#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jhh h ALA 83 N 1.35 1.25 0.00 0.00 0.00 -2.01 -3.20 119.26 116.65 2jhh h ALA 83 Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2jhh h ALA 83 Cb 0.41 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2jhh h ALA 83 CO 0.02 0.54 -1.27 0.25 0.00 0.00 0.00 179.25 178.78 2jhh n THR 84 N -4.30 0.00 -1.82 0.00 -2.24 -1.09 -5.02 114.28 99.80 2jhh n THR 84 Ca 0.05 -0.22 -0.30 0.00 -2.27 0.00 0.00 64.05 61.30 2jhh n THR 84 Cb 0.19 0.62 0.04 0.00 -2.10 0.00 0.00 70.33 69.08 2jhh n THR 84 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jhh s GLY 85 N -3.31 1.64 0.52 3.38 0.00 0.23 -4.95 107.32 104.83 2jhh s GLY 85 Ca 0.01 -0.23 -0.18 0.00 0.00 0.00 0.00 44.72 44.32 2jhh s GLY 85 CO 0.76 0.11 1.01 2.56 0.00 0.00 0.00 173.10 177.54 2jhh s PRO 86 N -5.27 3.77 0.05 2.90 0.04 -1.26 -4.86 135.00 130.38 2jhh s PRO 86 Ca 0.58 1.12 0.21 0.00 0.04 0.00 0.00 61.00 62.95 2jhh s PRO 86 Cb -0.12 -2.10 -0.19 0.00 0.04 0.00 0.00 34.50 32.13 2jhh s PRO 86 CO 0.53 -0.43 0.69 0.54 0.04 0.00 0.00 177.00 178.37 2jhh n ARG 87 N -1.48 0.64 -2.73 4.56 1.74 -1.26 -0.32 116.66 117.81 2jhh n ARG 87 Ca 0.08 -0.03 -0.02 0.00 -0.77 0.00 0.00 57.85 57.11 2jhh n ARG 87 Cb 0.53 -1.66 0.01 0.00 -1.02 0.00 0.00 32.46 30.32 2jhh n ARG 87 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2jhh n ASN 88 N -2.51 -0.97 0.21 0.55 0.23 -1.26 -4.41 115.26 107.10 2jhh n ASN 88 Ca -0.05 -1.52 0.10 0.00 -0.53 0.00 0.00 54.58 52.57 2jhh n ASN 88 Cb 0.63 1.58 0.36 0.00 -2.08 0.00 0.00 39.78 40.27 2jhh n ASN 88 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jhh h LYS 90 N 0.00 0.53 -0.63 0.00 1.63 -1.89 -1.19 116.57 115.02 2jhh h LYS 90 Ca -0.00 -0.18 0.07 0.00 -0.85 0.00 0.00 60.65 59.70 2jhh h LYS 90 Cb 0.88 -0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 32.40 2jhh h LYS 90 CO 0.03 0.69 0.30 -0.44 -3.45 0.00 0.00 179.45 176.58 2jhh h ASP 91 N 0.31 0.40 -0.54 4.20 5.19 -1.89 -1.11 116.42 122.98 2jhh h ASP 91 Ca 0.08 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.54 2jhh h ASP 91 Cb 0.46 -0.02 -0.03 0.00 0.18 0.00 0.00 39.33 39.93 2jhh h ASP 91 CO 0.02 0.25 0.33 -0.07 -3.12 0.00 0.00 179.24 176.65 2jhh h LEU 92 N 0.55 0.65 -0.69 1.55 3.38 -1.36 -1.97 115.31 117.42 2jhh h LEU 92 Ca 0.30 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 2jhh h LEU 92 Cb 0.27 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2jhh h LEU 92 CO -0.23 0.52 0.35 0.25 0.09 0.00 0.00 178.44 179.42 2jhh h LEU 93 N 0.73 0.88 -1.69 1.67 5.85 -0.77 -2.00 115.31 119.97 2jhh h LEU 93 Ca 0.19 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.82 2jhh h LEU 93 Cb -0.01 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 2jhh h LEU 93 CO -0.04 0.75 0.23 0.44 -0.34 0.00 0.00 178.44 179.49 2jhh h ASP 94 N 0.95 0.35 -0.03 1.25 3.32 -0.97 -1.87 116.42 119.42 2jhh h ASP 94 Ca 0.24 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2jhh h ASP 94 Cb 0.09 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2jhh h ASP 94 CO -0.03 0.25 0.00 0.54 -1.72 0.00 0.00 179.24 178.28 2jhh n ARG 95 N -4.49 1.24 -0.48 3.56 1.74 -0.76 -4.92 116.66 112.55 2jhh n ARG 95 Ca 0.03 -0.35 0.00 0.00 -0.77 0.00 0.00 57.85 56.75 2jhh n ARG 95 Cb 0.11 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 2jhh n ARG 95 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jhh n GLY 96 N 0.97 1.13 3.45 -0.13 0.00 -0.70 -5.05 105.19 104.85 2jhh n GLY 96 Ca 0.18 -0.32 -0.44 0.00 0.00 0.00 0.00 46.02 45.44 2jhh n GLY 96 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jhh s TYR 97 N -2.00 3.00 -0.94 1.61 2.02 -0.95 -4.90 117.35 115.19 2jhh s TYR 97 Ca 0.00 -1.14 0.22 0.00 -0.37 0.00 0.00 57.07 55.78 2jhh s TYR 97 Cb 0.00 -4.26 0.01 0.00 -0.40 0.00 0.00 41.96 37.30 2jhh s TYR 97 CO 0.00 -1.52 1.05 1.19 -1.57 0.00 0.00 175.55 174.71 2jhh n PHE 98 N 6.83 0.02 -3.75 2.71 3.72 -1.26 -4.11 117.46 121.62 2jhh n PHE 98 Ca 0.14 0.01 -0.37 0.00 -0.05 0.00 0.00 57.45 57.18 2jhh n PHE 98 Cb 0.48 -0.13 -0.06 0.00 -0.94 0.00 0.00 39.48 38.83 2jhh n PHE 98 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2jhh s LEU 99 N -3.12 4.39 0.56 4.37 1.43 -1.26 -4.75 118.68 120.30 2jhh s LEU 99 Ca 0.08 0.59 -0.20 0.00 -1.03 0.00 0.00 54.13 53.56 2jhh s LEU 99 Cb 0.16 -2.23 -0.05 0.00 0.03 0.00 0.00 46.19 44.11 2jhh s LEU 99 CO 0.82 0.35 1.23 -0.44 0.23 0.00 0.00 176.35 178.54 2jhh s SER 100 N -0.85 5.39 0.00 2.29 0.01 -1.26 -4.73 113.70 114.55 2jhh s SER 100 Ca 0.17 2.45 0.00 0.00 1.31 0.00 0.00 55.95 59.88 2jhh s SER 100 Cb -0.13 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2jhh s SER 100 CO 0.06 -1.46 0.00 0.61 0.41 0.00 0.00 173.24 172.86 2jhh n GLY 101 N 0.54 -1.64 3.69 3.44 0.00 -0.78 -4.98 105.19 105.46 2jhh n GLY 101 Ca 0.12 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 2jhh n GLY 101 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jhh s TRP 102 N -1.90 3.48 0.06 1.61 0.52 -1.26 -0.90 118.94 120.56 2jhh s TRP 102 Ca 0.00 1.21 0.01 0.00 0.02 0.00 0.00 56.10 57.34 2jhh s TRP 102 Cb 0.00 -2.90 -0.03 0.00 -1.15 0.00 0.00 33.47 29.39 2jhh s TRP 102 CO 0.00 -0.09 -0.05 -1.01 0.02 0.00 0.00 176.95 175.82 2jhh s HIS 103 N 1.54 0.63 -0.07 -1.98 3.76 -0.29 -4.93 115.29 113.94 2jhh s HIS 103 Ca 0.37 -0.82 -0.29 0.00 -0.15 0.00 0.00 55.06 54.17 2jhh s HIS 103 Cb -0.17 -0.40 -0.02 0.00 1.11 0.00 0.00 32.58 33.10 2jhh s HIS 103 CO 0.15 -0.22 0.96 0.99 -0.85 0.00 0.00 174.74 175.77 2jhh s THR 104 N -2.93 4.84 0.43 1.30 2.01 -1.26 -0.82 115.64 119.20 2jhh s THR 104 Ca 0.02 1.97 0.06 0.00 0.31 0.00 0.00 61.69 64.04 2jhh s THR 104 Cb 0.01 -4.28 -0.07 0.00 0.01 0.00 0.00 72.50 68.17 2jhh s THR 104 CO -0.05 0.08 0.02 0.27 -0.69 0.00 0.00 174.62 174.24 2jhh s ILE 105 N 1.61 1.88 -0.17 1.82 -5.25 -0.30 -4.70 121.20 116.08 2jhh s ILE 105 Ca 0.48 -1.99 0.00 0.00 -0.99 0.00 0.00 60.65 58.15 2jhh s ILE 105 Cb -0.19 -2.87 0.01 0.00 2.95 0.00 0.00 42.46 42.36 2jhh s ILE 105 CO 0.21 0.00 -0.17 -0.31 -1.79 0.00 0.00 174.94 172.88 2jhh s TYR 106 N -2.73 2.78 0.87 1.37 2.02 0.57 -1.37 117.35 120.85 2jhh s TYR 106 Ca 0.31 -1.25 -0.12 0.00 -0.37 0.00 0.00 57.07 55.64 2jhh s TYR 106 Cb 0.08 -1.90 0.12 0.00 -0.40 0.00 0.00 41.96 39.86 2jhh s TYR 106 CO 0.16 -0.60 1.11 -0.51 -1.57 0.00 0.00 175.55 174.14 2jhh s LEU 107 N 1.01 2.22 0.64 -1.29 1.43 -0.19 -4.42 118.68 118.07 2jhh s LEU 107 Ca -0.02 1.18 0.38 0.00 -1.03 0.00 0.00 54.13 54.64 2jhh s LEU 107 Cb -0.15 -3.61 2.15 0.00 0.03 0.00 0.00 46.19 44.61 2jhh s LEU 107 CO -0.04 -2.40 2.29 -0.65 0.23 0.00 0.00 176.35 175.78 2jhh h PRO 108 N -1.39 0.00 -0.72 1.29 0.11 -1.88 0.22 132.00 129.63 2jhh h PRO 108 Ca -0.49 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.47 2jhh h PRO 108 Cb 1.30 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.33 2jhh h PRO 108 CO 0.60 0.00 0.18 -0.40 -0.21 0.00 0.00 178.00 178.17 2jhh n ASP 109 N -3.35 5.02 0.00 -2.05 