#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wnu s PRO 91 N 0.00 4.12 -0.31 -1.09 0.04 -1.26 -4.96 135.00 131.54 2wnu s PRO 91 Ca 0.00 2.62 0.18 0.00 0.04 0.00 0.00 61.00 63.83 2wnu s PRO 91 Cb 0.00 -3.07 0.47 0.00 0.04 0.00 0.00 34.50 31.95 2wnu s PRO 91 CO 0.00 -0.75 1.03 0.54 0.04 0.00 0.00 177.00 177.86 2wnu n ARG 92 N 3.83 1.72 -2.32 4.56 1.74 -1.26 -5.10 116.66 119.83 2wnu n ARG 92 Ca 0.15 -3.52 -0.43 0.00 -0.77 0.00 0.00 57.85 53.29 2wnu n ARG 92 Cb 0.35 -1.53 -0.02 0.00 -1.02 0.00 0.00 32.46 30.24 2wnu n ARG 92 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2wnu s PRO 93 N -3.41 4.24 -0.28 5.56 0.02 -1.26 -4.64 135.00 135.24 2wnu s PRO 93 Ca 0.31 1.81 -0.22 0.00 0.02 0.00 0.00 61.00 62.91 2wnu s PRO 93 Cb 0.41 -3.75 0.09 0.00 0.02 0.00 0.00 34.50 31.26 2wnu s PRO 93 CO -0.01 -0.68 0.80 0.00 -0.33 0.00 0.00 177.00 176.77 2wnu s ALA 94 N 3.28 -1.87 0.04 -1.55 0.00 -1.18 -2.09 121.76 118.39 2wnu s ALA 94 Ca 0.60 2.09 -0.05 0.00 0.00 0.00 0.00 51.96 54.60 2wnu s ALA 94 Cb -0.26 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.53 2wnu s ALA 94 CO 0.20 -0.33 0.08 -0.59 0.00 0.00 0.00 175.76 175.12 2wnu s PHE 95 N 0.68 0.25 -0.09 0.00 -0.12 -0.36 -0.58 117.98 117.77 2wnu s PHE 95 Ca -0.02 -0.61 -0.05 0.00 -0.05 0.00 0.00 56.93 56.20 2wnu s PHE 95 Cb -0.05 -0.18 0.04 0.00 -0.63 0.00 0.00 43.02 42.20 2wnu s PHE 95 CO -0.06 -0.38 0.20 -1.12 -0.05 0.00 0.00 175.22 173.81 2wnu s SER 96 N -2.31 -0.20 0.01 1.98 0.01 0.43 -2.48 113.70 111.14 2wnu s SER 96 Ca -0.02 0.42 0.01 0.00 1.31 0.00 0.00 55.95 57.67 2wnu s SER 96 Cb 0.01 0.33 -0.01 0.00 0.21 0.00 0.00 66.02 66.56 2wnu s SER 96 CO -0.06 -0.14 -0.04 0.00 0.41 0.00 0.00 173.24 173.41 2wnu s ALA 97 N 1.04 0.27 0.38 1.44 0.00 -0.69 -0.44 121.76 123.77 2wnu s ALA 97 Ca -0.08 -0.29 0.08 0.00 0.00 0.00 0.00 51.96 51.67 2wnu s ALA 97 Cb -0.09 -0.01 -0.07 0.00 0.00 0.00 0.00 23.12 22.94 2wnu s ALA 97 CO -0.06 0.02 0.00 0.96 0.00 0.00 0.00 175.76 176.68 2wnu s ILE 98 N -0.47 2.18 -0.18 0.00 -4.36 0.13 -1.63 121.20 116.86 2wnu s ILE 98 Ca -0.03 -2.01 -0.13 0.00 -0.26 0.00 0.00 60.65 58.22 2wnu s ILE 98 Cb -0.04 -2.88 -0.05 0.00 1.25 0.00 0.00 42.46 40.75 2wnu s ILE 98 CO -0.00 -0.08 0.26 -0.13 0.24 0.00 0.00 174.94 175.23 2wnu s ARG 99 N -3.71 4.21 0.23 0.37 0.52 -1.13 -1.09 118.95 118.36 2wnu s ARG 99 Ca 0.35 0.01 0.00 0.00 -0.52 0.00 0.00 55.73 55.57 2wnu s ARG 99 Cb 0.06 -3.46 0.00 0.00 0.52 0.00 0.00 34.95 32.07 2wnu s ARG 99 CO 0.18 0.19 0.00 0.54 0.02 0.00 0.00 175.30 176.23 2wnu n ARG 100 N 3.79 0.00 -3.50 3.54 1.74 -1.26 -4.71 116.66 116.26 2wnu n ARG 100 Ca -0.12 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.68 2wnu n ARG 100 Cb 0.52 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.87 2wnu n ARG 100 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2wnu n ASN 101 N -3.22 3.69 -4.73 0.55 5.15 -1.26 -4.80 115.26 110.63 2wnu n ASN 101 Ca 0.00 -3.41 -0.41 0.00 -0.60 0.00 0.00 54.58 50.17 2wnu n ASN 101 Cb 0.00 -0.70 -0.05 0.00 -0.53 0.00 0.00 39.78 38.51 2wnu n ASN 101 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2wnu s PRO 102 N -2.31 4.69 -0.13 1.20 0.04 -1.26 -4.87 135.00 132.37 2wnu s PRO 102 Ca 0.37 1.40 -0.29 0.00 0.04 0.00 0.00 61.00 62.52 2wnu s PRO 102 Cb 0.11 -3.36 -0.05 0.00 0.04 0.00 0.00 34.50 31.24 2wnu s PRO 102 CO -0.04 0.28 1.81 -1.25 0.04 0.00 0.00 177.00 177.84 2wnu s PRO 103 N -0.21 3.83 0.35 0.56 0.04 -1.26 -4.99 135.00 133.31 2wnu s PRO 103 Ca 0.45 2.04 -0.05 0.00 0.04 0.00 0.00 61.00 63.48 2wnu s PRO 103 Cb -0.23 -4.12 -0.05 0.00 0.04 0.00 0.00 34.50 30.14 