#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r14 h GLU 85 N 0.00 -0.23 -0.12 0.11 4.22 -2.06 -3.23 114.58 113.26 1r14 h GLU 85 Ca 0.00 0.02 0.04 0.00 0.08 0.00 0.00 59.36 59.49 1r14 h GLU 85 Cb 0.00 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1r14 h GLU 85 CO 0.00 -0.15 0.27 1.49 -2.18 0.00 0.00 179.01 178.44 1r14 h GLU 86 N -0.92 0.00 0.22 1.92 4.81 -2.06 -1.35 114.58 117.20 1r14 h GLU 86 Ca -0.02 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1r14 h GLU 86 Cb 0.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1r14 h GLU 86 CO 0.04 0.00 -0.10 1.25 -0.73 0.00 0.00 179.01 179.47 1r14 h LEU 87 N 0.00 -0.25 -0.96 1.64 7.12 -2.00 -1.58 115.31 119.28 1r14 h LEU 87 Ca 0.06 -0.15 0.13 0.00 0.13 0.00 0.00 57.88 58.05 1r14 h LEU 87 Cb 0.60 0.06 -0.09 0.00 -0.53 0.00 0.00 40.66 40.71 1r14 h LEU 87 CO -0.00 0.01 0.58 -0.61 -0.13 0.00 0.00 178.44 178.29 1r14 h GLN 88 N -0.50 0.87 0.73 1.25 5.75 -1.26 -1.71 115.11 120.23 1r14 h GLN 88 Ca -0.03 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.38 1r14 h GLN 88 Cb 0.38 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.74 1r14 h GLN 88 CO 0.05 0.57 -0.37 1.15 -2.65 0.00 0.00 178.83 177.58 1r14 h THR 89 N 0.89 0.24 -0.98 2.39 2.02 -1.43 -2.60 112.91 113.45 1r14 h THR 89 Ca 0.49 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.77 1r14 h THR 89 Cb 0.54 0.24 -0.08 0.00 -1.74 0.00 0.00 68.15 67.12 1r14 h THR 89 CO -0.29 0.00 0.61 -0.33 0.37 0.00 0.00 175.52 175.88 1r14 h GLU 90 N -1.01 0.99 -0.40 6.66 5.08 -0.92 -0.88 114.58 124.10 1r14 h GLU 90 Ca -0.10 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1r14 h GLU 90 Cb 0.78 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1r14 h GLU 90 CO 0.15 0.65 0.19 -0.07 -1.00 0.00 0.00 179.01 178.93 1r14 h LEU 91 N 1.02 0.49 -0.10 1.33 3.38 -1.20 -1.24 115.31 118.98 1r14 h LEU 91 Ca 0.46 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.36 1r14 h LEU 91 Cb 0.37 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1r14 h LEU 91 CO -0.24 0.42 -0.06 0.22 0.09 0.00 0.00 178.44 178.88 1r14 h TYR 92 N 0.55 0.26 -0.09 1.13 5.03 -0.78 -1.67 116.97 121.40 1r14 h TYR 92 Ca 0.14 -0.07 0.02 0.00 2.58 0.00 0.00 58.73 61.40 1r14 h TYR 92 Cb 0.06 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.26 1r14 h TYR 92 CO 0.00 0.59 -0.03 1.49 -1.32 0.00 0.00 178.16 178.89 1r14 h GLU 93 N -0.15 -0.02 -0.23 1.82 4.81 -1.06 -0.68 114.58 119.07 1r14 h GLU 93 Ca 0.02 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1r14 h GLU 93 Cb 0.53 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.87 1r14 h GLU 93 CO 0.02 -0.01 -0.08 0.82 -0.73 0.00 0.00 179.01 179.02 1r14 h ILE 94 N -0.02 0.71 -0.61 2.32 2.04 -1.23 0.24 117.51 120.96 1r14 h ILE 94 Ca 0.05 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.96 1r14 h ILE 94 Cb 0.09 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 36.83 1r14 h ILE 94 CO -0.11 0.00 0.33 0.11 0.00 0.00 0.00 178.15 178.48 1r14 h LYS 95 N -0.04 0.59 -0.19 2.37 1.57 -0.99 -1.00 116.57 118.88 1r14 h LYS 95 Ca 0.12 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 1r14 h LYS 95 Cb 0.22 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1r14 h LYS 95 CO -0.26 0.39 0.04 1.25 -0.57 0.00 0.00 179.45 180.30 1r14 h HIS 96 N 0.61 0.06 -0.40 -1.35 2.76 -0.23 -1.92 115.15 114.68 1r14 h HIS 96 Ca 0.27 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.44 1r14 h HIS 96 Cb 0.17 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.12 1r14 h HIS 96 CO -0.09 0.02 0.19 1.96 -1.30 0.00 0.00 177.93 178.71 1r14 h GLN 97 N 0.11 0.57 -0.36 5.26 4.20 -0.45 -1.23 115.11 123.21 1r14 h GLN 97 Ca 0.09 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.74 1r14 h GLN 97 Cb 0.08 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1r14 h GLN 97 CO -0.12 0.49 0.19 0.82 -0.67 0.00 0.00 178.83 179.55 1r14 h ILE 98 N 0.50 1.00 -0.60 2.54 2.04 -1.07 -0.90 117.51 121.02 1r14 h ILE 98 Ca 0.14 -0.13 0.07 0.00 1.00 0.00 0.00 64.86 65.93 1r14 h ILE 98 Cb 0.11 0.58 -0.06 0.00 -0.74 0.00 0.00 36.82 36.71 1r14 h ILE 98 CO -0.02 0.07 0.29 0.25 0.00 0.00 0.00 178.15 178.74 1r14 h LEU 99 N 0.39 0.39 0.08 1.44 6.46 -1.09 0.38 115.31 123.36 1r14 h LEU 99 Ca 0.15 0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1r14 h LEU 99 Cb 0.04 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 39.95 1r14 h LEU 99 CO -0.09 0.25 -0.04 1.56 -0.62 0.00 0.00 178.44 179.50 1r14 h GLN 100 N 0.53 -0.11 -0.36 1.25 4.20 -0.57 0.21 115.11 120.27 1r14 h GLN 100 Ca 0.28 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.94 1r14 h GLN 100 Cb 0.24 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1r14 h GLN 100 CO -0.22 -0.06 -0.02 1.79 -0.67 0.00 0.00 178.83 179.65 1r14 h THR 101 N -0.12 1.21 -0.08 -0.54 1.35 -0.85 0.06 112.91 113.94 1r14 h THR 101 Ca -0.01 -0.87 -0.11 0.00 -0.55 0.00 0.00 66.41 64.87 1r14 h THR 101 Cb 0.10 0.96 -0.01 0.00 -1.73 0.00 0.00 68.15 67.47 1r14 h THR 101 CO 0.02 0.30 -0.44 0.24 -0.25 0.00 0.00 175.52 175.38 1r14 h MET 102 N 0.54 0.18 -0.42 4.72 2.86 -0.52 -1.98 114.93 120.32 1r14 h MET 102 Ca 0.11 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.56 1r14 h MET 102 Cb 0.38 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1r14 h MET 102 CO 0.02 0.59 -0.14 0.78 1.06 0.00 0.00 176.91 179.22 1r14 h GLY 103 N 1.29 0.90 0.97 8.32 0.00 0.57 -1.84 103.07 113.28 1r14 h GLY 103 Ca 0.01 -0.77 -0.00 0.00 0.00 0.00 0.00 47.33 46.57 1r14 h GLY 103 CO 0.07 0.70 0.16 -2.08 0.00 0.00 0.00 176.54 175.38 1r14 h VAL 104 N 0.65 1.11 0.00 4.60 2.07 -0.67 0.68 116.25 124.69 1r14 h VAL 104 Ca 0.10 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 1r14 h VAL 104 Cb 0.68 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1r14 h VAL 104 CO 0.05 0.10 -0.26 -0.07 0.02 0.00 0.00 177.57 177.41 1r14 h LEU 105 N 0.33 0.00 -0.00 2.57 3.38 -1.35 -1.16 115.31 119.08 1r14 h LEU 105 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1r14 h LEU 105 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1r14 h LEU 105 CO -0.02 0.26 -0.01 0.28 0.09 0.00 0.00 178.44 179.05 1r14 h SER 106 N 0.00 0.01 -0.82 -0.43 0.02 -0.71 -1.11 113.55 110.52 1r14 h SER 106 Ca -0.00 -0.58 0.06 0.00 -0.84 0.00 0.00 61.79 60.42 1r14 h SER 106 Cb 0.52 -0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.01 1r14 h SER 106 CO 0.03 0.59 0.54 0.25 -1.14 0.00 0.00 176.83 177.10 1r14 h LEU 107 N -0.56 0.82 0.00 5.07 5.85 -0.66 0.16 115.31 125.99 1r14 h LEU 107 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1r14 h LEU 107 Cb 0.59 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1r14 h LEU 107 CO 0.00 0.54 0.00 0.00 -0.34 0.00 0.00 178.44 178.64 1r14 n GLN 108 N -4.47 0.08 -1.07 1.25 1.13 -0.46 -4.87 117.38 108.96 1r14 n GLN 108 Ca 0.12 0.12 -0.02 0.00 -1.94 0.00 0.00 57.00 55.28 1r14 n GLN 108 Cb 0.18 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 29.02 1r14 n GLN 108 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1r14 n GLY 109 N 0.65 0.56 0.05 1.08 0.00 0.56 -4.90 105.19 103.19 1r14 n GLY 109 Ca 0.06 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 45.91 1r14 n GLY 109 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1r14 n SER 110 N 0.24 0.25 -3.58 1.61 3.41 -0.45 -4.88 113.62 110.23 1r14 n SER 110 Ca -0.02 -0.18 -0.13 0.00 -0.26 0.00 0.00 58.87 58.27 1r14 n SER 110 Cb 0.17 -0.19 -0.05 0.00 -0.26 0.00 0.00 64.21 63.88 1r14 n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r14 s MET 111 N -2.68 1.04 -0.11 4.33 0.23 -1.16 -4.43 119.30 116.52 1r14 s MET 111 Ca 0.23 -0.28 0.01 0.00 -1.03 0.00 0.00 55.69 54.62 1r14 s MET 111 Cb 0.20 0.47 0.02 0.00 -1.53 0.00 0.00 34.83 33.99 1r14 s MET 111 CO 0.51 -0.38 -0.12 -0.51 -2.03 0.00 0.00 175.02 172.49 1r14 s LEU 112 N -2.06 1.50 -0.22 0.18 1.43 0.32 -4.47 118.68 115.37 1r14 s LEU 112 Ca -0.04 -0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 52.58 1r14 s LEU 112 Cb -0.01 -0.99 -0.05 0.00 0.03 0.00 0.00 46.19 45.18 1r14 s LEU 112 CO -0.03 -0.05 0.13 -0.55 0.23 0.00 0.00 176.35 176.08 1r14 s SER 113 N 1.34 6.08 -0.18 2.29 0.15 -1.26 -0.36 113.70 121.75 1r14 s SER 113 Ca -0.00 0.15 -0.03 0.00 0.70 0.00 0.00 55.95 56.77 1r14 s SER 113 Cb -0.14 -2.08 0.06 0.00 -1.71 0.00 0.00 66.02 62.15 1r14 s SER 113 CO -0.06 0.13 0.04 -0.69 1.20 0.00 0.00 173.24 173.86 1r14 s VAL 114 N 0.67 0.40 0.00 4.45 1.01 -0.11 -5.02 120.40 121.80 1r14 s VAL 114 Ca 0.07 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1r14 s VAL 114 Cb -0.12 -0.90 0.00 0.00 0.00 0.00 0.00 36.38 35.36 1r14 s VAL 114 CO 0.01 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.55 1r14 n GLY 115 N 5.10 3.90 1.28 4.51 0.00 -1.26 -0.67 105.19 118.05 1r14 n GLY 115 Ca -0.08 0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.06 1r14 n GLY 115 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r14 n ASP 116 N 6.54 4.13 -4.77 1.61 10.43 -1.26 -4.94 116.55 128.30 1r14 n ASP 116 Ca 0.00 -2.30 -0.34 0.00 2.57 0.00 0.00 54.79 54.72 1r14 n ASP 116 Cb 0.00 -0.48 -0.07 0.00 1.84 0.00 0.00 41.12 42.40 1r14 n ASP 116 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1r14 s LYS 117 N -1.56 3.06 -0.11 -1.24 1.02 0.15 -4.98 119.74 116.08 1r14 s LYS 117 Ca 0.44 -0.46 0.03 0.00 0.02 0.00 0.00 55.97 56.01 1r14 s LYS 117 Cb 0.27 -2.86 0.01 0.00 -0.52 0.00 0.00 37.83 34.73 1r14 s LYS 117 CO 0.24 0.66 -0.22 0.08 -0.92 0.00 0.00 175.35 175.19 1r14 s VAL 118 N -1.13 1.98 0.00 3.17 1.01 -0.76 -0.94 120.40 123.74 1r14 s VAL 118 Ca 0.21 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.26 1r14 s VAL 118 Cb -0.12 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1r14 s VAL 118 CO 0.11 0.54 -0.04 -0.36 0.00 0.00 0.00 175.10 175.35 