#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cmz s SER 80 N 0.00 -0.10 0.64 2.55 0.15 -1.26 -5.01 113.70 110.67 1cmz s SER 80 Ca 0.00 -0.68 0.26 0.00 0.70 0.00 0.00 55.95 56.22 1cmz s SER 80 Cb 0.00 0.50 1.32 0.00 -1.71 0.00 0.00 66.02 66.14 1cmz s SER 80 CO 0.00 -0.97 1.75 -0.65 1.20 0.00 0.00 173.24 174.57 1cmz h PRO 81 N 2.38 0.00 -0.27 5.44 0.11 -1.98 0.46 132.00 138.14 1cmz h PRO 81 Ca -0.30 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 1cmz h PRO 81 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1cmz h PRO 81 CO 0.43 0.00 0.05 0.93 -0.21 0.00 0.00 178.00 179.20 1cmz h GLU 82 N 0.00 0.39 0.10 1.05 5.08 -1.97 2.16 114.58 121.39 1cmz h GLU 82 Ca 0.11 -0.06 -0.29 0.00 -1.00 0.00 0.00 59.36 58.12 1cmz h GLU 82 Cb 1.17 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1cmz h GLU 82 CO -0.00 0.38 -1.41 0.93 -1.00 0.00 0.00 179.01 177.91 1cmz h GLU 83 N 0.39 0.21 0.04 2.33 5.08 -0.49 -2.96 114.58 119.18 1cmz h GLU 83 Ca 0.09 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1cmz h GLU 83 Cb 0.19 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1cmz h GLU 83 CO -0.00 1.09 -0.02 0.28 -1.00 0.00 0.00 179.01 179.36 1cmz h VAL 84 N 0.06 1.32 -0.44 3.13 2.07 -1.18 -0.49 116.25 120.72 1cmz h VAL 84 Ca -0.19 -1.72 0.03 0.00 0.82 0.00 0.00 66.70 65.63 1cmz h VAL 84 Cb 1.98 2.38 -0.02 0.00 -1.52 0.00 0.00 31.29 34.10 1cmz h VAL 84 CO 0.16 0.40 0.29 1.56 0.02 0.00 0.00 177.57 180.01 1cmz h GLN 85 N -0.88 0.47 0.08 1.57 4.20 0.34 -2.83 115.11 118.06 1cmz h GLN 85 Ca -0.00 -0.03 -0.30 0.00 0.06 0.00 0.00 58.65 58.38 1cmz h GLN 85 Cb 0.70 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.35 1cmz h GLN 85 CO 0.01 0.31 -1.55 0.66 -0.67 0.00 0.00 178.83 177.59 1cmz h SER 86 N 0.48 0.28 -0.24 1.46 4.64 -1.58 -3.35 113.55 115.24 1cmz h SER 86 Ca 0.18 -0.42 -0.02 0.00 -0.47 0.00 0.00 61.79 61.06 1cmz h SER 86 Cb 0.11 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 1cmz h SER 86 CO -0.04 1.35 0.09 -0.50 -0.87 0.00 0.00 176.83 176.86 1cmz h TRP 87 N 0.05 0.43 0.00 4.77 6.55 -0.84 -0.45 115.95 126.46 1cmz h TRP 87 Ca -0.24 -0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.58 1cmz h TRP 87 Cb 1.99 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 30.16 1cmz h TRP 87 CO 0.05 0.37 0.00 0.00 -1.05 0.00 0.00 178.44 177.81 1cmz n ALA 88 N -2.48 2.57 -0.02 1.49 0.00 -1.14 -3.06 120.51 117.88 1cmz n ALA 88 Ca 0.01 -0.15 0.02 0.00 0.00 0.00 0.00 53.44 53.33 1cmz n ALA 88 Cb 0.16 -1.38 -0.08 0.00 0.00 0.00 0.00 19.45 18.15 1cmz n ALA 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1cmz n GLN 89 N -0.90 0.94 -3.87 0.00 6.02 -0.22 -5.03 117.38 114.32 1cmz n GLN 89 Ca 0.18 -0.07 -0.11 0.00 -0.01 0.00 0.00 57.00 56.99 1cmz n GLN 89 Cb 0.08 -1.24 -0.10 0.00 1.02 0.00 0.00 30.24 30.01 1cmz n GLN 89 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1cmz s SER 90 N -3.43 0.04 -0.07 1.08 1.04 -0.94 -5.06 113.70 106.36 1cmz s SER 90 Ca -0.04 -0.27 -0.07 0.00 0.48 0.00 0.00 55.95 56.06 1cmz s SER 90 Cb 0.05 0.22 -0.28 0.00 0.10 0.00 0.00 66.02 66.11 1cmz s SER 90 CO 0.40 -0.41 0.59 0.15 0.98 0.00 0.00 173.24 174.95 1cmz h PHE 91 N 4.07 0.54 -0.38 5.02 3.04 -1.90 -3.39 116.94 123.95 1cmz h PHE 91 Ca -0.31 -0.40 0.06 0.00 3.98 0.00 0.00 57.97 61.30 1cmz h PHE 91 Cb 1.19 -0.02 -0.08 0.00 2.56 0.00 0.00 35.95 39.60 1cmz h PHE 91 CO 0.57 1.63 -0.50 -0.44 -2.02 0.00 0.00 178.31 177.55 1cmz h ASP 92 N 0.08 -1.66 -0.95 0.41 3.32 -1.97 0.41 116.42 116.06 1cmz h ASP 92 Ca -0.35 0.23 0.27 0.00 0.02 0.00 0.00 57.03 57.20 1cmz h ASP 92 Cb 2.06 0.69 -0.04 0.00 0.22 0.00 0.00 39.33 42.26 1cmz h ASP 92 CO 0.14 -0.40 0.87 0.11 -1.72 0.00 0.00 179.24 178.24 1cmz h LYS 93 N -0.39 0.00 -0.14 3.56 1.57 -1.88 2.24 116.57 121.54 1cmz h LYS 93 Ca 0.10 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.80 1cmz h LYS 93 Cb 0.60 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 1cmz h LYS 93 CO -0.57 0.00 -0.23 1.25 -0.57 0.00 0.00 179.45 179.33 1cmz h LEU 94 N 0.00 0.44 0.00 2.94 5.85 -0.38 -3.33 115.31 120.84 1cmz h LEU 94 Ca 0.45 -0.53 -0.22 0.00 0.84 0.00 0.00 57.88 58.42 1cmz h LEU 94 Cb 2.18 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 43.04 1cmz h LEU 94 CO -0.00 0.89 -2.09 0.23 -0.34 0.00 0.00 178.44 177.12 1cmz n MET 95 N -4.47 0.98 -0.10 1.25 2.81 0.36 -1.67 117.12 116.29 1cmz n MET 95 Ca -0.06 -0.06 -0.01 0.00 -1.81 0.00 0.00 57.70 55.76 1cmz n MET 95 Cb 0.42 -1.45 0.01 0.00 -0.71 0.00 