5.75 -1.26 -4.93 116.55 115.73 2jhh n ASP 109 Ca -0.03 -3.08 0.00 0.00 -0.01 0.00 0.00 54.79 51.67 2jhh n ASP 109 Cb 0.11 -0.72 0.00 0.00 -1.03 0.00 0.00 41.12 39.48 2jhh n ASP 109 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jhh s ARG 111 N -1.64 4.22 0.30 0.00 3.52 -1.26 -4.69 118.95 119.41 2jhh s ARG 111 Ca 0.00 2.22 -0.28 0.00 -0.13 0.00 0.00 55.73 57.54 2jhh s ARG 111 Cb 0.00 -3.61 -0.09 0.00 -1.56 0.00 0.00 34.95 29.69 2jhh s ARG 111 CO 0.00 -0.69 1.06 -1.25 -0.81 0.00 0.00 175.30 173.61 2jhh s PRO 112 N 2.62 4.56 -0.04 5.12 0.04 -1.26 -1.03 135.00 145.02 2jhh s PRO 112 Ca 0.71 1.67 -0.01 0.00 0.04 0.00 0.00 61.00 63.41 2jhh s PRO 112 Cb -0.37 -3.04 0.03 0.00 0.04 0.00 0.00 34.50 31.16 2jhh s PRO 112 CO 0.30 0.18 0.08 -1.17 0.04 0.00 0.00 177.00 176.44 2jhh s LEU 113 N -1.70 0.97 -0.19 -3.56 2.96 -0.47 -4.95 118.68 111.75 2jhh s LEU 113 Ca 0.47 0.16 -0.25 0.00 -0.22 0.00 0.00 54.13 54.29 2jhh s LEU 113 Cb -0.28 0.13 -0.01 0.00 0.50 0.00 0.00 46.19 46.53 2jhh s LEU 113 CO 0.36 -0.13 0.82 -0.89 -1.32 0.00 0.00 176.35 175.19 2jhh s THR 114 N 1.04 4.87 0.15 3.68 2.01 -1.26 -1.15 115.64 124.98 2jhh s THR 114 Ca -0.08 1.60 0.06 0.00 0.31 0.00 0.00 61.69 63.58 2jhh s THR 114 Cb -0.11 -4.13 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 2jhh s THR 114 CO -0.04 0.01 -0.14 0.68 -0.69 0.00 0.00 174.62 174.44 2jhh s VAL 115 N 2.31 1.44 -0.28 3.82 -7.23 0.00 -4.92 120.40 115.54 2jhh s VAL 115 Ca 0.37 -1.92 -0.19 0.00 -1.81 0.00 0.00 61.98 58.43 2jhh s VAL 115 Cb -0.16 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 2jhh s VAL 115 CO 0.11 -0.51 0.54 -0.22 -0.31 0.00 0.00 175.10 174.71 2jhh s LEU 116 N -2.82 4.11 -0.10 1.32 2.96 -1.26 -1.14 118.68 121.75 2jhh s LEU 116 Ca 0.14 0.43 -0.14 0.00 -0.22 0.00 0.00 54.13 54.34 2jhh s LEU 116 Cb -0.03 -2.69 -0.05 0.00 0.50 0.00 0.00 46.19 43.92 2jhh s LEU 116 CO 0.04 -0.36 0.33 0.00 -1.32 0.00 0.00 176.35 175.04 2jhh s ASP 118 N -0.14 6.01 0.00 0.00 -1.08 0.46 -1.87 116.67 120.05 2jhh s ASP 118 Ca 0.20 -1.33 0.23 0.00 -0.52 0.00 0.00 52.55 51.13 2jhh s ASP 118 Cb -0.14 -2.13 0.41 0.00 -1.46 0.00 0.00 42.92 39.60 2jhh s ASP 118 CO 0.08 -0.60 1.39 0.23 0.52 0.00 0.00 175.17 176.79 2jhh n MET 119 N 5.12 2.40 -0.09 4.34 2.81 -1.26 -1.92 117.12 128.52 2jhh n MET 119 Ca -0.12 -2.09 -0.19 0.00 -1.81 0.00 0.00 57.70 53.50 2jhh n MET 119 Cb 0.44 -1.49 -0.06 0.00 -0.71 0.00 0.00 33.22 31.39 2jhh n MET 119 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2jhh n ASP 120 N 1.35 1.29 -4.72 7.83 2.03 -1.26 -4.05 116.55 119.02 2jhh n ASP 120 Ca 0.18 0.20 -0.42 0.00 0.52 0.00 0.00 54.79 55.27 2jhh n ASP 120 Cb 0.58 -0.50 -0.03 0.00 -0.72 0.00 0.00 41.12 40.45 2jhh n ASP 120 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2jhh s THR 121 N -2.32 2.88 -1.34 5.18 2.01 -1.26 -3.82 115.64 116.97 2jhh s THR 121 Ca -0.24 0.64 -0.04 0.00 0.31 0.00 0.00 61.69 62.36 2jhh s THR 121 Cb 0.09 -3.41 -0.00 0.00 0.01 0.00 0.00 72.50 69.19 2jhh s THR 121 CO 0.31 0.05 0.53 -0.67 -0.69 0.00 0.00 174.62 174.16 2jhh n ASP 122 N 3.82 -1.37 0.00 3.53 2.03 -1.26 -0.77 116.55 122.53 2jhh n ASP 122 Ca 0.12 -0.98 0.00 0.00 0.52 0.00 0.00 54.79 54.45 2jhh n ASP 122 Cb 0.40 -3.26 0.00 0.00 -0.72 0.00 0.00 41.12 37.54 2jhh n ASP 122 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jhh n GLY 123 N -1.87 2.78 0.10 0.27 0.00 -1.25 -4.94 105.19 100.28 2jhh n GLY 123 Ca -0.27 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.76 2jhh n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jhh n GLY 124 N -2.00 -1.37 1.56 -0.02 0.00 0.05 -4.87 105.19 98.54 2jhh n GLY 124 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.51 2jhh n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jhh n GLY 125 N -1.33 0.52 3.76 -0.02 0.00 -0.81 -4.94 105.19 102.38 2jhh n GLY 125 Ca 0.00 -0.79 -0.38 0.00 0.00 0.00 0.00 46.02 44.84 2jhh n GLY 125 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jhh s TRP 126 N -2.00 3.65 -0.30 1.61 0.52 -0.94 -2.95 118.94 118.52 2jhh s TRP 126 Ca 0.00 1.09 -0.15 0.00 0.02 0.00 0.00 56.10 57.06 2jhh s TRP 126 Cb 0.00 -2.54 -0.03 0.00 -1.15 0.00 0.00 33.47 29.75 2jhh s TRP 126 CO 0.00 0.35 0.37 0.99 0.02 0.00 0.00 176.95 178.68 2jhh s THR 127 N -0.13 5.17 -0.21 2.01 2.01 0.36 -0.41 115.64 124.45 2jhh s THR 127 Ca 0.29 0.38 -0.21 0.00 0.31 0.00 0.00 61.69 62.45 2jhh s THR 127 Cb -0.17 -3.74 -0.02 0.00 0.01 0.00 0.00 72.50 68.58 2jhh s THR 127 CO 0.15 0.07 0.67 -0.69 -0.69 0.00 0.00 174.62 174.13 2jhh s VAL 128 N 2.05 4.98 -0.74 3.82 1.01 -0.01 -0.81 120.40 130.70 2jhh s VAL 128 Ca 0.14 1.25 0.10 0.00 0.00 0.00 0.00 61.98 63.48 2jhh s VAL 128 Cb -0.16 -3.98 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 2jhh s VAL 128 CO 0.11 0.07 0.55 2.22 0.00 0.00 0.00 175.10 178.04 2jhh n PHE 129 N 5.31 0.00 -3.83 5.22 1.16 0.65 -4.34 117.46 121.63 2jhh n PHE 129 Ca 0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.46 2jhh n PHE 129 Cb 0.49 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 38.24 2jhh n PHE 129 CO 0.00 0.00 0.00 -1.14 -1.87 0.00 0.00 176.76 173.75 2jhh s GLN 130 N -1.70 0.16 -0.13 3.97 -0.44 -1.15 -0.96 119.66 119.42 2jhh s GLN 130 Ca 0.06 0.14 -0.06 0.00 -2.50 0.00 0.00 55.36 53.01 2jhh s GLN 130 Cb 0.08 0.08 0.06 0.00 -1.64 0.00 0.00 33.01 31.59 2jhh s GLN 130 CO 0.35 -0.02 0.29 0.50 0.50 0.00 0.00 175.29 176.90 2jhh s ARG 131 N -0.01 0.23 0.04 1.67 3.52 -0.82 -1.59 118.95 122.00 2jhh s ARG 131 Ca -0.01 0.66 0.04 0.00 -0.13 0.00 0.00 55.73 56.29 2jhh s ARG 131 Cb -0.01 -0.06 -0.02 0.00 -1.56 0.00 0.00 34.95 33.30 2jhh s ARG 131 CO 0.00 -0.20 -0.11 1.03 -0.81 0.00 0.00 175.30 175.22 2jhh s ARG 132 N 1.64 0.73 0.00 5.12 0.52 -0.45 -1.56 118.95 124.95 2jhh s ARG 132 Ca -0.06 -0.69 0.00 0.00 -0.52 0.00 0.00 55.73 54.46 2jhh s ARG 132 Cb -0.10 -0.66 0.00 0.00 0.52 0.00 0.00 34.95 34.70 2jhh s ARG 132 CO -0.10 0.16 0.00 0.00 0.02 0.00 0.00 175.30 175.38 2jhh n MET 133 N 1.87 0.00 0.00 3.54 0.00 -1.26 -1.58 117.12 119.69 2jhh n MET 133 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.51 2jhh n MET 133 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.77 2jhh n MET 133 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 2jhh n ASP 134 N 0.00 0.00 -0.38 3.17 5.68 -1.26 -4.81 116.55 118.96 2jhh n ASP 134 Ca 0.00 -0.45 -0.05 0.00 -0.50 0.00 0.00 54.79 53.79 2jhh n ASP 134 Cb 0.28 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.24 2jhh n ASP 134 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jhh n GLY 135 N 0.00 0.76 0.15 6.12 0.00 -1.26 -4.93 105.19 106.03 2jhh n GLY 135 Ca 0.00 -0.72 0.02 0.00 0.00 0.00 0.00 46.02 45.32 2jhh n GLY 135 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jhh h SER 136 N 0.00 0.00 -3.17 1.61 4.64 -1.96 -3.44 113.55 111.23 2jhh h SER 136 Ca -0.10 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.59 2jhh h SER 136 Cb 0.35 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.30 