1r14 s PHE 119 N 0.58 2.97 0.00 5.22 0.40 0.51 -0.61 117.98 127.06 1r14 s PHE 119 Ca -0.13 0.01 -0.26 0.00 -0.60 0.00 0.00 56.93 55.95 1r14 s PHE 119 Cb -0.17 -1.63 0.06 0.00 0.51 0.00 0.00 43.02 41.79 1r14 s PHE 119 CO 0.04 0.42 0.59 0.45 0.70 0.00 0.00 175.22 177.41 1r14 s SER 120 N -1.50 -0.54 0.04 1.36 0.15 -0.63 -0.52 113.70 112.06 1r14 s SER 120 Ca 0.18 0.42 0.02 0.00 0.70 0.00 0.00 55.95 57.27 1r14 s SER 120 Cb -0.11 0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 64.68 1r14 s SER 120 CO 0.09 -0.66 -0.07 0.28 1.20 0.00 0.00 173.24 174.08 1r14 s THR 121 N -1.84 0.46 -2.29 6.45 -1.32 -1.26 -1.03 115.64 114.81 1r14 s THR 121 Ca -0.08 -1.13 0.21 0.00 -1.21 0.00 0.00 61.69 59.48 1r14 s THR 121 Cb -0.01 -0.65 0.37 0.00 -1.51 0.00 0.00 72.50 70.70 1r14 s THR 121 CO 0.04 -0.46 1.33 -0.46 -2.21 0.00 0.00 174.62 172.86 1r14 n ASN 122 N 1.34 3.26 0.00 8.08 0.23 -1.25 -4.95 115.26 121.96 1r14 n ASN 122 Ca -0.22 -1.95 0.00 0.00 -0.53 0.00 0.00 54.58 51.88 1r14 n ASN 122 Cb 0.55 -0.21 0.00 0.00 -2.08 0.00 0.00 39.78 38.05 1r14 n ASN 122 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r14 n GLY 123 N 1.33 1.72 3.80 4.83 0.00 -1.26 -5.03 105.19 110.58 1r14 n GLY 123 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1r14 n GLY 123 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1r14 s GLN 124 N -0.20 3.56 -0.31 1.61 -1.52 -1.26 -4.89 119.66 116.65 1r14 s GLN 124 Ca 0.00 1.29 0.01 0.00 -1.95 0.00 0.00 55.36 54.71 1r14 s GLN 124 Cb 0.00 -2.06 0.10 0.00 -0.22 0.00 0.00 33.01 30.82 1r14 s GLN 124 CO 0.00 -0.62 0.07 0.45 -0.25 0.00 0.00 175.29 174.94 1r14 s SER 125 N -2.37 4.25 0.37 5.90 0.15 -1.26 -1.16 113.70 119.58 1r14 s SER 125 Ca 0.66 -1.77 0.04 0.00 0.70 0.00 0.00 55.95 55.58 1r14 s SER 125 Cb -0.16 -1.14 -0.03 0.00 -1.71 0.00 0.00 66.02 62.97 1r14 s SER 125 CO 0.28 -0.39 0.17 0.68 1.20 0.00 0.00 173.24 175.18 1r14 s VAL 126 N 1.36 0.42 1.00 4.45 -7.23 -0.69 -4.52 120.40 115.18 1r14 s VAL 126 Ca 0.09 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.11 1r14 s VAL 126 Cb -0.18 -2.43 0.19 0.00 0.56 0.00 0.00 36.38 34.52 1r14 s VAL 126 CO -0.18 0.00 1.17 0.54 -0.31 0.00 0.00 175.10 176.32 1r14 s ASN 127 N -3.50 2.75 0.11 4.85 2.20 -1.19 -1.02 114.94 119.14 1r14 s ASN 127 Ca 0.30 0.74 -0.26 0.00 -0.94 0.00 0.00 52.86 52.70 1r14 s ASN 127 Cb 0.03 -1.12 -0.08 0.00 -2.00 0.00 0.00 41.25 38.09 1r14 s ASN 127 CO 0.18 -3.00 1.65 0.15 -2.94 0.00 0.00 177.10 173.14 1r14 h PHE 128 N -1.81 -0.63 -0.36 1.54 3.04 -1.65 -1.40 116.94 115.67 1r14 h PHE 128 Ca -0.48 0.01 0.07 0.00 3.98 0.00 0.00 57.97 61.55 1r14 h PHE 128 Cb 1.30 0.27 -0.06 0.00 2.56 0.00 0.00 35.95 40.02 1r14 h PHE 128 CO -0.62 -0.33 -0.03 -0.44 -2.02 0.00 0.00 178.31 174.86 1r14 h ASP 129 N -0.42 -0.22 -0.86 0.41 3.45 -1.94 -1.66 116.42 115.17 1r14 h ASP 129 Ca 0.04 0.09 0.06 0.00 0.43 0.00 0.00 57.03 57.65 1r14 h ASP 129 Cb 0.46 0.18 -0.06 0.00 -0.56 0.00 0.00 39.33 39.34 1r14 h ASP 129 CO -0.15 -0.07 0.54 0.74 -1.57 0.00 0.00 179.24 178.72 1r14 h THR 130 N 0.06 1.05 -0.42 0.35 2.02 -1.88 -2.29 112.91 111.80 1r14 h THR 130 Ca 0.18 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1r14 h THR 130 Cb 0.26 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 1r14 h THR 130 CO -0.33 0.18 0.21 0.40 0.37 0.00 0.00 175.52 176.36 1r14 h ILE 131 N 0.98 1.17 -0.82 3.11 2.04 -0.37 -1.90 117.51 121.71 1r14 h ILE 131 Ca 0.38 -0.45 0.06 0.00 1.00 0.00 0.00 64.86 65.85 1r14 h ILE 131 Cb 0.17 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 1r14 h ILE 131 CO -0.17 0.18 0.54 0.11 0.00 0.00 0.00 178.15 178.80 1r14 h LYS 132 N 0.54 0.88 0.24 2.37 1.57 -0.83 -1.55 116.57 119.79 1r14 h LYS 132 Ca 0.14 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1r14 h LYS 132 Cb 0.09 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.20 1r14 h LYS 132 CO -0.02 0.58 -0.12 1.49 -0.57 0.00 0.00 179.45 180.81 1r14 h GLU 133 N 0.91 -0.31 -0.27 3.15 4.22 -1.01 -2.10 114.58 119.16 1r14 h GLU 133 Ca 0.35 0.02 0.06 0.00 0.08 0.00 0.00 59.36 59.88 1r14 h GLU 133 Cb 0.22 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.47 1r14 h GLU 133 CO -0.13 -0.07 -0.19 0.52 -2.18 0.00 0.00 179.01 176.96 1r14 h MET 134 N -0.53 -0.17 0.05 1.92 2.86 -0.77 0.24 114.93 118.53 1r14 h MET 134 Ca -0.03 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1r14 h MET 134 Cb 0.39 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 1r14 h MET 134 CO 0.05 -0.11 -0.06 0.00 1.06 0.00 0.00 176.91 177.85 1r14 h THR 136 N -0.13 1.23 -0.32 0.00 1.35 -1.10 0.33 112.91 114.26 1r14 h THR 136 Ca 0.01 -0.80 -0.02 0.00 -0.55 0.00 0.00 66.41 65.04 1r14 h THR 136 Cb 0.13 0.58 -0.02 0.00 -1.73 0.00 0.00 68.15 67.12 1r14 h THR 136 CO -0.03 0.31 0.11 -0.09 -0.25 0.00 0.00 175.52 175.56 1r14 h ARG 137 N 0.88 0.46 -0.13 4.72 2.43 -0.20 -1.26 114.38 121.27 