#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wnu n PHE 90 N 0.00 1.76 -4.63 2.13 3.72 -1.26 -4.94 117.46 114.25 2wnu n PHE 90 Ca 0.00 -0.65 -0.29 0.00 -0.05 0.00 0.00 57.45 56.46 2wnu n PHE 90 Cb 0.00 -0.37 -0.10 0.00 -0.94 0.00 0.00 39.48 38.07 2wnu n PHE 90 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2wnu s GLN 91 N -2.27 2.04 -0.13 -1.08 -1.52 -1.26 -5.00 119.66 110.44 2wnu s GLN 91 Ca 0.52 -2.17 -0.06 0.00 -1.95 0.00 0.00 55.36 51.70 2wnu s GLN 91 Cb 0.37 -1.63 0.06 0.00 -0.22 0.00 0.00 33.01 31.58 2wnu s GLN 91 CO 0.20 -0.14 0.29 0.45 -0.25 0.00 0.00 175.29 175.84 2wnu s SER 92 N -3.77 -0.00 -0.11 5.90 0.15 -1.26 -4.93 113.70 109.67 2wnu s SER 92 Ca 0.28 0.65 -0.19 0.00 0.70 0.00 0.00 55.95 57.39 2wnu s SER 92 Cb 0.07 0.69 0.04 0.00 -1.71 0.00 0.00 66.02 65.12 2wnu s SER 92 CO 0.14 -0.21 0.47 0.54 1.20 0.00 0.00 173.24 175.38 2wnu s VAL 93 N 1.97 0.02 -0.08 4.45 0.11 -1.26 -0.46 120.40 125.15 2wnu s VAL 93 Ca -0.04 -0.13 -0.25 0.00 -2.93 0.00 0.00 61.98 58.63 2wnu s VAL 93 Cb -0.11 -0.71 0.06 0.00 -1.53 0.00 0.00 36.38 34.08 2wnu s VAL 93 CO -0.09 -0.07 0.57 0.72 -3.33 0.00 0.00 175.10 172.90 2wnu s PHE 94 N -0.41 -0.54 -0.14 1.54 -0.12 -0.39 -4.06 117.98 113.86 2wnu s PHE 94 Ca -0.05 1.02 -0.02 0.00 -0.05 0.00 0.00 56.93 57.82 2wnu s PHE 94 Cb -0.03 0.30 0.04 0.00 -0.63 0.00 0.00 43.02 42.70 2wnu s PHE 94 CO 0.03 -0.50 0.01 0.99 -0.05 0.00 0.00 175.22 175.70 2wnu s THR 95 N -0.93 0.54 0.21 -4.49 2.01 0.15 -1.65 115.64 111.48 2wnu s THR 95 Ca -0.09 -0.27 0.11 0.00 0.31 0.00 0.00 61.69 61.74 2wnu s THR 95 Cb -0.02 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.59 2wnu s THR 95 CO 0.07 0.04 -0.18 0.68 -0.69 0.00 0.00 174.62 174.54 2wnu s VAL 96 N 1.88 2.68 0.18 3.82 -7.23 0.11 -0.91 120.40 120.93 2wnu s VAL 96 Ca 0.02 -1.97 0.04 0.00 -1.81 0.00 0.00 61.98 58.26 2wnu s VAL 96 Cb -0.15 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.42 2wnu s VAL 96 CO -0.07 -0.17 -0.06 0.28 -0.31 0.00 0.00 175.10 174.77 2wnu s THR 97 N -1.83 1.14 -0.52 5.32 -1.32 0.26 -1.11 115.64 117.58 2wnu s THR 97 Ca 0.24 -2.06 -0.06 0.00 -1.21 0.00 0.00 61.69 58.60 2wnu s THR 97 Cb -0.08 -2.06 0.13 0.00 -1.51 0.00 0.00 72.50 68.99 2wnu s THR 97 CO 0.13 -0.57 0.36 -0.60 -2.21 0.00 0.00 174.62 171.73 2wnu s ARG 98 N -3.79 2.45 -0.96 7.08 3.52 -1.00 -1.78 118.95 124.47 2wnu s ARG 98 Ca 0.22 -2.02 -0.10 0.00 -0.13 0.00 0.00 55.73 53.70 2wnu s ARG 98 Cb 0.04 -3.82 0.24 0.00 -1.56 0.00 0.00 34.95 29.85 2wnu s ARG 98 CO 0.04 -1.16 0.91 -1.14 -0.81 0.00 0.00 175.30 173.14 2wnu s GLN 99 N 0.87 3.81 -0.04 5.12 0.74 -1.26 -4.64 119.66 124.26 2wnu s GLN 99 Ca 0.10 -2.88 -0.29 0.00 0.05 0.00 0.00 55.36 52.34 2wnu s GLN 99 Cb -0.23 -4.42 0.09 0.00 1.10 0.00 0.00 33.01 29.55 2wnu s GLN 99 CO -0.03 -1.26 0.77 -0.08 -0.55 0.00 0.00 175.29 174.14 2wnu s THR 100 N -0.63 0.00 -0.41 -0.34 -1.32 -1.26 -4.96 115.64 106.72 2wnu s THR 100 Ca 0.25 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.95 2wnu s THR 100 Cb -0.10 -1.00 -0.12 0.00 -1.51 0.00 0.00 72.50 69.76 2wnu s THR 100 CO -0.09 0.00 0.93 1.57 -2.21 0.00 0.00 174.62 174.83 2wnu n HIS 101 N 0.54 0.40 -2.91 9.09 -0.00 -1.26 -4.85 115.22 116.23 2wnu n HIS 101 Ca -0.15 0.12 -0.41 0.00 0.46 0.00 0.00 57.72 57.73 2wnu n HIS 101 Cb 0.59 -0.58 -0.04 0.00 -0.12 0.00 0.00 29.99 29.84 2wnu n HIS 101 CO 0.00 0.00 0.00 -0.65 0.46 0.00 0.00 176.34 176.15 2wnu s GLN 102 N -3.30 4.38 0.86 1.57 -0.21 -1.26 -4.80 119.66 116.90 2wnu s GLN 102 Ca 0.01 1.03 -0.12 0.00 0.02 0.00 0.00 55.36 56.30 2wnu s GLN 102 Cb 0.13 -3.52 0.11 0.00 1.00 0.00 0.00 33.01 30.73 2wnu s GLN 102 CO 0.82 -0.16 1.10 -1.25 -2.12 0.00 0.00 175.29 173.68 2wnu s PRO 103 N 1.54 1.57 0.72 2.91 0.04 -1.26 -5.00 135.00 135.52 2wnu s PRO 103 Ca 0.40 0.62 -0.16 0.00 0.04 0.00 0.00 61.00 61.91 2wnu s PRO 103 Cb -0.18 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.54 2wnu s PRO 103 CO 0.17 -1.98 1.24 -2.14 0.04 0.00 0.00 177.00 174.33 2wnu s PRO 104 N -5.10 2.13 0.61 0.56 0.02 -1.26 -4.99 135.00 126.98 2wnu s PRO 104 Ca 0.62 1.88 -0.19 0.00 0.02 0.00 0.00 61.00 63.33 2wnu s PRO 104 Cb -0.16 -1.82 -0.03 0.00 0.02 0.00 0.00 34.50 32.52 2wnu s PRO 104 CO 0.55 -1.87 1.31 0.00 -0.33 0.00 0.00 177.00 176.66 2wnu s ALA 105 N -1.81 2.53 0.57 -1.55 0.00 -1.26 -4.84 121.76 115.40 2wnu s ALA 105 Ca 0.77 1.24 -0.21 0.00 0.00 0.00 0.00 51.96 53.76 2wnu s ALA 105 Cb -0.32 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.21 2wnu s ALA 105 CO 0.45 -1.49 1.35 -2.14 0.00 0.00 0.00 175.76 173.92 2wnu s PRO 106 N -3.22 3.01 -1.34 0.00 0.02 -1.26 -3.54 135.00 128.67 2wnu s PRO 106 Ca 0.79 2.20 -0.02 0.00 0.02 0.00 0.00 61.00 63.99 2wnu s PRO 106 Cb -0.38 -2.17 -0.00 0.00 0.02 0.00 0.00 34.50 31.97 2wnu s PRO 106 CO 0.42 -1.28 0.57 0.09 -0.33 0.00 0.00 177.00 176.46 2wnu n ASN 107 N -1.22 -1.11 -4.05 2.53 3.02 0.73 -4.98 115.26 110.19 2wnu n ASN 107 Ca 0.12 -0.93 -0.10 0.00 -0.03 0.00 0.00 54.58 53.64 2wnu n ASN 107 Cb 0.46 -3.51 -0.08 0.00 -0.61 0.00 0.00 39.78 36.03 2wnu n ASN 107 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wnu s SER 108 N -4.29 0.15 0.34 6.41 1.04 -1.19 -4.97 113.70 111.19 2wnu s SER 108 Ca 0.04 -1.03 -0.29 0.00 0.48 0.00 0.00 55.95 55.16 2wnu s SER 108 Cb -0.01 0.38 -0.11 0.00 0.10 0.00 0.00 66.02 66.38 2wnu s SER 108 CO 0.85 -0.83 1.39 -0.22 0.98 0.00 0.00 173.24 175.41 2wnu s LEU 109 N -3.01 4.38 -0.25 2.42 0.20 -1.26 -1.52 118.68 119.64 2wnu s LEU 109 Ca 0.21 2.82 -0.17 0.00 0.69 0.00 0.00 54.13 57.67 2wnu s LEU 109 Cb 0.05 -3.65 -0.03 0.00 -0.43 0.00 0.00 46.19 42.13 2wnu s LEU 109 CO 0.01 -0.67 0.49 -0.63 -0.29 0.00 0.00 176.35 175.26 2wnu s ILE 110 N -1.00 5.10 -0.30 6.68 1.01 -0.37 -4.89 121.20 127.44 2wnu s ILE 110 Ca 0.52 0.84 -0.14 0.00 0.00 0.00 0.00 60.65 61.86 2wnu s ILE 110 Cb -0.42 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.21 2wnu s ILE 110 CO 0.55 0.12 0.31 -0.13 0.00 0.00 0.00 174.94 175.79 2wnu s ARG 111 N 2.13 3.84 -0.44 2.79 0.52 -1.26 -4.70 118.95 121.83 2wnu s ARG 111 Ca 0.20 -0.23 -0.19 0.00 -0.52 0.00 0.00 55.73 54.99 2wnu s ARG 111 Cb -0.16 -3.71 0.03 0.00 0.52 0.00 0.00 34.95 31.63 2wnu s ARG 111 CO 0.09 -0.33 0.56 -0.06 0.02 0.00 0.00 175.30 175.59 2wnu s PHE 112 N 1.95 3.10 -0.64 -0.53 0.40 -1.26 -4.83 117.98 116.18 2wnu s PHE 112 Ca 0.11 -0.24 0.24 0.00 -0.60 0.00 0.00 56.93 56.44 2wnu s PHE 112 Cb -0.16 -3.21 0.29 0.00 0.51 0.00 0.00 43.02 40.46 2wnu s PHE 112 CO 0.11 -0.83 1.27 0.27 0.70 0.00 0.00 175.22 176.74 2wnu n ASN 113 N 6.01 0.68 -4.24 1.36 6.94 -0.88 -4.63 115.26 120.51 2wnu n ASN 113 Ca -0.04 0.06 -0.29 0.00 -0.02 0.00 0.00 54.58 54.29 2wnu n ASN 113 Cb 0.47 0.27 -0.16 0.00 -2.36 0.00 0.00 39.78 38.01 2wnu n ASN 113 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wnu s ALA 114 N -3.17 1.89 -0.20 -2.53 0.00 -0.73 -4.96 121.76 112.06 2wnu s ALA 114 Ca 0.06 -0.95 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 2wnu s ALA 114 Cb 0.14 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 2wnu s ALA 114 CO 0.73 0.42 0.05 0.08 0.00 0.00 0.00 175.76 177.05 2wnu s VAL 115 N -0.36 4.56 -0.16 0.00 1.01 -1.26 0.92 120.40 125.11 2wnu s VAL 115 Ca 0.04 -0.11 -0.16 0.00 0.00 0.00 0.00 61.98 61.75 2wnu s VAL 115 Cb -0.10 -3.07 -0.23 0.00 0.00 0.00 0.00 36.38 32.97 2wnu s VAL 115 CO 0.01 0.43 0.36 -0.07 0.00 0.00 0.00 175.10 175.82 2wnu h LEU 116 N 7.16 0.20 -7.22 3.92 3.38 -1.38 -3.48 115.31 117.89 2wnu h LEU 116 Ca -0.36 -0.73 -0.09 0.00 0.09 0.00 0.00 57.88 56.79 2wnu h LEU 116 Cb 1.17 -0.07 -0.22 0.00 0.09 0.00 0.00 40.66 41.64 2wnu h LEU 116 CO 0.65 1.61 -0.09 0.28 0.09 0.00 0.00 178.44 180.98 2wnu s THR 117 N -2.44 0.01 -0.36 0.22 -1.32 -1.01 -4.98 115.64 105.77 2wnu s THR 117 Ca -0.25 -0.08 0.05 0.00 -1.21 0.00 0.00 61.69 60.21 2wnu s THR 117 Cb 0.05 -0.75 0.32 0.00 -1.51 0.00 0.00 72.50 70.61 2wnu s THR 117 CO 0.68 -0.04 1.32 -3.20 -2.21 0.00 0.00 174.62 171.17 2wnu n ASN 118 N 2.28 -1.50 0.24 8.08 5.15 -1.26 -0.68 115.26 127.57 2wnu n ASN 118 Ca -0.16 -2.31 0.11 0.00 -0.60 0.00 0.00 54.58 51.63 2wnu n ASN 118 Cb 0.56 1.34 0.58 0.00 -0.53 0.00 0.00 39.78 41.73 2wnu n ASN 118 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2wnu h PRO 119 N 2.33 0.00 0.00 1.20 0.13 -2.00 -2.27 132.00 131.39 2wnu h PRO 119 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2wnu h PRO 119 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2wnu h PRO 119 CO 0.02 0.18 -0.80 1.04 -0.23 0.00 0.00 178.00 178.20 2wnu n GLN 120 N -3.47 0.09 -1.90 0.86 3.00 -1.26 -4.96 117.38 109.74 2wnu n GLN 120 Ca -0.01 -0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.88 2wnu n GLN 120 Cb 0.35 -1.53 -0.02 0.00 0.00 0.00 0.00 30.24 29.04 2wnu n GLN 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2wnu n GLY 121 N 1.46 0.35 0.19 1.08 0.00 -0.86 -4.95 105.19 102.46 2wnu n GLY 121 Ca 0.04 -0.50 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 2wnu n GLY 121 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wnu h ASP 122 N 0.00 0.57 -3.36 1.61 3.32 -1.87 -3.39 116.42 113.29 2wnu h ASP 122 Ca -0.23 -0.35 -0.56 0.00 0.02 0.00 0.00 57.03 55.91 2wnu h ASP 122 Cb 1.00 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 40.33 2wnu h ASP 122 CO 0.29 1.09 0.22 -0.47 -1.72 0.00 0.00 179.24 178.64 2wnu s TYR 123 N -3.73 3.54 -0.34 4.55 5.04 -1.26 -1.01 117.35 124.14 2wnu s TYR 123 Ca -0.07 1.32 -0.11 0.00 -2.44 0.00 0.00 57.07 55.78 2wnu s TYR 123 Cb 0.10 -2.91 0.00 0.00 0.35 0.00 0.00 41.96 39.50 2wnu s TYR 123 CO 0.85 -0.02 0.19 0.34 -1.34 0.00 0.00 175.55 175.56 2wnu s ASP 124 N 0.94 5.70 0.53 4.32 -1.08 0.55 -4.97 116.67 122.68 2wnu s ASP 124 Ca 0.40 -0.67 0.32 0.00 -0.52 0.00 0.00 52.55 52.08 2wnu s ASP 124 Cb -0.18 -2.04 1.32 0.00 -1.46 0.00 0.00 42.92 40.57 2wnu s ASP 124 CO 0.18 -0.27 1.97 0.71 0.52 0.00 0.00 175.17 178.28 2wnu h THR 125 N 5.70 0.12 0.00 1.71 1.35 -1.86 0.32 112.91 120.25 2wnu h THR 125 Ca -0.30 -0.61 -0.10 0.00 -0.55 0.00 0.00 66.41 64.85 2wnu h THR 125 Cb 1.13 1.54 -0.02 0.00 -1.73 0.00 0.00 68.15 69.07 2wnu h THR 125 CO 0.64 0.04 -0.65 0.77 -0.25 0.00 0.00 175.52 176.07 2wnu h SER 126 N 0.00 0.00 0.00 5.36 4.64 -1.93 -3.36 113.55 118.26 2wnu h SER 126 Ca -0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 2wnu h SER 126 Cb 0.53 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.59 2wnu h SER 126 CO 0.01 0.46 -1.84 0.35 -0.87 0.00 0.00 176.83 174.94 2wnu n THR 127 N -3.13 0.55 -0.63 2.95 -2.24 -1.11 -5.01 114.28 105.66 2wnu n THR 127 Ca 0.00 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2wnu n THR 127 Cb 0.73 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2wnu n THR 127 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wnu n GLY 128 N 1.95 0.68 3.49 3.38 0.00 0.11 -4.96 105.19 109.83 2wnu n GLY 128 Ca -0.14 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 2wnu n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnu s LYS 129 N -0.42 2.42 0.07 1.61 1.02 -1.15 -4.68 119.74 118.61 2wnu s LYS 129 Ca 0.00 -0.76 -0.24 0.00 0.02 0.00 0.00 55.97 54.99 2wnu s LYS 129 Cb 0.00 -2.35 -0.06 0.00 -0.52 0.00 0.00 37.83 34.89 2wnu s LYS 129 CO 0.00 0.60 0.74 0.12 -0.92 0.00 0.00 175.35 175.89 2wnu s PHE 130 N -0.81 3.78 -0.13 3.18 5.36 0.09 -0.33 117.98 129.13 2wnu s PHE 130 Ca 0.13 1.48 0.01 0.00 -0.96 0.00 0.00 56.93 57.58 2wnu s PHE 130 Cb -0.11 -2.76 0.02 0.00 -0.34 0.00 0.00 43.02 39.83 2wnu s PHE 130 CO 0.02 0.37 -0.14 0.99 -1.46 0.00 0.00 175.22 175.01 2wnu s THR 131 N -0.44 1.45 -0.01 0.12 2.01 -0.18 -0.89 115.64 117.70 2wnu s THR 131 Ca 0.36 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.48 2wnu s THR 131 Cb -0.21 -1.36 -0.07 0.00 0.01 0.00 0.00 72.50 70.86 2wnu s THR 131 CO 0.23 0.44 1.85 0.00 -0.69 0.00 0.00 174.62 176.44 2wnu n LYS 133 N 7.42 0.67 -3.75 0.00 5.02 -1.26 0.57 118.16 126.83 2wnu n LYS 133 Ca 0.19 0.22 -0.38 0.00 -2.02 0.00 0.00 58.31 56.33 2wnu n LYS 133 Cb 0.42 -1.59 -0.12 0.00 -0.02 0.00 0.00 35.03 33.72 2wnu n LYS 133 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wnu s VAL 134 N -2.52 3.77 0.69 -0.18 1.01 -1.26 -4.83 120.40 117.07 2wnu s VAL 134 Ca -0.31 -1.18 -0.16 0.00 0.00 0.00 0.00 61.98 60.33 2wnu s VAL 134 Cb 0.09 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.32 2wnu s VAL 134 CO 0.64 -0.21 1.19 -2.16 0.00 0.00 0.00 175.10 174.56 2wnu s PRO 135 N 1.39 2.45 0.00 2.72 0.04 -1.26 -4.94 135.00 135.40 2wnu s PRO 135 Ca -0.01 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2wnu s PRO 135 Cb -0.20 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2wnu s PRO 135 CO 0.02 -1.58 0.00 0.41 0.04 0.00 0.00 177.00 175.89 2wnu n GLY 136 N 0.24 0.98 3.65 0.56 0.00 -0.16 -2.24 105.19 108.22 2wnu n GLY 136 Ca 0.13 -1.90 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 2wnu n GLY 136 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wnu s LEU 137 N 0.00 4.12 0.04 0.99 2.96 -0.09 -0.39 