2wnu s PRO 103 CO 0.29 -1.28 0.62 -1.64 0.04 0.00 0.00 177.00 175.03 2wnu s MET 104 N 4.81 3.62 0.00 4.56 -1.94 -1.26 -4.80 119.30 124.29 2wnu s MET 104 Ca 0.81 0.05 0.00 0.00 -1.71 0.00 0.00 55.69 54.84 2wnu s MET 104 Cb -0.32 -2.57 0.00 0.00 2.01 0.00 0.00 34.83 33.95 2wnu s MET 104 CO 0.33 0.10 0.00 0.41 -0.01 0.00 0.00 175.02 175.85 2wnu n GLY 105 N -1.33 3.38 0.00 -0.03 0.00 -1.26 -5.15 105.19 100.79 2wnu n GLY 105 Ca -0.01 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.55 2wnu n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wnu n GLY 106 N 0.46 -1.09 0.02 -0.02 0.00 -1.26 -4.71 105.19 98.60 2wnu n GLY 106 Ca 0.00 -1.63 0.11 0.00 0.00 0.00 0.00 46.02 44.50 2wnu n GLY 106 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wnu n ASN 107 N -1.82 0.64 -4.71 1.61 3.02 -1.26 -4.85 115.26 107.88 2wnu n ASN 107 Ca 0.00 -0.29 -0.42 0.00 -0.03 0.00 0.00 54.58 53.84 2wnu n ASN 107 Cb 0.00 0.58 -0.03 0.00 -0.61 0.00 0.00 39.78 39.72 2wnu n ASN 107 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2wnu s VAL 108 N -3.11 3.23 -0.39 2.41 1.01 -1.26 -0.76 120.40 121.53 2wnu s VAL 108 Ca 0.07 0.85 -0.25 0.00 0.00 0.00 0.00 61.98 62.65 2wnu s VAL 108 Cb 0.15 -3.54 0.02 0.00 0.00 0.00 0.00 36.38 33.01 2wnu s VAL 108 CO 0.77 0.05 0.87 -0.69 0.00 0.00 0.00 175.10 176.10 2wnu s VAL 109 N 1.34 4.62 -0.28 2.92 1.01 0.15 -4.91 120.40 125.25 2wnu s VAL 109 Ca 0.66 0.96 -0.16 0.00 0.00 0.00 0.00 61.98 63.45 2wnu s VAL 109 Cb -0.37 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.66 2wnu s VAL 109 CO 0.30 -0.57 0.41 -0.63 0.00 0.00 0.00 175.10 174.61 2wnu s ILE 110 N 3.39 5.14 -0.73 2.22 1.01 -1.26 -4.56 121.20 126.41 2wnu s ILE 110 Ca 0.35 0.56 -0.17 0.00 0.00 0.00 0.00 60.65 61.40 2wnu s ILE 110 Cb -0.12 -3.75 0.15 0.00 0.01 0.00 0.00 42.46 38.75 2wnu s ILE 110 CO 0.20 0.10 0.78 -0.36 0.00 0.00 0.00 174.94 175.66 2wnu s PHE 111 N 2.13 3.33 0.29 3.97 0.40 -1.26 -4.78 117.98 122.06 2wnu s PHE 111 Ca 0.16 -1.46 0.13 0.00 -0.60 0.00 0.00 56.93 55.17 2wnu s PHE 111 Cb -0.16 -3.97 0.58 0.00 0.51 0.00 0.00 43.02 39.98 2wnu s PHE 111 CO 0.10 -1.19 1.72 0.38 0.70 0.00 0.00 175.22 176.94 2wnu h ASP 112 N 8.58 0.00 -3.55 1.36 2.03 -1.63 -3.41 116.42 119.80 2wnu h ASP 112 Ca -0.07 0.00 -0.71 0.00 -0.73 0.00 0.00 57.03 55.52 2wnu h ASP 112 Cb 1.06 0.00 -0.24 0.00 -0.83 0.00 0.00 39.33 39.32 2wnu h ASP 112 CO 0.97 0.47 -0.48 -0.89 -1.03 0.00 0.00 179.24 178.28 2wnu s THR 113 N -3.83 4.76 0.08 1.15 2.01 -0.25 -4.85 115.64 114.71 2wnu s THR 113 Ca -0.02 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 60.84 2wnu s THR 113 Cb 0.13 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.91 2wnu s THR 113 CO 0.73 -0.28 1.03 -0.69 -0.69 0.00 0.00 174.62 174.72 2wnu s VAL 114 N 1.58 4.43 -0.24 3.82 1.01 -1.26 0.19 120.40 129.94 2wnu s VAL 114 Ca 0.03 1.90 0.02 0.00 0.00 0.00 0.00 61.98 63.93 2wnu s VAL 114 Cb -0.19 -4.21 -0.16 0.00 0.00 0.00 0.00 36.38 31.82 2wnu s VAL 114 CO 0.07 0.24 -0.21 -0.38 0.00 0.00 0.00 175.10 174.82 2wnu n ILE 115 N 3.20 1.35 -3.78 2.22 2.08 0.42 -4.93 119.36 119.92 2wnu n ILE 115 Ca 0.04 -0.52 -0.13 0.00 0.56 0.00 0.00 62.75 62.70 2wnu n ILE 115 Cb 0.49 -1.33 -0.11 0.00 -0.75 0.00 0.00 39.64 37.94 2wnu n ILE 115 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 2wnu s THR 116 N -2.47 0.01 -0.45 1.39 2.01 -0.75 -4.93 115.64 110.45 2wnu s THR 116 Ca -0.32 -0.08 0.07 0.00 0.31 0.00 0.00 61.69 61.67 2wnu s THR 116 Cb 0.08 -0.42 0.33 0.00 0.01 0.00 0.00 72.50 72.49 2wnu s THR 116 CO 0.55 -0.05 1.10 -3.20 -0.69 0.00 0.00 174.62 172.33 2wnu n ASN 117 N 2.68 -2.04 -4.67 3.53 5.15 -1.24 -0.43 115.26 118.25 2wnu n ASN 117 Ca -0.14 -3.57 -0.42 0.00 -0.60 0.00 0.00 54.58 49.84 2wnu n ASN 117 Cb 0.58 1.66 -0.03 0.00 -0.53 0.00 0.00 39.78 41.46 2wnu n ASN 117 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2wnu s GLN 118 N 0.02 4.18 -0.32 1.20 2.00 0.25 -0.48 119.66 126.51 2wnu s GLN 118 Ca 0.24 2.32 0.00 0.00 -2.00 0.00 0.00 55.36 55.92 2wnu s GLN 118 Cb 0.30 -3.90 0.00 0.00 0.80 0.00 0.00 33.01 30.21 2wnu s GLN 118 CO -0.05 -0.83 0.00 0.39 -0.50 0.00 0.00 175.29 174.29 2wnu n GLU 119 N 6.74 -0.63 -4.21 1.67 1.02 -1.26 -3.10 120.64 120.88 2wnu n GLU 119 Ca 0.17 0.42 -0.34 0.00 -0.02 0.00 0.00 57.16 57.39 2wnu n GLU 119 Cb 0.42 -4.06 -0.03 0.00 -0.02 0.00 0.00 31.44 27.74 2wnu n GLU 119 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2wnu n GLU 120 N -2.08 -2.86 0.27 3.49 1.02 0.36 -4.88 120.64 115.97 2wnu n GLU 120 Ca -0.03 0.34 0.17 0.00 -0.02 0.00 0.00 57.16 57.62 2wnu n GLU 120 Cb 0.20 -4.86 0.65 0.00 -0.02 0.00 0.00 31.44 27.41 2wnu n GLU 120 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2wnu h PRO 121 N -1.54 0.00 -5.32 3.49 0.13 -1.79 -3.44 132.00 123.53 2wnu h PRO 121 Ca -0.60 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 63.92 2wnu h PRO 121 Cb 1.38 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.40 2wnu h PRO 121 CO 0.76 0.00 -0.49 -0.47 -0.23 0.00 0.00 178.00 177.57 2wnu s TYR 122 N -3.64 3.43 -0.46 1.56 5.04 -1.26 -0.26 117.35 121.76 2wnu s TYR 122 Ca 0.01 0.36 -0.17 0.00 -2.44 0.00 0.00 57.07 54.84 2wnu s TYR 122 Cb 0.09 -2.13 0.05 0.00 0.35 0.00 0.00 41.96 40.31 2wnu s TYR 122 CO 0.55 0.35 0.44 -0.65 -1.34 0.00 0.00 175.55 174.90 2wnu s GLN 123 N 0.19 3.03 0.40 4.97 -0.21 0.73 -4.96 119.66 123.82 2wnu s GLN 123 Ca 0.09 -1.08 0.28 0.00 0.02 0.00 0.00 55.36 54.68 2wnu s GLN 123 Cb -0.11 -4.07 1.12 0.00 1.00 0.00 0.00 33.01 30.95 2wnu s GLN 123 CO -0.01 -1.00 1.84 -2.95 -2.12 0.00 0.00 175.29 171.05 2wnu h ASN 124 N 8.79 0.00 0.91 5.90 7.08 -1.86 0.19 115.58 136.58 2wnu h ASN 124 Ca -0.28 0.00 -0.22 0.00 -3.08 0.00 0.00 56.30 52.72 2wnu h ASN 124 Cb 1.11 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 37.32 2wnu h ASN 124 CO 0.86 0.00 -1.08 1.12 -2.08 0.00 0.00 177.43 176.25 2wnu h HIS 125 N 0.00 0.08 0.00 4.14 2.07 -1.89 -3.37 115.15 116.18 2wnu h HIS 125 Ca 0.00 -0.06 0.00 0.00 -2.85 0.00 0.00 60.37 57.46 2wnu h HIS 125 Cb 0.49 -0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.46 2wnu h HIS 125 CO 0.00 1.05 -1.22 -1.13 -3.07 0.00 0.00 177.93 173.56 2wnu n SER 126 N -3.37 1.94 -0.23 3.10 3.41 -1.10 -4.95 113.62 112.42 2wnu n SER 126 Ca -0.02 -0.21 -0.03 0.00 -0.26 0.00 0.00 58.87 58.35 2wnu n SER 126 Cb 0.96 1.36 -0.01 0.00 -0.26 0.00 0.00 64.21 66.26 2wnu n SER 126 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wnu n GLY 127 N 1.70 0.62 3.60 5.00 0.00 0.65 -4.77 105.19 111.99 2wnu n GLY 127 Ca -0.01 -0.75 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 2wnu n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wnu s ARG 128 N -1.97 3.18 -0.02 1.61 0.52 -1.17 -4.48 118.95 116.61 2wnu s ARG 128 Ca 0.00 -0.48 -0.16 0.00 -0.52 0.00 0.00 55.73 54.57 2wnu s ARG 128 Cb 0.00 -2.79 -0.05 0.00 0.52 0.00 0.00 34.95 32.62 2wnu s ARG 128 CO 0.00 0.53 0.45 0.12 0.02 0.00 0.00 175.30 176.42 2wnu s PHE 129 N -0.43 3.68 -0.19 -0.53 5.36 0.16 -0.19 117.98 125.84 2wnu s PHE 129 Ca 0.07 1.00 -0.01 0.00 -0.96 0.00 0.00 56.93 57.03 2wnu s PHE 129 Cb -0.12 -2.39 0.00 0.00 -0.34 0.00 0.00 43.02 40.17 2wnu s PHE 129 CO 0.02 0.50 -0.13 0.08 -1.46 0.00 0.00 175.22 174.23 2wnu s VAL 