1r14 h ARG 137 Ca 0.20 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1r14 h ARG 137 Cb 0.27 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1r14 h ARG 137 CO -0.01 0.40 0.00 0.00 -1.51 0.00 0.00 179.97 178.86 1r14 n ALA 138 N -2.48 2.53 -0.60 2.80 0.00 -0.57 -4.89 120.51 117.30 1r14 n ALA 138 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1r14 n ALA 138 Cb 0.15 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1r14 n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r14 n GLY 139 N 1.00 0.69 0.00 0.00 0.00 -0.48 -5.04 105.19 101.37 1r14 n GLY 139 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1r14 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r14 n GLY 140 N -2.60 5.15 3.22 -0.02 0.00 0.11 -4.97 105.19 106.07 1r14 n GLY 140 Ca 0.00 -1.64 -0.11 0.00 0.00 0.00 0.00 46.02 44.27 1r14 n GLY 140 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1r14 s ASN 141 N 1.00 -0.04 0.28 1.61 -0.87 -0.86 -3.30 114.94 112.77 1r14 s ASN 141 Ca 0.00 -0.32 -0.30 0.00 -1.57 0.00 0.00 52.86 50.66 1r14 s ASN 141 Cb 0.00 0.34 -0.12 0.00 -0.02 0.00 0.00 41.25 41.45 1r14 s ASN 141 CO 0.00 -0.62 1.59 0.00 -2.57 0.00 0.00 177.10 175.49 1r14 n ILE 142 N 0.48 0.94 -1.98 0.60 3.06 -1.26 -0.65 119.36 120.55 1r14 n ILE 142 Ca -0.18 -0.24 -0.37 0.00 -2.50 0.00 0.00 62.75 59.46 1r14 n ILE 142 Cb 0.60 -1.91 0.03 0.00 0.54 0.00 0.00 39.64 38.89 1r14 n ILE 142 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1r14 s ALA 143 N 0.07 2.74 -0.19 1.51 0.00 -0.18 -4.34 121.76 121.38 1r14 s ALA 143 Ca 0.65 1.12 -0.09 0.00 0.00 0.00 0.00 51.96 53.64 1r14 s ALA 143 Cb -0.51 -3.48 0.07 0.00 0.00 0.00 0.00 23.12 19.20 1r14 s ALA 143 CO 0.47 -1.13 0.44 0.54 0.00 0.00 0.00 175.76 176.08 1r14 s VAL 144 N -1.47 -0.29 0.19 0.00 0.11 -1.26 0.31 120.40 117.99 1r14 s VAL 144 Ca 0.72 0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 59.60 1r14 s VAL 144 Cb -0.34 -0.66 -0.08 0.00 -1.53 0.00 0.00 36.38 33.77 1r14 s VAL 144 CO 0.39 0.05 0.91 -2.16 -3.33 0.00 0.00 175.10 170.96 1r14 s PRO 145 N 1.93 4.76 0.00 1.54 0.04 -1.26 -4.93 135.00 137.07 1r14 s PRO 145 Ca -0.06 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1r14 s PRO 145 Cb -0.10 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.14 1r14 s PRO 145 CO -0.13 0.44 0.56 0.54 0.04 0.00 0.00 177.00 178.44 1r14 n ARG 146 N 1.91 -0.19 -3.77 4.56 1.74 -1.26 -4.82 116.66 114.84 1r14 n ARG 146 Ca -0.01 -0.65 -0.10 0.00 -0.77 0.00 0.00 57.85 56.32 1r14 n ARG 146 Cb 0.48 -0.96 -0.06 0.00 -1.02 0.00 0.00 32.46 30.90 1r14 n ARG 146 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1r14 s THR 147 N -0.18 0.11 0.27 0.55 -4.23 -1.26 -4.65 115.64 106.25 1r14 s THR 147 Ca 0.00 -0.89 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 1r14 s THR 147 Cb 0.00 -1.20 0.26 0.00 1.34 0.00 0.00 72.50 72.90 1r14 s THR 147 CO 0.00 -0.49 1.77 -0.65 -0.54 0.00 0.00 174.62 174.71 1r14 h PRO 148 N 2.73 0.67 -0.44 3.99 0.11 -1.98 -1.62 132.00 135.46 1r14 h PRO 148 Ca -0.34 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.66 1r14 h PRO 148 Cb 1.22 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1r14 h PRO 148 CO 0.51 0.44 0.00 1.49 -0.21 0.00 0.00 178.00 180.24 1r14 h GLU 149 N 0.69 0.78 -0.27 1.05 4.81 -1.99 -1.94 114.58 117.71 1r14 h GLU 149 Ca 0.49 -0.25 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 1r14 h GLU 149 Cb 0.67 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 1r14 h GLU 149 CO -0.35 0.84 -0.05 0.93 -0.73 0.00 0.00 179.01 179.65 1r14 h GLU 150 N 0.62 0.42 -0.35 1.92 5.08 -1.81 -1.50 114.58 118.97 1r14 h GLU 150 Ca 0.13 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 1r14 h GLU 150 Cb 0.49 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1r14 h GLU 150 CO 0.02 0.49 0.03 -0.97 -1.00 0.00 0.00 179.01 177.58 1r14 h ASN 151 N 0.40 0.58 0.31 1.42 -1.24 -0.96 -1.84 115.58 114.26 1r14 h ASN 151 Ca 0.08 -0.29 -0.09 0.00 0.71 0.00 0.00 56.30 56.71 1r14 h ASN 151 Cb 0.35 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.23 1r14 h ASN 151 CO 0.01 0.72 -0.40 -0.08 -1.29 0.00 0.00 177.43 176.40 1r14 h GLU 152 N 0.42 0.12 -0.19 6.67 4.57 -1.10 -0.69 114.58 124.38 1r14 h GLU 152 Ca 0.10 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 1r14 h GLU 152 Cb 0.41 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 1r14 h GLU 152 CO 0.01 0.50 0.05 0.00 -1.18 0.00 0.00 179.01 178.39 1r14 h ALA 153 N 1.50 0.25 -0.37 2.92 0.00 -0.98 -0.56 119.26 122.01 1r14 h ALA 153 Ca 0.01 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1r14 h ALA 153 Cb 0.75 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1r14 h ALA 153 CO 0.06 -0.11 -0.19 0.82 0.00 0.00 0.00 179.25 179.82 1r14 h ILE 154 N 0.12 1.27 -0.65 0.00 2.04 -1.11 -2.82 117.51 116.35 1r14 h ILE 154 Ca 0.06 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.64 