0.00 33.22 31.50 1cmz n MET 95 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 1cmz n HIS 96 N -2.50 0.13 -3.80 2.03 -0.00 0.73 -4.72 115.22 107.10 1cmz n HIS 96 Ca -0.21 -0.60 -0.12 0.00 -0.00 0.00 0.00 57.72 56.78 1cmz n HIS 96 Cb 0.89 -0.30 -0.10 0.00 -0.00 0.00 0.00 29.99 30.48 1cmz n HIS 96 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1cmz s SER 97 N 0.98 -0.15 0.13 0.26 1.04 -1.25 -4.82 113.70 109.90 1cmz s SER 97 Ca 0.02 0.12 -0.14 0.00 0.48 0.00 0.00 55.95 56.43 1cmz s SER 97 Cb 0.02 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.47 1cmz s SER 97 CO 0.00 -0.32 1.58 1.55 0.98 0.00 0.00 173.24 177.03 1cmz h PRO 98 N 4.51 0.74 -0.01 4.02 0.13 -1.91 -3.15 132.00 136.33 1cmz h PRO 98 Ca -0.29 -0.23 -0.15 0.00 -0.87 0.00 0.00 66.00 64.45 1cmz h PRO 98 Cb 1.19 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 1cmz h PRO 98 CO 0.38 0.81 -0.72 0.00 -0.23 0.00 0.00 178.00 178.25 1cmz h ALA 99 N 0.89 0.80 0.02 -0.56 0.00 -1.94 -3.28 119.26 115.19 1cmz h ALA 99 Ca 0.12 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 1cmz h ALA 99 Cb 0.48 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1cmz h ALA 99 CO 0.02 0.87 -0.01 0.78 0.00 0.00 0.00 179.25 180.91 1cmz h GLY 100 N 2.02 -0.03 0.30 0.00 0.00 -1.71 -2.02 103.07 101.62 1cmz h GLY 100 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1cmz h GLY 100 CO 0.10 -0.01 0.67 0.07 0.00 0.00 0.00 176.54 177.36 1cmz h ARG 101 N -0.03 0.00 0.02 4.80 0.11 -1.28 0.73 114.38 118.73 1cmz h ARG 101 Ca -0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1cmz h ARG 101 Cb 0.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.10 1cmz h ARG 101 CO 0.01 0.00 -0.01 0.77 0.10 0.00 0.00 179.97 180.84 1cmz h SER 102 N 0.00 -0.02 -0.95 0.08 0.02 -1.43 -2.63 113.55 108.62 1cmz h SER 102 Ca 0.00 -0.48 0.01 0.00 -0.84 0.00 0.00 61.79 60.48 1cmz h SER 102 Cb 1.34 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.83 1cmz h SER 102 CO 0.00 0.71 0.62 0.58 -1.14 0.00 0.00 176.83 177.61 1cmz h VAL 103 N -0.99 1.25 -0.42 2.27 2.07 -0.64 -0.94 116.25 118.85 1cmz h VAL 103 Ca -0.00 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 1cmz h VAL 103 Cb 0.50 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1cmz h VAL 103 CO 0.00 0.24 0.01 0.15 0.02 0.00 0.00 177.57 177.99 1cmz h PHE 104 N 1.29 0.71 -0.02 1.57 3.57 -1.62 -1.94 116.94 120.51 1cmz h PHE 104 Ca 0.35 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 1cmz h PHE 104 Cb -0.14 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.39 1cmz h PHE 104 CO -0.00 0.67 -0.21 -0.09 -2.23 0.00 0.00 178.31 176.45 1cmz h ARG 105 N 0.64 0.03 0.10 1.11 2.43 -0.80 -2.76 114.38 115.13 1cmz h ARG 105 Ca 0.13 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1cmz h ARG 105 Cb 0.39 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1cmz h ARG 105 CO 0.01 0.24 -0.05 0.00 -1.51 0.00 0.00 179.97 178.67 1cmz h ALA 106 N 1.76 -0.19 -0.71 2.80 0.00 -0.57 -2.25 119.26 120.11 1cmz h ALA 106 Ca 0.00 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.03 1cmz h ALA 106 Cb 0.39 0.05 -0.13 0.00 0.00 0.00 0.00 17.79 18.10 1cmz h ALA 106 CO 0.03 -0.18 -0.11 0.35 0.00 0.00 0.00 179.25 179.34 1cmz h PHE 107 N -0.67 -0.25 -0.04 0.00 3.57 -1.59 0.38 116.94 118.34 1cmz h PHE 107 Ca -0.01 0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1cmz h PHE 107 Cb 0.10 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1cmz h PHE 107 CO 0.01 -0.27 -0.05 -0.07 -2.23 0.00 0.00 178.31 175.70 1cmz h LEU 108 N 0.04 -0.17 -1.00 0.59 4.07 -1.62 -2.41 115.31 114.81 1cmz h LEU 108 Ca 0.36 0.03 0.36 0.00 0.08 0.00 0.00 57.88 58.71 1cmz h LEU 108 Cb 0.58 0.08 -0.16 0.00 1.08 0.00 0.00 40.66 42.24 1cmz h LEU 108 CO -0.69 -0.08 0.53 -0.09 -1.08 0.00 0.00 178.44 177.04 1cmz h ARG 109 N -0.08 0.18 0.72 1.13 2.43 -0.28 0.56 114.38 119.04 1cmz h ARG 109 Ca 0.04 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1cmz h ARG 109 Cb 0.13 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1cmz h ARG 109 CO -0.09 0.12 -0.42 1.79 -1.51 0.00 0.00 179.97 179.85 1cmz h THR 110 N 0.18 0.00 0.00 0.20 1.35 -1.19 -0.92 112.91 112.53 1cmz h THR 110 Ca 0.77 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.63 1cmz h THR 110 Cb 1.88 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 1cmz h THR 110 CO -0.68 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 173.97 1cmz n GLU 111 N -5.11 0.42 -2.71 4.72 1.02 0.15 -4.71 120.64 114.42 1cmz n