2jhh h SER 136 CO 0.15 0.54 -0.55 -0.69 -0.87 0.00 0.00 176.83 175.41 2jhh s VAL 137 N -3.47 4.93 -0.17 0.95 1.01 -1.26 -5.07 120.40 117.32 2jhh s VAL 137 Ca -0.00 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.70 2jhh s VAL 137 Cb 0.11 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.29 2jhh s VAL 137 CO 0.73 0.51 1.25 -0.62 0.00 0.00 0.00 175.10 176.97 2jhh s ASP 138 N -0.06 6.95 0.00 3.32 2.15 -1.26 -4.92 116.67 122.85 2jhh s ASP 138 Ca 0.07 1.68 0.24 0.00 0.43 0.00 0.00 52.55 54.97 2jhh s ASP 138 Cb -0.12 -2.54 0.27 0.00 -0.30 0.00 0.00 42.92 40.23 2jhh s ASP 138 CO 0.01 -0.76 1.31 0.49 -0.17 0.00 0.00 175.17 176.05 2jhh n PHE 139 N 6.59 0.14 -2.64 -5.34 3.01 -1.26 -4.71 117.46 113.24 2jhh n PHE 139 Ca 0.14 -0.07 -0.43 0.00 1.01 0.00 0.00 57.45 58.09 2jhh n PHE 139 Cb 0.45 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.92 2jhh n PHE 139 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 2jhh n TYR 140 N 1.39 4.18 -4.49 1.38 9.36 -1.26 -4.34 117.16 123.37 2jhh n TYR 140 Ca 0.16 -3.10 -0.24 0.00 3.32 0.00 0.00 57.90 58.04 2jhh n TYR 140 Cb 0.60 -2.17 -0.11 0.00 -0.63 0.00 0.00 39.34 37.04 2jhh n TYR 140 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2jhh s ARG 141 N 1.50 1.70 0.85 2.98 0.52 -1.26 -5.03 118.95 120.21 2jhh s ARG 141 Ca 0.43 -1.89 -0.10 0.00 -0.52 0.00 0.00 55.73 53.65 2jhh s ARG 141 Cb 0.03 -1.36 0.16 0.00 0.52 0.00 0.00 34.95 34.30 2jhh s ARG 141 CO 0.01 0.03 1.17 0.16 0.02 0.00 0.00 175.30 176.69 2jhh s ASP 142 N -3.54 3.74 0.18 0.23 1.47 -1.26 -4.33 116.67 113.16 2jhh s ASP 142 Ca 0.32 0.07 -0.13 0.00 1.18 0.00 0.00 52.55 53.99 2jhh s ASP 142 Cb 0.05 -0.29 0.15 0.00 -0.34 0.00 0.00 42.92 42.49 2jhh s ASP 142 CO 0.15 -2.30 1.77 -0.25 0.68 0.00 0.00 175.17 175.21 2jhh h TRP 143 N -1.14 0.40 -0.56 2.11 2.91 -1.95 -1.94 115.95 115.78 2jhh h TRP 143 Ca -0.41 0.02 0.05 0.00 1.13 0.00 0.00 58.89 59.68 2jhh h TRP 143 Cb 1.26 -0.11 -0.05 0.00 -0.51 0.00 0.00 29.16 29.75 2jhh h TRP 143 CO -0.65 0.17 0.29 0.00 -1.03 0.00 0.00 178.44 177.22 2jhh h ALA 144 N 1.30 0.73 -0.37 2.65 0.00 -1.99 -0.09 119.26 121.49 2jhh h ALA 144 Ca 0.23 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2jhh h ALA 144 Cb 0.18 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2jhh h ALA 144 CO -0.19 -0.06 0.15 0.00 0.00 0.00 0.00 179.25 179.15 2jhh h ALA 145 N 1.31 0.48 -0.03 0.00 0.00 -1.78 -1.38 119.26 117.87 2jhh h ALA 145 Ca 0.25 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2jhh h ALA 145 Cb 0.17 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2jhh h ALA 145 CO -0.18 0.08 -0.38 1.88 0.00 0.00 0.00 179.25 180.66 2jhh h TYR 146 N 0.46 0.06 -0.18 0.00 -1.99 -1.11 0.11 116.97 114.32 2jhh h TYR 146 Ca 0.12 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.82 2jhh h TYR 146 Cb 0.18 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.89 2jhh h TYR 146 CO -0.00 0.43 0.04 -0.22 -0.00 0.00 0.00 178.16 178.41 2jhh h LYS 147 N 0.04 0.29 0.13 4.88 3.64 -0.70 0.98 116.57 125.84 2jhh h LYS 147 Ca 0.00 -0.07 -0.28 0.00 -1.27 0.00 0.00 60.65 59.04 2jhh h LYS 147 Cb 0.69 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.48 2jhh h LYS 147 CO 0.05 0.43 -1.25 1.96 -2.27 0.00 0.00 179.45 178.36 2jhh h GLN 148 N 0.10 0.29 0.00 1.90 4.20 -1.10 -2.76 115.11 117.73 2jhh h GLN 148 Ca 0.06 -0.49 0.00 0.00 0.06 0.00 0.00 58.65 58.27 2jhh h GLN 148 Cb 0.27 0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2jhh h GLN 148 CO 0.00 1.23 0.00 0.41 -0.67 0.00 0.00 178.83 179.81 2jhh n GLY 149 N 1.54 1.77 3.60 3.46 0.00 0.38 -4.50 105.19 111.43 2jhh n GLY 149 Ca -0.09 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 2jhh n GLY 149 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jhh s PHE 150 N -2.66 -0.31 0.00 1.61 -0.71 -0.42 -4.86 117.98 110.63 2jhh s PHE 150 Ca 0.00 -0.03 0.00 0.00 -1.04 0.00 0.00 56.93 55.86 2jhh s PHE 150 Cb 0.00 0.57 0.00 0.00 -1.21 0.00 0.00 43.02 42.38 2jhh s PHE 150 CO 0.00 -1.00 0.00 0.41 -1.34 0.00 0.00 175.22 173.29 2jhh n GLY 151 N -0.40 -0.09 2.92 1.99 0.00 -1.26 -1.46 105.19 106.89 2jhh n GLY 151 Ca -0.11 -1.93 -0.13 0.00 0.00 0.00 0.00 46.02 43.86 2jhh n GLY 151 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jhh s SER 152 N -4.00 -0.06 0.54 1.61 0.15 -0.40 -4.98 113.70 106.56 2jhh s SER 152 Ca 0.00 0.14 0.29 0.00 0.70 0.00 0.00 55.95 57.08 2jhh s SER 152 Cb 0.00 0.11 1.52 0.00 -1.71 0.00 0.00 66.02 65.95 2jhh s SER 152 CO 0.00 -0.05 2.10 1.56 1.20 0.00 0.00 173.24 178.04 2jhh h GLN 153 N 6.35 0.00 -0.00 5.44 4.20 -1.97 -1.98 115.11 127.15 2jhh h GLN 153 Ca -0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.42 2jhh h GLN 153 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 2jhh h GLN 153 CO 0.46 0.10 -0.07 1.28 -0.67 0.00 0.00 178.83 179.93 2jhh n LEU 154 N -3.59 0.21 0.00 1.46 4.32 -1.26 -4.94 117.00 113.20 2jhh n LEU 154 Ca -0.02 0.19 0.00 0.00 -0.02 0.00 0.00 56.01 56.16 2jhh n LEU 154 Cb 0.22 -0.27 0.00 0.00 -1.62 0.00 0.00 43.42 41.75 2jhh n LEU 154 CO 0.29 0.04 0.00 0.61 -1.22 0.00 0.00 177.39 177.11 2jhh n GLY 155 N 1.32 3.20 3.83 -0.72 0.00 -0.75 -5.16 105.19 106.92 2jhh n GLY 155 Ca 0.13 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 2jhh n GLY 155 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jhh s GLU 156 N 3.68 4.09 0.17 1.61 2.02 -1.25 -4.76 118.70 124.26 2jhh s GLU 156 Ca 0.00 0.67 -0.23 0.00 0.02 0.00 0.00 54.97 55.43 2jhh s GLU 156 Cb 0.00 -2.81 0.06 0.00 0.10 0.00 0.00 34.13 31.49 2jhh s GLU 156 CO 0.00 0.38 0.67 -0.59 0.02 0.00 0.00 175.26 175.74 2jhh s PHE 157 N -1.60 -0.43 -0.14 1.61 -0.71 -0.60 -1.28 117.98 114.83 2jhh s PHE 157 Ca 0.43 0.16 0.02 0.00 -1.04 0.00 0.00 56.93 56.51 2jhh s PHE 157 Cb -0.15 0.60 0.01 0.00 -1.21 0.00 0.00 43.02 42.27 2jhh s PHE 157 CO 0.20 -0.91 -0.20 -0.46 -1.34 0.00 0.00 175.22 172.51 2jhh s TRP 158 N -3.71 2.54 0.33 3.49 -0.11 -0.53 -1.94 118.94 119.00 2jhh s TRP 158 Ca 0.04 -1.33 0.18 0.00 1.22 0.00 0.00 56.10 56.22 2jhh s TRP 158 Cb -0.02 -1.75 0.91 0.00 -1.50 0.00 0.00 33.47 31.11 2jhh s TRP 158 CO -0.07 -0.63 1.87 1.25 -4.62 0.00 0.00 176.95 174.74 2jhh h LEU 159 N 7.51 0.00 0.00 5.86 5.85 -1.33 -1.11 115.31 132.09 2jhh h LEU 159 Ca -0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.37 2jhh h LEU 159 Cb 1.