130 N -0.59 2.76 -0.18 3.12 1.01 0.65 -0.20 120.40 126.96 2wnu s VAL 130 Ca 0.25 -0.71 -0.29 0.00 0.00 0.00 0.00 61.98 61.22 2wnu s VAL 130 Cb -0.17 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 2wnu s VAL 130 CO 0.13 0.49 1.26 0.00 0.00 0.00 0.00 175.10 176.98 2wnu n THR 132 N 5.43 1.53 -3.25 0.00 -1.04 -1.26 0.10 114.28 115.79 2wnu n THR 132 Ca 0.14 -0.28 -0.41 0.00 -2.04 0.00 0.00 64.05 61.46 2wnu n THR 132 Cb 0.45 -1.94 -0.08 0.00 -1.82 0.00 0.00 70.33 66.94 2wnu n THR 132 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2wnu s VAL 133 N -2.49 5.03 0.35 12.58 1.01 -1.26 -4.59 120.40 131.03 2wnu s VAL 133 Ca -0.36 0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.73 2wnu s VAL 133 Cb 0.12 -3.94 -0.11 0.00 0.00 0.00 0.00 36.38 32.46 2wnu s VAL 133 CO 0.51 -0.17 1.50 -2.84 0.00 0.00 0.00 175.10 174.09 2wnu s PRO 134 N 2.36 4.14 0.00 2.72 0.02 -1.26 -4.86 135.00 138.11 2wnu s PRO 134 Ca 0.19 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.74 2wnu s PRO 134 Cb -0.15 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.37 2wnu s PRO 134 CO 0.13 -0.53 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 2wnu n GLY 135 N 0.92 -0.92 3.70 0.52 0.00 -0.68 -2.21 105.19 106.52 2wnu n GLY 135 Ca 0.03 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 2wnu n GLY 135 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wnu s TYR 136 N -3.00 3.39 0.10 1.61 1.51 0.18 -0.32 117.35 120.82 2wnu s TYR 136 Ca 0.00 0.41 0.10 0.00 -1.01 0.00 0.00 57.07 56.57 2wnu s TYR 136 Cb 0.00 -2.29 -0.03 0.00 -0.11 0.00 0.00 41.96 39.53 2wnu s TYR 136 CO 0.00 0.17 -0.25 0.71 -1.11 0.00 0.00 175.55 175.08 2wnu s TYR 137 N 0.71 2.13 -0.15 2.71 1.51 -0.41 0.40 117.35 124.25 2wnu s TYR 137 Ca 0.12 -0.39 -0.08 0.00 -1.01 0.00 0.00 57.07 55.71 2wnu s TYR 137 Cb -0.13 -1.19 -0.04 0.00 -0.11 0.00 0.00 41.96 40.49 2wnu s TYR 137 CO 0.03 0.24 0.12 -0.47 -1.11 0.00 0.00 175.55 174.35 2wnu s TYR 138 N -1.00 3.47 -0.04 2.71 5.04 0.86 -1.01 117.35 127.37 2wnu s TYR 138 Ca 0.11 0.39 0.03 0.00 -2.44 0.00 0.00 57.07 55.17 2wnu s TYR 138 Cb -0.10 -2.01 0.00 0.00 0.35 0.00 0.00 41.96 40.21 2wnu s TYR 138 CO 0.04 0.52 -0.14 -0.06 -1.34 0.00 0.00 175.55 174.58 2wnu s PHE 139 N -0.46 1.44 -0.01 4.97 0.40 -0.61 -1.14 117.98 122.57 2wnu s PHE 139 Ca 0.12 -0.41 -0.16 0.00 -0.60 0.00 0.00 56.93 55.87 2wnu s PHE 139 Cb -0.12 -0.99 0.03 0.00 0.51 0.00 0.00 43.02 42.45 2wnu s PHE 139 CO 0.02 -0.16 0.34 -0.08 0.70 0.00 0.00 175.22 176.04 2wnu s THR 140 N 0.15 0.05 0.05 0.64 -1.32 -0.09 -1.27 115.64 113.86 2wnu s THR 140 Ca -0.05 -0.45 0.03 0.00 -1.21 0.00 0.00 61.69 60.01 2wnu s THR 140 Cb -0.11 -0.67 -0.03 0.00 -1.51 0.00 0.00 72.50 70.18 2wnu s THR 140 CO 0.02 -0.25 -0.09 0.72 -2.21 0.00 0.00 174.62 172.81 2wnu s PHE 141 N -1.42 0.78 -0.26 9.09 -0.12 -0.66 -0.68 117.98 124.70 2wnu s PHE 141 Ca -0.13 -0.52 -0.02 0.00 -0.05 0.00 0.00 56.93 56.21 2wnu s PHE 141 Cb -0.04 -0.46 0.08 0.00 -0.63 0.00 0.00 43.02 41.97 2wnu s PHE 141 CO 0.04 -0.06 0.08 -0.65 -0.05 0.00 0.00 175.22 174.58 2wnu s GLN 142 N -1.76 0.54 -0.08 1.99 1.11 -0.28 -2.77 119.66 118.41 2wnu s GLN 142 Ca -0.07 -0.66 0.05 0.00 0.01 0.00 0.00 55.36 54.68 2wnu s GLN 142 Cb -0.09 -1.83 -0.01 0.00 -1.01 0.00 0.00 33.01 30.07 2wnu s GLN 142 CO 0.00 -0.86 -0.24 0.08 0.01 0.00 0.00 175.29 174.29 2wnu s VAL 143 N 1.84 2.15 -0.14 1.09 1.01 -0.30 -0.32 120.40 125.74 2wnu s VAL 143 Ca 0.05 -1.01 -0.21 0.00 0.00 0.00 0.00 61.98 60.81 2wnu s VAL 143 Cb -0.17 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 2wnu s VAL 143 CO -0.21 0.56 0.64 -0.22 