GLU 111 Ca -0.13 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 56.96 1cmz n GLU 111 Cb 0.44 -1.25 -0.01 0.00 -0.02 0.00 0.00 31.44 30.60 1cmz n GLU 111 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1cmz n TYR 112 N 0.55 -1.90 -0.11 -0.32 0.18 -0.35 -4.71 117.16 110.51 1cmz n TYR 112 Ca 0.00 0.07 0.10 0.00 1.88 0.00 0.00 57.90 59.95 1cmz n TYR 112 Cb 0.16 -1.14 0.23 0.00 -0.38 0.00 0.00 39.34 38.21 1cmz n TYR 112 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1cmz n SER 113 N -1.61 3.43 -0.00 9.48 2.88 -1.02 -4.53 113.62 122.25 1cmz n SER 113 Ca 0.01 -1.97 0.22 0.00 -1.33 0.00 0.00 58.87 55.81 1cmz n SER 113 Cb 0.50 -0.33 0.72 0.00 -0.75 0.00 0.00 64.21 64.35 1cmz n SER 113 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1cmz h GLU 114 N 3.57 0.00 -0.44 -1.46 -0.00 -1.84 -2.29 114.58 112.12 1cmz h GLU 114 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 59.36 59.45 1cmz h GLU 114 Cb 0.89 0.00 -0.09 0.00 -0.00 0.00 0.00 28.75 29.55 1cmz h GLU 114 CO 0.00 0.00 -0.14 1.49 -0.00 0.00 0.00 179.01 180.36 1cmz h GLU 115 N 0.00 -0.04 -0.97 1.06 4.57 -1.95 0.59 114.58 117.85 1cmz h GLU 115 Ca 0.27 0.00 0.29 0.00 -1.18 0.00 0.00 59.36 58.74 1cmz h GLU 115 Cb 1.20 0.01 -0.15 0.00 -0.16 0.00 0.00 28.75 29.65 1cmz h GLU 115 CO -0.00 -0.03 0.47 -0.91 -1.18 0.00 0.00 179.01 177.36 1cmz h ASN 116 N -0.04 0.37 0.15 1.04 4.21 -1.78 0.14 115.58 119.66 1cmz h ASN 116 Ca 0.21 0.19 -0.22 0.00 1.21 0.00 0.00 56.30 57.70 1cmz h ASN 116 Cb 0.36 0.17 0.02 0.00 -1.12 0.00 0.00 38.32 37.75 1cmz h ASN 116 CO -0.47 -0.13 -0.98 0.24 -1.29 0.00 0.00 177.43 174.80 1cmz h MET 117 N 0.30 0.31 -0.27 0.81 2.86 -1.27 -3.01 114.93 114.67 1cmz h MET 117 Ca 0.68 -0.54 0.06 0.00 -2.06 0.00 0.00 59.70 57.84 1cmz h MET 117 Cb 1.48 0.20 -0.08 0.00 0.06 0.00 0.00 31.60 33.26 1cmz h MET 117 CO -0.62 1.26 -0.42 1.25 1.06 0.00 0.00 176.91 179.44 1cmz h LEU 118 N -0.31 -1.35 -1.27 1.22 7.12 0.87 0.49 115.31 122.08 1cmz h LEU 118 Ca -0.18 0.19 0.14 0.00 0.13 0.00 0.00 57.88 58.16 1cmz h LEU 118 Cb 1.71 0.57 -0.07 0.00 -0.53 0.00 0.00 40.66 42.35 1cmz h LEU 118 CO 0.15 -0.39 0.57 0.15 -0.13 0.00 0.00 178.44 178.79 1cmz h PHE 119 N -0.40 0.85 -0.07 1.25 3.04 -1.20 -1.27 116.94 119.13 1cmz h PHE 119 Ca 0.11 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.07 1cmz h PHE 119 Cb 0.60 -0.27 -0.00 0.00 2.56 0.00 0.00 35.95 38.84 1cmz h PHE 119 CO -0.55 0.32 -0.01 2.35 -2.02 0.00 0.00 178.31 178.40 1cmz h TRP 120 N 0.72 0.14 -0.58 0.41 7.01 -0.10 -2.97 115.95 120.59 1cmz h TRP 120 Ca 0.45 -0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.46 1cmz h TRP 120 Cb 0.67 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.65 1cmz h TRP 120 CO -0.00 0.44 0.33 -0.07 -2.79 0.00 0.00 178.44 176.34 1cmz h LEU 121 N -0.19 0.50 -0.89 0.65 3.38 0.47 -1.24 115.31 118.00 1cmz h LEU 121 Ca 0.02 0.02 0.19 0.00 0.09 0.00 0.00 57.88 58.19 1cmz h LEU 121 Cb 0.38 -0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.94 1cmz h LEU 121 CO 0.01 0.34 0.44 0.00 0.09 0.00 0.00 178.44 179.31 1cmz h ALA 122 N 1.28 1.40 -0.27 1.53 0.00 -1.20 0.12 119.26 122.12 1cmz h ALA 122 Ca 0.25 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 1cmz h ALA 122 Cb 0.10 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1cmz h ALA 122 CO -0.14 -0.21 0.12 0.00 0.00 0.00 0.00 179.25 179.02 1cmz h GLU 124 N 0.29 0.41 -0.07 0.00 4.81 -0.29 -1.64 114.58 118.09 1cmz h GLU 124 Ca 0.09 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.20 1cmz h GLU 124 Cb 0.15 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1cmz h GLU 124 CO -0.01 0.27 -0.33 1.49 -0.73 0.00 0.00 179.01 179.70 1cmz h GLU 125 N 0.42 0.35 0.00 1.92 4.81 -0.73 -3.08 114.58 118.28 1cmz h GLU 125 Ca 0.44 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1cmz h GLU 125 Cb 1.07 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1cmz h GLU 125 CO -0.16 0.92 0.40 1.25 -0.73 0.00 0.00 179.01 180.69 1cmz h LEU 126 N -0.14 0.00 0.00 1.64 5.85 -0.79 0.51 115.31 122.38 1cmz h LEU 126 Ca -0.02 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.57 1cmz h LEU 126 Cb 0.98 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1cmz h LEU 126 CO 0.07 0.00 -0.72 0.11 -0.34 0.00 0.00 178.44 177.56 1cmz h LYS 127 N 0.00 0.00 -0.96 1.25 1.57 -1.49 -3.15 116.57 113.79 1cmz h LYS 127 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1cmz h LYS 127 Cb 0.80 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1cmz