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2jhh h LEU 159 CO 0.56 0.30 0.00 0.61 -0.34 0.00 0.00 178.44 179.57 2jhh n GLY 160 N -0.35 3.32 0.27 3.75 0.00 -1.26 -4.30 105.19 106.62 2jhh n GLY 160 Ca -0.01 -1.47 -0.04 0.00 0.00 0.00 0.00 46.02 44.50 2jhh n GLY 160 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jhh h ASN 161 N 0.00 0.65 -0.61 1.61 2.35 -0.53 0.17 115.58 119.22 2jhh h ASN 161 Ca 0.00 -0.18 -0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2jhh h ASN 161 Cb 0.00 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.17 2jhh h ASN 161 CO 0.00 0.78 0.37 0.44 -1.65 0.00 0.00 177.43 177.37 2jhh h ASP 162 N 0.61 0.72 -0.67 5.81 3.32 -1.77 -0.73 116.42 123.72 2jhh h ASP 162 Ca 0.11 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 2jhh h ASP 162 Cb 0.52 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2jhh h ASP 162 CO 0.03 0.56 0.11 0.78 -1.72 0.00 0.00 179.24 179.01 2jhh h ASN 163 N 0.82 1.07 -0.16 6.45 2.35 -1.66 -1.62 115.58 122.83 2jhh h ASN 163 Ca 0.22 -0.26 -0.13 0.00 -0.55 0.00 0.00 56.30 55.58 2jhh h ASN 163 Cb -0.03 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.04 2jhh h ASN 163 CO -0.04 1.05 -0.34 0.40 -1.65 0.00 0.00 177.43 176.85 2jhh h ILE 164 N 1.04 1.29 -0.21 2.81 2.04 -0.82 -1.26 117.51 122.38 2jhh h ILE 164 Ca 0.21 -1.48 -0.01 0.00 1.00 0.00 0.00 64.86 64.57 2jhh h ILE 164 Cb 0.44 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 2jhh h ILE 164 CO 0.01 0.48 0.10 -0.74 0.00 0.00 0.00 178.15 178.00 2jhh h HIS 165 N 0.56 0.31 -0.92 1.37 2.76 -1.03 -2.40 115.15 115.79 2jhh h HIS 165 Ca 0.06 -0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.29 2jhh h HIS 165 Cb 0.85 -0.10 -0.07 0.00 1.55 0.00 0.00 27.41 29.65 2jhh h HIS 165 CO 0.04 0.31 0.58 0.00 -1.30 0.00 0.00 177.93 177.56 2jhh h ALA 166 N 0.97 1.30 0.00 5.26 0.00 -1.02 -1.33 119.26 124.43 2jhh h ALA 166 Ca 0.07 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2jhh h ALA 166 Cb 0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2jhh h ALA 166 CO -0.01 0.31 -0.28 -0.07 0.00 0.00 0.00 179.25 179.20 2jhh h LEU 167 N 1.03 0.00 -2.38 0.00 3.38 -1.05 -3.18 115.31 113.11 2jhh h LEU 167 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2jhh h LEU 167 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2jhh h LEU 167 CO -0.19 0.28 0.00 0.35 0.09 0.00 0.00 178.44 178.97 2jhh n THR 168 N -3.54 0.65 0.04 0.22 -2.24 -0.85 -4.68 114.28 103.87 2jhh n THR 168 Ca -0.01 -0.82 -0.02 0.00 -2.27 0.00 0.00 64.05 60.93 2jhh n THR 168 Cb 0.43 0.77 -0.01 0.00 -2.10 0.00 0.00 70.33 69.42 2jhh n THR 168 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jhh h ALA 169 N 2.30 -0.40 -1.90 6.98 0.00 -1.24 -3.44 119.26 121.55 2jhh h ALA 169 Ca 0.00 -0.03 -0.58 0.00 0.00 0.00 0.00 54.91 54.31 2jhh h ALA 169 Cb 0.67 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2jhh h ALA 169 CO 0.00 -0.39 1.29 -1.14 0.00 0.00 0.00 179.25 179.01 2jhh s GLN 170 N -2.07 3.37 1.91 0.00 0.74 -1.26 -4.80 119.66 117.55 2jhh s GLN 170 Ca -0.02 1.54 0.00 0.00 0.05 0.00 0.00 55.36 56.93 2jhh s GLN 170 Cb 0.00 -4.20 0.00 0.00 1.10 0.00 0.00 33.01 29.91 2jhh s GLN 170 CO 0.05 -1.82 0.00 0.41 -0.55 0.00 0.00 175.29 173.38 2jhh n GLY 171 N 5.39 0.27 3.16 2.59 0.00 -1.26 -4.88 105.19 110.46 2jhh n GLY 171 Ca 0.23 -1.34 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 2jhh n GLY 171 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jhh s SER 172 N -4.00 2.02 -0.01 1.61 0.15 -1.26 -5.09 113.70 107.12 2jhh s SER 172 Ca 0.00 -0.33 0.05 0.00 0.70 0.00 0.00 55.95 56.36 2jhh s SER 172 Cb 0.00 -0.21 -0.01 0.00 -1.71 0.00 0.00 66.02 64.08 2jhh s SER 172 CO 0.00 0.20 -0.16 -0.44 1.20 0.00 0.00 173.24 174.04 2jhh s SER 173 N -0.50 1.83 0.30 5.45 0.01 -1.26 -0.22 113.70 119.30 2jhh s SER 173 Ca 0.06 -0.28 -0.14 0.00 1.31 0.00 0.00 55.95 56.90 2jhh s SER 173 Cb -0.07 -0.22 -0.09 0.00 0.21 0.00 0.00 66.02 65.86 2jhh s SER 173 CO -0.00 0.19 0.69 -1.61 0.41 0.00 0.00 173.24 172.91 2jhh s GLU 174 N -0.35 3.96 -0.05 12.44 2.02 0.38 -0.35 118.70 136.75 2jhh s GLU 174 Ca 0.06 0.58 0.02 0.00 0.02 0.00 0.00 54.97 55.64 2jhh s GLU 174 Cb -0.06 -2.50 -0.03 0.00 0.10 0.00 0.00 34.13 31.64 2jhh s GLU 174 CO -0.01 0.20 -0.08 -1.17 0.02 0.00 0.00 175.26 174.23 2jhh s LEU 175 N -2.91 3.11 -0.02 1.80 2.96 -0.74 -2.45 118.68 120.44 2jhh s LEU 175 Ca 0.52 -0.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.37 2jhh s LEU 175 Cb -0.11 -1.71 0.01 0.00 0.50 0.00 0.00 46.19 44.88 2jhh s LEU 175 CO 0.18 0.34 -0.06 -0.60 -1.32 0.00 0.00 176.35 174.89 2jhh s ARG 176 N -0.97 0.66 -0.17 1.98 3.52 -0.26 -0.63 118.95 123.07 2jhh s ARG 176 Ca 0.14 -0.19 -0.00 0.00 -0.13 0.00 0.00 55.73 55.55 2jhh s ARG 176 Cb -0.11 -0.65 0.00 0.00 -1.56 0.00 0.00 34.95 32.63 2jhh s ARG 176 CO 0.03 0.06 -0.15 0.99 -0.81 0.00 0.00 175.30 175.42 2jhh s THR 177 N 0.26 2.64 -0.13 4.11 2.01 -0.05 -0.97 115.64 123.51 2jhh s THR 177 Ca -0.03 -0.77 -0.01 0.00 0.31 0.00 0.00 61.69 61.20 2jhh s THR 177 Cb -0.07 -2.13 -0.02 0.00 0.01 0.00 0.00 72.50 70.29 2jhh s THR 177 CO -0.00 0.51 -0.12 -1.81 -0.69 0.00 0.00 174.62 172.51 2jhh s ASP 178 N 1.00 4.11 0.07 3.53 1.01 -0.14 -1.20 116.67 125.04 2jhh s ASP 178 Ca -0.02 -0.30 0.06 0.00 0.71 0.00 0.00 52.55 53.00 2jhh s ASP 178 Cb -0.15 -1.62 -0.03 0.00 1.01 0.00 0.00 42.92 42.13 2jhh s ASP 178 CO -0.03 0.17 -0.15 -0.76 0.21 0.00 0.00 175.17 174.61 2jhh s LEU 179 N 0.33 2.26 -0.07 1.23 1.43 0.18 -0.57 118.68 123.47 2jhh s LEU 179 Ca -0.10 -0.59 0.01 0.00 -1.03 0.00 0.00 54.13 52.41 2jhh s LEU 179 Cb -0.16 -0.61 0.02 0.00 0.03 0.00 0.00 46.19 45.48 2jhh s LEU 179 CO 0.05 -0.03 -0.06 -0.69 0.23 0.00 0.00 176.35 175.86 2jhh s VAL 180 N -1.16 0.73 0.85 -1.59 1.01 -0.70 -0.49 120.40 119.06 2jhh s VAL 180 Ca 0.00 -0.19 -0.10 0.00 0.00 0.00 0.00 61.98 61.69 2jhh s VAL 180 Cb -0.10 -0.75 0.15 0.00 0.00 0.00 0.00 36.38 35.68 2jhh s VAL 180 CO 0.02 0.29 1.18 1.51 0.00 0.00 0.00 175.10 178.10 2jhh s ASP 181 N 1.19 3.77 0.00 3.32 1.47 -0.92 -0.06 116.67 125.44 2jhh s ASP 181 Ca -0.06 0.14 0.18 0.00 1.18 0.00 0.00 52.55 53.99 2jhh s ASP 181 Cb -0.14 -0.38 0.91 0.00 -0.34 0.00 0.00 42.92 42.96 2jhh s ASP 181 CO -0.02 -2.29 1.52 0.49 0.68 0.00 0.00 175.17 175.56 2jhh n PHE 182 N -3.36 0.00 0.96 2.11 3.01 -1.26 -2.06 117.46 116.86 2jhh n PHE 182 Ca 0.14 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.72 2jhh n PHE 182 Cb 0.60 -0.26 0.17 0.00 -0.01 0.00 0.00 39.48 39.98 2jhh n PHE 182 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2jhh n GLU 183 N -1.26 2.27 -0.58 -1.08 1.02 -1.26 -4.96 120.64 114.78 2jhh n GLU 183 Ca 0.09 -1.85 0.00 0.00 -0.02 0.00 0.00 57.16 55.37 2jhh n GLU 183 Cb 0.13 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 2jhh n GLU 183 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jhh n GLY 184 N 1.35 0.75 3.63 0.62 0.00 -0.87 -5.03 105.19 105.64 2jhh n GLY 184 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 2jhh n GLY 184 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jhh s ASN 185 N -2.54 6.87 0.02 1.61 2.47 -1.26 -4.86 114.94 117.24 2jhh s ASN 185 Ca 0.00 0.94 -0.28 0.00 0.42 0.00 0.00 52.86 53.94 2jhh s ASN 185 Cb 0.00 -2.52 -0.04 0.00 -1.45 0.00 0.00 41.25 37.24 2jhh s ASN 185 CO 0.00 -0.84 0.90 -2.28 -3.72 0.00 0.00 177.10 171.16 2jhh s HIS 186 N 3.54 3.70 0.24 0.43 5.65 -1.26 -2.17 115.29 125.42 2jhh s HIS 186 Ca 0.43 1.62 0.04 0.00 0.25 0.00 0.00 55.06 57.40 2jhh s HIS 186 Cb -0.12 -3.01 -0.05 0.00 -1.18 0.00 0.00 32.58 28.21 