 309 CO 0.00 0.78 -0.19 -1.00 0.37 0.00 0.00 175.52 175.48 2qqh s HIS 310 N -3.02 -0.04 0.12 3.16 3.76 -0.44 -0.38 115.29 118.46 2qqh s HIS 310 Ca 0.01 -0.32 0.04 0.00 -0.15 0.00 0.00 55.06 54.64 2qqh s HIS 310 Cb 0.10 0.13 -0.04 0.00 1.11 0.00 0.00 32.58 33.89 2qqh s HIS 310 CO 0.79 -0.65 -0.10 1.52 -0.85 0.00 0.00 174.74 175.45 2qqh s TYR 311 N -3.83 1.16 0.03 1.40 1.13 -0.12 -0.32 117.35 116.79 2qqh s TYR 311 Ca 0.04 -0.74 -0.21 0.00 -1.41 0.00 0.00 57.07 54.76 2qqh s TYR 311 Cb 0.03 -0.61 -0.06 0.00 -1.10 0.00 0.00 41.96 40.22 2qqh s TYR 311 CO -0.11 0.03 0.61 0.42 -2.51 0.00 0.00 175.55 173.99 2qqh s ILE 312 N -3.05 4.83 -0.05 -3.49 1.01 -1.26 -0.64 121.20 118.55 2qqh s ILE 312 Ca 0.12 1.29 0.11 0.00 0.00 0.00 0.00 60.65 62.17 2qqh s ILE 312 Cb 0.01 -3.95 -0.16 0.00 0.01 0.00 0.00 42.46 38.37 2qqh s ILE 312 CO -0.00 0.45 0.16 0.35 0.00 0.00 0.00 174.94 175.90 2qqh n THR 313 N 2.45 0.29 -3.82 2.92 -2.24 -0.33 -4.85 114.28 108.70 2qqh n THR 313 Ca -0.07 -0.33 -0.05 0.00 -2.27 0.00 0.00 64.05 61.32 2qqh n THR 313 Cb 0.51 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 2qqh n THR 313 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qqh s SER 314 N -3.70 -0.11 0.00 3.42 1.04 -1.22 0.05 113.70 113.18 2qqh s SER 314 Ca -0.05 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.69 2qqh s SER 314 Cb 0.06 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.81 2qqh s SER 314 CO 0.45 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 174.07 2qqh n GLY 315 N -0.53 -0.24 3.39 7.32 0.00 -0.62 -0.22 105.19 114.29 2qqh n GLY 315 Ca -0.05 -1.09 -0.28 0.00 0.00 0.00 0.00 46.02 44.60 2qqh n GLY 315 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qqh s SER 316 N -4.00 3.28 0.20 1.61 0.01 0.03 -0.87 113.70 113.96 2qqh s SER 316 Ca 0.00 -0.79 0.01 0.00 1.31 0.00 0.00 55.95 56.48 2qqh s SER 316 Cb 0.00 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 65.97 2qqh s SER 316 CO 0.00 0.14 0.37 -0.04 0.41 0.00 0.00 173.24 174.12 2qqh s MET 317 N -2.27 3.49 0.00 12.44 1.00 0.87 -0.92 119.30 133.91 2qqh s MET 317 Ca 0.16 -0.44 0.00 0.00 0.00 0.00 0.00 55.69 55.40 2qqh s MET 317 Cb -0.09 -2.87 0.00 0.00 0.00 0.00 0.00 34.83 31.87 2qqh s MET 317 CO 0.07 0.42 0.00 0.41 0.00 0.00 0.00 175.02 175.92 2qqh n GLY 318 N -0.75 -0.05 1.73 -0.03 0.00 -0.73 -0.30 105.19 105.05 2qqh n GLY 318 Ca -0.06 -1.16 -0.01 0.00 0.00 0.00 0.00 46.02 44.79 2qqh n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqh n GLY 319 N 0.00 0.97 2.91 -0.02 0.00 -0.39 -1.10 105.19 107.56 2qqh n GLY 319 Ca 0.00 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 44.87 2qqh n GLY 319 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qqh s ILE 320 N -2.34 0.16 -0.18 -0.61 -5.25 -1.03 -1.51 121.20 110.46 2qqh s ILE 320 Ca 0.10 -0.15 0.01 0.00 -0.99 0.00 0.00 60.65 59.62 2qqh s ILE 320 Cb -0.01 -0.15 0.03 0.00 2.95 0.00 0.00 42.46 45.28 2qqh s ILE 320 CO 0.02 0.01 -0.13 -0.47 -1.79 0.00 0.00 174.94 172.58 2qqh s TYR 321 N -0.15 2.35 -0.17 1.37 6.14 -0.36 -1.65 117.35 124.87 2qqh s TYR 321 Ca -0.00 -1.45 -0.04 0.00 0.64 0.00 0.00 57.07 56.21 2qqh s TYR 321 Cb -0.01 -1.64 -0.03 0.00 0.42 0.00 0.00 41.96 40.70 2qqh s TYR 321 CO -0.00 -0.72 -0.02 -2.00 0.64 0.00 0.00 175.55 173.45 2qqh s GLU 322 N 1.42 3.67 -0.01 4.97 2.12 0.16 -1.30 118.70 