h LYS 127 CO 0.00 0.54 0.03 0.00 -0.57 0.00 0.00 179.45 179.45 1cmz n ALA 128 N -2.27 2.75 -3.19 3.86 0.00 0.18 -4.00 120.51 117.84 1cmz n ALA 128 Ca -0.00 -0.29 -0.22 0.00 0.00 0.00 0.00 53.44 52.94 1cmz n ALA 128 Cb 0.78 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.15 1cmz n ALA 128 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1cmz n GLU 129 N 0.15 1.10 0.00 0.00 4.71 -1.19 -4.93 120.64 120.49 1cmz n GLU 129 Ca 0.05 -3.49 0.00 0.00 -0.01 0.00 0.00 57.16 53.71 1cmz n GLU 129 Cb 0.47 -1.57 0.00 0.00 -1.01 0.00 0.00 31.44 29.32 1cmz n GLU 129 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1cmz n ALA 130 N 0.73 2.25 -1.11 0.62 0.00 -1.26 -4.67 120.51 117.08 1cmz n ALA 130 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1cmz n ALA 130 Cb 0.58 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1cmz n ALA 130 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1cmz n ASN 131 N 0.49 0.00 0.00 0.00 3.02 -1.26 -5.07 115.26 112.44 1cmz n ASN 131 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1cmz n ASN 131 Cb 0.34 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 1cmz n ASN 131 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1cmz n GLN 132 N 0.00 0.00 0.13 3.52 -0.06 -1.26 -4.83 117.38 114.88 1cmz n GLN 132 Ca 0.00 0.00 -0.24 0.00 -2.00 0.00 0.00 57.00 54.76 1cmz n GLN 132 Cb 0.00 0.00 -0.16 0.00 -4.06 0.00 0.00 30.24 26.02 1cmz n GLN 132 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 1cmz h HIS 133 N 0.00 0.91 0.00 3.69 3.86 -1.97 -3.27 115.15 118.37 1cmz h HIS 133 Ca 0.00 -0.67 -0.01 0.00 -1.16 0.00 0.00 60.37 58.54 1cmz h HIS 133 Cb 0.00 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 1cmz h HIS 133 CO 0.00 1.53 -0.51 -0.24 0.86 0.00 0.00 177.93 179.57 1cmz h VAL 134 N 0.06 0.05 0.00 2.45 3.04 -1.96 -3.24 116.25 116.66 1cmz h VAL 134 Ca -0.24 -1.08 -0.03 0.00 -1.01 0.00 0.00 66.70 64.33 1cmz h VAL 134 Cb 2.09 1.80 -0.00 0.00 -2.01 0.00 0.00 31.29 33.16 1cmz h VAL 134 CO 0.25 0.03 -0.17 0.58 -1.01 0.00 0.00 177.57 177.26 1cmz h VAL 135 N 0.00 0.66 0.18 1.51 2.07 -1.85 -2.76 116.25 116.07 1cmz h VAL 135 Ca -0.01 -0.71 -0.28 0.00 0.82 0.00 0.00 66.70 66.52 1cmz h VAL 135 Cb 1.03 1.45 0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1cmz h VAL 135 CO 0.00 0.16 -1.32 0.44 0.02 0.00 0.00 177.57 176.88 1cmz h ASP 136 N 0.00 0.59 0.47 0.57 3.32 -1.61 -2.71 116.42 117.05 1cmz h ASP 136 Ca -0.00 -0.92 -0.02 0.00 0.02 0.00 0.00 57.03 56.11 1cmz h ASP 136 Cb 0.43 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1cmz h ASP 136 CO 0.02 1.61 -0.22 -0.33 -1.72 0.00 0.00 179.24 178.60 1cmz h GLU 137 N -0.12 -0.60 -0.71 3.56 5.08 -1.61 -2.93 114.58 117.24 1cmz h GLU 137 Ca -0.25 0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1cmz h GLU 137 Cb 1.91 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 31.27 1cmz h GLU 137 CO 0.17 -0.34 0.27 -0.22 -1.00 0.00 0.00 179.01 177.89 1cmz h LYS 138 N -0.75 1.06 -0.99 2.33 3.64 -1.67 -2.01 116.57 118.18 1cmz h LYS 138 Ca -0.06 -0.19 0.23 0.00 -1.27 0.00 0.00 60.65 59.36 1cmz h LYS 138 Cb 0.54 -0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.10 1cmz h LYS 138 CO 0.11 0.87 0.64 0.00 -2.27 0.00 0.00 179.45 178.79 1cmz h ALA 139 N 1.26 2.14 -0.11 5.00 0.00 -1.35 0.18 119.26 126.38 1cmz h ALA 139 Ca 0.24 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1cmz h ALA 139 Cb 0.22 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1cmz h ALA 139 CO -0.02 -0.49 0.01 0.00 0.00 0.00 0.00 179.25 178.74 1cmz h ARG 140 N 0.46 0.19 -0.95 0.00 2.47 -1.19 -2.47 114.38 112.89 1cmz h ARG 140 Ca 0.55 -0.06 0.27 0.00 -1.26 0.00 0.00 59.98 59.48 1cmz h ARG 140 Cb 1.29 -0.02 -0.17 0.00 -1.65 0.00 0.00 29.97 29.43 1cmz h ARG 140 CO -0.26 0.43 0.14 1.25 0.56 0.00 0.00 179.97 182.08 1cmz h LEU 141 N -0.07 -0.26 -0.02 3.04 5.85 -0.91 1.84 115.31 124.79 1cmz h LEU 141 Ca 0.03 0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 1cmz h LEU 141 Cb 0.34 0.40 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1cmz h LEU 141 CO 0.00 -0.30 -0.04 0.40 -0.34 0.00 0.00 178.44 178.16 1cmz h ILE 142 N 0.06 1.45 -0.11 4.05 2.04 -1.40 -0.43 117.51 123.18 1cmz h ILE 142 Ca 0.60 -1.