2jhh s HIS 186 CO 0.15 0.10 -0.00 -0.65 -0.65 0.00 0.00 174.74 173.69 2jhh s GLN 187 N 0.57 1.38 0.21 2.88 -0.21 0.36 -4.99 119.66 119.86 2jhh s GLN 187 Ca 0.47 -1.70 -0.20 0.00 0.02 0.00 0.00 55.36 53.94 2jhh s GLN 187 Cb -0.21 -0.67 0.04 0.00 1.00 0.00 0.00 33.01 33.17 2jhh s GLN 187 CO 0.26 -0.09 0.61 -0.59 -2.12 0.00 0.00 175.29 173.36 2jhh s PHE 188 N -3.38 -0.27 -0.07 0.91 -0.71 -1.26 -0.65 117.98 112.55 2jhh s PHE 188 Ca 0.29 -0.06 -0.06 0.00 -1.04 0.00 0.00 56.93 56.06 2jhh s PHE 188 Cb 0.06 0.55 0.02 0.00 -1.21 0.00 0.00 43.02 42.43 2jhh s PHE 188 CO 0.09 -1.00 0.18 0.00 -1.34 0.00 0.00 175.22 173.16 2jhh s ALA 189 N -3.85 -0.44 -0.01 1.99 0.00 -0.34 -1.01 121.76 118.10 2jhh s ALA 189 Ca 0.07 0.54 0.08 0.00 0.00 0.00 0.00 51.96 52.66 2jhh s ALA 189 Cb -0.03 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 2jhh s ALA 189 CO -0.03 -0.10 -0.26 0.15 0.00 0.00 0.00 175.76 175.53 2jhh s LYS 190 N 0.21 2.05 -0.02 0.00 1.02 -0.43 -0.87 119.74 121.71 2jhh s LYS 190 Ca -0.01 -0.96 0.05 0.00 0.02 0.00 0.00 55.97 55.07 2jhh s LYS 190 Cb -0.02 -2.03 -0.01 0.00 -0.52 0.00 0.00 37.83 35.25 2jhh s LYS 190 CO -0.01 0.55 -0.16 0.71 -0.92 0.00 0.00 175.35 175.52 2jhh s TYR 191 N -0.65 1.48 0.14 3.18 1.51 0.20 -1.04 117.35 122.17 2jhh s TYR 191 Ca 0.10 -0.29 -0.15 0.00 -1.01 0.00 0.00 57.07 55.72 2jhh s TYR 191 Cb -0.10 -0.96 0.01 0.00 -0.11 0.00 0.00 41.96 40.81 2jhh s TYR 191 CO -0.00 -0.04 1.71 -0.22 -1.11 0.00 0.00 175.55 175.89 2jhh h LYS 192 N 5.78 0.64 -4.09 -0.62 3.64 -1.46 -1.98 116.57 118.49 2jhh h LYS 192 Ca -0.36 -0.10 -0.18 0.00 -1.27 0.00 0.00 60.65 58.74 2jhh h LYS 192 Cb 1.15 -0.11 -0.21 0.00 -0.41 0.00 0.00 32.23 32.66 2jhh h LYS 192 CO 0.48 0.57 -0.70 -1.54 -2.27 0.00 0.00 179.45 175.99 2jhh s SER 193 N -5.85 0.35 -0.19 4.20 1.04 -1.26 -4.28 113.70 107.71 2jhh s SER 193 Ca -0.13 -0.54 -0.07 0.00 0.48 0.00 0.00 55.95 55.69 2jhh s SER 193 Cb 0.11 0.10 0.09 0.00 0.10 0.00 0.00 66.02 66.41 2jhh s SER 193 CO 0.76 -0.31 0.41 0.12 0.98 0.00 0.00 173.24 175.20 2jhh s PHE 194 N -1.63 -0.77 -0.01 5.02 5.36 0.52 -0.95 117.98 125.53 2jhh s PHE 194 Ca -0.13 1.49 -0.00 0.00 -0.96 0.00 0.00 56.93 57.32 2jhh s PHE 194 Cb -0.09 0.29 0.01 0.00 -0.34 0.00 0.00 43.02 42.89 2jhh s PHE 194 CO -0.01 -0.47 0.02 0.21 -1.46 0.00 0.00 175.22 173.50 2jhh s LYS 195 N 2.54 0.01 -0.11 10.12 2.20 0.37 -4.38 119.74 130.48 2jhh s LYS 195 Ca -0.02 0.05 0.02 0.00 -0.36 0.00 0.00 55.97 55.66 2jhh s LYS 195 Cb -0.12 -0.03 -0.01 0.00 -1.51 0.00 0.00 37.83 36.16 2jhh s LYS 195 CO -0.13 -0.03 -0.19 0.14 -0.36 0.00 0.00 175.35 174.79 2jhh s VAL 196 N 0.18 2.53 1.07 4.02 -7.23 -1.26 0.18 120.40 119.89 2jhh s VAL 196 Ca -0.01 -0.85 -0.15 0.00 -1.81 0.00 0.00 61.98 59.15 2jhh s VAL 196 Cb -0.02 -2.02 0.23 0.00 0.56 0.00 0.00 36.38 35.13 2jhh s VAL 196 CO -0.00 0.54 1.11 0.00 -0.31 0.00 0.00 175.10 176.44 2jhh s ALA 197 N 0.31 0.87 1.02 1.32 0.00 0.04 -4.41 121.76 120.91 2jhh s ALA 197 Ca -0.14 -0.62 -0.16 0.00 0.00 0.00 0.00 51.96 51.04 2jhh s ALA 197 Cb -0.17 -3.02 0.21 0.00 0.00 0.00 0.00 23.12 20.14 2jhh s ALA 197 CO 0.07 -3.10 1.19 0.34 0.00 0.00 0.00 175.76 174.26 2jhh s ASP 198 N -3.68 2.52 0.35 0.00 -1.08 -1.26 -4.00 116.67 109.51 2jhh s ASP 198 Ca 0.68 0.62 0.07 0.00 -0.52 0.00 0.00 52.55 53.40 2jhh s ASP 198 Cb -0.15 -0.91 0.64 0.00 -1.46 0.00 0.00 42.92 41.04 2jhh s ASP 198 CO 0.57 -3.13 1.84 -0.08 0.52 0.00 0.00 175.17 174.89 2jhh h GLU 199 N -1.91 0.33 -0.01 4.34 4.81 -1.94 -1.25 114.58 118.94 2jhh h GLU 199 Ca -0.47 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 2jhh h GLU 199 Cb 1.29 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 2jhh h GLU 199 CO 0.45 0.50 0.03 0.00 -0.73 0.00 0.00 179.01 179.25 2jhh h ALA 200 N 1.52 1.27 -0.45 2.92 0.00 -2.04 -0.70 119.26 121.79 2jhh h ALA 200 Ca 0.06 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 2jhh h ALA 200 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.18 2jhh h ALA 200 CO 0.03 -0.04 0.08 0.39 0.00 0.00 0.00 179.25 179.71 2jhh n GLU 201 N -3.41 2.51 -3.18 0.00 1.02 -0.55 -4.95 120.64 112.09 2jhh n GLU 201 Ca -0.03 -3.05 -0.23 0.00 -0.02 0.00 0.00 57.16 53.84 2jhh n GLU 201 Cb 0.11 -1.93 0.02 0.00 -0.02 0.00 0.00 31.44 29.62 2jhh n GLU 201 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2jhh n LYS 202 N -0.79 -4.38 -4.10 3.49 4.76 -0.27 -1.76 118.16 115.11 2jhh n LYS 202 Ca 0.34 0.73 -0.33 0.00 -2.87 0.00 0.00 58.31 56.18 2jhh n LYS 202 Cb 1.12 -5.54 -0.01 0.00 -1.84 0.00 0.00 35.03 28.75 2jhh n LYS 202 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2jhh n TYR 203 N -4.30 -1.86 -1.67 2.13 4.01 -0.73 -1.00 117.16 113.75 2jhh n TYR 203 Ca -0.07 0.82 -0.44 0.00 -0.16 0.00 0.00 57.90 58.04 2jhh n TYR 203 Cb 0.59 -3.35 -0.02 0.00 -0.31 0.00 0.00 39.34 36.25 2jhh n TYR 203 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2jhh n LYS 204 N -4.46 1.94 -3.06 -0.72 4.81 -0.72 -4.15 118.16 111.81 2jhh n LYS 204 Ca -0.01 0.69 -0.40 0.00 -0.87 0.00 0.00 58.31 57.72 2jhh n LYS 204 Cb 0.54 -2.27 -0.05 0.00 0.02 0.00 0.00 35.03 33.26 2jhh n LYS 204 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2jhh s LEU 205 N -0.23 4.22 -0.35 3.14 2.96 -0.57 -0.78 118.68 127.07 2jhh s LEU 205 Ca 0.63 1.03 -0.04 0.00 -0.22 0.00 0.00 54.13 55.53 2jhh s LEU 205 Cb -0.64 -3.02 0.07 0.00 0.50 0.00 0.00 46.19 43.11 2jhh s LEU 205 CO 0.55 -0.22 0.11 -0.69 -1.32 0.00 0.00 176.35 174.79 2jhh s VAL 206 N 1.45 3.35 -0.08 1.68 1.01 0.13 0.28 120.40 128.21 2jhh s VAL 206 Ca 0.34 -1.57 0.04 0.00 0.00 0.00 0.00 61.98 60.79 2jhh s VAL 206 Cb -0.17 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2jhh s VAL 206 CO 0.14 -0.36 -0.21 -0.22 0.00 0.00 0.00 175.10 174.45 2jhh s LEU 207 N 1.26 2.26 0.00 3.92 2.96 -1.26 -0.48 118.68 127.34 2jhh s LEU 207 Ca 0.01 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.46 2jhh s LEU 207 Cb -0.21 -1.45 0.00 0.00 0.50 0.00 0.00 46.19 45.03 2jhh s LEU 207 CO -0.01 0.21 0.00 0.61 -1.32 0.00 0.00 176.35 175.84 2jhh n GLY 208 N 3.19 0.62 3.77 7.98 0.00 -0.12 -4.82 105.19 115.80 2jhh n GLY 208 Ca -0.18 -1.89 -0.41 0.00 0.00 0.00 0.00 46.02 43.55 2jhh n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jhh s ALA 209 N -2.91 3.49 0.06 4.61 0.00 -1.26 -4.57 121.76 121.19 2jhh s ALA 209 Ca 0.00 1.22 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 2jhh s ALA 209 Cb 0.00 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 2jhh s ALA 209 CO 0.00 -0.58 1.81 0.12 0.00 0.00 0.00 175.76 177.11 2jhh s PHE 210 N -1.08 1.93 -1.90 0.00 2.19 -1.26 -1.37 117.98 116.49 2jhh s PHE 210 Ca 0.49 -0.05 0.22 0.00 0.33 0.00 0.00 56.93 57.92 2jhh s PHE 210 Cb -0.39 -4.12 -0.04 0.00 -1.31 0.00 0.00 43.02 37.16 2jhh s PHE 210 CO 0.51 -4.74 1.06 0.28 1.83 0.00 0.00 175.22 174.16 2jhh n VAL 211 N 5.06 0.00 0.00 3.12 0.31 -0.21 -4.94 118.33 121.67 2jhh n VAL 211 Ca 0.18 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 