1r14 h ILE 154 Cb 0.26 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 1r14 h ILE 154 CO 0.00 0.42 0.34 0.00 0.00 0.00 0.00 178.15 178.91 1r14 h ALA 155 N 1.16 0.83 -0.89 1.87 0.00 -0.91 -1.39 119.26 119.94 1r14 h ALA 155 Ca 0.09 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1r14 h ALA 155 Cb 0.67 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1r14 h ALA 155 CO 0.05 0.37 0.58 0.66 0.00 0.00 0.00 179.25 180.91 1r14 h SER 156 N 0.89 0.89 -0.45 0.00 4.64 -0.86 0.68 113.55 119.34 1r14 h SER 156 Ca 0.23 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.43 1r14 h SER 156 Cb 0.08 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1r14 h SER 156 CO -0.03 0.58 -0.17 0.40 -0.87 0.00 0.00 176.83 176.73 1r14 h ILE 157 N 1.02 1.27 -0.20 0.95 2.04 -1.22 0.11 117.51 121.48 1r14 h ILE 157 Ca 0.38 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 1r14 h ILE 157 Cb 0.20 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1r14 h ILE 157 CO -0.14 0.45 0.10 0.00 0.00 0.00 0.00 178.15 178.56 1r14 h ALA 158 N 0.85 0.26 -0.40 1.87 0.00 -0.07 -1.88 119.26 119.90 1r14 h ALA 158 Ca 0.11 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1r14 h ALA 158 Cb 0.74 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 1r14 h ALA 158 CO 0.06 -0.19 0.17 -0.22 0.00 0.00 0.00 179.25 179.07 1r14 h LYS 159 N 0.20 0.34 -0.97 0.00 3.64 0.45 0.13 116.57 120.35 1r14 h LYS 159 Ca 0.07 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.53 1r14 h LYS 159 Cb 0.11 -0.08 -0.07 0.00 -0.41 0.00 0.00 32.23 31.78 1r14 h LYS 159 CO -0.01 0.22 0.62 -0.22 -2.27 0.00 0.00 179.45 177.80 1r14 h LYS 160 N 0.35 0.99 -0.02 1.90 3.64 -0.66 -2.10 116.57 120.67 1r14 h LYS 160 Ca 0.18 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1r14 h LYS 160 Cb 0.12 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1r14 h LYS 160 CO -0.15 0.65 -0.16 0.66 -2.27 0.00 0.00 179.45 178.18 1r14 n TYR 161 N -4.56 0.00 -3.71 1.91 4.02 -0.73 -4.98 117.16 109.11 1r14 n TYR 161 Ca 0.17 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.84 1r14 n TYR 161 Cb 0.29 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.63 1r14 n TYR 161 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1r14 n ASN 162 N 0.39 -1.66 -3.71 7.72 5.03 0.42 -4.99 115.26 118.47 1r14 n ASN 162 Ca 0.14 -0.80 -0.13 0.00 0.87 0.00 0.00 54.58 54.66 1r14 n ASN 162 Cb 0.47 -4.11 -0.07 0.00 -1.02 0.00 0.00 39.78 35.05 1r14 n ASN 162 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1r14 s ASN 163 N -4.24 -0.22 0.59 6.41 3.04 -1.08 -5.06 114.94 114.38 1r14 s ASN 163 Ca 0.08 -0.04 -0.12 0.00 0.04 0.00 0.00 52.86 52.83 1r14 s ASN 163 Cb -0.04 0.39 -0.05 0.00 -1.54 0.00 0.00 41.25 40.01 1r14 s ASN 163 CO 0.81 -0.61 1.00 -0.31 -3.04 0.00 0.00 177.10 174.95 1r14 s TYR 164 N -2.30 3.59 -0.04 0.43 4.12 -1.26 -4.61 117.35 117.27 1r14 s TYR 164 Ca -0.07 1.29 0.07 0.00 0.02 0.00 0.00 57.07 58.39 1r14 s TYR 164 Cb -0.01 -2.70 -0.01 0.00 -1.52 0.00 0.00 41.96 37.71 1r14 s TYR 164 CO -0.01 -0.59 -0.25 0.08 0.02 0.00 0.00 175.55 174.79 1r14 s VAL 165 N -3.03 2.04 0.05 0.71 1.01 -0.96 -2.04 120.40 118.19 1r14 s VAL 165 Ca 0.55 -1.08 -0.26 0.00 0.00 0.00 0.00 61.98 61.19 1r14 s VAL 165 Cb -0.11 -1.71 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 1r14 s VAL 165 CO 0.49 0.57 0.81 -0.31 0.00 0.00 0.00 175.10 176.65 1r14 s TYR 166 N -0.37 3.74 0.28 5.22 2.02 -1.26 0.10 117.35 127.09 1r14 s TYR 166 Ca 0.03 1.53 0.05 0.00 -0.37 0.00 0.00 57.07 58.30 1r14 s TYR 166 Cb -0.12 -2.87 -0.03 0.00 -0.40 0.00 0.00 41.96 38.54 1r14 s TYR 166 CO 0.02 0.24 0.41 -0.51 -1.57 0.00 0.00 175.55 174.14 1r14 s LEU 167 N 0.02 4.20 -1.27 -1.29 1.43 0.14 -4.75 118.68 117.17 1r14 s LEU 167 Ca 0.40 0.08 -0.17 0.00 -1.03 0.00 0.00 54.13 53.42 1r14 s LEU 167 Cb -0.21 -2.91 0.00 0.00 0.03 0.00 0.00 46.19 43.10 1r14 s LEU 167 CO 0.24 -0.18 2.02 0.61 0.23 0.00 0.00 176.35 179.27 1r14 n GLY 168 N -1.52 3.30 3.58 -3.19 0.00 0.15 -4.66 105.19 102.84 1r14 n GLY 168 Ca -0.07 -1.42 -0.11 0.00 0.00 0.00 0.00 46.02 44.42 1r14 n GLY 168 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1r14 s MET 169 N 4.08 0.62 0.17 1.61 0.23 -1.26 -3.97 119.30 120.79 1r14 s MET 169 Ca 0.53 0.20 0.02 0.00 -1.03 0.00 0.00 55.69 55.41 1r14 s MET 169 Cb 0.10 0.29 -0.05 0.00 -1.53 0.00 0.00 34.83 33.65 1r14 s MET 169 CO 0.01 -0.18 -0.00 0.96 -2.03 0.00 0.00 175.02 173.78 1r14 s ILE 170 N -0.98 0.69 0.13 3.16 -4.36 -0.86 -4.12 121.20 114.86 1r14 s ILE 170 Ca -0.02 -1.98 -0.30 0.00 -0.26 0.00 0.00 60.65 58.09 1r14 s ILE 170 Cb -0.01 -2.10 -0.06 0.00 1.25 0.00 0.00 42.46 41.54 1r14 s ILE 170 CO 0.02 -0.50 0.95 -0.70 0.24 0.00 0.00 174.94 174.95 1r14 s GLU 171 N -3.91 4.71 0.10 0.37 2.12 -0.63 -0.39 118.70 121.07 1r14 s GLU 171 Ca 0.23 1.44 -0.02 0.00 0.36 0.00 0.00 54.97 56.98 1r14 s GLU 171 