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.04 1cmz h ILE 142 Cb 1.29 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 39.71 1cmz h ILE 142 CO -0.82 0.37 -0.01 0.22 0.00 0.00 0.00 178.15 177.92 1cmz h TYR 143 N -0.50 0.22 -0.43 1.37 3.20 -0.44 -2.54 116.97 117.85 1cmz h TYR 143 Ca 0.00 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1cmz h TYR 143 Cb 0.63 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 1cmz h TYR 143 CO 0.13 0.46 0.27 1.49 -1.64 0.00 0.00 178.16 178.86 1cmz h GLU 144 N -0.08 0.57 0.00 1.82 4.81 0.26 -1.66 114.58 120.31 1cmz h GLU 144 Ca 0.03 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1cmz h GLU 144 Cb 0.38 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.63 1cmz h GLU 144 CO 0.01 0.41 0.00 0.22 -0.73 0.00 0.00 179.01 178.92 1cmz h ASP 145 N 0.57 0.00 0.00 1.04 3.58 -1.03 -3.40 116.42 117.18 1cmz h ASP 145 Ca 0.15 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.60 1cmz h ASP 145 Cb -0.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.03 1cmz h ASP 145 CO -0.03 0.00 0.00 -1.22 -2.88 0.00 0.00 179.24 175.11 1cmz n TYR 146 N -2.34 0.00 -0.18 0.28 4.01 -0.96 -4.91 117.16 113.06 1cmz n TYR 146 Ca 0.02 0.00 0.17 0.00 -0.16 0.00 0.00 57.90 57.93 1cmz n TYR 146 Cb 0.23 0.00 0.31 0.00 -0.31 0.00 0.00 39.34 39.57 1cmz n TYR 146 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1cmz n VAL 147 N 0.00 -0.19 -0.56 -0.72 0.31 -1.14 -3.92 118.33 112.10 1cmz n VAL 147 Ca 0.00 1.00 -0.16 0.00 -0.01 0.00 0.00 64.34 65.17 1cmz n VAL 147 Cb 0.00 -1.64 0.13 0.00 -0.91 0.00 0.00 33.84 31.42 1cmz n VAL 147 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1cmz n SER 148 N -4.03 -2.90 -0.23 4.52 3.41 -0.66 -4.55 113.62 109.17 1cmz n SER 148 Ca 0.20 -0.34 0.29 0.00 -0.26 0.00 0.00 58.87 58.76 1cmz n SER 148 Cb 0.70 -0.73 0.47 0.00 -0.26 0.00 0.00 64.21 64.39 1cmz n SER 148 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1cmz h ILE 149 N -2.59 0.02 -2.23 -1.33 2.10 -1.91 -3.41 117.51 108.16 1cmz h ILE 149 Ca -0.21 0.00 -0.58 0.00 1.08 0.00 0.00 64.86 65.14 1cmz h ILE 149 Cb 0.68 0.03 0.20 0.00 -1.09 0.00 0.00 36.82 36.64 1cmz h ILE 149 CO 0.13 0.00 -1.18 0.18 -1.08 0.00 0.00 178.15 176.21 1cmz n LEU 150 N -3.31 -3.36 0.13 2.19 4.32 -1.25 -4.91 117.00 110.81 1cmz n LEU 150 Ca 0.24 0.54 0.00 0.00 -0.02 0.00 0.00 56.01 56.77 1cmz n LEU 150 Cb 1.53 -0.90 0.00 0.00 -1.62 0.00 0.00 43.42 42.43 1cmz n LEU 150 CO 0.25 -4.76 0.00 -0.24 -1.22 0.00 0.00 177.39 171.42 1cmz n SER 151 N 2.23 -1.73 -0.34 -1.43 2.88 -1.26 -4.84 113.62 109.12 1cmz n SER 151 Ca 0.06 0.48 0.17 0.00 -1.33 0.00 0.00 58.87 58.26 1cmz n SER 151 Cb 0.50 1.77 0.39 0.00 -0.75 0.00 0.00 64.21 66.12 1cmz n SER 151 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1cmz h PRO 152 N 0.00 0.58 -2.05 -1.46 0.10 -2.00 0.68 132.00 127.85 1cmz h PRO 152 Ca 0.00 -0.03 -0.77 0.00 0.10 0.00 0.00 66.00 65.30 1cmz h PRO 152 Cb 0.00 -0.13 -0.27 0.00 0.10 0.00 0.00 31.00 30.70 1cmz h PRO 152 CO 0.00 0.38 1.05 1.63 0.10 0.00 0.00 178.00 181.16 1cmz n LYS 153 N -4.83 3.23 -3.89 1.05 4.76 -1.26 -4.90 118.16 112.32 1cmz n LYS 153 Ca 0.26 -3.69 -0.28 0.00 -2.87 0.00 0.00 58.31 51.74 1cmz n LYS 153 Cb 0.73 -2.30 -0.17 0.00 -1.84 0.00 0.00 35.03 31.45 1cmz n LYS 153 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1cmz s GLU 154 N -4.03 1.46 0.77 1.97 -6.30 0.23 -4.79 118.70 108.01 1cmz s GLU 154 Ca 0.50 -0.42 -0.16 0.00 -2.50 0.00 0.00 54.97 52.39 1cmz s GLU 154 Cb 0.39 -1.85 -0.07 0.00 0.00 0.00 0.00 34.13 32.60 1cmz s GLU 154 CO -0.36 -0.37 0.16 1.33 0.02 0.00 0.00 175.26 176.04 1cmz n VAL 155 N 4.90 0.90 -1.52 3.70 0.24 -1.26 -4.56 118.33 120.73 1cmz n VAL 155 Ca -0.12 -0.40 -0.13 0.00 -2.04 0.00 0.00 64.34 61.65 1cmz n VAL 155 Cb 0.49 -0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 32.29 1cmz n VAL 155 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1cmz n SER 156 N 0.70 1.06 -3.63 -1.34 7.64 -1.26 -4.76 113.62 112.03 1cmz n SER 156 Ca 0.07 -2.05 -0.13 0.00 1.01 0.00 0.00 58.87 57.77 1cmz n SER 156 Cb 0.51 -1.57 -0.07 0.00 -1.01 0.00 0.00 64.21 62.07 1cmz n SER 156 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1cmz s LEU 157 N 14.65 -0.73 0.00 -3.43 0.20 -1.26 -5.01 118.68 123.10 1cmz s LEU 157 Ca 0.80 1.38 0.00 0.00 0.69 0.00 0.00 54.13 57.00 1cmz s LEU 157 Cb -0.10 2.39 0.00 0.00 -0.43 0.00 0.00 46.19 48.06 1cmz s LEU 157 CO 0.16 -0.24 0.00 -0.90 -0.29 0.00 0.00 176.35 175.08 1cmz n ASP 158 N 2.73 0.00 -2.25 3.68 5.68 -1.26 -5.04 116.55 120.09 1cmz n ASP 158 Ca -0.14 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.15 1cmz n ASP 158 Cb 0.55 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.53 1cmz n ASP 158 