2jhh n VAL 211 Cb 0.40 1.23 0.00 0.00 -0.91 0.00 0.00 33.84 34.56 2jhh n VAL 211 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jhh n GLY 212 N 1.43 1.56 0.00 2.92 0.00 -1.25 -4.95 105.19 104.91 2jhh n GLY 212 Ca 0.09 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 44.01 2jhh n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jhh n GLY 213 N -1.45 4.77 0.05 -0.02 0.00 -1.26 -1.31 105.19 105.97 2jhh n GLY 213 Ca 0.00 -0.98 0.11 0.00 0.00 0.00 0.00 46.02 45.14 2jhh n GLY 213 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jhh n SER 214 N 0.00 0.29 0.15 1.61 3.41 -0.82 -1.89 113.62 116.38 2jhh n SER 214 Ca 0.00 0.55 0.12 0.00 -0.26 0.00 0.00 58.87 59.28 2jhh n SER 214 Cb 0.00 -0.62 0.16 0.00 -0.26 0.00 0.00 64.21 63.49 2jhh n SER 214 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jhh h ALA 215 N 2.55 0.81 0.00 7.33 0.00 -1.38 -3.43 119.26 125.13 2jhh h ALA 215 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jhh h ALA 215 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2jhh h ALA 215 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2jhh n GLY 216 N 1.18 -1.19 3.48 0.00 0.00 -0.79 -4.82 105.19 103.05 2jhh n GLY 216 Ca 0.03 -1.60 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 2jhh n GLY 216 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jhh s ASN 217 N -2.52 6.25 -0.13 1.61 2.47 -1.26 -4.76 114.94 116.61 2jhh s ASN 217 Ca 0.00 -0.63 0.08 0.00 0.42 0.00 0.00 52.86 52.73 2jhh s ASN 217 Cb 0.00 -2.28 -0.13 0.00 -1.45 0.00 0.00 41.25 37.39 2jhh s ASN 217 CO 0.00 -0.75 -0.01 -1.54 -3.72 0.00 0.00 177.10 171.09 2jhh n SER 218 N 6.01 2.31 -3.43 -4.21 3.41 -1.26 -4.41 113.62 112.03 2jhh n SER 218 Ca -0.05 -0.02 -0.38 0.00 -0.26 0.00 0.00 58.87 58.16 2jhh n SER 218 Cb 0.47 0.50 -0.02 0.00 -0.26 0.00 0.00 64.21 64.90 2jhh n SER 218 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jhh n LEU 219 N -2.58 7.34 -3.88 1.04 4.77 -1.26 -4.83 117.00 117.61 2jhh n LEU 219 Ca -0.21 -3.98 -0.31 0.00 -0.03 0.00 0.00 56.01 51.48 2jhh n LEU 219 Cb 0.85 -1.49 -0.09 0.00 -2.33 0.00 0.00 43.42 40.37 2jhh n LEU 219 CO 0.22 1.42 0.14 1.07 -1.33 0.00 0.00 177.39 178.91 2jhh n THR 220 N 4.27 2.32 -3.22 -5.08 5.66 -1.26 -4.02 114.28 112.95 2jhh n THR 220 Ca 0.64 -5.05 -0.24 0.00 -3.05 0.00 0.00 64.05 56.35 2jhh n THR 220 Cb 0.27 -2.22 -0.07 0.00 -1.55 0.00 0.00 70.33 66.75 2jhh n THR 220 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jhh n GLY 221 N 1.82 2.65 2.96 1.09 0.00 -1.26 -5.08 105.19 107.37 2jhh n GLY 221 Ca 0.23 -1.48 -0.24 0.00 0.00 0.00 0.00 46.02 44.53 2jhh n GLY 221 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2jhh n HIS 222 N 1.71 0.89 -1.73 1.61 -0.00 -1.26 -4.86 115.22 111.58 2jhh n HIS 222 Ca 0.23 -1.30 -0.33 0.00 -0.00 0.00 0.00 57.72 56.31 2jhh n HIS 222 Cb 0.52 -1.24 0.05 0.00 -0.00 0.00 0.00 29.99 29.32 2jhh n HIS 222 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2jhh s ASN 223 N 4.74 5.01 -1.20 4.39 2.47 -1.26 -3.91 114.94 125.17 2jhh s ASN 223 Ca 0.37 2.05 0.00 0.00 0.42 0.00 0.00 52.86 55.70 2jhh s ASN 223 Cb 0.09 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.33 2jhh s ASN 223 CO 0.07 -1.70 0.00 0.59 -3.72 0.00 0.00 177.10 172.33 2jhh n ASN 224 N -2.42 -5.28 -4.81 -4.21 4.13 0.14 -4.99 115.26 97.81 2jhh n ASN 224 Ca 0.11 0.28 -0.38 0.00 1.68 0.00 0.00 54.58 56.27 2jhh n ASN 224 Cb 0.52 -3.78 -0.06 0.00 -1.54 0.00 0.00 39.78 34.92 2jhh n ASN 224 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2jhh s ASN 225 N -2.52 7.08 0.70 6.41 0.01 -1.25 -4.79 114.94 120.58 2jhh s ASN 225 Ca 0.00 1.33 -0.12 0.00 -0.71 0.00 0.00 52.86 53.36 2jhh s ASN 225 Cb 0.00 -2.38 0.02 0.00 0.41 0.00 0.00 41.25 39.29 2jhh s ASN 225 CO 0.00 0.18 1.08 -0.36 -1.51 0.00 0.00 177.10 176.49 2jhh s PHE 226 N -1.27 2.79 0.31 2.20 2.99 -1.26 -1.51 117.98 122.24 2jhh s PHE 226 Ca 0.35 1.51 -0.27 0.00 0.00 0.00 0.00 56.93 58.52 2jhh s PHE 226 Cb -0.19 -3.02 -0.10 0.00 0.00 0.00 0.00 43.02 39.72 2jhh s PHE 226 CO 0.21 -1.52 0.96 0.12 -0.00 0.00 0.00 175.22 174.99 2jhh s PHE 227 N -2.77 3.69 0.01 0.36 5.36 -0.17 -3.89 117.98 120.57 2jhh s PHE 227 Ca 0.62 1.79 0.03 0.00 -0.96 0.00 0.00 56.93 58.40 2jhh s PHE 227 Cb -0.17 -2.98 -0.01 0.00 -0.34 0.00 0.00 43.02 39.52 2jhh s PHE 227 CO 0.50 0.11 -0.08 -1.54 -1.46 0.00 0.00 175.22 172.75 2jhh s SER 228 N -1.49 0.96 0.38 6.13 1.04 -0.27 -4.51 113.70 115.94 2jhh s SER 228 Ca 0.49 -0.27 0.04 0.00 0.48 0.00 0.00 55.95 56.68 2jhh s SER 228 Cb -0.21 -0.06 -0.04 0.00 0.10 0.00 0.00 66.02 65.80 2jhh s SER 228 CO 0.27 0.01 0.08 0.42 0.98 0.00 0.00 173.24 175.00 2jhh s THR 229 N -0.55 0.94 0.39 2.02 -4.23 -0.75 -2.36 115.64 111.11 2jhh s THR 229 Ca -0.00 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.61 2jhh s THR 229 Cb -0.05 -2.53 0.31 0.00 1.34 0.00 0.00 72.50 71.57 2jhh s THR 229 CO 0.00 0.00 1.95 0.07 -0.54 0.00 0.00 174.62 176.10 2jhh h LYS 230 N 1.88 0.57 -0.02 3.99 2.10 -1.87 -2.00 116.57 121.22 2jhh h LYS 230 Ca -0.39 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.23 2jhh h LYS 230 Cb 1.26 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 2jhh h LYS 230 CO 0.65 0.38 -0.23 -0.40 -2.00 0.00 0.00 179.45 177.85 2jhh n ASP 231 N -4.49 2.00 -3.46 7.07 5.75 -1.26 -4.70 116.55 117.46 2jhh n ASP 231 Ca 0.11 -1.51 -0.27 0.00 -0.01 0.00 0.00 54.79 53.11 2jhh n ASP 231 Cb 0.34 0.20 -0.12 0.00 -1.03 0.00 0.00 41.12 40.51 2jhh n ASP 231 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2jhh s GLN 232 N -2.28 0.50 -0.60 0.11 -1.52 -0.75 -5.01 119.66 110.10 2jhh s GLN 232 Ca 0.25 -1.12 -0.26 0.00 -1.95 0.00 0.00 55.36 52.28 2jhh s GLN 232 Cb 0.19 -1.19 0.04 0.00 -0.22 0.00 0.00 33.01 31.83 2jhh s GLN 232 CO 0.45 -1.18 1.06 0.34 -0.25 0.00 0.00 175.29 175.72 2jhh s ASP 233 N 1.30 6.33 -0.12 5.90 -1.08 -1.25 -1.82 116.67 125.93 2jhh s ASP 233 Ca 0.16 -0.30 0.16 0.00 -0.52 0.00 0.00 52.55 52.05 2jhh s ASP 233 Cb -0.21 -2.48 0.31 0.00 -1.46 0.00 0.00 42.92 39.08 2jhh s ASP 233 CO -0.06 -1.41 1.20 0.59 0.52 0.00 0.00 175.17 176.02 2jhh n ASN 234 N 8.03 2.70 -3.87 -0.34 3.02 -1.26 -5.05 115.26 118.49 2jhh n ASN 234 Ca 0.03 -2.88 -0.27 0.00 -0.03 0.00 0.00 54.58 51.43 2jhh n ASN 234 Cb 0.48 -0.39 0.18 0.00 -0.61 0.00 0.00 39.78 39.43 2jhh n ASN 234 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2jhh n ASP 235 N -1.00 0.28 -1.03 6.41 5.68 -1.26 -4.53 116.55 121.09 2jhh n ASP 235 Ca 0.15 -1.55 0.05 0.00 -0.50 0.00 0.00 54.79 52.94 2jhh n ASP 235 Cb 0.64 -0.90 0.25 0.00 -1.14 0.00 0.00 41.12 39.97 2jhh n ASP 235 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2jhh n VAL 236 N -3.57 2.40 -4.01 2.12 0.24 -0.57 -5.01 118.33 109.93 2jhh n VAL 236 Ca 0.16 -2.05 -0.25 0.00 -2.04 0.00 0.00 64.34 60.15 2jhh n VAL 236 Cb 0.54 -0.28 -0.04 0.00 -1.47 0.00 0.00 33.84 32.59 2jhh n VAL 236 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2jhh s SER 237 N -2.01 6.00 