129.73 2qqh s GLU 322 Ca 0.02 -0.51 0.06 0.00 0.36 0.00 0.00 54.97 54.89 2qqh s GLU 322 Cb -0.15 -3.00 -0.03 0.00 0.26 0.00 0.00 34.13 31.22 2qqh s GLU 322 CO -0.10 0.15 -0.17 0.71 -0.54 0.00 0.00 175.26 175.32 2qqh s TYR 323 N 0.62 2.60 -0.18 5.30 1.51 0.23 -0.51 117.35 126.92 2qqh s TYR 323 Ca -0.01 -0.23 -0.02 0.00 -1.01 0.00 0.00 57.07 55.79 2qqh s TYR 323 Cb -0.14 -1.54 0.05 0.00 -0.11 0.00 0.00 41.96 40.22 2qqh s TYR 323 CO 0.02 0.19 0.02 0.42 -1.11 0.00 0.00 175.55 175.09 2qqh s ILE 324 N -0.80 0.60 0.18 2.71 1.01 0.97 -1.03 121.20 124.85 2qqh s ILE 324 Ca 0.13 -0.52 -0.26 0.00 0.00 0.00 0.00 60.65 60.00 2qqh s ILE 324 Cb -0.10 -1.03 -0.08 0.00 0.01 0.00 0.00 42.46 41.25 2qqh s ILE 324 CO 0.02 -0.13 0.80 -0.76 0.00 0.00 0.00 174.94 174.88 2qqh s LEU 325 N 1.83 4.59 -0.30 2.97 1.43 -0.68 -1.26 118.68 127.26 2qqh s LEU 325 Ca -0.00 1.69 -0.04 0.00 -1.03 0.00 0.00 54.13 54.75 2qqh s LEU 325 Cb -0.16 -3.37 0.04 0.00 0.03 0.00 0.00 46.19 42.72 2qqh s LEU 325 CO -0.08 0.19 0.03 -0.69 0.23 0.00 0.00 176.35 176.03 2qqh s VAL 326 N -1.18 3.30 0.17 -1.59 1.01 -1.26 -2.70 120.40 118.16 2qqh s VAL 326 Ca 0.37 -1.17 0.10 0.00 0.00 0.00 0.00 61.98 61.28 2qqh s VAL 326 Cb -0.23 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 2qqh s VAL 326 CO 0.27 -0.05 -0.15 -0.63 0.00 0.00 0.00 175.10 174.54 2qqh s ILE 327 N 1.34 2.91 -0.42 2.22 1.01 -0.44 -2.45 121.20 125.37 2qqh s ILE 327 Ca -0.02 -1.73 -0.04 0.00 0.00 0.00 0.00 60.65 58.86 2qqh s ILE 327 Cb -0.19 -2.42 0.11 0.00 0.01 0.00 0.00 42.46 39.98 2qqh s ILE 327 CO -0.00 -0.07 0.23 -0.62 0.00 0.00 0.00 174.94 174.47 2qqh s ASP 328 N -2.67 5.35 0.00 3.58 2.15 -1.26 -3.33 116.67 120.49 2qqh s ASP 328 Ca 0.23 -1.99 0.00 0.00 0.43 0.00 0.00 52.55 51.21 2qqh s ASP 328 Cb -0.09 -1.87 0.00 0.00 -0.30 0.00 0.00 42.92 40.67 2qqh s ASP 328 CO 0.13 -0.57 0.32 0.29 -0.17 0.00 0.00 175.17 175.17 2qqh n LYS 329 N 4.66 0.00 0.28 4.34 5.02 -1.26 0.15 118.16 131.36 2qqh n LYS 329 Ca -0.04 0.32 0.13 0.00 -2.02 0.00 0.00 58.31 56.70 2qqh n LYS 329 Cb 0.41 -0.52 0.68 0.00 -0.02 0.00 0.00 35.03 35.58 2qqh n LYS 329 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qqh h ALA 330 N -0.54 1.29 -1.22 7.82 0.00 -2.00 -2.65 119.26 121.97 2qqh h ALA 330 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qqh h ALA 330 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qqh h ALA 330 CO 0.00 -0.29 0.00 1.63 0.00 0.00 0.00 179.25 180.59 2qqh n LYS 331 N -2.64 0.00 -0.31 0.00 4.76 0.40 -2.93 118.16 117.45 2qqh n LYS 331 Ca -0.02 0.30 0.30 0.00 -2.87 0.00 0.00 58.31 56.02 2qqh n LYS 331 Cb 0.35 -0.93 0.55 0.00 -1.84 0.00 0.00 35.03 33.17 2qqh n LYS 331 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 2qqh n MET 332 N -1.39 -0.06 -0.05 1.97 1.56 -1.10 0.65 117.12 118.70 2qqh n MET 332 Ca 0.00 1.33 -0.01 0.00 -0.27 0.00 0.00 57.70 58.75 2qqh n MET 332 Cb 0.00 -2.38 -0.01 0.00 2.15 0.00 0.00 33.22 32.98 2qqh n MET 332 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 2qqh n GLU 333 N -5.19 -0.05 0.20 2.12 1.02 -1.02 -3.03 120.64 114.70 2qqh n GLU 333 Ca 0.36 0.95 -0.09 0.00 -0.02 0.00 0.00 57.16 58.35 2qqh n GLU 333 Cb 1.20 -1.42 -0.05 0.00 -0.02 0.00 0.00 31.44 31.16 2qqh n GLU 333 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2qqh h SER 334 N 0.00 -0.59 0.00 1.62 4.64 0.33 -3.52 113.55 116.04 2qqh h SER 334 Ca 0.02 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2qqh h SER 334 Cb 0.04 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2qqh h SER 334 CO -0.10 -0.36 0.00 0.00 -0.87 0.00 0.00 176.83 175.50 2qqh n LEU 335 N -3.75 1.05 0.00 5.97 -0.00 -0.70 -5.13 117.00 114.44 2qqh n LEU 335 Ca -0.07 0.30 0.00 0.00 -0.00 0.00 0.00 56.01 56.24 2qqh n LEU 335 Cb 0.24 -0.32 0.00 0.00 -0.00 0.00 0.00 43.42 43.34 2qqh n LEU 335 CO 0.16 -0.32 0.00 0.00 -0.00 0.00 0.00 177.39 177.23 2qqh n ARG 381 N 0.00 0.37 -0.00 0.00 0.63 -1.26 -4.97 116.66 111.43 2qqh n ARG 381 Ca 0.00 -2.01 -0.00 0.00 -0.92 0.00 0.00 57.85 54.92 2qqh n ARG 381 Cb 0.00 -0.53 -0.00 0.00 0.45 0.00 0.00 32.46 32.38 2qqh n ARG 381 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2qqh n LYS 382 N -0.07 0.00 0.00 -0.14 5.02 -1.26 -5.12 118.16 116.60 2qqh n LYS 382 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2qqh n LYS 382 Cb 0.91 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 2qqh n LYS 382 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qqh n ALA 383 N -2.85 0.00 -1.32 7.82 0.00 -1.26 -5.08 120.51 117.82 2qqh n ALA 383 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 2qqh n ALA 383 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.90 2qqh n ALA 383 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2qqh n MET 384 N 0.00 -1.38 -3.32 0.00 2.81 -1.26 -1.80 117.12 112.17 2qqh n MET 384 Ca 0.00 0.77 -0.24 0.00 -1.81 0.00 0.00 57.70 56.42 2qqh n MET 384 Cb 0.00 -4.98 0.03 0.00 -0.71 0.00 0.00 33.22 27.56 2qqh n MET 384 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qqh n ALA 385 N 0.59 -1.08 -1.43 3.04 0.00 -1.26 -4.87 120.51 115.50 2qqh n ALA 385 Ca -0.12 0.23 -0.39 0.00 0.00 0.00 0.00 53.44 53.15 2qqh n ALA 385 Cb 0.44 -3.83 -0.02 0.00 0.00 0.00 0.00 19.45 16.04 2qqh n ALA 385 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2qqh n VAL 386 N -4.42 4.40 0.00 0.00 3.14 -0.74 -4.44 118.33 116.26 2qqh n VAL 386 Ca -0.05 -2.84 0.00 0.00 -2.96 0.00 0.00 64.34 58.50 2qqh n VAL 386 Cb 0.58 -2.55 0.00 0.00 -1.06 0.00 0.00 33.84 30.81 2qqh n VAL 386 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2qqh n GLU 387 N 3.48 0.00 -2.66 1.45 4.07 -1.03 -4.72 120.64 121.24 2qqh n GLU 387 Ca 0.75 0.00 -0.03 0.00 -0.06 0.00 0.00 57.16 57.82 2qqh n GLU 387 Cb 0.24 0.00 0.04 0.00 -0.06 0.00 0.00 31.44 31.66 2qqh n GLU 387 CO 0.00 0.00 0.00 0.16 -0.06 0.00 0.00 177.13 177.23 2qqh s ASP 388 N 0.00 -0.12 0.00 4.31 3.84 -1.26 -5.00 116.67 118.44 2qqh s ASP 388 Ca 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 52.55 52.41 2qqh s ASP 388 Cb 0.00 0.16 0.00 0.00 -1.38 0.00 0.00 42.92 41.70 2qqh s ASP 388 CO 0.00 -0.00 0.00 -0.38 -0.00 0.00 0.00 175.17 174.79 2qqh n ILE 389 N 2.59 0.00 -4.06 2.11 -0.00 -1.26 -4.70 119.36 114.05 2qqh n ILE 389 Ca 0.10 0.00 -0.35 0.00 -0.00 0.00 0.00 62.75 62.50 2qqh n ILE 389 Cb 0.66 0.00 -0.09 0.00 -0.00 0.00 0.00 39.64 40.21 2qqh n ILE 389 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 2qqh s ILE 390 N 0.00 4.87 0.06 1.39 1.01 -0.39 -4.91 121.20 123.23 2qqh s ILE 390 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 60.65 60.71 2qqh s ILE 390 Cb 0.00 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 2qqh s ILE 390 CO 0.00 0.53 -0.21 -0.94 0.00 