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1cmz n SER 159 N 0.00 -0.46 0.22 -1.12 7.64 -1.26 -4.59 113.62 114.05 1cmz n SER 159 Ca 0.00 -0.75 0.11 0.00 1.01 0.00 0.00 58.87 59.24 1cmz n SER 159 Cb 0.00 0.00 0.39 0.00 -1.01 0.00 0.00 64.21 63.59 1cmz n SER 159 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1cmz h ARG 160 N 0.00 0.00 -0.65 1.43 1.12 -2.02 0.51 114.38 114.77 1cmz h ARG 160 Ca 0.00 0.00 0.11 0.00 -1.11 0.00 0.00 59.98 58.98 1cmz h ARG 160 Cb 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 29.97 29.92 1cmz h ARG 160 CO 0.00 0.00 0.43 0.28 -3.11 0.00 0.00 179.97 177.57 1cmz h VAL 161 N 0.00 0.88 -0.03 0.20 2.07 -2.01 0.25 116.25 117.62 1cmz h VAL 161 Ca 0.10 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 67.47 1cmz h VAL 161 Cb 1.66 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1cmz h VAL 161 CO -0.00 0.08 0.13 0.08 0.02 0.00 0.00 177.57 177.88 1cmz h ARG 162 N 0.44 0.00 0.11 1.57 0.11 -0.21 -1.47 114.38 114.93 1cmz h ARG 162 Ca 0.30 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 60.13 1cmz h ARG 162 Cb 0.59 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.67 1cmz h ARG 162 CO -0.09 0.00 -1.29 1.49 0.10 0.00 0.00 179.97 180.18 1cmz h GLU 163 N 0.00 0.23 -0.87 0.08 4.81 -0.68 -3.03 114.58 115.12 1cmz h GLU 163 Ca 0.01 -0.38 0.02 0.00 -0.13 0.00 0.00 59.36 58.88 1cmz h GLU 163 Cb 0.27 0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.74 1cmz h GLU 163 CO -0.00 1.18 0.57 0.78 -0.73 0.00 0.00 179.01 180.82 1cmz h GLY 164 N -0.07 1.24 1.40 1.92 0.00 -1.18 -0.23 103.07 106.15 1cmz h GLY 164 Ca -0.28 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 46.46 1cmz h GLY 164 CO 0.05 0.42 -0.43 -2.22 0.00 0.00 0.00 176.54 174.36 1cmz h ILE 165 N 1.15 1.30 -0.06 2.60 2.04 -1.48 -0.11 117.51 122.95 1cmz h ILE 165 Ca 0.33 -1.62 -0.11 0.00 1.00 0.00 0.00 64.86 64.46 1cmz h ILE 165 Cb -0.09 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1cmz h ILE 165 CO -0.08 0.52 -0.48 -1.13 0.00 0.00 0.00 178.15 176.97 1cmz h ASN 166 N 0.53 0.17 0.71 1.72 -1.24 -1.28 0.19 115.58 116.38 1cmz h ASN 166 Ca 0.04 -0.08 -0.26 0.00 0.71 0.00 0.00 56.30 56.71 1cmz h ASN 166 Cb 0.96 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.95 1cmz h ASN 166 CO 0.09 0.62 -1.29 0.50 -1.29 0.00 0.00 177.43 176.06 1cmz h LYS 167 N 0.13 0.11 0.00 6.67 1.63 -0.89 -3.30 116.57 120.92 1cmz h LYS 167 Ca 0.01 -0.19 -0.03 0.00 -0.85 0.00 0.00 60.65 59.58 1cmz h LYS 167 Cb 0.90 0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 32.59 1cmz h LYS 167 CO 0.07 0.99 -0.60 -0.22 -3.45 0.00 0.00 179.45 176.24 1cmz h LYS 168 N 0.03 0.00 -1.30 1.90 1.63 -0.91 -3.33 116.57 114.59 1cmz h LYS 168 Ca -0.14 0.00 0.41 0.00 -0.85 0.00 0.00 60.65 60.08 1cmz h LYS 168 Cb 1.91 0.00 -0.12 0.00 -0.60 0.00 0.00 32.23 33.42 1cmz h LYS 168 CO 0.14 0.08 0.84 1.98 -3.45 0.00 0.00 179.45 179.05 1cmz h MET 169 N 0.00 0.12 -6.44 1.90 4.05 -0.69 -3.37 114.93 110.49 1cmz h MET 169 Ca -0.02 -0.01 -0.54 0.00 -0.28 0.00 0.00 59.70 58.86 1cmz h MET 169 Cb 1.10 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.88 1cmz h MET 169 CO 0.01 0.08 0.72 -0.65 0.23 0.00 0.00 176.91 177.29 1cmz s GLN 170 N -5.30 4.34 -0.80 0.39 -0.21 -1.25 -3.55 119.66 113.27 1cmz s GLN 170 Ca -0.08 1.91 -0.02 0.00 0.02 0.00 0.00 55.36 57.19 1cmz s GLN 170 Cb 0.29 -3.43 -0.01 0.00 1.00 0.00 0.00 33.01 30.86 1cmz s GLN 170 CO 0.82 -0.44 0.71 0.39 -2.12 0.00 0.00 175.29 174.65 1cmz n GLU 171 N 4.61 -1.44 0.00 2.91 1.02 -1.26 -5.00 120.64 121.48 1cmz n GLU 171 Ca 0.11 1.29 0.00 0.00 -0.02 0.00 0.00 57.16 58.54 1cmz n GLU 171 Cb 0.44 -5.22 0.00 0.00 -0.02 0.00 0.00 31.44 26.64 1cmz n GLU 171 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1cmz n PRO 172 N -2.15 0.15 0.00 3.49 -0.04 -1.23 -5.07 135.00 130.15 1cmz n PRO 172 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1cmz n PRO 172 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 1cmz n PRO 172 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1cmz n SER 173 N -1.43 0.00 0.00 3.54 3.41 -1.26 -5.07 113.62 112.82 1cmz n SER 173 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1cmz n SER 173 Cb 0.00 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 1cmz n SER 173 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cmz n ALA 174 N -2.22 0.00 0.12 7.33 0.00 -1.26 -4.86 120.51 119.62 1cmz n ALA 174 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 1cmz n ALA 174 Cb 0.00 