0.43 -1.34 0.15 -1.17 -4.82 113.70 110.95 2jhh s SER 237 Ca 0.44 0.02 0.27 0.00 0.70 0.00 0.00 55.95 57.38 2jhh s SER 237 Cb 0.36 -1.71 0.85 0.00 -1.71 0.00 0.00 66.02 63.81 2jhh s SER 237 CO 0.07 0.03 1.78 0.77 1.20 0.00 0.00 173.24 177.09 2jhh h SER 238 N 2.01 0.00 -2.39 5.45 4.64 -1.94 -3.45 113.55 117.86 2jhh h SER 238 Ca -0.49 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.38 2jhh h SER 238 Cb 1.21 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 63.36 2jhh h SER 238 CO 0.65 0.00 0.03 -0.94 -0.87 0.00 0.00 176.83 175.70 2jhh s SER 239 N -5.60 4.90 -0.68 4.97 1.04 -1.26 -5.05 113.70 112.03 2jhh s SER 239 Ca 0.05 -0.14 -0.17 0.00 0.48 0.00 0.00 55.95 56.17 2jhh s SER 239 Cb 0.08 -0.53 0.14 0.00 0.10 0.00 0.00 66.02 65.80 2jhh s SER 239 CO 0.58 -1.44 0.73 0.21 0.98 0.00 0.00 173.24 174.31 2jhh s ASN 240 N -4.55 6.37 0.24 7.02 3.04 -1.26 -4.95 114.94 120.85 2jhh s ASN 240 Ca 0.61 -1.86 -0.05 0.00 0.04 0.00 0.00 52.86 51.60 2jhh s ASN 240 Cb -0.08 -2.28 0.38 0.00 -1.54 0.00 0.00 41.25 37.73 2jhh s ASN 240 CO 0.41 -0.94 1.82 0.00 -3.04 0.00 0.00 177.10 175.34 2jhh h ALA 242 N 1.44 1.14 -0.42 0.00 0.00 -1.86 -1.31 119.26 118.25 2jhh h ALA 242 Ca 0.39 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 2jhh h ALA 242 Cb 0.32 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2jhh h ALA 242 CO -0.23 0.59 -0.19 0.93 0.00 0.00 0.00 179.25 180.35 2jhh h GLU 243 N 1.23 0.87 0.00 0.00 5.08 -1.68 0.41 114.58 120.49 2jhh h GLU 243 Ca 0.32 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2jhh h GLU 243 Cb -0.06 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2jhh h GLU 243 CO -0.06 1.02 -1.05 1.17 -1.00 0.00 0.00 179.01 179.09 2jhh n LYS 244 N -4.22 0.39 -0.07 2.33 4.81 -0.60 -2.04 118.16 118.77 2jhh n LYS 244 Ca -0.01 0.02 0.02 0.00 -0.87 0.00 0.00 58.31 57.47 2jhh n LYS 244 Cb 0.43 -1.65 0.05 0.00 0.02 0.00 0.00 35.03 33.87 2jhh n LYS 244 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2jhh n PHE 245 N -2.17 0.17 -3.88 5.64 3.72 -0.53 -5.06 117.46 115.35 2jhh n PHE 245 Ca 0.01 -0.08 -0.26 0.00 -0.05 0.00 0.00 57.45 57.08 2jhh n PHE 245 Cb 0.47 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 2jhh n PHE 245 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2jhh n GLN 246 N -0.14 -4.22 -3.61 -1.08 1.13 0.13 -3.65 117.38 105.96 2jhh n GLN 246 Ca 0.04 0.51 -0.01 0.00 -1.94 0.00 0.00 57.00 55.59 2jhh n GLN 246 Cb 0.15 -4.96 -0.01 0.00 0.11 0.00 0.00 30.24 25.52 2jhh n GLN 246 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2jhh s GLY 247 N -4.10 -0.35 -0.07 1.08 0.00 -0.44 -3.58 107.32 99.86 2jhh s GLY 247 Ca 0.17 1.13 -0.03 0.00 0.00 0.00 0.00 44.72 45.99 2jhh s GLY 247 CO 0.86 0.32 0.08 0.00 0.00 0.00 0.00 173.10 174.35 2jhh s ALA 248 N -2.42 3.59 0.15 3.20 0.00 -1.26 -4.28 121.76 120.73 2jhh s ALA 248 Ca 0.12 -0.77 -0.25 0.00 0.00 0.00 0.00 51.96 51.06 2jhh s ALA 248 Cb 0.02 -1.68 0.07 0.00 0.00 0.00 0.00 23.12 21.53 2jhh s ALA 248 CO -0.04 0.64 1.00 -0.46 0.00 0.00 0.00 175.76 176.89 2jhh s TRP 249 N -1.05 -0.09 -1.34 0.00 -0.11 -0.99 -4.66 118.94 110.70 2jhh s TRP 249 Ca 0.17 -0.21 -0.13 0.00 1.22 0.00 0.00 56.10 57.16 2jhh s TRP 249 Cb -0.12 0.64 0.11 0.00 -1.50 0.00 0.00 33.47 32.61 2jhh s TRP 249 CO 0.07 -0.80 1.92 0.91 -4.62 0.00 0.00 176.95 174.43 2jhh n TRP 250 N -0.50 3.64 -2.60 5.86 8.01 -1.26 -1.12 117.44 129.46 2jhh n TRP 250 Ca -0.06 -2.94 -0.37 0.00 -1.31 0.00 0.00 57.50 52.82 2jhh n TRP 250 Cb 0.61 -2.28 -0.05 0.00 -2.01 0.00 0.00 31.31 27.58 2jhh n TRP 250 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 2jhh s TYR 251 N 2.00 3.43 0.00 -5.99 1.51 -1.25 -4.89 117.35 112.15 2jhh s TYR 251 Ca 0.44 1.69 0.00 0.00 -1.01 0.00 0.00 57.07 58.19 2jhh s TYR 251 Cb 0.09 -3.09 0.00 0.00 -0.11 0.00 0.00 41.96 38.85 2jhh s TYR 251 CO -0.02 -0.38 0.00 0.00 -1.11 0.00 0.00 175.55 174.04 2jhh n ALA 252 N 0.27 0.52 -0.83 3.71 0.00 -1.26 -4.43 120.51 118.49 2jhh n ALA 252 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.55 2jhh n ALA 252 Cb 0.49 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.17 2jhh n ALA 252 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2jhh n ASP 253 N -0.04 3.60 -0.04 0.00 5.75 -1.26 -1.51 116.55 123.05 2jhh n ASP 253 Ca 0.00 -2.81 0.00 0.00 -0.01 0.00 0.00 54.79 51.97 2jhh n ASP 253 Cb 0.00 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 39.62 2jhh n ASP 253 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jhh h HIS 255 N 0.00 0.98 -4.40 0.00 3.86 -2.01 -3.48 115.15 110.10 2jhh h HIS 255 Ca 0.00 -0.50 -0.25 0.00 -1.16 0.00 0.00 60.37 58.46 2jhh h HIS 255 Cb 0.97 -0.13 -0.13 0.00 1.06 0.00 0.00 27.41 29.19 2jhh h HIS 255 CO 0.00 1.33 -0.45 0.00 0.86 0.00 0.00 177.93 179.67 2jhh s ALA 256 N -3.44 0.97 1.07 2.45 0.00 -1.26 -5.17 121.76 116.38 2jhh s ALA 256 Ca -0.11 -1.58 -0.18 0.00 0.00 0.00 0.00 51.96 50.09 2jhh s ALA 256 Cb 0.07 1.32 0.24 0.00 0.00 0.00 0.00 23.12 24.75 2jhh s ALA 256 CO 0.90 -0.68 1.25 -1.54 0.00 0.00 0.00 175.76 175.69 2jhh s SER 257 N -3.18 2.14 0.24 0.00 1.04 -1.26 -4.96 113.70 107.73 2jhh s SER 257 Ca 0.35 0.36 0.00 0.00 0.48 0.00 0.00 55.95 57.14 2jhh s SER 257 Cb 0.04 -0.43 0.00 0.00 0.10 0.00 0.00 66.02 65.73 2jhh s SER 257 CO 0.15 -3.34 0.31 -0.46 0.98 0.00 0.00 173.24 170.88 2jhh n ASN 258 N -4.19 -0.86 0.17 7.02 0.23 -1.25 -4.70 115.26 111.68 2jhh n ASN 258 Ca 0.15 -2.37 0.13 0.00 -0.53 0.00 0.00 54.58 51.96 2jhh n ASN 258 Cb 0.59 1.65 0.60 0.00 -2.08 0.00 0.00 39.78 40.55 2jhh n ASN 258 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2jhh h LEU 259 N 0.00 0.00 -2.72 -4.53 3.38 -1.94 -0.31 115.31 109.19 2jhh h LEU 259 Ca -0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2jhh h LEU 259 Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 2jhh h LEU 259 CO 0.25 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.37 2jhh n ASN 260 N -2.37 3.71 -3.56 -0.43 3.02 -1.26 -4.97 115.26 109.41 2jhh n ASN 260 Ca 0.00 -1.99 -0.26 0.00 -0.03 0.00 0.00 54.58 52.30 2jhh n ASN 260 Cb 0.14 -0.42 0.20 0.00 -0.61 0.00 0.00 39.78 39.09 2jhh n ASN 260 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jhh n GLY 261 N 1.43 -1.99 3.70 7.41 0.00 -0.13 -4.21 105.19 111.41 2jhh n GLY 261 Ca 0.22 -1.