Cb 0.06 -3.36 0.02 0.00 0.26 0.00 0.00 34.13 31.11 1r14 s GLU 171 CO 0.04 0.27 0.06 -0.25 -0.54 0.00 0.00 175.26 174.83 1r14 n ASP 172 N 2.58 -2.03 -0.11 -1.70 9.92 0.65 -4.87 116.55 120.98 1r14 n ASP 172 Ca 0.01 -0.11 -0.13 0.00 -0.53 0.00 0.00 54.79 54.04 1r14 n ASP 172 Cb 0.49 -0.07 -0.01 0.00 -0.64 0.00 0.00 41.12 40.89 1r14 n ASP 172 CO 0.00 0.00 0.00 0.06 0.13 0.00 0.00 177.20 177.39 1r14 h GLN 173 N 0.00 0.92 -4.95 -1.24 -0.00 -1.97 -3.39 115.11 104.47 1r14 h GLN 173 Ca -0.03 -0.48 -0.68 0.00 -0.00 0.00 0.00 58.65 57.46 1r14 h GLN 173 Cb 0.09 0.02 -0.18 0.00 -0.00 0.00 0.00 27.48 27.40 1r14 h GLN 173 CO 0.02 1.14 0.22 0.95 -0.00 0.00 0.00 178.83 181.15 1r14 s THR 174 N -4.39 4.70 0.29 1.86 -4.23 -1.26 -5.03 115.64 107.58 1r14 s THR 174 Ca -0.11 -0.72 -0.16 0.00 -1.18 0.00 0.00 61.69 59.53 1r14 s THR 174 Cb 0.11 -4.50 -0.11 0.00 1.34 0.00 0.00 72.50 69.33 1r14 s THR 174 CO 0.88 -1.15 0.08 -2.65 -0.54 0.00 0.00 174.62 171.24 1r14 n PRO 175 N 6.66 0.00 0.00 3.99 -0.02 -1.26 -3.22 135.00 141.15 1r14 n PRO 175 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1r14 n PRO 175 Cb 0.44 -0.73 0.00 0.00 -0.02 0.00 0.00 33.50 33.19 1r14 n PRO 175 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r14 n GLY 176 N 1.70 2.85 3.82 -1.23 0.00 -1.26 -5.04 105.19 106.03 1r14 n GLY 176 Ca 0.08 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 1r14 n GLY 176 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1r14 s ASP 177 N 0.36 5.96 0.17 1.61 1.01 -1.20 -4.94 116.67 119.64 1r14 s ASP 177 Ca 0.00 0.28 0.11 0.00 0.71 0.00 0.00 52.55 53.65 1r14 s ASP 177 Cb 0.00 -1.81 -0.04 0.00 1.01 0.00 0.00 42.92 42.08 1r14 s ASP 177 CO 0.00 0.32 -0.25 -0.36 0.21 0.00 0.00 175.17 175.10 1r14 s PHE 178 N -1.13 2.28 0.06 4.23 0.40 -1.26 -0.25 117.98 122.30 1r14 s PHE 178 Ca 0.20 -0.37 0.02 0.00 -0.60 0.00 0.00 56.93 56.18 1r14 s PHE 178 Cb -0.12 -1.17 -0.03 0.00 0.51 0.00 0.00 43.02 42.21 1r14 s PHE 178 CO 0.10 0.43 -0.08 -3.38 0.70 0.00 0.00 175.22 172.99 1r14 s HIS 179 N -1.44 0.76 0.95 0.36 -3.43 0.48 -1.71 115.29 111.25 1r14 s HIS 179 Ca 0.18 -0.60 -0.11 0.00 -0.80 0.00 0.00 55.06 53.72 1r14 s HIS 179 Cb -0.09 -0.45 0.16 0.00 -1.43 0.00 0.00 32.58 30.77 1r14 s HIS 179 CO 0.08 -0.09 1.09 0.71 -2.00 0.00 0.00 174.74 174.53 1r14 s TYR 180 N -1.93 1.99 0.25 0.38 1.51 0.22 -2.04 117.35 117.74 1r14 s TYR 180 Ca -0.04 1.38 0.37 0.00 -1.01 0.00 0.00 57.07 57.76 1r14 s TYR 180 Cb -0.06 -3.18 1.73 0.00 -0.11 0.00 0.00 41.96 40.34 1r14 s TYR 180 CO -0.01 -2.74 2.10 -0.07 -1.11 0.00 0.00 175.55 173.72 1r14 h LEU 181 N -1.81 0.00 0.00 -1.29 4.07 -1.87 -0.99 115.31 113.43 1r14 h LEU 181 Ca -0.50 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.46 1r14 h LEU 181 Cb 1.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.03 1r14 h LEU 181 CO 0.51 0.00 0.00 -0.90 -1.08 0.00 0.00 178.44 176.97 1r14 n ASP 182 N -2.99 0.00 0.00 -0.43 3.85 -1.26 -4.87 116.55 110.85 1r14 n ASP 182 Ca -0.01 0.26 0.00 0.00 -0.71 0.00 0.00 54.79 54.33 1r14 n ASP 182 Cb 0.20 -0.40 0.00 0.00 -1.35 0.00 0.00 41.12 39.57 1r14 n ASP 182 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1r14 n GLY 183 N 0.63 2.51 3.74 6.12 0.00 -0.37 -5.07 105.19 112.74 1r14 n GLY 183 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1r14 n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r14 s ALA 184 N -2.49 2.50 0.20 4.61 0.00 -1.26 -4.63 121.76 120.70 1r14 s ALA 184 Ca 0.00 1.23 -0.27 0.00 0.00 0.00 0.00 51.96 52.91 1r14 s ALA 184 Cb 0.00 -3.55 -0.08 0.00 0.00 0.00 0.00 23.12 19.49 1r14 s ALA 184 CO 0.00 -1.50 0.85 0.45 0.00 0.00 0.00 175.76 175.56 1r14 s SER 185 N -1.30 7.51 0.43 0.00 0.15 -1.26 0.71 113.70 119.93 1r14 s SER 185 Ca 0.79 1.79 -0.24 0.00 0.70 0.00 0.00 55.95 58.99 1r14 s SER 185 Cb -0.38 -2.55 -0.10 0.00 -1.71 0.00 0.00 66.02 61.28 1r14 s SER 185 CO 0.41 0.18 1.03 0.52 1.20 0.00 0.00 173.24 176.58 1r14 n VAL 186 N 1.52 2.53 0.00 4.45 0.31 -0.69 -4.77 118.33 121.68 1r14 n VAL 186 Ca -0.04 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.79 1r14 n VAL 186 Cb 0.48 -1.19 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 1r14 n VAL 186 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1r14 n SER 187 N 0.40 0.00 -4.73 4.52 7.64 -1.26 -4.99 113.62 115.20 1r14 n SER 187 Ca 0.09 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.56 1r14 n SER 187 Cb 0.40 -0.21 -0.03 0.00 -1.01 0.00 0.00 64.21 63.35 1r14 n SER 187 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1r14 s TYR 188 N -0.87 3.47 0.11 1.43 5.04 -1.26 -5.03 117.35 120.23 1r14 s TYR 188 Ca 0.00 1.40 0.01 0.00 -2.44 0.00 0.00 57.07 56.04 1r14 s TYR 188 Cb 0.00 -3.40 -0.04 0.00 0.35 0.00 0.00 41.96 38.87 1r14 s TYR 188 CO 0.00 -1.13 -0.04 0.95 -1.34 0.00 0.00 175.55 174.00 1r14 s THR 189 N 0.46 0.59 -0.44 4.34 -4.23 -1.26 -4.92 115.64 