#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmw s LYS 82 N 0.00 3.05 -0.36 -1.58 -0.14 -1.26 -5.10 119.74 114.36 2jmw s LYS 82 Ca 0.00 -0.84 -0.00 0.00 -1.36 0.00 0.00 55.97 53.77 2jmw s LYS 82 Cb 0.00 -2.36 0.09 0.00 -1.68 0.00 0.00 37.83 33.88 2jmw s LYS 82 CO 0.00 0.22 0.10 1.03 -0.76 0.00 0.00 175.35 175.94 2jmw s ARG 83 N 0.25 1.97 -0.23 1.68 1.81 -1.26 -5.06 118.95 118.12 2jmw s ARG 83 Ca -0.14 -1.68 -0.28 0.00 -1.72 0.00 0.00 55.73 51.91 2jmw s ARG 83 Cb -0.17 -3.35 0.14 0.00 -0.45 0.00 0.00 34.95 31.12 2jmw s ARG 83 CO 0.07 -0.90 1.09 0.00 -0.68 0.00 0.00 175.30 174.88 2jmw s ALA 84 N 1.10 -1.99 -1.20 2.13 0.00 -1.26 -5.08 121.76 115.45 2jmw s ALA 84 Ca 0.05 1.73 -0.20 0.00 0.00 0.00 0.00 51.96 53.54 2jmw s ALA 84 Cb -0.21 -1.16 0.05 0.00 0.00 0.00 0.00 23.12 21.80 2jmw s ALA 84 CO -0.05 -0.25 1.67 -2.00 0.00 0.00 0.00 175.76 175.13 2jmw s GLU 85 N -0.50 3.77 -0.27 0.00 2.56 -1.26 -4.87 118.70 118.13 2jmw s GLU 85 Ca 0.02 -1.66 -0.23 0.00 0.00 0.00 0.00 54.97 53.10 2jmw s GLU 85 Cb -0.03 -5.46 0.08 0.00 2.00 0.00 0.00 34.13 30.73 2jmw s GLU 85 CO -0.04 -2.34 0.78 0.99 -0.56 0.00 0.00 175.26 174.09 2jmw s THR 86 N 4.88 0.00 -0.11 -1.70 2.01 -1.26 -5.14 115.64 114.33 2jmw s THR 86 Ca 0.53 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 62.23 2jmw s THR 86 Cb 0.02 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.51 2jmw s THR 86 CO 0.03 0.00 1.17 0.26 -0.69 0.00 0.00 174.62 175.39 2jmw s TRP 87 N 0.62 3.17 0.35 4.92 0.52 -1.26 -5.02 118.94 122.24 2jmw s TRP 87 Ca -0.02 1.25 -0.14 0.00 0.02 0.00 0.00 56.10 57.21 2jmw s TRP 87 Cb -0.05 -3.39 -0.09 0.00 -1.15 0.00 0.00 33.47 28.80 2jmw s TRP 87 CO -0.05 -1.16 0.76 0.14 0.02 0.00 0.00 176.95 176.66 2jmw s VAL 88 N 2.57 4.69 0.21 4.03 -7.23 -1.26 -4.84 120.40 118.57 2jmw s VAL 88 Ca 0.53 0.91 -0.20 0.00 -1.81 0.00 0.00 61.98 61.41 2jmw s VAL 88 Cb -0.22 -3.63 0.16 0.00 0.56 0.00 0.00 36.38 33.25 2jmw s VAL 88 CO 0.18 -0.27 1.50 1.67 -0.31 0.00 0.00 175.10 177.87 2jmw n GLN 89 N -0.59 -0.27 -0.04 4.82 7.27 -1.26 -0.97 117.38 126.34 2jmw n GLN 89 Ca 0.03 1.48 -0.02 0.00 0.07 0.00 0.00 57.00 58.57 2jmw n GLN 89 Cb 0.53 -2.20 -0.02 0.00 2.41 0.00 0.00 30.24 30.97 2jmw n GLN 89 CO 0.00 0.00 0.00 -0.44 0.07 0.00 0.00 177.06 176.69 2jmw h ASP 90 N 0.00 -0.31 -0.24 1.69 3.32 -1.99 0.17 116.42 119.05 2jmw h ASP 90 Ca 0.29 0.04 0.05 0.00 0.02 0.00 0.00 57.03 57.44 2jmw h ASP 90 Cb 0.54 0.13 -0.08 0.00 0.22 0.00 0.00 39.33 40.14 2jmw h ASP 90 CO -0.95 -0.05 -0.42 -0.33 -1.72 0.00 0.00 179.24 175.77 2jmw h GLU 91 N -0.04 -0.40 -0.74 3.56 5.08 -1.65 0.71 114.58 121.10 2jmw h GLU 91 Ca 0.02 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.53 2jmw h GLU 91 Cb 0.08 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 29.29 2jmw h GLU 91 CO -0.12 -0.27 -0.32 1.15 -1.00 0.00 0.00 179.01 178.45 2jmw h THR 92 N -0.42 0.13 -0.74 1.13 2.02 -0.45 0.41 