0.00 0.00 174.94 174.32 2qqh s SER 391 N -0.27 2.54 -0.03 3.58 1.04 -1.26 -0.02 113.70 119.29 2qqh s SER 391 Ca 0.08 -0.57 0.05 0.00 0.48 0.00 0.00 55.95 55.99 2qqh s SER 391 Cb -0.12 -0.19 -0.01 0.00 0.10 0.00 0.00 66.02 65.80 2qqh s SER 391 CO 0.01 0.14 -0.16 -0.60 0.98 0.00 0.00 173.24 173.61 2qqh s ARG 392 N -1.39 1.48 -0.01 4.02 6.06 0.34 -4.97 118.95 124.48 2qqh s ARG 392 Ca 0.08 -0.58 0.01 0.00 -2.50 0.00 0.00 55.73 52.73 2qqh s ARG 392 Cb -0.09 -1.37 0.01 0.00 0.06 0.00 0.00 34.95 33.56 2qqh s ARG 392 CO 0.03 0.30 -0.01 0.54 -2.50 0.00 0.00 175.30 173.65 2qqh s VAL 393 N -0.18 0.17 -0.02 7.11 0.11 -1.26 0.38 120.40 126.70 2qqh s VAL 393 Ca 0.02 -0.02 0.05 0.00 -2.93 0.00 0.00 61.98 59.10 2qqh s VAL 393 Cb -0.09 -0.19 -0.01 0.00 -1.53 0.00 0.00 36.38 34.56 2qqh s VAL 393 CO 0.00 0.08 -0.18 -0.13 -3.33 0.00 0.00 175.10 171.55 2qqh s ARG 394 N 0.35 1.51 0.00 1.54 0.52 -0.66 -5.01 118.95 117.20 2qqh s ARG 394 Ca -0.03 -0.63 0.00 0.00 -0.52 0.00 0.00 55.73 54.55 2qqh s ARG 394 Cb -0.06 -1.42 0.00 0.00 0.52 0.00 0.00 34.95 33.99 2qqh s ARG 394 CO -0.01 0.35 0.00 0.41 0.02 0.00 0.00 175.30 176.08 2qqh n GLY 395 N 2.74 -2.67 1.68 -3.53 0.00 -1.26 -2.45 105.19 99.70 2qqh n GLY 395 Ca -0.15 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.46 2qqh n GLY 395 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqh n GLY 396 N -1.85 -2.65 3.58 -0.02 0.00 0.12 -4.93 105.19 99.44 2qqh n GLY 396 Ca 0.00 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.14 2qqh n GLY 396 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qqh s SER 397 N -2.32 -0.62 0.67 1.61 1.04 -1.26 -4.90 113.70 107.92 2qqh s SER 397 Ca 0.00 0.95 -0.17 0.00 0.48 0.00 0.00 55.95 57.21 2qqh s SER 397 Cb 0.00 0.88 -0.07 0.00 0.10 0.00 0.00 66.02 66.94 2qqh s SER 397 CO 0.00 -0.38 0.41 -0.24 0.98 0.00 0.00 173.24 174.01 2qqh n SER 398 N 1.71 -1.59 0.00 7.02 2.88 -1.26 -4.80 113.62 117.57 2qqh n SER 398 Ca -0.15 0.62 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 2qqh n SER 398 Cb 0.56 -1.15 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 2qqh n SER 398 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qqh n GLY 399 N 1.85 1.15 0.83 0.46 0.00 -1.26 -5.13 105.19 103.08 2qqh n GLY 399 Ca 0.10 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.19 2qqh n GLY 399 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qqh n TYR 413 N 0.00 0.65 0.55 1.61 4.02 -1.26 -4.96 117.16 117.76 2qqh n TYR 413 Ca 0.00 -0.54 0.07 0.00 -0.01 0.00 0.00 57.90 57.42 2qqh n TYR 413 Cb 0.00 -0.06 0.21 0.00 -0.02 0.00 0.00 39.34 39.46 2qqh n TYR 413 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2qqh n ARG 414 N 0.62 2.06 0.16 -0.72 5.12 -1.26 -2.33 116.66 120.31 2qqh n ARG 414 Ca 0.15 -1.65 0.11 0.00 -1.93 0.00 0.00 57.85 54.54 2qqh n ARG 414 Cb 0.53 -1.36 0.57 0.00 -1.16 0.00 0.00 32.46 31.04 2qqh n ARG 414 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2qqh n SER 415 N 0.84 0.58 -0.02 0.55 3.41 -1.26 -1.79 113.62 115.93 2qqh n SER 415 Ca 0.15 0.75 -0.09 0.00 -0.26 0.00 0.00 58.87 59.42 2qqh n SER 415 Cb 0.39 -0.83 -0.04 0.00 -0.26 0.00 0.00 64.21 63.47 2qqh n SER 415 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 2qqh h TRP 416 N 0.00 -0.05 -0.37 7.33 7.01 -1.78 -2.11 115.95 125.99 2qqh h TRP 416 Ca 0.00 