110.18 1r14 s THR 189 Ca 0.55 -1.93 0.08 0.00 -1.18 0.00 0.00 61.69 59.21 1r14 s THR 189 Cb -0.30 -1.79 0.34 0.00 1.34 0.00 0.00 72.50 72.08 1r14 s THR 189 CO 0.33 -0.77 1.09 -3.20 -0.54 0.00 0.00 174.62 171.53 1r14 n ASN 190 N -0.07 -1.73 -4.77 3.99 5.15 -1.26 -5.09 115.26 111.48 1r14 n ASN 190 Ca -0.11 -3.43 -0.37 0.00 -0.60 0.00 0.00 54.58 50.08 1r14 n ASN 190 Cb 0.62 1.39 0.00 0.00 -0.53 0.00 0.00 39.78 41.25 1r14 n ASN 190 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1r14 s TRP 191 N -0.22 2.75 0.35 1.20 0.52 -1.26 0.93 118.94 123.20 1r14 s TRP 191 Ca 0.25 1.52 -0.27 0.00 0.02 0.00 0.00 56.10 57.62 1r14 s TRP 191 Cb 0.32 -3.42 -0.09 0.00 -1.15 0.00 0.00 33.47 29.13 1r14 s TRP 191 CO -0.06 -1.72 1.10 -0.47 0.02 0.00 0.00 176.95 175.83 1r14 s TYR 192 N -1.56 3.34 -0.43 -1.98 5.04 0.99 -4.53 117.35 118.22 1r14 s TYR 192 Ca 0.67 1.64 -0.44 0.00 -2.44 0.00 0.00 57.07 56.50 1r14 s TYR 192 Cb -0.29 -3.27 -0.18 0.00 0.35 0.00 0.00 41.96 38.57 1r14 s TYR 192 CO 0.35 -0.78 1.77 -2.30 -1.34 0.00 0.00 175.55 173.24 1r14 n PRO 193 N 0.50 0.36 0.00 4.97 -0.02 -1.26 -0.80 135.00 138.76 1r14 n PRO 193 Ca 0.02 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1r14 n PRO 193 Cb 0.47 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 1r14 n PRO 193 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r14 n GLY 194 N 4.80 1.75 3.82 -1.23 0.00 -1.26 -5.08 105.19 108.00 1r14 n GLY 194 Ca 0.35 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 1r14 n GLY 194 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r14 s GLU 195 N 0.00 4.19 0.14 1.61 0.41 0.02 -3.84 118.70 121.23 1r14 s GLU 195 Ca 0.00 1.09 -0.31 0.00 -0.41 0.00 0.00 54.97 55.34 1r14 s GLU 195 Cb 0.00 -2.18 -0.09 0.00 -1.78 0.00 0.00 34.13 30.08 1r14 s GLU 195 CO 0.00 -0.05 1.43 -2.14 -0.49 0.00 0.00 175.26 174.01 1r14 s PRO 196 N -3.28 4.30 -0.24 0.39 0.02 -1.26 -4.70 135.00 130.22 1r14 s PRO 196 Ca 0.61 2.16 -0.26 0.00 0.02 0.00 0.00 61.00 63.53 1r14 s PRO 196 Cb -0.09 -3.21 0.10 0.00 0.02 0.00 0.00 34.50 31.32 1r14 s PRO 196 CO 0.15 -0.47 0.92 0.50 -0.33 0.00 0.00 177.00 177.77 1r14 s ARG 197 N 0.94 0.65 0.00 5.54 3.52 -1.25 -5.07 118.95 123.28 1r14 s ARG 197 Ca 0.65 0.62 0.00 0.00 -0.13 0.00 0.00 55.73 56.87 1r14 s ARG 197 Cb -0.39 0.31 0.00 0.00 -1.56 0.00 0.00 34.95 33.32 1r14 s ARG 197 CO 0.32 -0.11 0.00 0.41 -0.81 0.00 0.00 175.30 175.11 1r14 n GLY 198 N 2.04 1.13 0.06 8.12 0.00 -1.26 -4.74 105.19 110.54 1r14 n GLY 198 Ca -0.13 -0.91 -0.02 0.00 0.00 0.00 0.00 46.02 44.97 1r14 n GLY 198 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1r14 h GLN 199 N 0.00 -0.01 0.00 1.61 4.20 -2.01 -3.47 115.11 115.43 1r14 h GLN 199 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1r14 h GLN 199 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1r14 h GLN 199 CO 0.00 -0.01 0.00 0.41 -0.67 0.00 0.00 178.83 178.56 1r14 n GLY 200 N -1.04 2.56 0.30 3.46 0.00 -1.26 -5.05 105.19 104.16 1r14 n GLY 200 Ca 0.00 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 1r14 n GLY 200 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r14 h LYS 201 N 0.00 -0.71 -5.94 1.61 1.57 -1.97 -3.48 116.57 107.64 1r14 h LYS 201 Ca 0.00 0.05 -0.21 0.00 -1.87 0.00 0.00 60.65 58.62 1r14 h LYS 201 Cb 0.00 0.16 0.01 0.00 0.08 0.00 0.00 32.23 32.48 1r14 h LYS 201 CO 0.00 -0.48 -0.48 0.39 -0.57 0.00 0.00 179.45 178.32 1r14 n GLU 202 N -4.48 -1.41 0.08 3.15 1.02 -1.26 -4.93 120.64 112.80 1r14 n GLU 202 Ca -0.09 1.16 0.12 0.00 -0.02 0.00 0.00 57.16 58.32 1r14 n GLU 202 Cb 0.29 -4.35 0.08 0.00 -0.02 0.00 0.00 31.44 27.44 1r14 n GLU 202 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1r14 h LYS 203 N 0.05 0.00 -6.34 3.49 1.57 -1.78 -3.36 116.57 110.20 1r14 h LYS 203 Ca -0.28 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.05 1r14 h LYS 203 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1r14 h LYS 203 CO 0.34 0.00 -0.30 0.00 -0.57 0.00 0.00 179.45 178.91 1r14 s VAL 205 N -2.40 1.42 0.12 0.00 1.01 -1.26 0.85 120.40 120.14 1r14 s VAL 205 Ca 0.52 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.96 1r14 s VAL 205 Cb -0.07 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 1r14 s VAL 205 CO 0.31 0.42 -0.10 -1.83 0.00 0.00 0.00 175.10 173.91 1r14 s GLU 206 N 0.83 2.13 -0.16 2.72 -1.05 0.13 -0.68 118.70 122.61 1r14 s GLU 206 Ca -0.10 -1.06 -0.05 0.00 -0.15 0.00 0.00 54.97 53.61 1r14 s GLU 206 Cb -0.15 -2.29 -0.03 0.00 -0.44 0.00 0.00 34.13 31.21 1r14 s GLU 206 CO 0.01 0.50 0.01 1.41 0.95 0.00 0.00 175.26 178.13 1r14 s MET 207 N -2.31 3.72 0.75 -4.83 -2.45 0.28 -1.50 119.30 112.95 1r14 s MET 207 Ca 0.22 -0.44 -0.11 0.00 -1.25 0.00 0.00 55.69 54.11 1r14 s MET 207 Cb -0.11 -3.02 0.04 0.00 1.25 0.00 0.00 34.83 32.99 1r14 s MET 207 CO 0.14 0.31 1.08 0.71 1.05 0.00 0.00 175.02 178.31 1r14 s TYR 208 N 0.22 3.01 -0.83 4.11 