112.91 114.99 2jmw h THR 92 Ca 0.10 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 2jmw h THR 92 Cb 0.60 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 2jmw h THR 92 CO -0.47 0.00 0.35 -0.09 0.37 0.00 0.00 175.52 175.69 2jmw h ARG 93 N -0.09 1.06 0.04 6.66 2.43 0.16 -1.30 114.38 123.35 2jmw h ARG 93 Ca 0.29 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2jmw h ARG 93 Cb 0.57 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 2jmw h ARG 93 CO -0.79 0.81 -0.02 0.66 -1.51 0.00 0.00 179.97 179.12 2jmw h SER 94 N 1.05 -0.05 0.52 -3.80 4.64 0.20 -2.50 113.55 113.61 2jmw h SER 94 Ca 0.26 -0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.46 2jmw h SER 94 Cb 0.11 0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2jmw h SER 94 CO -0.03 0.05 -0.25 0.25 -0.87 0.00 0.00 176.83 175.98 2jmw h LEU 95 N -0.15 -0.59 -0.83 5.97 5.85 -0.45 -2.64 115.31 122.48 2jmw h LEU 95 Ca -0.01 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.81 2jmw h LEU 95 Cb 0.13 0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.21 2jmw h LEU 95 CO 0.01 -0.39 -0.47 -0.38 -0.34 0.00 0.00 178.44 176.86 2jmw n ILE 96 N -4.04 -0.55 -0.05 4.05 5.41 -0.51 -0.47 119.36 123.21 2jmw n ILE 96 Ca -0.09 2.00 -0.14 0.00 1.00 0.00 0.00 62.75 65.52 2jmw n ILE 96 Cb 0.28 -2.49 -0.09 0.00 -0.71 0.00 0.00 39.64 36.63 2jmw n ILE 96 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 2jmw h MET 97 N 0.00 -0.48 -0.75 0.38 2.86 -1.47 0.99 114.93 116.45 2jmw h MET 97 Ca 0.15 0.03 0.15 0.00 -2.06 0.00 0.00 59.70 57.97 2jmw h MET 97 Cb 0.36 0.11 -0.10 0.00 0.06 0.00 0.00 31.60 32.02 2jmw h MET 97 CO -0.78 -0.32 0.26 0.74 1.06 0.00 0.00 176.91 177.87 2jmw h PHE 98 N -0.50 0.44 0.85 -0.22 0.04 -0.38 0.02 116.94 117.19 2jmw h PHE 98 Ca 0.06 0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.83 2jmw h PHE 98 Cb 0.65 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.72 2jmw h PHE 98 CO -0.61 0.00 -0.45 -0.09 -0.60 0.00 0.00 178.31 176.57 2jmw h ARG 99 N 0.38 -1.15 -0.27 1.51 1.12 0.68 -2.13 114.38 114.52 2jmw h ARG 99 Ca 0.42 0.08 0.06 0.00 -1.11 0.00 0.00 59.98 59.44 2jmw h ARG 99 Cb 0.69 0.26 -0.07 0.00 -0.01 0.00 0.00 29.97 30.83 2jmw h ARG 99 CO -0.45 -0.77 -0.26 0.00 -3.11 0.00 0.00 179.97 175.38 2jmw h ARG 100 N -1.19 -0.25 -1.00 0.20 3.08 -0.30 0.12 114.38 115.04 2jmw h ARG 100 Ca -0.12 0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.17 2jmw h ARG 100 Cb 0.93 0.06 -0.10 0.00 0.08 0.00 0.00 29.97 30.94 2jmw h ARG 100 CO 0.17 -0.17 0.62 0.78 -1.07 0.00 0.00 179.97 180.31 2jmw h GLY 101 N -0.26 1.49 1.87 0.04 0.00 -0.95 0.73 103.07 105.98 2jmw h GLY 101 Ca 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2jmw h GLY 101 CO -0.42 -0.10 -0.08 1.03 0.00 0.00 0.00 176.54 176.98 2jmw n MET 102 N -4.70 0.13 -0.40 4.80 2.81 -0.25 -4.13 117.12 115.38 2jmw n MET 102 Ca 0.24 0.09 -0.08 0.00 -1.81 0.00 0.00 57.70 56.14 2jmw