118.68 126.31 2wnu s LEU 137 Ca 0.00 0.86 0.07 0.00 -0.22 0.00 0.00 54.13 54.84 2wnu s LEU 137 Cb 0.00 -2.95 -0.03 0.00 0.50 0.00 0.00 46.19 43.71 2wnu s LEU 137 CO 0.00 -0.33 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.22 2wnu s TYR 138 N 2.15 2.58 -0.16 5.38 1.51 0.64 -0.01 117.35 129.44 2wnu s TYR 138 Ca 0.30 -0.24 -0.06 0.00 -1.01 0.00 0.00 57.07 56.06 2wnu s TYR 138 Cb -0.16 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.19 2wnu s TYR 138 CO 0.10 0.27 0.02 -0.47 -1.11 0.00 0.00 175.55 174.36 2wnu s TYR 139 N -0.94 3.17 -0.05 2.71 5.04 -0.64 -0.69 117.35 125.95 2wnu s TYR 139 Ca 0.15 -0.03 0.06 0.00 -2.44 0.00 0.00 57.07 54.80 2wnu s TYR 139 Cb -0.11 -2.00 -0.01 0.00 0.35 0.00 0.00 41.96 40.19 2wnu s TYR 139 CO 0.06 0.14 -0.23 -0.06 -1.34 0.00 0.00 175.55 174.11 2wnu s PHE 140 N 0.20 2.29 -0.12 4.97 0.40 -0.26 -1.33 117.98 124.13 2wnu s PHE 140 Ca 0.02 -0.68 -0.16 0.00 -0.60 0.00 0.00 56.93 55.51 2wnu s PHE 140 Cb -0.13 -1.51 0.04 0.00 0.51 0.00 0.00 43.02 41.94 2wnu s PHE 140 CO 0.01 -0.21 0.42 0.54 0.70 0.00 0.00 175.22 176.68 2wnu s VAL 141 N -0.12 0.01 0.06 -0.44 0.11 -0.21 -0.96 120.40 118.84 2wnu s VAL 141 Ca -0.04 -0.11 0.01 0.00 -2.93 0.00 0.00 61.98 58.91 2wnu s VAL 141 Cb -0.13 -0.63 -0.03 0.00 -1.53 0.00 0.00 36.38 34.06 2wnu s VAL 141 CO 0.03 -0.06 -0.06 -0.72 -3.33 0.00 0.00 175.10 170.97 2wnu s TYR 142 N -0.23 0.63 -0.16 1.54 -0.85 -0.77 -0.01 117.35 117.50 2wnu s TYR 142 Ca -0.04 -0.72 -0.02 0.00 -0.52 0.00 0.00 57.07 55.77 2wnu s TYR 142 Cb -0.03 -0.39 0.05 0.00 0.38 0.00 0.00 41.96 41.96 2wnu s TYR 142 CO 0.02 -0.17 0.01 -1.01 -1.52 0.00 0.00 175.55 172.88 2wnu s HIS 143 N -2.48 1.06 -0.16 -3.49 3.76 -0.39 -2.82 115.29 110.77 2wnu s HIS 143 Ca -0.02 -0.75 0.01 0.00 -0.15 0.00 0.00 55.06 54.15 2wnu s HIS 143 Cb -0.02 -1.03 0.01 0.00 1.11 0.00 0.00 32.58 32.65 2wnu s HIS 143 CO -0.03 -0.55 -0.17 0.00 -0.85 0.00 0.00 174.74 173.13 2wnu s ALA 144 N 1.85 2.41 0.06 -1.40 0.00 0.19 -0.69 121.76 124.17 2wnu s ALA 144 Ca 0.01 -1.11 -0.22 0.00 0.00 0.00 0.00 51.96 50.63 2wnu s ALA 144 Cb -0.16 -1.19 -0.06 0.00 0.00 0.00 0.00 23.12 21.71 2wnu s ALA 144 CO -0.07 -0.15 0.67 -1.12 0.00 0.00 0.00 175.76 175.09 2wnu s SER 145 N 0.99 7.14 -0.03 0.00 0.01 -1.20 0.51 113.70 121.11 2wnu s SER 145 Ca -0.02 1.35 -0.14 0.00 1.31 0.00 0.00 55.95 58.45 2wnu s SER 145 Cb -0.15 -2.42 0.02 0.00 0.21 0.00 0.00 66.02 63.69 2wnu s SER 145 CO -0.04 0.13 0.30 -1.38 0.41 0.00 0.00 173.24 172.66 2wnu s HIS 146 N -0.50 -0.20 -0.66 2.43 -3.43 -0.60 -3.66 115.29 108.67 2wnu s HIS 146 Ca 0.34 0.35 0.06 0.00 -0.80 0.00 0.00 55.06 55.01 2wnu s HIS 146 Cb -0.20 0.09 0.12 0.00 -1.43 0.00 0.00 32.58 31.17 2wnu s HIS 146 CO 0.21 -0.35 0.96 0.25 -2.00 0.00 0.00 174.74 173.81 2wnu n THR 147 N 1.57 0.57 -4.12 -5.38 -2.24 -1.04 -1.82 114.28 101.82 2wnu n THR 147 Ca -0.20 -0.78 -0.14 0.00 -2.27 0.00 0.00 64.05 60.65 2wnu n THR 147 Cb 0.56 0.78 -0.05 0.00 -2.10 0.00 0.00 70.33 69.52 2wnu n THR 147 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wnu n ALA 148 N 0.21 0.24 -1.64 6.98 0.00 -1.26 -2.34 120.51 122.71 2wnu n ALA 148 Ca 0.05 -1.46 -0.45 0.00 0.00 0.00 0.00 53.44 51.58 2wnu n ALA 148 Cb 0.27 1.18 -0.02 0.00 0.00 0.00 0.00 19.45 20.88 2wnu n ALA 148 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wnu n ASN 149 N -1.86 2.19 -3.68 0.00 4.13 -1.25 -4.43 115.26 110.36 2wnu n ASN 149 Ca 0.04 1.16 -0.15 0.00 1.68 0.00 0.00 54.58 57.31 2wnu n ASN 149 Cb 0.48 -1.36 -0.15 0.00 -1.54 0.00 0.00 39.78 37.21 2wnu n ASN 149 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2wnu s LEU 150 N 0.12 -0.04 -0.17 3.41 2.96 0.11 -2.65 118.68 122.41 2wnu s LEU 150 Ca 0.66 0.42 -0.03 0.00 -0.22 0.00 0.00 54.13 54.95 2wnu s LEU 150 Cb -0.69 0.44 -0.02 0.00 0.50 0.00 0.00 46.19 46.41 2wnu s LEU 150 CO 0.54 -0.23 -0.05 0.00 -1.32 0.00 0.00 176.35 175.29 2wnu s VAL 152 N 0.71 3.16 -0.09 0.00 1.01 -0.01 -3.84 120.40 121.34 2wnu s VAL 152 Ca -0.02 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.35 2wnu s VAL 152 Cb -0.15 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 2wnu s VAL 152 CO 0.02 0.53 -0.17 -0.76 0.00 0.00 0.00 175.10 174.72 2wnu s LEU 153 N 0.17 2.51 -0.21 3.92 1.02 -0.10 -1.44 118.68 124.56 2wnu s LEU 153 Ca -0.07 -0.36 -0.09 0.00 0.02 0.00 