4.12 0.10 -2.25 117.35 125.82 1r14 s TYR 208 Ca 0.01 1.23 0.12 0.00 0.02 0.00 0.00 57.07 58.44 1r14 s TYR 208 Cb -0.13 -3.02 0.52 0.00 -1.52 0.00 0.00 41.96 37.81 1r14 s TYR 208 CO 0.02 -1.49 1.36 0.25 0.02 0.00 0.00 175.55 175.71 1r14 n THR 209 N -3.26 1.33 1.21 -0.71 -2.24 -1.26 -1.09 114.28 108.26 1r14 n THR 209 Ca 0.07 0.39 0.13 0.00 -2.27 0.00 0.00 64.05 62.37 1r14 n THR 209 Cb 0.55 -1.28 0.28 0.00 -2.10 0.00 0.00 70.33 67.78 1r14 n THR 209 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1r14 n ASP 210 N -1.69 1.68 0.00 3.42 3.85 -1.26 -4.42 116.55 118.12 1r14 n ASP 210 Ca 0.02 -1.35 0.00 0.00 -0.71 0.00 0.00 54.79 52.74 1r14 n ASP 210 Cb 0.10 0.17 0.00 0.00 -1.35 0.00 0.00 41.12 40.04 1r14 n ASP 210 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1r14 n GLY 211 N 1.32 3.05 3.78 6.12 0.00 -0.25 -5.04 105.19 114.18 1r14 n GLY 211 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1r14 n GLY 211 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r14 s THR 212 N -2.76 3.41 0.14 2.61 -4.23 -1.26 -4.67 115.64 108.88 1r14 s THR 212 Ca 0.00 0.79 0.02 0.00 -1.18 0.00 0.00 61.69 61.32 1r14 s THR 212 Cb 0.00 -3.29 -0.04 0.00 1.34 0.00 0.00 72.50 70.51 1r14 s THR 212 CO 0.00 -0.28 0.27 0.26 -0.54 0.00 0.00 174.62 174.33 1r14 s TRP 213 N -2.06 3.48 -0.09 3.99 0.51 0.26 -0.72 118.94 124.31 1r14 s TRP 213 Ca 0.69 0.13 -0.04 0.00 -2.12 0.00 0.00 56.10 54.75 1r14 s TRP 213 Cb -0.20 -1.67 0.05 0.00 -0.81 0.00 0.00 33.47 30.83 1r14 s TRP 213 CO 0.31 0.52 0.20 1.21 -0.51 0.00 0.00 176.95 178.68 1r14 s ASN 214 N -3.17 -0.05 0.52 2.95 2.47 -0.56 -0.01 114.94 117.09 1r14 s ASN 214 Ca 0.34 0.43 -0.17 0.00 0.42 0.00 0.00 52.86 53.88 1r14 s ASN 214 Cb -0.11 0.34 -0.07 0.00 -1.45 0.00 0.00 41.25 39.96 1r14 s ASN 214 CO 0.28 -0.17 1.00 1.51 -3.72 0.00 0.00 177.10 176.00 1r14 s ASP 215 N 1.44 6.43 0.08 -4.21 -4.77 -1.26 -0.70 116.67 113.68 1r14 s ASP 215 Ca -0.07 1.68 -0.15 0.00 -3.30 0.00 0.00 52.55 50.71 1r14 s ASP 215 Cb -0.11 -2.52 0.05 0.00 -1.09 0.00 0.00 42.92 39.25 1r14 s ASP 215 CO -0.07 -0.72 0.73 -1.14 0.70 0.00 0.00 175.17 174.66 1r14 n ARG 216 N -1.51 0.33 -1.27 2.11 0.63 0.25 -4.85 116.66 112.34 1r14 n ARG 216 Ca 0.07 -0.82 -0.29 0.00 -0.92 0.00 0.00 57.85 55.89 1r14 n ARG 216 Cb 0.54 1.16 0.15 0.00 0.45 0.00 0.00 32.46 34.76 1r14 n ARG 216 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1r14 s GLY 217 N -3.07 1.58 -0.08 5.14 0.00 -1.26 0.01 107.32 109.64 1r14 s GLY 217 Ca 0.16 -0.31 0.16 0.00 0.00 0.00 0.00 44.72 44.74 1r14 s GLY 217 CO 0.02 0.25 1.46 0.00 0.00 0.00 0.00 173.10 174.84 1r14 n LEU 219 N 0.68 3.00 -4.86 0.00 4.77 -1.26 -2.32 117.00 117.02 1r14 n LEU 219 Ca 0.20 -1.61 -0.29 0.00 -0.03 0.00 0.00 56.01 54.28 1r14 n LEU 219 Cb 0.72 -0.21 0.11 0.00 -2.33 0.00 0.00 43.42 41.70 1r14 n LEU 219 CO 0.16 0.68 0.76 -1.10 -1.33 0.00 0.00 177.39 176.57 1r14 s GLN 220 N -1.15 1.66 -0.45 3.23 -1.52 -1.26 -4.79 119.66 115.38 1r14 s GLN 220 Ca 0.29 0.19 -0.15 0.00 -1.95 0.00 0.00 55.36 53.74 1r14 s GLN 220 Cb 0.16 -1.91 0.06 0.00 -0.22 0.00 0.00 33.01 31.11 1r14 s GLN 220 CO 0.22 -1.82 0.36 0.71 -0.25 0.00 0.00 175.29 174.51 1r14 s TYR 221 N -3.46 3.25 0.13 0.91 4.12 -1.26 -3.20 117.35 117.84 1r14 s TYR 221 Ca 0.63 -0.90 0.10 0.00 0.02 0.00 0.00 57.07 56.92 1r14 s TYR 221 Cb -0.12 -3.01 -0.04 0.00 -1.52 0.00 0.00 41.96 37.27 1r14 s TYR 221 CO 0.51 -0.75 -0.24 1.03 0.02 0.00 0.00 175.55 176.12 1r14 s ARG 222 N 1.63 1.30 0.17 -0.62 1.81 -0.19 -4.71 118.95 118.35 1r14 s ARG 222 Ca 0.04 -1.30 -0.33 0.00 -1.72 0.00 0.00 55.73 52.41 1r14 s ARG 222 Cb -0.23 -1.67 -0.13 0.00 -0.45 0.00 0.00 34.95 32.47 1r14 s ARG 222 CO 0.07 0.39 1.62 -0.11 -0.68 0.00 0.00 175.30 176.59 1r14 n LEU 223 N 0.87 3.34 -4.64 2.53 7.94 -0.86 -1.71 117.00 124.47 1r14 n LEU 223 Ca -0.18 1.07 -0.42 0.00 -1.11 0.00 0.00 56.01 55.38 1r14 n LEU 223 Cb 0.54 -1.46 -0.05 0.00 0.53 0.00 0.00 43.42 42.98 1r14 n LEU 223 CO 0.24 -0.16 0.59 0.00 -1.11 0.00 0.00 177.39 176.94 1r14 s ALA 224 N 1.06 3.63 -0.07 1.96 0.00 -0.31 -4.10 121.76 123.92 1r14 s ALA 224 Ca 0.78 -0.24 0.02 0.00 0.00 0.00 0.00 51.96 52.53 1r14 s ALA 224 Cb -0.63 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.26 1r14 s ALA 224 CO 0.37 -0.94 -0.13 0.08 0.00 0.00 0.00 175.76 175.14 1r14 s VAL 225 N 2.79 1.22 0.23 0.00 1.01 -1.26 -3.89 120.40 120.50 1r14 s VAL 225 Ca 0.33 -0.52 0.10 0.00 0.00 0.00 0.00 61.98 61.89 1r14 s VAL 225 Cb -0.15 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 1r14 s VAL 225 CO 0.08 0.37 -0.12 0.00 0.00 0.00 0.00 175.10 175.44 1r14 s GLU 227 N -3.19 1.94 0.00 0.00 -1.05 0.18 -1.61 118.70 114.97 1r14 s GLU 227 Ca 0.27 -1.05 0.00 0.00 -0.15 0.00 0.00 54.97 54.05 1r14 s GLU 227 Cb -0.07 -2.09 0.00 0.00 -0.44 0.00 0.00 34.13 31.53 1r14 s GLU 227 CO 0.16 0.53 0.33 1.19 0.95 0.00 0.00 175.26 178.41