n MET 102 Cb 0.70 -1.64 -0.06 0.00 -0.71 0.00 0.00 33.22 31.52 2jmw n MET 102 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2jmw n ASP 103 N -1.85 -0.92 -0.33 7.83 -0.08 0.25 0.60 116.55 122.05 2jmw n ASP 103 Ca 0.06 1.73 0.30 0.00 -1.51 0.00 0.00 54.79 55.37 2jmw n ASP 103 Cb 0.38 -0.27 0.52 0.00 2.34 0.00 0.00 41.12 44.09 2jmw n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jmw n GLY 104 N -1.31 -0.66 0.19 0.27 0.00 -1.26 0.21 105.19 102.63 2jmw n GLY 104 Ca 0.04 0.64 -0.17 0.00 0.00 0.00 0.00 46.02 46.53 2jmw n GLY 104 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jmw h LEU 105 N 0.00 0.75 -0.34 0.99 3.38 -0.14 -2.94 115.31 117.01 2jmw h LEU 105 Ca 0.71 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2jmw h LEU 105 Cb 2.11 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.64 2jmw h LEU 105 CO -0.49 1.30 0.00 0.49 0.09 0.00 0.00 178.44 179.83 2jmw n PHE 106 N -4.09 0.18 -0.10 1.13 3.01 0.56 -0.28 117.46 117.87 2jmw n PHE 106 Ca -0.08 0.09 -0.17 0.00 1.01 0.00 0.00 57.45 58.30 2jmw n PHE 106 Cb 0.69 -0.65 -0.07 0.00 -0.01 0.00 0.00 39.48 39.43 2jmw n PHE 106 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2jmw n ASN 107 N -1.69 1.87 -0.03 4.37 4.13 -0.85 -4.45 115.26 118.62 2jmw n ASN 107 Ca -0.00 0.46 -0.06 0.00 1.68 0.00 0.00 54.58 56.66 2jmw n ASN 107 Cb 0.02 -0.89 0.14 0.00 -1.54 0.00 0.00 39.78 37.51 2jmw n ASN 107 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2jmw h THR 108 N -1.00 1.28 -3.70 3.41 1.03 -1.31 -3.40 112.91 109.21 2jmw h THR 108 Ca -0.27 -1.36 -0.68 0.00 -0.01 0.00 0.00 66.41 64.08 2jmw h THR 108 Cb 1.10 1.34 -0.19 0.00 -1.07 0.00 0.00 68.15 69.33 2jmw h THR 108 CO -0.17 0.44 -0.48 -0.44 -0.01 0.00 0.00 175.52 174.87 2jmw s SER 109 N -6.80 6.05 0.14 0.00 0.01 0.61 -4.98 113.70 108.74 2jmw s SER 109 Ca -0.08 -0.46 -0.25 0.00 1.31 0.00 0.00 55.95 56.48 2jmw s SER 109 Cb 0.13 -2.14 -0.00 0.00 0.21 0.00 0.00 66.02 64.22 2jmw s SER 109 CO 0.81 -0.25 1.61 0.50 0.41 0.00 0.00 173.24 176.33 2jmw h LYS 110 N 8.50 -0.34 -6.84 12.44 3.64 -1.83 -3.41 116.57 128.73 2jmw h LYS 110 Ca -0.31 0.02 -0.48 0.00 -1.27 0.00 0.00 60.65 58.62 2jmw h LYS 110 Cb 1.15 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.03 2jmw h LYS 110 CO 0.64 -0.22 0.24 -1.12 -2.27 0.00 0.00 179.45 176.71 2jmw s SER 111 N -4.96 7.04 -0.21 4.20 0.01 -1.26 -4.99 113.70 113.52 2jmw s SER 111 Ca -0.15 1.58 0.11 0.00 1.31 0.00 0.00 55.95 58.80 2jmw s SER 111 Cb 0.11 -2.49 0.43 0.00 0.21 0.00 0.00 66.02 64.28 2jmw s SER 111 CO 0.67 -0.16 1.21 -0.46 0.41 0.00 0.00 173.24 174.91 2jmw n ASN 112 N 0.04 2.09 0.10 2.44 2.04 -1.26 -4.83 115.26 115.87 2jmw n ASN 112 Ca 0.03 -3.80 -0.04 0.00 -0.44 0.00 0.00 54.58 50.32 2jmw n ASN 112 Cb 0.52 -0.50 -0.02 0.00 -2.53 0.00 0.00 39.78 37.25 2jmw n ASN 112 CO 0.00 0.00 0.00 0.11 -0.44 0.00 0.00 177.26 176.93 2jmw h LYS 113 N 1.16 -0.27 -0.62 -3.83 1.79 -1.97 -1.70 116.57 111.12 2jmw h LYS 113 Ca 0.04 0.02 0.12 0.00 -2.18 0.00 0.00 60.65 58.64 2jmw h LYS 113 Cb 1.11 0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 31.78 2jmw h LYS 113 CO 0.10 -0.18 0.42 1.12 -1.08 0.00 0.00 179.45 179.83 2jmw h HIS 114 N -0.43 0.39 0.21 -1.35 2.07 -2.00 -2.06 115.15 111.99 2jmw h HIS 114 Ca -0.03 0.01 -0.01 0.00 -2.85 0.00 0.00 60.37 57.49 2jmw h HIS 114 Cb 0.22 -0.13 0.00 0.00 2.57 0.00 0.00 27.41 30.07 2jmw h HIS 114 CO 0.09 0.17 -0.10 -0.07 -3.07 0.00 0.00 177.93 174.95 2jmw h LEU 115 N 0.36 -0.24 -0.84 6.12 3.38 -1.88 -1.93 115.31 120.27 2jmw h LEU 115 Ca 0.29 -0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.23 2jmw h LEU 115 Cb 0.67 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.41 2jmw h LEU 115 CO -0.08 -0.01 0.49 -0.50 0.09 0.00 0.00 178.44 178.43 2jmw h TRP 116 N -0.47 0.89 -0.33 1.13 -0.00 -0.63 -0.28 115.95 116.26 2jmw h TRP 116 Ca -0.03 0.03 -0.04 0.00 -0.00 0.00 0.00 58.89 58.85 2jmw h TRP 116 Cb 0.35 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 29.22 2jmw h TRP 116 CO -0.01 0.37 0.03 0.93 -0.00 0.00 0.00 178.44 179.76 2jmw h GLU 117 N 0.82 0.49 0.33 0.49 4.39 -1.30 -2.60 114.58 117.20 2jmw h GLU 117 Ca 0.40 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 60.00 2jmw h GLU 117 Cb 0.36 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2jmw h GLU 117 CO -0.24 0.49 -0.16 1.96 -1.16 0.00 0.00 179.01 179.90 2jmw h GLN 118 N 0.48 -0.43 -0.75 2.33 4.20 -0.27 -2.29 115.11 118.37 2jmw h GLN 118 Ca 0.11 0.03 0.17 0.00 0.06 0.00 0.00 58.65 59.02 2jmw h GLN 118 Cb 0.26 0.10 -0.12 0.00 0.30 0.00 0.00 27.48 28.02 2jmw h GLN 118 CO 0.00 -0.10 0.16 0.82 -0.67 0.00 0.00 178.83 179.04 2jmw h ILE 119 N -0.88 0.47 0.91 2.54 2.04 -1.21 -0.91 117.51 120.47 2jmw h ILE 119 Ca -0.05 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 2jmw h ILE 119 Cb 0.53 0.21 0.01 0.00 -0.74 0.00 0.00 36.82 36.82 2jmw h ILE 119 CO 0.07 0.04 -0.44 0.77 0.00 0.00 0.00 178.15 178.60 2jmw h SER 120 N 0.24 -1.04 -0.94 1.72 4.64 -1.49 -2.48 113.55 114.20 2jmw h SER 120 Ca 0.43 0.03 0.26 0.00 -0.47 0.00 0.00 61.79 62.05 2jmw h SER 120 Cb 0.76 0.27 -0.14 0.00 -0.31 0.00 0.00 62.40 62.97 2jmw h SER 120 CO -0.55 -0.72 0.43 -1.28 -0.87 0.00 0.00 176.83 173.84 2jmw h SER 121 N -1.27 0.33 0.48 4.97 0.87 -0.79 -0.45 113.55 117.69 2jmw h SER 121 Ca -0.12 0.18 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 2jmw h SER 121 Cb 0.94 0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 63.06 2jmw h SER 121 CO 0.21 -0.08 -0.32 0.11 -0.53 0.00 0.00 176.83 176.21 2jmw h LYS 122 N 0.34 -0.75 -0.57 2.24 1.57 -0.98 -2.39 116.57 116.03 2jmw h LYS 122 Ca 0.63 0.05 0.08 0.00 -1.87 0.00 0.00 60.65 59.54 2jmw h LYS 122 Cb 1.31 0.17 -0.10 0.00 0.08 0.00 0.00 32.23 33.69 2jmw h LYS 122 CO -0.59 -0.50 -0.49 0.52 -0.57 0.00 0.00 179.45 177.82 2jmw h MET 123 N -0.78 -0.25 -1.01 3.15 2.86 -0.63 0.31 114.93 118.59 2jmw h MET 123 Ca -0.05 0.02 0.22 0.00 -2.06 0.00 0.00 59.70 57.83 2jmw h MET 123 Cb 0.65 0.06 -0.11 0.00 0.06 0.00 0.00 31.60 32.25 2jmw h MET 123 CO 0.03 -0.17 0.61 -0.09 1.06 0.00 0.00 176.91 178.35 2jmw h ARG 124 N -0.26 0.63 -0.57 1.72 2.43 0.13 0.20 114.38 118.66 2jmw h ARG 124 Ca 0.15 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.19 2jmw h ARG 124 Cb 0.56 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 2jmw h ARG 124 CO -0.69 0.41 0.01 0.93 -1.51 0.00 0.00 179.97 179.13 2jmw h GLU 125 N 0.64 1.00 0.00 0.20 4.39 0.05 -2.60 114.58 118.27 2jmw h GLU 125 Ca 0.61 -0.31 -0.04 0.00 0.34 0.00 0.00 59.36 59.95 2jmw h GLU 125 Cb 1.10 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 2jmw h GLU 125 CO -0.42 0.99 -0.20 0.87 -1.16 0.00 0.00 179.01 179.10 2jmw h LYS 126 N 0.89 0.00 0.00 2.33 1.79 0.12 -3.46 116.57 118.24 2jmw h LYS 126 Ca 0.16 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2jmw h LYS 126 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 2jmw h LYS 126 CO 0.03 0.20 0.00 0.41 -1.08 0.00 0.00 179.45 179.01 2jmw n GLY 127 N -0.13 -0.07 3.14 3.86 0.00 -0.12 -5.10 105.19 106.77 2jmw n GLY 127 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2jmw n GLY 127 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jmw s PHE 128 N -0.92 3.42 -0.53 1.61 0.08 0.41 -4.92 117.98 117.13 2jmw s PHE 128 Ca 0.00 -2.17 -0.21 0.00 0.12 0.00 0.00 56.93 54.67 2jmw s PHE 128 Cb 0.00 -2.53 0.05 0.00 -0.57 0.00 0.00 43.02 39.98 2jmw s PHE 128 CO 0.00 -0.87 0.76 0.34 -0.10 0.00 0.00 175.22 175.35 2jmw s ASP 129 N 1.38 6.27 -0.05 1.36 2.15 -1.26 0.12 116.67 126.64 2jmw s ASP 129 Ca 0.00 -0.68 -0.02 0.00 0.43 0.00 0.00 52.55 52.29 2jmw s ASP 129 Cb -0.21 -2.35 0.04 0.00 -0.30 0.00 0.00 42.92 40.10 2jmw s ASP 129 CO -0.03 -1.04 0.10 -0.13 -0.17 0.00 0.00 175.17 173.91 2jmw s ARG 130 N 3.19 0.02 0.78 4.34 1.81 -1.26 -4.98 118.95 122.84 2jmw s ARG 130 Ca 0.22 0.35 -0.16 0.00 -1.72 0.00 0.00 55.73 54.42 2jmw s ARG 130 Cb -0.16 -0.27 -0.04 0.00 -0.45 0.00 0.00 34.95 34.03 2jmw s ARG 130 CO 0.15 -0.22 0.37 -1.13 -0.68 0.00 0.00 175.30 173.79 2jmw n SER 131 N 4.56 -1.87 0.01 0.23 3.41 -1.26 -4.81 113.62 113.89 2jmw n SER 131 Ca -0.20 0.51 -0.07 0.00 -0.26 0.00 0.00 58.87 58.86 2jmw n SER 131 Cb 0.51 -1.16 0.11 0.00 -0.26 0.00 0.00 64.21 63.41 2jmw n SER 131 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2jmw h PRO 132 N -0.64 0.51 -0.17 4.33 0.13 -1.95 -3.21 132.00 130.99 2jmw h PRO 132 Ca -0.45 -0.27 -0.00 0.00 -0.87 0.00 0.00 66.00 64.41 2jmw h PRO 132 Cb 1.34 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 2jmw h PRO 132 CO 0.39 0.85 0.10 1.79 -0.23 0.00 0.00 178.00 180.90 2jmw h THR 133 N 0.42 1.10 -0.79 1.56 1.35 -1.93 -2.37 112.91 112.24 2jmw h THR 133 Ca 0.03 -0.27 0.14 0.00 -0.55 0.00 0.00 66.41 65.76 2jmw h THR 133 Cb 0.93 0.97 -0.09 0.00 -1.73 0.00 0.00 