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.69 1cmz n ALA 174 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1cmz n HIS 175 N -1.74 1.01 -0.41 0.00 1.44 -1.26 -4.42 115.22 109.84 1cmz n HIS 175 Ca 0.00 -0.39 0.38 0.00 -2.01 0.00 0.00 57.72 55.69 1cmz n HIS 175 Cb 0.00 -0.20 0.73 0.00 0.12 0.00 0.00 29.99 30.64 1cmz n HIS 175 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 1cmz h THR 176 N 2.64 0.32 -0.09 0.61 2.02 -1.97 1.91 112.91 118.33 1cmz h THR 176 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1cmz h THR 176 Cb 1.07 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1cmz h THR 176 CO 0.17 0.01 0.00 0.49 0.37 0.00 0.00 175.52 176.56 1cmz n PHE 177 N -4.23 0.12 -0.00 3.16 3.01 -1.26 -4.57 117.46 113.69 1cmz n PHE 177 Ca 0.30 -0.06 -0.00 0.00 1.01 0.00 0.00 57.45 58.70 1cmz n PHE 177 Cb 1.37 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.84 1cmz n PHE 177 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1cmz n ASP 178 N -0.06 -0.00 -0.19 4.37 2.03 0.65 0.30 116.55 123.64 1cmz n ASP 178 Ca 0.16 0.66 -0.01 0.00 0.52 0.00 0.00 54.79 56.12 1cmz n ASP 178 Cb 0.25 -0.33 0.07 0.00 -0.72 0.00 0.00 41.12 40.40 1cmz n ASP 178 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 1cmz h ASP 179 N 0.00 -0.41 0.10 1.67 2.03 -1.82 0.18 116.42 118.17 1cmz h ASP 179 Ca 0.00 0.16 -0.01 0.00 -0.73 0.00 0.00 57.03 56.46 1cmz h ASP 179 Cb 0.00 0.32 0.00 0.00 -0.83 0.00 0.00 39.33 38.82 1cmz h ASP 179 CO -0.00 -0.16 -0.05 0.00 -1.03 0.00 0.00 179.24 178.00 1cmz h ALA 180 N 1.57 -0.14 -0.13 4.15 0.00 -0.36 -0.56 119.26 123.79 1cmz h ALA 180 Ca 0.30 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1cmz h ALA 180 Cb 0.47 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1cmz h ALA 180 CO -0.56 -0.45 0.26 0.37 0.00 0.00 0.00 179.25 178.88 1cmz h GLN 181 N -0.40 0.00 0.00 0.00 4.15 0.55 -2.07 115.11 117.34 1cmz h GLN 181 Ca -0.01 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 1cmz h GLN 181 Cb 0.34 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.02 1cmz h GLN 181 CO 0.02 0.00 -0.30 1.25 -1.93 0.00 0.00 178.83 177.87 1cmz h LEU 182 N 0.00 0.00 -0.89 -2.39 5.85 -0.09 -3.04 115.31 114.75 1cmz h LEU 182 Ca 0.06 -0.32 0.24 0.00 0.84 0.00 0.00 57.88 58.70 1cmz h LEU 182 Cb 0.59 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.47 1cmz h LEU 182 CO -0.00 0.83 0.25 -0.61 -0.34 0.00 0.00 178.44 178.56 1cmz h GLN 183 N -1.00 0.20 0.01 1.25 4.15 -0.46 -0.63 115.11 118.64 1cmz h GLN 183 Ca -0.05 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 1cmz h GLN 183 Cb 0.55 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.20 1cmz h GLN 183 CO -0.03 0.13 -0.01 0.82 -1.93 0.00 0.00 178.83 177.81 1cmz h ILE 184 N 0.21 1.35 -1.17 2.39 1.08 -1.56 -2.67 117.51 117.14 1cmz h ILE 184 Ca 0.57 -1.11 0.34 0.00 -0.39 0.00 0.00 64.86 64.26 1cmz h ILE 184 Cb 1.15 2.10 -0.05 0.00 -3.07 0.00 0.00 36.82 36.95 1cmz h ILE 184 CO -0.66 0.29 0.85 0.22 -0.69 0.00 0.00 178.15 178.16 1cmz h TYR 185 N -0.50 0.00 -0.03 1.37 5.03 -1.03 1.15 116.97 122.95 1cmz h TYR 185 Ca -0.00 0.00 -0.20 0.00 2.58 0.00 0.00 58.73 61.11 1cmz h TYR 185 Cb 0.48 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.76 1cmz h TYR 185 CO 0.09 0.00 -0.82 1.15 -1.32 0.00 0.00 178.16 177.26 1cmz h THR 186 N 0.00 1.42 -0.14 1.81 2.02 -0.93 -2.92 112.91 114.17 1cmz h THR 186 Ca 0.55 -2.36 -0.00 0.00 0.77 0.00 0.00 66.41 65.37 1cmz h THR 186 Cb 2.26 2.30 -0.01 0.00 -1.74 0.00 0.00 68.15 70.96 1cmz h THR 186 CO -0.01 0.70 0.09 -0.07 0.37 0.00 0.00 175.52 176.60 1cmz h LEU 187 N 0.20 0.17 -0.81 2.58 3.38 0.17 -2.47 115.31 118.53 1cmz h LEU 187 Ca -0.05 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1cmz h LEU 187 Cb 1.42 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 1cmz h LEU 187 CO 0.13 0.16 0.04 0.24 0.09 0.00 0.00 178.44 179.10 1cmz h MET 188 N 0.17 0.93 -0.83 1.13 2.86 -1.55 0.97 114.93 118.61 1cmz h MET 188 Ca 0.05 -0.26 0.07 0.00 -2.06 0.00 0.00 59.70 57.51 1cmz h MET 188 Cb 0.02 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.52 1cmz h MET 188 CO -0.01 0.90 0.54 1.25 1.06 0.00 0.00 176.91 180.65 1cmz h HIS 189 N 0.87 0.90 0.01 -0.22 -0.00 -1.27 0.04 115.15 115.49 1cmz h HIS 189 Ca 0.17 0.02 -0.38 0.00 -0.00 0.00 0.00 60.37 60.18 1cmz h HIS 189 Cb 0.46 -0.30 -0.06 0.00 -0.00 0.00 0.00 27.41 27.51 1cmz h HIS 189 CO 0.03 0.46 -2.41 0.54 -0.00 0.00 0.00 177.93 176.55 1cmz n ARG 190 N -4.49 0.67 0.05 5.26 1.74 -0.96 -3.81 116.66 115.11 1cmz n ARG 190 Ca 0.13 0.15 -0.18 0.00 -0.77 0.00 0.00 57.85 57.17 1cmz n ARG 190 Cb 0.23 -1.54 -0.14 0.00 -1.02 0.00 0.00 32.46 29.98 1cmz n ARG 190 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1cmz h ASP 191 N 0.01 0.43 0.08 0.55 3.58 -0.85 -3.38 116.42 116.83 1cmz h ASP 191 Ca -0.56 -0.66 -0.35 0.00 0.42 0.00 0.00 57.03 55.89 1cmz h ASP 191 Cb 1.94 -0.14 -0.07 0.00 1.72 0.00 0.00 39.33 42.79 1cmz h ASP 191 CO -0.06 1.56 -2.26 -1.54 -2.88 0.00 0.00 179.24 174.05 1cmz n SER 192 N -3.46 0.15 -0.22 2.28 3.41 -0.60 -4.44 113.62 110.73 1cmz n SER 192 Ca -0.21 0.07 -0.07 0.00 -0.26 0.00 0.00 58.87 58.40 1cmz n SER 192 Cb 1.05 0.84 0.03 0.00 -0.26 0.00 0.00 64.21 65.88 1cmz n SER 192 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1cmz h TYR 193 N 0.00 0.99 -0.26 7.33 3.20 -1.13 0.43 116.97 127.53 1cmz h TYR 193 Ca -0.49 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.22 1cmz h TYR 193 Cb 2.18 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 40.15 1cmz h TYR 193 CO 0.00 0.81 -0.09 -1.00 -1.64 0.00 0.00 178.16 176.24 1cmz h PRO 194 N 0.89 0.42 0.08 1.82 0.14 -1.78 -2.36 132.00 131.22 1cmz h PRO 194 Ca 0.20 -0.10 -0.36 0.00 0.14 0.00 0.00 66.00 65.88 1cmz h PRO 194 Cb 0.27 -0.05 -0.04 0.00 0.14 0.00 0.00 31.00 31.32 1cmz h PRO 194 CO -0.01 0.52 -2.10 0.54 0.14 0.00 0.00 178.00 177.09 1cmz n ARG 195 N -4.25 0.72 -0.35 0.86 1.74 -1.14 -4.16 116.66 110.08 1cmz n ARG 195 Ca 0.00 0.23 -0.00 0.00 -0.77 0.00 0.00 57.85 57.31 1cmz n ARG 195 Cb 0.28 -1.66 0.13 0.00 -1.02 0.00 0.00 32.46 30.19 1cmz n ARG 195 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1cmz h PHE 196 N 0.04 1.17 0.00 -1.55 3.57 -0.16 1.16 116.94 121.17 1cmz h PHE 196 Ca -0.45 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.08 1cmz h PHE 196 Cb 2.01 -0.39 0.00 0.00 2.79 0.00 0.00 35.95 40.36 1cmz h PHE 196 CO 0.06 0.67 0.00 -0.11 -2.23 0.00 0.00 178.31 176.69 1cmz n LEU 197 N -4.48 0.00 0.00 0.59 7.94 -0.89 -1.68 117.00 118.48 1cmz n LEU 197 Ca 0.13 0.44 0.00 0.00 -1.11 0.00 0.00 56.01 55.47 1cmz n LEU 197 Cb 0.10 -0.44 0.00 0.00 0.53 0.00 0.00 43.42 43.61 1cmz n LEU 197 CO 0.34 -0.33 0.37 -1.20 -1.11 0.00 0.00 177.39 175.46 1cmz n SER 198 N -1.44 0.96 -4.82 1.96 7.64 0.11 -4.96 113.62 113.06 1cmz n SER 198 Ca 0.02 -1.48 -0.34 0.00 1.01 0.00 0.00 58.87 58.09 1cmz n SER 198 Cb 0.08 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.21 1cmz n SER 198 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1cmz s SER 199 N -0.48 6.95 0.38 6.43 1.04 0.36 -4.94 113.70 123.43 1cmz s SER 199 Ca 0.00 1.53 0.05 0.00 0.48 0.00 0.00 55.95 58.01 1cmz s SER 199 Cb 0.00 -2.47 0.75 0.00 0.10 0.00 0.00 66.02 64.40 1cmz s SER 199 CO 0.00 -0.22 2.02 1.55 0.98 0.00 0.00 173.24 177.57 1cmz h PRO 200 N 2.37 0.70 -1.14 4.02 0.13 -1.89 -1.79 132.00 134.40 1cmz h PRO 200 Ca -0.48 -0.04 0.33 0.00 -0.87 0.00 0.00 66.00 64.93 1cmz h PRO 200 Cb 1.18 -0.16 -0.06 0.00 0.13 0.00 0.00 31.00 32.10 1cmz h PRO 200 CO 0.64 0.46 0.81 1.15 -0.23 0.00 0.00 178.00 180.82 1cmz h THR 201 N 0.72 0.43 0.00 1.56 2.02 -1.92 1.68 112.91 117.40 1cmz h THR 201 Ca 0.22 -0.03 -0.33 0.00 0.77 0.00 0.00 66.41 67.05 1cmz h THR 201 Cb 0.01 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 66.70 1cmz h THR 201 CO -0.05 0.01 -2.27 0.00 0.37 0.00 0.00 175.52 173.58 1cmz n TYR 202 N -4.28 0.12 0.83 3.16 4.19 -0.72 -4.00 117.16 116.45 1cmz n TYR 202 Ca 0.25 0.04 0.07 0.00 3.31 0.00 0.00 57.90 61.58 1cmz n TYR 202 Cb 1.16 -0.98 0.21 0.00 0.49 0.00 0.00 39.34 40.22 1cmz n TYR 202 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 1cmz n ARG 203 N -2.74 1.89 0.01 2.98 1.74 0.07 -3.58 116.66 117.03 1cmz n ARG 203 Ca -0.29 -1.38 -0.08 0.00 -0.77 0.00 0.00 57.85 55.34 1cmz n ARG 203 Cb 1.09 -1.33 -0.13 0.00 -1.02 0.00 0.00 32.46 31.08 1cmz n ARG 203 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1cmz h ALA 204 N 3.80 0.65 -0.25 7.54 0.00 0.23 -3.30 119.26 127.93 1cmz h ALA 204 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 54.91 53.63 1cmz h ALA 204 Cb 0.53 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1cmz h ALA 204 CO 0.00 1.47 0.00 1.28 0.00 0.00 0.00 179.25 182.00 1cmz n LEU 205 N -3.13 2.92 -0.58 0.00 4.77 -1.24 -5.08 117.00 114.65 1cmz n LEU 205 Ca -0.11 -1.41 0.14 0.00 -0.03 0.00 0.00 56.01 54.59 1cmz n LEU 205 Cb 1.01 -0.16 0.43 0.00 -2.33 0.00 0.00 43.42 42.38 1cmz n LEU 205 CO 0.45 0.62 0.82 -0.11 -1.33 0.00 0.00 177.39 177.84