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.07 2qqh h TRP 416 Cb 0.06 0.05 -0.05 0.00 -2.10 0.00 0.00 29.16 27.12 2qqh h TRP 416 CO 0.00 -0.05 0.07 0.78 -2.79 0.00 0.00 178.44 176.45 2qqh h GLY 417 N 0.02 0.42 1.08 2.65 0.00 -1.60 0.02 103.07 105.66 2qqh h GLY 417 Ca 0.07 -0.02 -0.11 0.00 0.00 0.00 0.00 47.33 47.28 2qqh h GLY 417 CO -0.14 -0.03 -0.10 3.21 0.00 0.00 0.00 176.54 179.47 2qqh h ARG 418 N 0.19 1.00 0.00 4.80 3.08 -1.62 -3.29 114.38 118.54 2qqh h ARG 418 Ca 0.17 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2qqh h ARG 418 Cb 0.21 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2qqh h ARG 418 CO -0.23 1.05 -0.61 -1.13 -1.07 0.00 0.00 179.97 177.98 2qqh n SER 419 N -4.18 0.57 -0.08 7.04 3.41 -0.80 -4.51 113.62 115.07 2qqh n SER 419 Ca 0.01 -0.26 -0.08 0.00 -0.26 0.00 0.00 58.87 58.27 2qqh n SER 419 Cb 0.39 0.35 -0.01 0.00 -0.26 0.00 0.00 64.21 64.69 2qqh n SER 419 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2qqh h LEU 420 N 0.00 0.25 -1.69 1.04 5.85 -1.06 -2.44 115.31 117.27 2qqh h LEU 420 Ca 0.00 0.01 0.21 0.00 0.84 0.00 0.00 57.88 58.94 2qqh h LEU 420 Cb 0.55 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 2qqh h LEU 420 CO 0.00 0.19 0.58 0.50 -0.34 0.00 0.00 178.44 179.37 2qqh h LYS 421 N 0.33 0.25 -0.00 1.25 3.64 -1.82 -0.56 116.57 119.67 2qqh h LYS 421 Ca 0.12 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2qqh h LYS 421 Cb 0.02 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2qqh h LYS 421 CO -0.07 0.17 -0.62 0.66 -2.27 0.00 0.00 179.45 177.32 2qqh n TYR 422 N -4.43 0.00 -2.97 1.91 4.01 -0.94 -4.42 117.16 110.32 2qqh n TYR 422 Ca 0.18 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.78 2qqh n TYR 422 Cb 0.75 -0.13 -0.01 0.00 -0.31 0.00 0.00 39.34 39.64 2qqh n TYR 422 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2qqh n ASN 423 N -1.25 1.06 -4.92 7.72 5.03 -0.27 -4.79 115.26 117.83 2qqh n ASN 423 Ca 0.06 -2.89 -0.27 0.00 0.87 0.00 0.00 54.58 52.36 2qqh n ASN 423 Cb 0.35 -0.57 0.06 0.00 -1.02 0.00 0.00 39.78 38.60 2qqh n ASN 423 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2qqh s PRO 424 N -2.69 2.37 0.38 3.52 0.04 -0.87 0.12 135.00 137.86 2qqh s PRO 424 Ca 0.35 -0.11 0.08 0.00 0.04 0.00 0.00 61.00 61.36 2qqh s PRO 424 Cb 0.39 -2.16 -0.06 0.00 0.04 0.00 0.00 34.50 32.72 2qqh s PRO 424 CO -0.03 -1.15 0.04 0.14 0.04 0.00 0.00 177.00 176.04 2qqh s VAL 425 N -3.24 2.29 0.02 -0.36 -7.23 -0.26 -4.70 120.40 106.92 2qqh s VAL 425 Ca 0.59 -1.94 -0.26 0.00 -1.81 0.00 0.00 61.98 58.56 2qqh s VAL 425 Cb -0.11 -2.90 -0.05 0.00 0.56 0.00 0.00 36.38 33.89 2qqh s VAL 425 CO 0.46 -0.08 0.80 -0.69 -0.31 0.00 0.00 175.10 175.27 2qqh s VAL 426 N -2.61 4.80 0.10 1.32 1.01 -1.26 -1.78 120.40 121.97 2qqh s VAL 426 Ca 0.36 1.68 -0.03 0.00 0.00 0.00 0.00 61.98 63.99 2qqh s VAL 426 Cb 0.05 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 2qqh s VAL 426 CO 0.19 0.31 0.06 0.27 0.00 0.00 0.00 175.10 175.94 2qqh s ILE 427 N 0.29 0.15 -1.41 2.22 -4.36 -0.10 -4.90 121.20 113.09 2qqh s ILE 427 Ca 0.41 -1.71 -0.01 0.00 -0.26 0.00 0.00 60.65 59.08 2qqh s ILE 427 Cb -0.20 -1.71 0.00 0.00 1.25 0.00 0.00 42.46 41.80 2qqh s ILE 427 CO 0.23 -0.69 0.40 0.47 0.24 0.00 0.00 174.94 175.59 2qqh n ASP 428 N -0.02 -0.32 -4.90 4.36 8.00 -1.15 -0.79 116.55 121.73 2qqh n ASP 428 Ca -0.10 -1.02 -0.27 0.00 0.71 0.00 0.00 54.79 54.10 2qqh n ASP 428 Cb 0.62 -2.97 -0.04 0.00 -0.02 0.00 0.00 41.12 38.71 2qqh n ASP 428 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2qqh s PHE 429 N -3.98 3.41 0.11 1.24 -0.71 -1.01 -4.00 117.98 113.03 2qqh s PHE 429 Ca 0.01 0.10 0.03 0.00 -1.04 0.00 0.00 56.93 56.03 2qqh s PHE 429 Cb -0.00 -1.64 -0.04 0.00 -1.21 0.00 0.00 43.02 40.12 2qqh s PHE 429 CO 0.89 0.53 0.16 -1.21 -1.34 0.00 0.00 175.22 174.25 2qqh s GLU 430 N -3.09 3.11 0.08 1.99 2.02 0.69 -1.99 118.70 121.52 2qqh s GLU 430 Ca 0.34 -0.66 -0.11 0.00 0.02 0.00 0.00 54.97 54.56 2qqh s GLU 430 Cb -0.11 -2.82 0.01 0.00 0.10 0.00 0.00 34.13 31.31 2qqh s GLU 430 CO 0.27 0.55 0.25 0.00 0.02 0.00 0.00 175.26 176.35 2qqh s MET 431 N -2.73 0.85 0.08 1.61 0.23 -0.17 -1.18 119.30 117.99 2qqh s MET 431 Ca 0.32 -0.76 0.08 0.00 -1.03 0.00 0.00 55.69 54.30 2qqh s MET 431 Cb -0.12 0.36 -0.03 0.00 -1.53 0.00 0.00 34.83 33.51 2qqh s MET 431 CO 0.25 -0.28 -0.22 -0.65 -2.03 0.00 0.00 175.02 172.09 2qqh s GLN 432 N -3.34 1.25 0.36 3.16 -1.52 0.19 -0.76 119.66 118.99 2qqh s GLN 432 Ca 0.01 -1.11 -0.26 0.00 -1.95 0.00 0.00 55.36 52.05 2qqh s GLN 432 Cb 0.02 -1.49 -0.12 0.00 -0.22 0.00 0.00 33.01 31.20 2qqh s GLN 432 CO -0.08 0.36 1.10 -2.30 -0.25 0.00 0.00 175.29 174.11 2qqh n PRO 433 N 1.33 1.59 -0.42 2.91 -0.02 -1.26 -0.94 135.00 138.18 2qqh n PRO 433 Ca -0.19 0.56 0.35 0.00 -2.02 0.00 0.00 63.50 62.20 2qqh n PRO 433 Cb 0.53 -2.08 0.64 0.00 -0.02 0.00 0.00 33.50 32.58 2qqh n PRO 433 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2qqh h ILE 434 N 1.97 0.25 0.00 4.25 6.09 -0.98 -0.82 117.51 128.27 2qqh h ILE 434 Ca -0.44 -0.05 -0.01 0.00 -1.37 0.00 0.00 64.86 63.00 2qqh h ILE 434 Cb 1.32 0.09 -0.00 0.00 0.47 0.00 0.00 36.82 38.70 2qqh h ILE 434 CO 0.60 0.03 -0.05 1.12 -3.07 0.00 0.00 178.15 176.78 2qqh h HIS 435 N 0.14 0.00 0.00 2.19 2.07 -1.88 -2.38 115.15 115.30 2qqh h HIS 435 Ca 0.74 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.26 2qqh h HIS 435 Cb 2.38 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.36 2qqh h HIS 435 CO -0.00 0.05 0.00 0.93 -3.07 0.00 0.00 177.93 175.83 2qqh h GLU 436 N 0.00 0.00 0.00 5.12 4.39 -1.49 -2.93 114.58 119.68 2qqh h GLU 436 Ca -0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2qqh h GLU 436 Cb 0.72 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2qqh h GLU 436 CO 0.01 0.00 -0.07 -0.24 -1.16 0.00 0.00 179.01 177.54 2qqh h VAL 437 N 0.00 0.68 -0.42 3.13 3.04 -1.58 -2.54 116.25 118.56 2qqh h VAL 437 Ca 0.00 -0.29 0.00 0.00 -1.01 0.00 0.00 66.70 65.40 2qqh h VAL 437 Cb 0.36 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.82 2qqh h VAL 437 CO 0.00 0.07 0.00 0.00 -1.01 0.00 0.00 177.57 176.63 2qqh n LEU 438 N -3.91 3.12 0.06 3.16 -0.00 -1.10 -4.58 117.00 113.75 2qqh n LEU 438 Ca -0.02 -1.99 -0.13 0.00 -0.00 0.00 0.00 56.01 53.87 2qqh n LEU 438 Cb 0.16 -0.28 -0.04 0.00 -0.00 0.00 0.00 43.42 43.27 2qqh n LEU 438 CO 0.30 0.78 0.20 -0.09 -0.00 0.00 0.00 177.39 178.58 2qqh h ARG 439 N 2.47 0.41 0.00 1.47 2.43 -1.59 -3.44 114.38 116.13 2qqh h ARG 439 Ca 0.00 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 2qqh h ARG 439 Cb 0.78 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2qqh h ARG 439 CO 0.00 1.09 0.00 0.72 -1.51 0.00 0.00 179.97 180.27 2qqh n HIS 440 