68.15 68.22 2jmw h THR 133 CO 0.08 0.10 0.37 0.24 -0.25 0.00 0.00 175.52 176.05 2jmw h MET 134 N 0.18 0.52 -0.65 4.72 2.86 -1.92 0.24 114.93 120.88 2jmw h MET 134 Ca 0.06 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.62 2jmw h MET 134 Cb 0.07 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 2jmw h MET 134 CO -0.01 0.34 0.20 0.00 1.06 0.00 0.00 176.91 178.50 2jmw h THR 136 N 0.95 0.50 -0.09 0.00 2.02 -0.47 0.11 112.91 115.93 2jmw h THR 136 Ca 0.21 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 2jmw h THR 136 Cb 0.27 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2jmw h THR 136 CO -0.01 0.02 0.02 -0.78 0.37 0.00 0.00 175.52 175.15 2jmw h ASP 137 N -0.74 0.14 -0.96 4.18 1.82 -1.26 -2.62 116.42 116.97 2jmw h ASP 137 Ca -0.07 -0.22 0.09 0.00 -0.39 0.00 0.00 57.03 56.44 2jmw h ASP 137 Cb 0.55 -0.04 -0.07 0.00 0.68 0.00 0.00 39.33 40.45 2jmw h ASP 137 CO 0.11 0.32 0.62 0.50 -1.61 0.00 0.00 179.24 179.18 2jmw h LYS 138 N -0.05 0.99 0.17 0.28 1.63 -0.79 -2.30 116.57 116.49 2jmw h LYS 138 Ca 0.03 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 2jmw h LYS 138 Cb 0.24 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.64 2jmw h LYS 138 CO -0.00 0.65 -0.08 2.35 -3.45 0.00 0.00 179.45 178.92 2jmw h TRP 139 N 1.02 -0.21 -0.75 1.91 2.91 -0.59 -2.47 115.95 117.76 2jmw h TRP 139 Ca 0.44 -0.01 0.14 0.00 1.13 0.00 0.00 58.89 60.60 2jmw h TRP 139 Cb 0.35 0.07 -0.09 0.00 -0.51 0.00 0.00 29.16 28.97 2jmw h TRP 139 CO -0.00 -0.10 0.30 0.00 -1.03 0.00 0.00 178.44 177.61 2jmw h ARG 140 N -0.26 0.44 -0.87 2.65 -0.00 -1.05 -0.10 114.38 115.18 2jmw h ARG 140 Ca -0.02 -0.03 0.03 0.00 -0.50 0.00 0.00 59.98 59.46 2jmw h ARG 140 Cb 0.20 -0.10 -0.05 0.00 0.00 0.00 0.00 29.97 30.02 2jmw h ARG 140 CO 0.04 0.29 0.56 -0.97 0.00 0.00 0.00 179.97 179.89 2jmw h ASN 141 N 0.45 0.93 -0.71 7.04 -0.73 -1.20 -2.17 115.58 119.19 2jmw h ASN 141 Ca 0.41 -0.01 0.04 0.00 1.87 0.00 0.00 56.30 58.62 2jmw h ASN 141 Cb 0.62 -0.21 -0.05 0.00 0.27 0.00 0.00 38.32 38.95 2jmw h ASN 141 CO -0.40 0.64 0.43 -0.07 -0.37 0.00 0.00 177.43 177.66 2jmw h LEU 142 N 1.09 0.68 -0.84 0.34 3.38 -0.56 -2.00 115.31 117.39 2jmw h LEU 142 Ca 0.35 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 2jmw h LEU 142 Cb 0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2jmw h LEU 142 CO -0.12 0.46 0.50 -0.07 0.09 0.00 0.00 178.44 179.30 2jmw h LEU 143 N 0.82 1.01 0.05 1.67 3.38 -0.97 0.96 115.31 122.22 2jmw h LEU 143 Ca 0.30 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.21 2jmw h LEU 143 Cb 0.10 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2jmw h LEU 143 CO -0.14 0.78 -0.11 0.11 0.09 0.00 0.00 178.44 179.17 2jmw h LYS 144 N 1.15 -0.20 -0.08 1.13 1.79 -0.97 -2.29 116.57 117.11 2jmw h LYS 144 Ca 0.30 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.77 2jmw h LYS 144 Cb -0.04 0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2jmw