0.00 0.00 0.00 175.10 175.87 2wnu s LEU 144 N 0.07 4.23 0.19 3.92 2.96 -1.26 -1.55 118.68 127.24 2wnu s LEU 144 Ca -0.10 0.97 0.03 0.00 -0.22 0.00 0.00 54.13 54.81 2wnu s LEU 144 Cb -0.16 -2.94 -0.05 0.00 0.50 0.00 0.00 46.19 43.55 2wnu s LEU 144 CO 0.06 -0.17 -0.03 -0.55 -1.32 0.00 0.00 176.35 174.34 2wnu s SER 145 N 0.95 1.62 0.00 3.68 0.15 -0.51 -0.47 113.70 119.11 2wnu s SER 145 Ca 0.32 -1.15 0.00 0.00 0.70 0.00 0.00 55.95 55.82 2wnu s SER 145 Cb -0.16 0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.19 2wnu s SER 145 CO 0.13 -0.48 0.00 0.00 1.20 0.00 0.00 173.24 174.09 2wnu n GLN 146 N -0.30 4.82 0.00 5.44 6.02 -1.26 -0.99 117.38 131.11 2wnu n GLN 146 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 2wnu n GLN 146 Cb 0.63 -0.49 0.00 0.00 1.02 0.00 0.00 30.24 31.40 2wnu n GLN 146 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 2wnu n TRP 147 N -0.88 0.00 -4.90 1.08 7.02 -1.26 -0.15 117.44 118.35 2wnu n TRP 147 Ca 0.00 0.00 -0.27 0.00 -1.02 0.00 0.00 57.50 56.21 2wnu n TRP 147 Cb 0.00 0.00 -0.16 0.00 -2.42 0.00 0.00 31.31 28.73 2wnu n TRP 147 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2wnu s GLU 148 N 1.11 1.88 -0.10 -0.99 2.02 -1.26 -1.96 118.70 119.41 2wnu s GLU 148 Ca 0.00 -0.65 -0.04 0.00 0.02 0.00 0.00 54.97 54.30 2wnu s GLU 148 Cb 0.00 -1.63 0.05 0.00 0.10 0.00 0.00 34.13 32.65 2wnu s GLU 148 CO 0.00 0.27 0.20 -1.50 0.02 0.00 0.00 175.26 174.25 2wnu s ILE 149 N -0.01 -0.21 -0.12 -1.63 2.07 -0.31 -1.40 121.20 119.59 2wnu s ILE 149 Ca -0.03 0.26 0.01 0.00 -1.41 0.00 0.00 60.65 59.48 2wnu s ILE 149 Cb -0.12 -0.34 -0.01 0.00 0.13 0.00 0.00 42.46 42.12 2wnu s ILE 149 CO 0.02 0.11 -0.16 0.00 -1.91 0.00 0.00 174.94 172.99 2wnu s LEU 151 N 0.33 2.19 -0.02 0.00 1.43 0.62 -1.42 118.68 121.80 2wnu s LEU 151 Ca -0.13 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 2wnu s LEU 151 Cb -0.16 -0.69 0.00 0.00 0.03 0.00 0.00 46.19 45.37 2wnu s LEU 151 CO 0.07 0.05 -0.06 -0.55 0.23 0.00 0.00 176.35 176.08 2wnu s SER 152 N -1.24 0.87 -0.34 2.29 0.15 0.20 -0.50 113.70 115.14 2wnu s SER 152 Ca 0.03 -0.13 -0.24 0.00 0.70 0.00 0.00 55.95 56.30 2wnu s SER 152 Cb -0.08 -0.22 0.01 0.00 -1.71 0.00 0.00 66.02 64.01 2wnu s SER 152 CO 0.02 0.04 0.84 -0.63 1.20 0.00 0.00 173.24 174.71 2wnu s ILE 153 N 0.21 4.71 0.17 6.45 1.01 -1.25 -0.71 121.20 131.78 2wnu s ILE 153 Ca -0.03 1.16 0.07 0.00 0.00 0.00 0.00 60.65 61.86 2wnu s ILE 153 Cb -0.07 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 2wnu s ILE 153 CO -0.00 -0.38 0.00 -0.69 0.00 0.00 0.00 174.94 173.87 2wnu s VAL 154 N 3.17 3.75 0.24 2.92 1.01 0.22 -4.13 120.40 127.59 2wnu s VAL 154 Ca 0.35 -1.38 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2wnu s VAL 154 Cb -0.13 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 2wnu s VAL 154 CO 0.15 -0.09 0.12 -0.94 0.00 0.00 0.00 175.10 174.35 2wnu s SER 155 N -2.88 0.83 0.06 3.32 1.04 -1.05 -1.14 113.70 113.89 2wnu s SER 155 Ca 0.27 -1.42 0.03 0.00 0.48 0.00 0.00 55.95 55.31 2wnu s SER 155 Cb -0.10 0.29 -0.03 0.00 0.10 0.00 0.00 66.02 66.28 2wnu s SER 155 CO 0.19 -0.80 -0.09 -0.94 0.98 0.00 0.00 173.24 172.57 2wnu s SER 156 N -3.26 1.10 -0.04 7.02 1.04 0.44 0.12 113.70 120.12 2wnu s SER 156 Ca 0.38 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 56.15 2wnu s SER 156 Cb 0.07 0.03 0.02 0.00 0.10 0.00 0.00 66.02 66.24 2wnu s SER 156 CO 0.14 -0.23 -0.02 -0.55 0.98 0.00 0.00 173.24 173.55 2wnu s SER 157 N -1.95 0.82 -1.43 7.02 0.15 -0.97 -2.22 113.70 115.12 2wnu s SER 157 Ca -0.03 -0.08 -0.08 0.00 0.70 0.00 0.00 55.95 56.46 2wnu s SER 157 Cb -0.07 -0.36 0.04 0.00 -1.71 0.00 0.00 66.02 63.93 2wnu s SER 157 CO -0.00 -0.09 0.65 0.54 1.20 0.00 0.00 173.24 175.53 2wnu n ARG 158 N 4.22 -4.57 -0.29 5.44 1.74 -1.26 -1.89 116.66 120.06 2wnu n ARG 158 Ca -0.23 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 2wnu n ARG 158 Cb 0.51 -5.51 0.00 0.00 -1.02 0.00 0.00 32.46 26.44 2wnu n ARG 158 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wnu n GLY 159 N -1.44 2.06 3.66 -0.13 0.00 -1.26 -5.00 105.19 103.08 2wnu n GLY 159 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2wnu n GLY 159 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wnu s GLN 160 N -0.04 4.25 0.15 1.61 1.11 -0.79 -5.02 119.66 120.93 2wnu s GLN 160 Ca 0.00 1.02 -0.30 0.00 0.01 0.00 0.00 55.36 56.09 2wnu s GLN 160 Cb 0.00 -3.61 -0.08 0.00 -1.01 0.00 0.00 33.01 28.31 2wnu s GLN 160 CO 0.00 -0.43 1.27 0.08 0.01 0.00 0.00 175.29 176.21 2wnu s VAL 161 N 2.53 3.52 -0.43 1.09 1.01 -1.26 -2.29 120.40 124.56 2wnu s VAL 161 Ca 0.37 1.19 0.03 0.00 0.00 0.00 0.00 61.98 63.57 2wnu s VAL 161 Cb -0.16 -3.76 0.12 0.00 0.00 0.00 0.00 36.38 32.58 2wnu s VAL 161 CO 0.10 0.15 0.17 -0.13 0.00 0.00 0.00 175.10 175.38 2wnu s ARG 162 N 0.33 1.77 0.55 2.72 0.52 0.12 -4.98 118.95 119.98 2wnu s ARG 162 Ca 0.57 -2.23 -0.20 0.00 -0.52 0.00 0.00 55.73 53.36 2wnu s ARG 162 Cb -0.34 -3.30 -0.05 0.00 0.52 0.00 0.00 34.95 31.78 2wnu s ARG 162 CO 0.34 -1.03 1.17 1.03 0.02 0.00 0.00 175.30 176.83 2wnu s ARG 163 N 0.36 3.27 0.00 3.54 1.81 -1.26 -2.52 118.95 124.15 2wnu s ARG 163 Ca 0.14 1.72 0.00 0.00 -1.72 0.00 0.00 55.73 55.86 2wnu s ARG 163 Cb -0.22 -2.03 0.00 0.00 -0.45 0.00 0.00 34.95 32.25 2wnu s ARG 163 CO -0.04 -0.94 0.00 0.45 -0.68 0.00 0.00 175.30 174.08 2wnu n SER 164 N -1.30 0.04 -4.61 0.23 2.88 -1.26 -4.98 113.62 104.62 2wnu n SER 164 Ca 0.12 -0.12 -0.37 0.00 -1.33 0.00 0.00 58.87 57.17 2wnu n SER 164 Cb 0.50 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.03 2wnu n SER 164 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2wnu n LEU 165 N 0.00 3.55 -4.52 2.46 7.99 -1.26 -4.89 117.00 120.33 2wnu n LEU 165 Ca 0.00 0.72 -0.24 0.00 -0.01 0.00 0.00 56.01 56.49 2wnu n LEU 165 Cb 0.00 -1.39 -0.09 0.00 -0.11 0.00 0.00 43.42 41.83 2wnu n LEU 165 CO 0.00 -2.00 -0.44 -0.83 -1.51 0.00 0.00 177.39 172.62 2wnu s GLY 166 N -1.46 1.82 -0.07 -0.72 0.00 -1.26 -3.87 107.32 101.76 2wnu s GLY 166 Ca 0.75 -1.82 -0.03 0.00 0.00 0.00 0.00 44.72 43.62 2wnu s GLY 166 CO 0.48 -1.90 0.16 -1.36 0.00 0.00 0.00 173.10 170.48 2wnu s PHE 167 N -2.46 -0.18 0.07 1.90 0.40 0.34 -4.97 117.98 113.08 2wnu s PHE 167 Ca 0.30 0.53 0.06 0.00 -0.60 0.00 0.00 56.93 57.23 2wnu s PHE 167 Cb -0.05 -0.10 -0.03 0.00 0.51 0.00 0.00 43.02 43.35 2wnu s PHE 167 CO 0.16 -0.19 -0.17 0.00 0.70 0.00 0.00 175.22 175.72 2wnu s ASP 169 N -1.52 2.69 -0.14 0.00 -1.08 0.24 -4.97 116.67 111.89 2wnu s ASP 169 Ca 0.03 -0.50 0.15 0.00 -0.52 0.00 0.00 52.55 51.71 2wnu s ASP 169 Cb -0.09 -1.15 0.32 0.00 -1.46 0.00 0.00 42.92 40.54 2wnu s ASP 169 CO 0.02 -0.07 1.17 0.35 0.52 0.00 0.00 175.17 177.16 2wnu n THR 170 N 4.78 1.82 -0.19 1.71 -2.24 -1.26 -1.17 114.28 117.74 2wnu n THR 170 Ca -0.16 -2.42 -0.05 0.00 -2.27 0.00 0.00 64.05 59.14 2wnu n THR 170 Cb 0.50 -0.15 0.01 0.00 -2.10 0.00 0.00 70.33 68.58 2wnu n THR 170 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2wnu h THR 171 N 0.99 0.20 -4.29 4.28 2.02 -1.96 -3.46 112.91 110.68 2wnu h THR 171 Ca -0.01 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 66.92 2wnu h THR 171 Cb 1.05 0.20 0.10 0.00 -1.74 0.00 0.00 68.15 67.76 2wnu h THR 171 CO 0.00 0.00 -0.47 -3.20 