N -3.75 0.00 -3.49 2.20 8.25 -1.26 -4.99 115.22 112.18 2qqh n HIS 440 Ca -0.06 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.19 2qqh n HIS 440 Cb 0.82 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.96 2qqh n HIS 440 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2qqh n THR 441 N 0.00 -6.99 -4.91 1.59 -2.24 -1.26 -4.80 114.28 95.66 2qqh n THR 441 Ca 0.00 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 2qqh n THR 441 Cb 0.00 -5.07 0.00 0.00 -2.10 0.00 0.00 70.33 63.16 2qqh n THR 441 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2qqh n SER 442 N -2.54 0.00 -3.61 3.42 2.88 -1.26 -4.90 113.62 107.60 2qqh n SER 442 Ca -0.10 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.13 2qqh n SER 442 Cb 0.59 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.07 2qqh n SER 442 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qqh n LEU 443 N 0.00 -2.45 0.00 2.46 -0.00 -1.26 -4.96 117.00 110.79 2qqh n LEU 443 Ca 0.00 -0.50 0.00 0.00 -0.00 0.00 0.00 56.01 55.51 2qqh n LEU 443 Cb 0.00 -1.69 0.00 0.00 -0.00 0.00 0.00 43.42 41.73 2qqh n LEU 443 CO 0.00 0.09 0.37 0.61 -0.00 0.00 0.00 177.39 178.46 2qqh n GLY 444 N -0.87 -2.46 0.12 1.47 0.00 -1.26 -3.74 105.19 98.45 2qqh n GLY 444 Ca -0.19 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.93 2qqh n GLY 444 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qqh n PRO 445 N -1.37 -0.02 0.00 1.61 -0.02 -1.26 -1.43 135.00 132.51 2qqh n PRO 445 Ca 0.00 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2qqh n PRO 445 Cb 0.00 -0.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 2qqh n PRO 445 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2qqh n LEU 446 N -4.00 0.07 0.22 2.45 4.77 -1.24 -4.21 117.00 115.05 2qqh n LEU 446 Ca 0.13 -0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 2qqh n LEU 446 Cb 0.43 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.40 2qqh n LEU 446 CO -0.01 0.02 0.48 -0.33 -1.33 0.00 0.00 177.39 176.22 2qqh h GLU 447 N 0.02 -0.56 0.00 3.23 4.39 -1.46 -3.07 114.58 117.13 2qqh h GLU 447 Ca 0.00 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.74 2qqh h GLU 447 Cb 0.04 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2qqh h GLU 447 CO 0.00 -0.25 0.27 0.00 -1.16 0.00 0.00 179.01 177.87 2qqh h ALA 448 N -0.57 1.24 0.00 3.43 0.00 -1.86 1.49 119.26 122.98 2qqh h ALA 448 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qqh h ALA 448 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2qqh h ALA 448 CO 0.10 -0.24 0.00 0.87 0.00 0.00 0.00 179.25 179.98 2qqh h LYS 449 N 0.00 0.00 -0.15 0.00 1.57 -1.82 -3.17 116.57 112.99 2qqh h LYS 449 Ca 0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 2qqh h LYS 449 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2qqh h LYS 449 CO 0.00 0.00 -0.69 -0.09 -0.57 0.00 0.00 179.45 178.10 2qqh h ARG 450 N 0.00 0.65 -0.33 3.15 2.43 0.20 -1.02 114.38 119.46 2qqh h ARG 450 Ca 0.00 -0.49 -0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2qqh h ARG 450 Cb 0.58 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 2qqh h ARG 450 CO 0.00 1.11 0.19 1.96 -1.51 0.00 0.00 179.97 181.72 2qqh h GLN 451 N 0.46 0.46 -0.56 0.20 1.08 -1.61 0.15 115.11 115.28 2qqh h GLN 451 Ca -0.03 -0.05 0.03 0.00 -1.45 0.00 0.00 58.65 57.16 2qqh h GLN 451 Cb 1.29 