h LYS 144 CO -0.06 -0.13 0.01 0.93 -1.08 0.00 0.00 179.45 179.12 2jmw h GLU 145 N -0.21 0.13 -1.12 3.15 4.39 -1.22 -0.08 114.58 119.62 2jmw h GLU 145 Ca 0.02 -0.04 0.33 0.00 0.34 0.00 0.00 59.36 60.02 2jmw h GLU 145 Cb 0.23 -0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 28.75 2jmw h GLU 145 CO -0.07 0.37 0.70 0.74 -1.16 0.00 0.00 179.01 179.59 2jmw h PHE 146 N -0.13 0.69 0.07 4.33 0.04 -0.68 0.77 116.94 122.04 2jmw h PHE 146 Ca 0.02 0.03 -0.30 0.00 2.80 0.00 0.00 57.97 60.52 2jmw h PHE 146 Cb 0.31 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 2jmw h PHE 146 CO 0.02 -0.08 -1.57 -0.22 -0.60 0.00 0.00 178.31 175.86 2jmw h LYS 147 N 0.29 0.14 -0.82 1.51 3.64 -1.21 -3.31 116.57 116.81 2jmw h LYS 147 Ca 0.70 -0.24 -0.13 0.00 -1.27 0.00 0.00 60.65 59.71 2jmw h LYS 147 Cb 1.87 0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 33.71 2jmw h LYS 147 CO -0.42 0.92 0.16 1.63 -2.27 0.00 0.00 179.45 179.48 2jmw n LYS 148 N -3.32 2.99 -2.03 1.90 5.02 0.12 -4.65 118.16 118.20 2jmw n LYS 148 Ca -0.16 -2.09 -0.29 0.00 -2.02 0.00 0.00 58.31 53.75 2jmw n LYS 148 Cb 1.03 -1.94 0.19 0.00 -0.02 0.00 0.00 35.03 34.30 2jmw n LYS 148 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jmw n ALA 149 N 0.05 -1.27 -0.14 7.82 0.00 0.23 -4.63 120.51 122.57 2jmw n ALA 149 Ca 0.27 -1.79 -0.11 0.00 0.00 0.00 0.00 53.44 51.81 2jmw n ALA 149 Cb 1.04 -0.02 -0.02 0.00 0.00 0.00 0.00 19.45 20.45 2jmw n ALA 149 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2jmw h LYS 150 N 0.00 0.74 -0.87 0.00 2.10 -1.91 -3.17 116.57 113.45 2jmw h LYS 150 Ca -0.42 -0.26 0.15 0.00 -2.00 0.00 0.00 60.65 58.12 2jmw h LYS 150 Cb 1.20 -0.05 -0.15 0.00 -0.90 0.00 0.00 32.23 32.33 2jmw h LYS 150 CO 0.32 0.85 -0.32 0.45 -2.00 0.00 0.00 179.45 178.74 2jmw h HIS 151 N 0.56 -0.86 -2.99 0.07 3.86 -1.94 -3.41 115.15 110.44 2jmw h HIS 151 Ca 0.11 0.09 -0.46 0.00 -1.16 0.00 0.00 60.37 58.94 2jmw h HIS 151 Cb 0.55 0.51 0.04 0.00 1.06 0.00 0.00 27.41 29.56 2jmw h HIS 151 CO 0.04 -0.39 -0.02 -1.01 0.86 0.00 0.00 177.93 177.41 2jmw s HIS 152 N -6.06 3.23 -0.69 2.45 3.76 -1.20 -4.93 115.29 111.85 2jmw s HIS 152 Ca -0.14 0.34 -0.36 0.00 -0.15 0.00 0.00 55.06 54.75 2jmw s HIS 152 Cb 0.21 -2.43 -0.18 0.00 1.11 0.00 0.00 32.58 31.28 2jmw s HIS 152 CO 0.73 -0.49 2.40 -3.47 -0.85 0.00 0.00 174.74 173.06 2jmw n ASP 153 N -2.22 0.84 -4.34 1.40 2.03 -1.26 -4.68 116.55 108.32 2jmw n ASP 153 Ca 0.02 0.35 -0.33 0.00 0.52 0.00 0.00 54.79 55.36 2jmw n ASP 153 Cb 0.58 -1.00 0.14 0.00 -0.72 0.00 0.00 41.12 40.11 2jmw n ASP 153 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2jmw n ARG 154 N 8.12 -0.83 -2.65 -0.67 0.00 -1.26 -4.89 116.66 114.48 2jmw n ARG 154 Ca 0.57 -0.21 -0.21 0.00 -0.00 0.00 0.00 57.85 57.99 2jmw n ARG 154 Cb 0.06 -1.75 0.10 0.00 -0.00 0.00 0.00 32.46 30.87 2jmw n ARG 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2jmw n GLY 155 N 