0.37 0.00 0.00 175.52 172.22 2wnu n ASN 172 N -5.43 -4.08 -0.16 4.18 4.05 -0.83 -4.92 115.26 108.07 2wnu n ASN 172 Ca 0.04 -0.38 0.02 0.00 0.45 0.00 0.00 54.58 54.72 2wnu n ASN 172 Cb 0.35 -3.54 0.01 0.00 1.23 0.00 0.00 39.78 37.83 2wnu n ASN 172 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2wnu n LYS 173 N -3.39 0.73 -0.80 1.20 4.76 -1.24 -4.97 118.16 114.46 2wnu n LYS 173 Ca -0.05 -0.66 0.00 0.00 -2.87 0.00 0.00 58.31 54.73 2wnu n LYS 173 Cb 0.56 -1.03 0.00 0.00 -1.84 0.00 0.00 35.03 32.72 2wnu n LYS 173 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wnu n GLY 174 N 0.43 0.64 3.63 0.72 0.00 0.78 -5.05 105.19 106.35 2wnu n GLY 174 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2wnu n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wnu s LEU 175 N 0.00 3.25 -0.06 0.99 1.43 -1.21 -4.90 118.68 118.18 2wnu s LEU 175 Ca 0.00 -0.30 -0.38 0.00 -1.03 0.00 0.00 54.13 52.42 2wnu s LEU 175 Cb 0.00 -2.00 -0.16 0.00 0.03 0.00 0.00 46.19 44.05 2wnu s LEU 175 CO 0.00 0.17 1.48 0.49 0.23 0.00 0.00 176.35 178.72 2wnu n PHE 176 N 0.56 1.68 -4.17 0.29 0.99 -1.26 -4.40 117.46 111.15 2wnu n PHE 176 Ca -0.12 0.62 -0.18 0.00 -0.00 0.00 0.00 57.45 57.78 2wnu n PHE 176 Cb 0.52 -2.37 -0.15 0.00 -1.00 0.00 0.00 39.48 36.48 2wnu n PHE 176 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 2wnu s GLN 177 N 1.63 0.59 -0.33 -1.08 -1.52 -0.16 -5.00 119.66 113.79 2wnu s GLN 177 Ca 0.90 -0.15 -0.14 0.00 -1.95 0.00 0.00 55.36 54.02 2wnu s GLN 177 Cb -1.02 -0.60 -0.02 0.00 -0.22 0.00 0.00 33.01 31.16 2wnu s GLN 177 CO 0.55 0.04 0.32 0.08 -0.25 0.00 0.00 175.29 176.02 2wnu s VAL 178 N 0.31 5.21 0.08 1.09 1.01 -1.26 -1.43 120.40 125.42 2wnu s VAL 178 Ca -0.04 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.75 2wnu s VAL 178 Cb -0.08 -3.76 -0.07 0.00 0.00 0.00 0.00 36.38 32.47 2wnu s VAL 178 CO -0.00 -0.03 0.60 0.54 0.00 0.00 0.00 175.10 176.21 2wnu s VAL 179 N 1.92 4.70 0.07 2.92 0.11 -0.60 -4.90 120.40 124.62 2wnu s VAL 179 Ca 0.10 1.29 0.02 0.00 -2.93 0.00 0.00 61.98 60.46 2wnu s VAL 179 Cb -0.17 -3.93 -0.03 0.00 -1.53 0.00 0.00 36.38 30.72 2wnu s VAL 179 CO 0.11 0.54 -0.08 -0.94 -3.33 0.00 0.00 175.10 171.41 2wnu s SER 180 N -1.05 1.02 0.17 3.54 1.04 -1.26 -1.15 113.70 116.01 2wnu s SER 180 Ca 0.30 -0.75 -0.24 0.00 0.48 0.00 0.00 55.95 55.74 2wnu s SER 180 Cb -0.20 0.06 0.06 0.00 0.10 0.00 0.00 66.02 66.03 2wnu s SER 180 CO 0.20 -0.31 0.89 -0.83 0.98 0.00 0.00 173.24 174.17 2wnu s GLY 181 N -2.21 -0.23 0.00 7.32 0.00 -1.11 -4.87 107.32 106.22 2wnu s GLY 181 Ca -0.00 0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.82 2wnu s GLY 181 CO -0.02 0.01 0.00 0.61 0.00 0.00 0.00 173.10 173.71 2wnu n GLY 182 N -0.45 0.77 3.50 0.20 0.00 -1.26 -1.66 105.19 106.29 2wnu n GLY 182 Ca -0.06 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.34 2wnu n GLY 182 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2wnu s MET 183 N -2.00 0.92 0.14 1.61 0.23 -0.40 -5.00 119.30 114.80 2wnu s MET 183 Ca 0.00 -0.17 -0.30 0.00 -1.03 0.00 0.00 55.69 54.19 2wnu s MET 183 Cb 0.00 0.43 -0.07 0.00 -1.53 0.00 0.00 34.83 33.66 2wnu s MET 183 CO 0.00 -0.37 0.94 0.08 -2.03 0.00 0.00 175.02 173.65 2wnu s VAL 184 N -2.59 4.39 -0.13 5.16 1.01 -1.26 -1.57 120.40 125.41 2wnu s VAL 184 Ca 0.00 2.05 0.01 0.00 0.00 0.00 0.00 61.98 64.04 2wnu s VAL 184 Cb -0.01 -4.31 0.02 0.00 0.00 0.00 0.00 36.38 32.08 2wnu s VAL 184 CO -0.05 0.37 -0.14 -0.76 0.00 0.00 0.00 175.10 174.52 2wnu s LEU 185 N -0.34 1.66 -0.27 3.92 1.43 -0.18 -4.96 118.68 119.94 2wnu s LEU 185 Ca 0.45 -0.45 -0.29 0.00 -1.03 0.00 0.00 