0.00 54.13 53.64 2wnu s LEU 153 Cb -0.15 -1.52 -0.04 0.00 0.02 0.00 0.00 46.19 44.50 2wnu s LEU 153 CO 0.05 0.23 0.11 -0.22 0.02 0.00 0.00 176.35 176.53 2wnu s LEU 154 N -0.07 3.94 -0.10 1.79 0.20 -0.33 0.06 118.68 124.18 2wnu s LEU 154 Ca -0.04 0.09 -0.01 0.00 0.69 0.00 0.00 54.13 54.86 2wnu s LEU 154 Cb -0.14 -2.03 -0.03 0.00 -0.43 0.00 0.00 46.19 43.56 2wnu s LEU 154 CO 0.04 0.12 -0.06 -0.31 -0.29 0.00 0.00 176.35 175.85 2wnu s TYR 155 N 0.70 2.96 -0.19 5.38 1.51 0.14 -0.43 117.35 127.41 2wnu s TYR 155 Ca 0.06 -0.15 0.01 0.00 -1.01 0.00 0.00 57.07 55.98 2wnu s TYR 155 Cb -0.13 -1.81 0.03 0.00 -0.11 0.00 0.00 41.96 39.95 2wnu s TYR 155 CO 0.01 0.16 -0.14 0.50 -1.11 0.00 0.00 175.55 174.97 2wnu s ARG 156 N -0.31 2.39 -1.49 -0.62 3.52 0.66 -1.64 118.95 121.46 2wnu s ARG 156 Ca 0.04 -0.83 -0.09 0.00 -0.13 0.00 0.00 55.73 54.72 2wnu s ARG 156 Cb -0.13 -2.44 0.06 0.00 -1.56 0.00 0.00 34.95 30.89 2wnu s ARG 156 CO 0.02 -0.34 0.77 0.43 -0.81 0.00 0.00 175.30 175.38 2wnu n SER 157 N 4.66 -2.82 0.00 -2.12 7.64 0.58 -1.56 113.62 120.00 2wnu n SER 157 Ca -0.17 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 58.84 2wnu n SER 157 Cb 0.48 -3.55 0.00 0.00 -1.01 0.00 0.00 64.21 60.12 2wnu n SER 157 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wnu n GLY 158 N -1.67 1.06 3.39 0.23 0.00 -1.26 -5.02 105.19 101.92 2wnu n GLY 158 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 2wnu n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wnu s VAL 159 N -2.59 3.53 -0.01 1.61 1.01 -0.60 -5.08 120.40 118.28 2wnu s VAL 159 Ca 0.00 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 2wnu s VAL 159 Cb 0.00 -2.57 -0.07 0.00 0.00 0.00 0.00 36.38 33.74 2wnu s VAL 159 CO 0.00 0.46 1.78 -0.75 0.00 0.00 0.00 175.10 176.59 2wnu s LYS 160 N 0.87 4.17 -0.23 2.72 2.20 -1.26 -0.25 119.74 127.96 2wnu s LYS 160 Ca -0.01 2.36 -0.14 0.00 -0.36 0.00 0.00 55.97 57.82 2wnu s LYS 160 Cb -0.15 -4.03 -0.17 0.00 -1.51 0.00 0.00 37.83 31.97 2wnu s LYS 160 CO 0.01 -0.88 -0.01 0.28 -0.36 0.00 0.00 175.35 174.39 2wnu n VAL 161 N 5.46 1.56 -3.71 4.02 0.31 0.43 -4.94 118.33 121.47 2wnu n VAL 161 Ca 0.18 -0.30 -0.14 0.00 -0.01 0.00 0.00 64.34 64.07 2wnu n VAL 161 Cb 0.42 -1.88 -0.09 0.00 -0.91 0.00 0.00 33.84 31.39 2wnu n VAL 161 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2wnu s VAL 162 N -2.46 0.03 -0.03 2.52 -7.23 -1.23 -5.01 120.40 106.99 2wnu s VAL 162 Ca -0.32 -0.23 0.04 0.00 -1.81 0.00 0.00 61.98 59.65 2wnu s VAL 162 Cb 0.09 -0.68 -0.00 0.00 0.56 0.00 0.00 36.38 36.35 2wnu s VAL 162 CO 0.58 -0.13 -0.13 -0.89 -0.31 0.00 0.00 175.10 174.23 2wnu s THR 163 N -0.76 1.08 -0.05 5.32 2.01 -1.26 -1.18 115.64 120.79 2wnu s THR 163 Ca -0.08 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 61.38 2wnu s THR 163 Cb -0.04 -0.93 0.02 0.00 0.01 0.00 0.00 72.50 71.57 2wnu s THR 163 CO 0.04 0.32 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.89 2wnu s PHE 164 N 0.00 0.78 -0.04 4.92 0.40 -0.52 -4.99 117.98 118.53 2wnu s PHE 164 Ca -0.01 -0.23 0.07 0.00 -0.60 0.00 0.00 56.93 56.16 2wnu s PHE 164 Cb -0.09 -0.72 -0.02 0.00 0.51 0.00 0.00 43.02 42.71 2wnu s PHE 164 CO 0.01 -0.23 -0.25 0.00 0.70 0.00 0.00 175.22 175.44 2wnu s GLY 166 N -0.40 0.99 -0.17 0.00 0.00 0.11 -4.96 107.32 102.89 2wnu s GLY 166 Ca 0.04 -0.70 -0.04 0.00 0.00 0.00 0.00 44.72 44.02 2wnu s GLY 166 CO 0.01 -0.25 -0.02 0.30 0.00 0.00 0.00 173.10 173.14 2wnu s HIS 167 N 0.23 3.05 0.05 1.90 3.76 -1.26 -0.71 115.29 122.32 2wnu s HIS 167 Ca -0.09 -0.28 -0.06 0.00 -0.15 0.00 0.00 55.06 54.48 2wnu s HIS 167 Cb -0.14 -1.99 -0.01 0.00 1.11 0.00 0.00 32.58 31.55 2wnu s HIS 167 CO 0.04 -0.04 0.11 -0.08 -0.85 0.00 0.00 174.74 173.92 2wnu s THR 168 N 0.46 0.15 -0.22 1.30 -1.32 -1.26 -4.96 115.64 109.79 2wnu s THR 168 Ca -0.02 -1.21 -0.00 0.00 -1.21 0.00 0.00 61.69 59.25 2wnu s THR 168 Cb -0.14 -1.11 0.06 0.00 -1.51 0.00 0.00 72.50 69.80 2wnu s THR 168 CO 0.02 -0.67 -0.03 -0.55 -2.21 0.00 0.00 174.62 171.19 2wnu s SER 169 N -2.44 3.50 0.00 8.08 0.15 -1.26 -3.77 113.70 117.96 2wnu s SER 169 Ca -0.01 -1.03 0.00 0.00 0.70 0.00 0.00 55.95 55.62 2wnu s SER 169 Cb 0.02 -1.01 0.00 0.00 -1.71 0.00 0.00 66.02 63.32 2wnu s SER 169 CO -0.07 -0.25 0.00 0.29 1.20 0.00 0.00 173.24 174.41 2wnu n LYS 170 N 4.79 0.00 -1.71 5.44 5.02 -0.99 -4.92 118.16 125.79 2wnu n LYS 170 Ca -0.11 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.87 2wnu n LYS 170 Cb 0.45 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.51 2wnu n LYS 170 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2wnu s THR 171 N 0.00 3.78 -0.09 -0.18 -4.23 -1.26 -4.80 115.64 108.85 2wnu s THR 171 Ca 0.00 0.58 -0.11 0.00 -1.18 0.00 0.00 61.69 60.97 2wnu s THR 171 Cb 0.00 -3.44 -0.05 0.00 1.34 0.00 0.00 72.50 70.35 2wnu s THR 171 CO 0.00 -0.75 0.26 0.21 -0.54 0.00 0.00 174.62 173.80 2wnu s ASN 172 N -4.06 6.53 0.31 3.99 2.47 -1.26 -4.31 114.94 118.62 2wnu s ASN 172 Ca 0.58 0.63 0.06 0.00 0.42 0.00 0.00 52.86 54.55 2wnu s ASN 172 Cb -0.13 -2.16 -0.03 0.00 -1.45 0.00 0.00 41.25 37.48 2wnu s ASN 172 CO 0.54 0.30 0.24 -1.10 -3.72 0.00 0.00 177.10 173.35 2wnu s GLN 173 N -0.62 1.67 -0.15 0.43 -0.21 -0.75 -4.99 119.66 115.04 2wnu s GLN 173 Ca 0.18 -1.96 0.02 0.00 0.02 0.00 0.00 55.36 53.61 2wnu s GLN 173 Cb -0.14 0.22 0.01 0.00 1.00 0.00 0.00 33.01 34.11 2wnu s GLN 173 CO 0.07 -0.58 -0.20 0.08 -2.12 0.00 0.00 175.29 172.53 2wnu s VAL 174 N -3.55 2.17 -0.13 1.09 1.01 -1.26 -1.55 120.40 118.17 2wnu s VAL 174 Ca 0.39 -0.93 -0.16 0.00 0.00 0.00 0.00 61.98 61.27 2wnu s VAL 174 Cb 0.03 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2wnu s VAL 174 CO 0.24 0.54 0.40 0.21 0.00 0.00 0.00 175.10 176.49 2wnu s ASN 175 N 0.93 6.59 0.05 3.32 3.84 0.18 -4.88 114.94 124.97 2wnu s ASN 175 Ca -0.04 0.69 0.05 0.00 0.21 0.00 0.00 52.86 53.78 2wnu s ASN 175 Cb -0.15 -2.24 -0.02 0.00 -0.55 0.00 0.00 41.25 38.28 2wnu s ASN 175 CO -0.04 0.04 -0.15 -0.55 -2.79 0.00 0.00 177.10 173.61 2wnu s SER 176 N 0.54 1.76 0.23 -4.21 0.15 -1.26 0.55 113.70 111.46 2wnu s SER 176 Ca 0.22 -0.49 -0.22 0.00 0.70 0.00 0.00 55.95 56.16 2wnu s SER 176 Cb -0.14 -0.11 0.04 0.00 -1.71 0.00 0.00 66.02 64.10 2wnu s SER 176 CO 0.08 0.03 0.70 -0.83 1.20 0.00 0.00 173.24 174.42 2wnu s GLY 177 N -1.24 -0.28 0.00 9.45 0.00 -1.13 -4.91 107.32 109.22 2wnu s GLY 177 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 44.72 44.74 2wnu s GLY 177 CO 0.02 0.00 0.00 0.61 0.00 0.00 0.00 173.10 173.73 2wnu n GLY 178 N -0.43 0.68 3.58 0.20 0.00 -1.26 -1.85 105.19 106.11 2wnu n GLY 178 Ca -0.08 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.13 2wnu n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnu s VAL 179 N -2.00 0.00 -0.20 1.61 0.11 -0.14 -4.99 120.40 114.79 2wnu s VAL 179 Ca 0.00 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 58.96 2wnu s VAL 179 Cb 0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 2wnu s VAL 179 CO 0.00 0.00 0.11 -0.76 -3.33 0.00 0.00 175.10 171.12 2wnu s LEU 180 N -1.10 4.03 -0.02 2.54 1.43 -1.26 -1.10 118.68 123.21 2wnu s LEU 180 Ca -0.02 0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 2wnu s LEU 180 Cb -0.00 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.18 2wnu s LEU 180 CO 0.02 0.15 -0.04 -0.76 0.23 0.00 0.00 176.35 175.95 2wnu s LEU 181 N 0.55 1.67 -0.47 1.79 1.43 0.13 -4.96 118.68 118.82 2wnu s LEU 181 Ca 0.06 -0.09 -0.20 0.00 -1.03 0.00 0.00 54.13 52.87 2wnu s LEU 181 Cb -0.12 -0.31 0.03 0.00 0.03 0.00 0.00 46.19 45.82 2wnu s LEU 181 CO 0.00 0.00 0.65 -0.60 0.23 0.00 0.00 176.35 176.63 2wnu s ARG 182 N 0.37 3.22 0.01 1.70 3.52 -1.26 -0.26 118.95 126.25 2wnu s ARG 182 Ca -0.04 -0.54 0.01 0.00 -0.13 0.00 0.00 55.73 55.04 2wnu s ARG 182 Cb -0.08 -4.00 -0.04 0.00 -1.56 0.00 0.00 34.95 29.28 2wnu s ARG 182 CO -0.00 -1.10 0.02 -0.51 -0.81 0.00 0.00 175.30 172.90 2wnu s LEU 183 N 2.81 3.61 0.31 -0.88 1.43 0.48 -4.92 118.68 121.51 2wnu s LEU 183 Ca 0.20 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 2wnu s LEU 183 Cb -0.16 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 2wnu s LEU 183 CO 0.17 0.27 0.49 -1.10 0.23 0.00 0.00 176.35 176.40 2wnu s GLN 184 N -1.68 3.48 0.12 1.70 1.11 -1.26 -0.99 119.66 122.14 2wnu s GLN 184 Ca 0.21 -0.45 -0.34 0.00 0.01 0.00 0.00 55.36 54.80 2wnu s GLN 184 Cb -0.12 -2.74 -0.13 0.00 -1.01 0.00 0.00 33.01 29.02 2wnu s GLN 184 CO 0.12 0.24 1.66 0.28 0.01 0.00 0.00 175.29 177.60 2wnu n VAL 185 N -1.60 0.12 -0.10 1.09 0.31 -1.26 -2.24 118.33 114.65 2wnu n VAL 185 Ca -0.06 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2wnu n VAL 185 Cb 0.56 