1.82 1.14 1.06 2.89 0.00 -1.26 -5.02 105.19 105.81 2jmw n GLY 155 Ca 0.04 -2.10 0.08 0.00 0.00 0.00 0.00 46.02 44.03 2jmw n GLY 155 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2jmw n ASN 156 N -2.70 3.99 -2.57 1.61 2.85 -1.26 -4.74 115.26 112.44 2jmw n ASN 156 Ca 0.16 -2.63 -0.24 0.00 -0.11 0.00 0.00 54.58 51.76 2jmw n ASN 156 Cb 0.57 -0.48 -0.10 0.00 1.24 0.00 0.00 39.78 41.01 2jmw n ASN 156 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2jmw n GLY 157 N 0.19 3.81 3.31 8.20 0.00 -1.26 -4.84 105.19 114.61 2jmw n GLY 157 Ca 0.20 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 2jmw n GLY 157 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jmw n SER 158 N 2.32 2.70 -0.10 1.61 2.88 -1.26 -4.48 113.62 117.29 2jmw n SER 158 Ca 0.55 -2.68 -0.24 0.00 -1.33 0.00 0.00 58.87 55.17 2jmw n SER 158 Cb 0.61 -1.35 -0.12 0.00 -0.75 0.00 0.00 64.21 62.61 2jmw n SER 158 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jmw n ALA 159 N 10.35 1.10 -1.55 -1.46 0.00 -1.26 -4.96 120.51 122.73 2jmw n ALA 159 Ca 0.48 -0.86 -0.50 0.00 0.00 0.00 0.00 53.44 52.56 2jmw n ALA 159 Cb 0.43 -0.24 -0.04 0.00 0.00 0.00 0.00 19.45 19.59 2jmw n ALA 159 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2jmw n LYS 160 N -3.92 0.87 -3.59 0.00 2.85 -1.26 -4.97 118.16 108.15 2jmw n LYS 160 Ca -0.43 0.31 -0.11 0.00 -1.05 0.00 0.00 58.31 57.03 2jmw n LYS 160 Cb 0.89 -1.74 -0.06 0.00 -0.65 0.00 0.00 35.03 33.47 2jmw n LYS 160 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jmw s MET 161 N -0.44 0.64 -0.09 -1.58 0.23 -1.26 -5.18 119.30 111.62 2jmw s MET 161 Ca 0.74 0.34 -0.15 0.00 -1.03 0.00 0.00 55.69 55.59 2jmw s MET 161 Cb -0.91 0.30 0.03 0.00 -1.53 0.00 0.00 34.83 32.73 2jmw s MET 161 CO 0.54 -0.16 0.38 -1.12 -2.03 0.00 0.00 175.02 172.63 2jmw s SER 162 N -0.63 -0.34 -0.12 -1.18 0.01 -1.26 -5.16 113.70 105.02 2jmw s SER 162 Ca -0.01 0.51 -0.02 0.00 1.31 0.00 0.00 55.95 57.74 2jmw s SER 162 Cb -0.02 0.59 -0.03 0.00 0.21 0.00 0.00 66.02 66.77 2jmw s SER 162 CO 0.00 -0.29 -0.05 -0.72 0.41 0.00 0.00 173.24 172.59 2jmw s TYR 163 N -0.50 3.00 -1.03 2.43 1.13 -1.26 -4.99 117.35 116.13 2jmw s TYR 163 Ca -0.06 -0.16 0.23 0.00 -1.41 0.00 0.00 57.07 55.67 2jmw s TYR 163 Cb -0.04 -1.85 1.02 0.00 -1.10 0.00 0.00 41.96 39.99 2jmw s TYR 163 CO 0.03 0.13 1.75 0.98 -2.51 0.00 0.00 175.55 175.93 2jmw n TYR 164 N 2.95 0.00 -1.87 -3.49 4.19 -1.26 -4.82 117.16 112.86 2jmw n TYR 164 Ca -0.18 0.00 -0.29 0.00 3.31 0.00 0.00 57.90 60.74 2jmw n TYR 164 Cb 0.53 -0.48 0.09 0.00 0.49 0.00 0.00 39.34 39.96 2jmw n TYR 164 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 2jmw s LYS 165 N -2.97 2.00 0.00 2.98 -0.14 -1.26 -5.40 119.74 114.95 2jmw s LYS 165 Ca 0.12 0.16 0.24 0.00 -1.36 0.00 0.00 55.97 55.13 2jmw s LYS 165 Cb 0.15 -1.95 0.19 0.00 -1.68 0.00 0.00 37.83 34.54 2jmw s LYS 165 CO 0.42 -1.58 1.25 -0.85 -0.76 0.00 0.00 175.35 173.83