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 28.59 2qqh h GLN 451 CO 0.14 0.37 0.33 -0.91 -0.95 0.00 0.00 178.83 177.80 2qqh h ASN 452 N 0.42 0.53 -0.44 1.46 2.35 -1.58 0.82 115.58 119.14 2qqh h ASN 452 Ca 0.12 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.78 2qqh h ASN 452 Cb 0.03 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 2qqh h ASN 452 CO -0.02 0.37 -0.08 0.25 -1.65 0.00 0.00 177.43 176.30 2qqh h LEU 453 N 0.65 0.87 0.46 1.61 5.85 -0.76 0.43 115.31 124.43 2qqh h LEU 453 Ca 0.23 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2qqh h LEU 453 Cb 0.04 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2qqh h LEU 453 CO -0.11 0.98 -0.22 0.03 -0.34 0.00 0.00 178.44 178.78 2qqh h ARG 454 N 0.80 -0.60 -0.48 1.25 3.08 -0.43 -1.63 114.38 116.37 2qqh h ARG 454 Ca 0.14 0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.30 2qqh h ARG 454 Cb 0.59 0.14 -0.06 0.00 0.08 0.00 0.00 29.97 30.72 2qqh h ARG 454 CO 0.04 -0.38 0.12 -0.09 -1.07 0.00 0.00 179.97 178.58 2qqh h ARG 455 N -0.65 0.26 -0.60 0.04 2.43 -0.41 -0.24 114.38 115.20 2qqh h ARG 455 Ca -0.06 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.02 2qqh h ARG 455 Cb 0.49 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 2qqh h ARG 455 CO 0.10 0.17 0.09 0.00 -1.51 0.00 0.00 179.97 178.82 2qqh h ALA 456 N 1.35 1.01 -0.26 2.80 0.00 -0.88 -1.93 119.26 121.36 2qqh h ALA 456 Ca 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2qqh h ALA 456 Cb 0.29 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2qqh h ALA 456 CO -0.29 0.63 0.11 1.25 0.00 0.00 0.00 179.25 180.95 2qqh h LEU 457 N 0.93 0.36 -1.02 0.00 5.85 -0.27 0.21 115.31 121.36 2qqh h LEU 457 Ca 0.19 -0.16 0.12 0.00 0.84 0.00 0.00 57.88 58.87 2qqh h LEU 457 Cb 0.42 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.27 2qqh h LEU 457 CO 0.01 0.42 0.63 -0.78 -0.34 0.00 0.00 178.44 178.38 2qqh h ASP 458 N 0.28 0.93 -0.14 1.25 3.58 -0.73 -1.31 116.42 120.27 2qqh h ASP 458 Ca 0.09 0.04 -0.12 0.00 0.42 0.00 0.00 57.03 57.46 2qqh h ASP 458 Cb 0.17 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2qqh h ASP 458 CO -0.01 0.50 -0.37 -0.61 -2.88 0.00 0.00 179.24 175.87 2qqh h GLN 459 N 1.00 0.51 -0.84 0.28 4.15 -0.57 -2.94 115.11 116.70 2qqh h GLN 459 Ca 0.49 -0.35 0.08 0.00 0.77 0.00 0.00 58.65 59.63 2qqh h GLN 459 Cb 0.47 0.05 -0.06 0.00 0.21 0.00 0.00 27.48 28.16 2qqh h GLN 459 CO -0.25 0.97 0.55 -0.92 -1.93 0.00 0.00 178.83 177.24 2qqh h TYR 460 N 0.13 0.91 0.00 3.99 3.20 -0.08 -2.42 116.97 122.71 2qqh h TYR 460 Ca -0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2qqh h TYR 460 Cb 0.98 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.96 2qqh h TYR 460 CO 0.10 0.46 -0.40 -0.07 -1.64 0.00 0.00 178.16 176.61 2qqh h LEU 461 N 0.88 0.00 -0.72 2.82 4.07 -1.26 -3.24 115.31 117.86 2qqh h LEU 461 Ca 0.37 -0.03 -0.14 0.00 0.08 0.00 0.00 57.88 58.17 2qqh h LEU 461 Cb 0.30 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.02 2qqh h LEU 461 CO -0.14 0.01 -0.63 0.24 -1.08 0.00 0.00 178.44 176.84 2qqh h MET 462 N 0.00 0.04 0.00 1.13 2.86 -1.25 -3.52 114.93 114.19 2qqh h MET 462 Ca 0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2qqh h MET 462 Cb 0.93 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.60 2qqh h MET 462 CO 0.00 0.66 0.00 0.00 1.06 0.00 0.00 176.91 178.63