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.82 2wnu n VAL 185 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wnu n GLY 186 N 3.67 0.90 3.73 2.92 0.00 0.19 -5.00 105.19 111.61 2wnu n GLY 186 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2wnu n GLY 186 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wnu s GLU 187 N -0.67 4.32 -0.05 1.61 2.02 -0.95 -4.66 118.70 120.32 2wnu s GLU 187 Ca 0.00 2.15 -0.14 0.00 0.02 0.00 0.00 54.97 57.00 2wnu s GLU 187 Cb 0.00 -3.19 -0.05 0.00 0.10 0.00 0.00 34.13 30.99 2wnu s GLU 187 CO 0.00 -0.39 0.38 -1.21 0.02 0.00 0.00 175.26 174.06 2wnu s GLU 188 N 0.37 4.00 -0.05 1.61 2.02 -1.26 -1.12 118.70 124.27 2wnu s GLU 188 Ca 0.61 0.32 0.03 0.00 0.02 0.00 0.00 54.97 55.96 2wnu s GLU 188 Cb -0.39 -3.28 0.01 0.00 0.10 0.00 0.00 34.13 30.57 2wnu s GLU 188 CO 0.36 0.54 -0.13 0.08 0.02 0.00 0.00 175.26 176.13 2wnu s VAL 189 N -0.57 1.15 0.16 2.63 1.01 -0.07 -0.31 120.40 124.41 2wnu s VAL 189 Ca 0.22 -0.52 -0.10 0.00 0.00 0.00 0.00 61.98 61.59 2wnu s VAL 189 Cb -0.15 -1.03 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 2wnu s VAL 189 CO 0.11 0.35 0.30 -1.66 0.00 0.00 0.00 175.10 174.19 2wnu s TRP 190 N 0.43 0.34 -0.00 5.22 -2.14 -0.65 -0.73 118.94 121.41 2wnu s TRP 190 Ca -0.10 -0.71 -0.02 0.00 2.66 0.00 0.00 56.10 57.93 2wnu s TRP 190 Cb -0.14 -0.02 -0.04 0.00 -3.10 0.00 0.00 33.47 30.17 2wnu s TRP 190 CO 0.03 -0.72 0.17 -0.51 -2.66 0.00 0.00 176.95 173.25 2wnu s LEU 191 N -2.95 4.29 0.18 -4.66 1.43 -1.26 0.24 118.68 115.95 2wnu s LEU 191 Ca 0.16 0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 53.57 2wnu s LEU 191 Cb 0.03 -2.58 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 2wnu s LEU 191 CO -0.01 0.26 0.07 0.00 0.23 0.00 0.00 176.35 176.90 2wnu s ALA 192 N -1.32 1.18 0.32 4.21 0.00 0.11 -1.23 121.76 125.03 2wnu s ALA 192 Ca 0.27 -1.62 0.09 0.00 0.00 0.00 0.00 51.96 50.70 2wnu s ALA 192 Cb -0.13 0.97 -0.04 0.00 0.00 0.00 0.00 23.12 23.92 2wnu s ALA 192 CO 0.19 -0.48 0.08 0.14 0.00 0.00 0.00 175.76 175.69 2wnu s VAL 193 N -3.95 3.04 0.00 0.00 -7.23 -0.58 -0.92 120.40 110.76 2wnu s VAL 193 Ca 0.30 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.68 2wnu s VAL 193 Cb 0.07 -2.92 0.00 0.00 0.56 0.00 0.00 36.38 34.10 2wnu s VAL 193 CO 0.07 -0.23 0.00 -0.46 -0.31 0.00 0.00 175.10 174.17 2wnu n ASN 194 N -1.05 0.00 0.18 4.85 0.23 -1.25 -3.19 115.26 115.03 2wnu n ASN 194 Ca -0.04 0.00 0.06 0.00 -0.53 0.00 0.00 54.58 54.07 2wnu n ASN 194 Cb 0.61 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.59 2wnu n ASN 194 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2wnu h ASP 195 N 0.00 0.00 -3.18 0.53 3.32 -1.94 0.21 116.42 115.36 2wnu h ASP 195 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 2wnu h ASP 195 Cb 0.00 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.38 2wnu h ASP 195 CO 0.00 0.37 0.20 -0.31 -1.72 0.00 0.00 179.24 177.78 2wnu s TYR 196 N -3.43 2.96 0.00 4.55 4.12 -1.26 -4.89 117.35 119.40 2wnu s TYR 196 Ca 0.01 -0.45 0.00 0.00 0.02 0.00 0.00 57.07 56.66 2wnu s TYR 196 Cb 0.10 -3.74 0.00 0.00 -1.52 0.00 0.00 41.96 36.80 2wnu s TYR 196 CO 0.69 -1.16 0.35 2.48 0.02 0.00 0.00 175.55 177.93 2wnu n TYR 197 N 6.57 0.00 -2.13 2.71 0.18 -1.19 -1.96 117.16 121.34 2wnu n TYR 197 Ca -0.05 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.31 2wnu n TYR 197 Cb 0.46 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.39 2wnu n TYR 197 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2wnu s ASP 198 N -0.01 6.78 -0.08 9.48 -1.08 -1.09 -4.03 116.67 126.65 2wnu s ASP 198 Ca 0.00 2.38 0.22 0.00 -0.52 0.00 0.00 52.55 54.63 2wnu s ASP 198 Cb 0.00 -2.59 0.44 0.00 -1.46 0.00 0.00 42.92 39.31 2wnu s ASP 198 CO 0.00 -0.68 1.17 0.23 0.52 0.00 0.00 175.17 176.41 2wnu n MET 199 N 3.90 0.63 -2.97 4.34 2.81 -1.26 -4.63 117.12 119.94 2wnu n MET 199 Ca 0.12 -2.50 -0.44 0.00 -1.81 0.00 0.00 57.70 53.06 2wnu n MET 199 Cb 0.42 -0.58 -0.03 0.00 -0.71 0.00 0.00 33.22 32.31 2wnu n MET 199 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2wnu s VAL 200 N -1.23 4.67 0.52 2.03 -7.23 -1.25 -4.78 120.40 113.13 2wnu s VAL 200 Ca 0.35 -1.13 -0.17 0.00 -1.81 0.00 0.00 61.98 59.21 2wnu s VAL 200 Cb 0.38 -4.67 -0.07 0.00 0.56 0.00 0.00 36.38 32.57 2wnu s VAL 200 CO -0.13 -1.39 1.00 -0.83 -0.31 0.00 0.00 175.10 