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.19 2jhh n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jhh n LEU 262 N 0.00 3.67 -4.40 0.99 4.77 -1.23 -4.91 117.00 115.89 2jhh n LEU 262 Ca 0.14 1.10 -0.44 0.00 -0.03 0.00 0.00 56.01 56.77 2jhh n LEU 262 Cb 0.51 -1.51 -0.04 0.00 -2.33 0.00 0.00 43.42 40.04 2jhh n LEU 262 CO 0.36 -0.06 0.53 -0.47 -1.33 0.00 0.00 177.39 176.42 2jhh s TYR 263 N 0.67 2.94 0.28 -1.77 5.04 -1.26 -4.58 117.35 118.67 2jhh s TYR 263 Ca 0.73 -0.91 -0.30 0.00 -2.44 0.00 0.00 57.07 54.15 2jhh s TYR 263 Cb -0.58 -4.10 -0.12 0.00 0.35 0.00 0.00 41.96 37.51 2jhh s TYR 263 CO 0.40 -1.39 1.54 1.28 -1.34 0.00 0.00 175.55 176.03 2jhh n LEU 264 N 6.64 3.97 -2.81 6.97 4.32 -0.63 -4.72 117.00 130.74 2jhh n LEU 264 Ca -0.06 1.14 -0.25 0.00 -0.02 0.00 0.00 56.01 56.83 2jhh n LEU 264 Cb 0.44 -1.54 -0.02 0.00 -1.62 0.00 0.00 43.42 40.67 2jhh n LEU 264 CO 0.59 -0.05 0.11 0.23 -1.22 0.00 0.00 177.39 177.05 2jhh n MET 265 N 2.12 2.97 -0.90 3.23 2.81 -1.25 -1.62 117.12 124.49 2jhh n MET 265 Ca 0.09 -4.54 -0.08 0.00 -1.81 0.00 0.00 57.70 51.37 2jhh n MET 265 Cb 0.35 -2.14 0.05 0.00 -0.71 0.00 0.00 33.22 30.77 2jhh n MET 265 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jhh n GLY 266 N -0.26 -0.24 3.67 3.03 0.00 -0.12 -5.01 105.19 106.26 2jhh n GLY 266 Ca 0.32 -1.83 -0.44 0.00 0.00 0.00 0.00 46.02 44.06 2jhh n GLY 266 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jhh n PRO 267 N -1.71 1.95 -0.23 1.61 -0.02 -1.26 -4.85 135.00 130.48 2jhh n PRO 267 Ca 0.05 0.69 0.25 0.00 -2.02 0.00 0.00 63.50 62.47 2jhh n PRO 267 Cb 0.18 -2.27 0.62 0.00 -0.02 0.00 0.00 33.50 32.01 2jhh n PRO 267 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2jhh h HIS 268 N 3.29 0.28 -0.00 6.00 2.76 -1.96 -0.32 115.15 125.20 2jhh h HIS 268 Ca -0.45 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.73 2jhh h HIS 268 Cb 1.29 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 30.17 2jhh h HIS 268 CO 0.53 0.06 -0.15 -0.85 -1.30 0.00 0.00 177.93 176.22 2jhh n GLU 269 N -4.40 0.12 -3.02 5.26 0.00 -1.26 -4.94 120.64 112.40 2jhh n GLU 269 Ca 0.20 -0.03 -0.18 0.00 0.00 0.00 0.00 57.16 57.15 2jhh n GLU 269 Cb 0.89 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.86 2jhh n GLU 269 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 2jhh s SER 270 N -2.90 5.40 0.42 -1.84 1.04 -0.13 -5.02 113.70 110.67 2jhh s SER 270 Ca 0.16 -0.62 0.23 0.00 0.48 0.00 0.00 55.95 56.21 2jhh s SER 270 Cb 0.19 -0.22 0.67 0.00 0.10 0.00 0.00 66.02 66.76 2jhh s SER 270 CO 0.56 -1.03 1.72 0.10 0.98 0.00 0.00 173.24 175.57 2jhh h TYR 271 N 0.42 0.00 -0.07 5.02 -0.00 -1.92 -3.40 116.97 117.02 2jhh h TYR 271 Ca -0.35 0.00 -0.67 0.00 0.00 0.00 0.00 58.73 57.70 2jhh h TYR 271 Cb 1.28 0.00 0.02 0.00 0.00 0.00 0.00 36.73 38.03 2jhh h TYR 271 CO 0.41 0.19 3.78 0.00 -0.00 0.00 0.00 178.16 182.54 2jhh n ALA 272 N -2.17 7.53 -2.92 0.10 0.00 -1.26 -4.82 120.51 116.97 2jhh n ALA 272 Ca 0.02 -3.57 -0.11 0.00 0.00 0.00 0.00 53.44 49.78 2jhh n ALA 272 Cb 0.50 -3.34 -0.13 0.00 0.00 0.00 0.00 19.45 16.48 2jhh n ALA 272 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2jhh s ASN 273 N 2.07 0.08 0.00 0.00 0.01 -1.26 -0.95 114.94 114.89 2jhh s ASN 273 Ca 0.69 -0.16 0.00 0.00 -0.71 0.00 0.00 52.86 52.68 2jhh s ASN 273 Cb 0.18 0.05 0.00 0.00 0.41 0.00 0.00 41.25 41.89 2jhh s ASN 273 CO -0.06 -0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.03 2jhh n GLY 274 N 2.56 -1.34 3.45 0.66 0.00 -0.64 -4.59 105.19 105.29 2jhh n GLY 274 Ca -0.16 -1.35 -0.22 0.00 0.00 0.00 0.00 46.02 44.29 2jhh n GLY 274 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jhh s ILE 275 N 0.00 1.61 0.09 -0.61 -4.36 -0.25 -1.61 121.20 116.08 2jhh s ILE 275 Ca 0.00 -2.10 0.07 0.00 -0.26 0.00 0.00 60.65 58.37 2jhh s ILE 275 Cb 0.00 -2.54 -0.04 0.00 1.25 0.00 0.00 42.46 41.13 2jhh s ILE 275 CO 0.00 -0.23 -0.14 0.20 0.24 0.00 0.00 174.94 175.01 2jhh s ASN 276 N -3.47 4.11 0.00 4.36 0.01 -1.26 0.68 114.94 119.37 2jhh s ASN 276 Ca 0.31 -0.44 0.00 0.00 -0.71 0.00 0.00 52.86 52.02 2jhh s ASN 276 Cb 0.05 -0.70 0.00 0.00 0.41 0.00 0.00 41.25 41.01 2jhh s ASN 276 CO 0.13 0.20 0.00 1.87 -1.51 0.00 0.00 177.10 177.79 2jhh n TRP 277 N 0.97 0.00 -3.15 2.20 -0.00 -1.26 -3.25 117.44 112.95 2jhh n TRP 277 Ca -0.15 0.00 -0.41 0.00 -0.00 0.00 0.00 57.50 56.95 2jhh n TRP 277 Cb 0.52 0.00 -0.07 0.00 -0.00 0.00 0.00 31.31 31.77 2jhh n TRP 277 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 2jhh s SER 286 N -2.49 6.52 0.03 5.87 0.15 -1.26 -4.96 113.70 117.56 2jhh s SER 286 Ca 0.00 0.58 0.06 0.00 0.70 0.00 0.00 55.95 57.29 2jhh s SER 286 Cb 0.00 -2.32 -0.03 0.00 -1.71 0.00 0.00 66.02 61.96 2jhh s SER 286 CO 0.00 -0.37 -0.15 -0.31 1.20 0.00 0.00 173.24 173.61 2jhh s TYR 287 N 2.47 2.66 -0.01 3.44 1.51 0.21 -4.33 117.35 123.31 2jhh s TYR 287 Ca 0.24 -0.19 -0.05 0.00 -1.01 0.00 0.00 57.07 56.06 2jhh s TYR 287 Cb -0.15 -1.50 -0.29 0.00 -0.11 0.00 0.00 41.96 39.91 2jhh s TYR 287 CO 0.09 0.29 0.82 -0.22 -1.11 0.00 0.00 175.55 175.43 2jhh h LYS 288 N 4.51 0.29 -4.88 -0.62 3.64 -0.71 -0.64 116.57 118.16 2jhh h LYS 288 Ca -0.48 -0.49 -0.43 0.00 -1.27 0.00 0.00 60.65 57.98 2jhh h LYS 288 Cb 1.16 0.18 -0.29 0.00 -0.41 0.00 0.00 32.23 32.87 2jhh h LYS 288 CO 0.50 1.16 -0.79 0.08 -2.27 0.00 0.00 179.45 178.13 2jhh s VAL 289 N -2.61 0.86 0.01 2.00 1.01 -0.68 -4.05 120.40 116.95 2jhh s VAL 289 Ca -0.10 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.45 2jhh s VAL 289 Cb 0.06 -0.73 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 2jhh s VAL 289 CO 0.86 0.25 -0.07 -0.94 0.00 0.00 0.00 175.10 175.19 2jhh s SER 290 N -0.16 0.86 -0.02 3.32 1.04 -0.62 -1.72 113.70 116.41 2jhh s SER 290 Ca 0.03 -0.26 -0.01 0.00 0.48 0.00 0.00 55.95 56.19 2jhh s SER 290 Cb -0.05 -0.05 0.02 0.00 0.10 0.00 0.00 66.02 66.03 2jhh s SER 290 CO -0.00 -0.00 0.04 -1.61 0.98 0.00 0.00 173.24 172.64 2jhh s GLU 291 N -0.63 -0.00 -0.09 4.02 2.02 0.27 -1.34 118.70 122.95 2jhh s GLU 291 Ca -0.01 0.14 0.03 0.00 0.02 0.00 0.00 54.97 55.15 2jhh s GLU 291 Cb -0.05 -0.14 -0.01 0.00 0.10 0.00 0.00 34.13 34.03 2jhh s GLU 291 CO 0.00 -0.10 -0.18 -1.64 0.02 0.00 0.00 175.26 173.35 2jhh s MET 292 N 0.67 2.93 0.08 1.61 -1.94 -0.62 -0.97 119.30 121.06 2jhh s MET 292 Ca -0.05 -0.78 -0.12 0.00 -1.71 0.00 0.00 55.69 53.03 2jhh s MET 292 Cb -0.08 -2.40 0.01 0.00 2.01 0.00 0.00 34.83 34.38 2jhh s MET 292 CO -0.02 0.33 0.28 -1.59 -0.01 0.00 0.00 175.02 174.01 2jhh s LYS 293 N -0.00 0.88 0.04 2.03 -2.85 -0.14 -0.25 119.74 119.44 2jhh s LYS 293 Ca -0.06 -0.73 0.03 0.00 -1.00 0.00 0.00 55.97 54.21 2jhh s LYS 293 Cb -0.15 0.37 -0.02 0.00 -2.06 0.00 0.00 37.83 35.97 2jhh s LYS 293 CO 0.05 -0.30 -0.11 0.08 0.10 0.00 0.00 175.35 175.18 2jhh s VAL 294 N -3.34 0.81 -0.06 1.79 1.01 0.01 -1.10 120.40 119.51 2jhh s VAL 294 Ca 0.01 -1.01 -0.09 0.00 0.00 0.00 0.00 61.98 60.88 2jhh s VAL 294 Cb 0.02 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.63 2jhh s VAL 294 CO -0.08 -0.19 0.23 -0.60 0.00 0.00 0.00 175.10 174.46 2jhh s ARG 295 N -1.34 0.40 0.21 2.72 3.52 -1.02 -0.48 118.95 122.95 2jhh s ARG 295 Ca -0.04 0.07 -0.31 0.00 -0.13 0.00 0.00 55.73 55.32 2jhh s ARG 295 Cb -0.09 0.18 -0.15 0.00 -1.56 0.00 0.00 34.95 33.34 2jhh s ARG 295 CO 0.01 -0.08 1.15 -2.30 -0.81 0.00 0.00 175.30 173.27 2jhh n PRO 296 N 2.29 1.30 0.00 5.12 -0.02 -1.26 -0.47 135.00 141.96 2jhh n PRO 296 Ca -0.17 0.46 0.16 0.00 -2.02 0.00 0.00 63.50 61.93 2jhh n PRO 296 Cb 0.57 -1.95 0.90 0.00 -0.02 0.00 0.00 33.50 33.00 2jhh n PRO 296 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48