173.45 2wnu s GLY 201 N 3.57 2.18 1.02 2.32 0.00 -1.24 -2.48 107.32 112.68 2wnu s GLY 201 Ca 0.24 0.31 -0.12 0.00 0.00 0.00 0.00 44.72 45.16 2wnu s GLY 201 CO -0.00 0.60 1.08 -0.26 0.00 0.00 0.00 173.10 174.52 2wnu s ILE 202 N -2.44 2.24 -0.25 0.90 -4.36 -1.26 -4.81 121.20 111.21 2wnu s ILE 202 Ca 0.61 0.08 -0.37 0.00 -0.26 0.00 0.00 60.65 60.71 2wnu s ILE 202 Cb -0.12 -2.30 -0.13 0.00 1.25 0.00 0.00 42.46 41.15 2wnu s ILE 202 CO 0.28 -0.10 1.90 1.67 0.24 0.00 0.00 174.94 178.94 2wnu n GLN 203 N -4.39 1.41 0.00 0.37 7.27 -1.26 -1.16 117.38 119.62 2wnu n GLN 203 Ca 0.06 0.49 0.00 0.00 0.07 0.00 0.00 57.00 57.62 2wnu n GLN 203 Cb 0.54 -2.34 0.00 0.00 2.41 0.00 0.00 30.24 30.85 2wnu n GLN 203 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2wnu n GLY 204 N 4.90 0.44 3.12 1.69 0.00 -1.26 -5.06 105.19 109.02 2wnu n GLY 204 Ca 0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.99 2wnu n GLY 204 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wnu s SER 205 N -2.80 3.07 0.45 1.61 0.15 -0.31 -5.12 113.70 110.76 2wnu s SER 205 Ca 0.00 -0.62 0.05 0.00 0.70 0.00 0.00 55.95 56.08 2wnu s SER 205 Cb 0.00 -1.44 -0.04 0.00 -1.71 0.00 0.00 66.02 62.83 2wnu s SER 205 CO 0.00 0.02 0.06 -1.81 1.20 0.00 0.00 173.24 172.71 2wnu s ASP 206 N 1.18 4.10 -0.07 5.45 1.11 -1.26 -4.31 116.67 122.87 2wnu s ASP 206 Ca 0.02 -1.42 0.05 0.00 0.18 0.00 0.00 52.55 51.38 2wnu s ASP 206 Cb -0.14 -0.04 -0.00 0.00 1.07 0.00 0.00 42.92 43.81 2wnu s ASP 206 CO -0.10 -0.65 -0.21 -0.44 1.18 0.00 0.00 175.17 174.95 2wnu s SER 207 N -3.84 2.69 0.01 0.27 0.01 -1.26 -3.27 113.70 108.30 2wnu s SER 207 Ca 0.26 -0.46 0.03 0.00 1.31 0.00 0.00 55.95 57.09 2wnu s SER 207 Cb 0.05 -0.94 -0.01 0.00 0.21 0.00 0.00 66.02 65.34 2wnu s SER 207 CO 0.14 0.17 -0.09 -0.69 0.41 0.00 0.00 173.24 173.17 2wnu s VAL 208 N 0.13 0.74 -0.08 3.43 1.01 0.13 -2.37 120.40 123.39 2wnu s VAL 208 Ca -0.09 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.35 2wnu s VAL 208 Cb -0.15 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.59 2wnu s VAL 208 CO 0.05 0.09 -0.14 0.12 0.00 0.00 0.00 175.10 175.22 2wnu s PHE 209 N -0.45 1.64 0.04 5.22 5.36 -0.26 -1.26 117.98 128.26 2wnu s PHE 209 Ca 0.01 -0.66 0.05 0.00 -0.96 0.00 0.00 56.93 55.37 2wnu s PHE 209 Cb -0.05 -1.19 -0.02 0.00 -0.34 0.00 0.00 43.02 41.41 2wnu s PHE 209 CO 0.00 -0.34 -0.13 -1.12 -1.46 0.00 0.00 175.22 172.17 2wnu s SER 210 N 0.75 1.55 -0.15 6.13 0.01 0.99 -0.71 113.70 122.26 2wnu s SER 210 Ca -0.13 -0.47 -0.19 0.00 1.31 0.00 0.00 55.95 56.47 2wnu s SER 210 Cb -0.16 -0.09 0.05 0.00 0.21 0.00 0.00 66.02 66.04 2wnu s SER 210 CO 0.03 0.00 0.51 -0.83 0.41 0.00 0.00 173.24 173.35 2wnu s GLY 211 N -1.20 -0.38 -0.08 3.44 0.00 -0.66 -1.05 107.32 107.39 2wnu s GLY 211 Ca 0.00 1.27 -0.08 0.00 0.00 0.00 0.00 44.72 45.90 2wnu s GLY 211 CO 0.01 1.05 0.24 -0.11 0.00 0.00 0.00 173.10 174.29 2wnu s PHE 212 N -0.16 -0.25 0.13 1.90 -0.12 -0.44 -1.26 117.98 117.78 2wnu s PHE 212 Ca -0.03 0.60 -0.31 0.00 -0.05 0.00 0.00 56.93 57.13 2wnu s PHE 212 Cb -0.03 0.08 -0.08 0.00 -0.63 0.00 0.00 43.02 42.36 2wnu s PHE 212 CO 0.02 -0.14 1.44 -1.17 -0.05 0.00 0.00 175.22 175.32 2wnu s LEU 213 N 0.02 4.37 -0.16 -1.99 2.96 0.40 -1.61 118.68 122.66 2wnu s LEU 213 Ca -0.01 2.40 -0.11 0.00 -0.22 0.00 0.00 54.13 56.19 2wnu s LEU 213 Cb -0.02 -3.59 -0.07 0.00 0.50 0.00 0.00 46.19 43.01 2wnu s LEU 213 CO 0.01 -0.70 -0.25 0.18 -1.32 0.00 0.00 176.35 174.26 2wnu n LEU 214 N 3.98 1.51 -3.93 -0.68 4.77 0.99 -4.74 117.00 118.90 2wnu n LEU 214 Ca 0.12 0.25 -0.30 0.00 -0.03 0.00 0.00 56.01 56.05 2wnu n LEU 214 Cb 0.41 -0.60 -0.15 0.00 -2.33 0.00 0.00 43.42 40.75 2wnu n LEU 214 CO 0.59 0.09 -0.39 -0.36 -1.33 0.00 0.00 177.39 176.00 2wnu s PHE 215 N -2.47 2.59 0.34 -1.77 0.08 -1.16 -4.98 117.98 110.61 2wnu s PHE 215 Ca -0.25 -2.02 -0.28 0.00 0.12 0.00 0.00 56.93 54.50 2wnu s PHE 215 Cb 0.08 -1.88 -0.09 0.00 -0.57 0.00 0.00 43.02 40.55 2wnu s PHE 215 CO 0.33 -0.83 1.18 -2.14 -0.10 0.00 0.00 175.22 173.66 2wnu s PRO 216 N 1.32 4.36 0.00 0.24 0.02 -1.26 -0.92 135.00 138.76 2wnu s PRO 216 Ca -0.00 1.92 0.00 0.00 0.02 0.00 0.00 61.00 62.94 2wnu s PRO 216 Cb -0.19 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.36 2wnu s PRO 216 CO -0.09 -0.08 0.00 -0.40 -0.33 0.00 0.00 177.00 176.10