54.13 52.81 2wnu s LEU 185 Cb -0.24 -1.12 0.01 0.00 0.03 0.00 0.00 46.19 44.87 2wnu s LEU 185 CO 0.30 -0.03 1.14 -1.58 0.23 0.00 0.00 176.35 176.40 2wnu s GLN 186 N 1.31 4.12 0.05 1.70 0.74 -1.26 -1.28 119.66 125.04 2wnu s GLN 186 Ca 0.00 1.27 0.07 0.00 0.05 0.00 0.00 55.36 56.76 2wnu s GLN 186 Cb -0.14 -3.74 -0.03 0.00 1.10 0.00 0.00 33.01 30.20 2wnu s GLN 186 CO -0.07 -0.84 -0.17 -0.51 -0.55 0.00 0.00 175.29 173.16 2wnu s LEU 187 N 3.64 2.69 0.28 3.68 1.43 0.56 -4.98 118.68 125.97 2wnu s LEU 187 Ca 0.48 -0.42 0.06 0.00 -1.03 0.00 0.00 54.13 53.22 2wnu s LEU 187 Cb -0.15 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.48 2wnu s LEU 187 CO 0.14 0.24 0.39 -1.10 0.23 0.00 0.00 176.35 176.26 2wnu s GLN 188 N -1.58 3.30 0.14 1.70 -0.21 -1.26 -1.69 119.66 120.06 2wnu s GLN 188 Ca 0.16 -0.87 -0.34 0.00 0.02 0.00 0.00 55.36 54.33 2wnu s GLN 188 Cb -0.11 -2.85 -0.14 0.00 1.00 0.00 0.00 33.01 30.92 2wnu s GLN 188 CO 0.07 0.29 1.58 0.94 -2.12 0.00 0.00 175.29 176.05 2wnu n GLN 189 N -1.48 2.11 0.00 2.91 7.27 -1.26 -1.81 117.38 125.12 2wnu n GLN 189 Ca -0.06 0.76 0.00 0.00 0.07 0.00 0.00 57.00 57.78 2wnu n GLN 189 Cb 0.57 -2.53 0.00 0.00 2.41 0.00 0.00 30.24 30.70 2wnu n GLN 189 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2wnu n GLY 190 N 3.43 2.08 3.77 1.69 0.00 0.11 -4.99 105.19 111.28 2wnu n GLY 190 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2wnu n GLY 190 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wnu s ASP 191 N -1.91 6.33 0.01 1.61 -0.00 -0.75 -4.71 116.67 117.25 2wnu s ASP 191 Ca 0.00 3.04 0.04 0.00 -0.00 0.00 0.00 52.55 55.63 2wnu s ASP 191 Cb 0.00 -2.66 -0.03 0.00 -0.00 0.00 0.00 42.92 40.23 2wnu s ASP 191 CO 0.00 -0.90 -0.07 -1.10 -0.00 0.00 0.00 175.17 173.09 2wnu s GLN 192 N -1.59 2.50 -0.03 8.23 -0.21 -0.94 -0.58 119.66 127.05 2wnu s GLN 192 Ca 0.56 -0.76 0.03 0.00 0.02 0.00 0.00 55.36 55.22 2wnu s GLN 192 Cb -0.47 -2.48 -0.00 0.00 1.00 0.00 0.00 33.01 31.06 2wnu s GLN 192 CO 0.59 0.59 -0.11 0.08 -2.12 0.00 0.00 175.29 174.32 2wnu s VAL 193 N -1.02 0.95 0.22 1.09 1.01 0.71 -0.42 120.40 122.94 2wnu s VAL 193 Ca 0.17 -0.46 -0.17 0.00 0.00 0.00 0.00 61.98 61.53 2wnu s VAL 193 Cb -0.11 -0.83 0.02 0.00 0.00 0.00 0.00 36.38 35.46 2wnu s VAL 193 CO 0.08 0.28 0.53 -1.66 0.00 0.00 0.00 175.10 174.34 2wnu s TRP 194 N 0.08 0.01 -0.22 5.22 -2.14 -0.29 0.36 118.94 121.97 2wnu s TRP 194 Ca -0.02 -0.38 -0.08 0.00 2.66 0.00 0.00 56.10 58.29 2wnu s TRP 194 Cb -0.08 0.37 -0.04 0.00 -3.10 0.00 0.00 33.47 30.62 2wnu s TRP 194 CO 0.01 -0.98 0.08 0.08 -2.66 0.00 0.00 176.95 173.48 2wnu s VAL 195 N -3.92 4.66 -0.06 -0.66 1.01 -1.26 -0.61 120.40 119.56 2wnu s VAL 195 Ca 0.13 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.06 2wnu s VAL 195 Cb -0.01 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 2wnu s VAL 195 CO 0.02 0.39 -0.09 -1.61 0.00 0.00 0.00 175.10 173.80 2wnu s GLU 196 N 1.00 2.69 0.27 2.72 2.02 0.11 0.34 118.70 127.85 2wnu s GLU 196 Ca 0.04 -0.60 -0.07 0.00 0.02 0.00 0.00 54.97 54.36 2wnu s GLU 196 Cb -0.14 -2.53 -0.06 0.00 0.10 0.00 0.00 34.13 31.50 2wnu s GLU 196 CO 0.03 0.63 0.57 -1.59 0.02 0.00 0.00 175.26 174.93 2wnu s LYS 197 N -0.74 3.72 0.12 1.61 -2.85 0.06 -0.62 119.74 121.04 2wnu s LYS 197 Ca 0.11 0.16 -0.31 0.00 -1.00 0.00 0.00 55.97 54.93 2wnu s LYS 197 Cb -0.11 -2.62 -0.09 0.00 -2.06 0.00 0.00 37.83 32.95 2wnu s LYS 197 CO 0.01 0.23 1.51 0.34 0.10 0.00 0.00 175.35 177.55 2wnu s ASP 198 N -2.82 6.69 0.45 0.03 -1.08 -0.51 -4.87 116.67 114.57 2wnu s ASP 198 Ca 0.46 2.46 0.11 0.00 -0.52 0.00 0.00 52.55 55.05 2wnu s ASP 198 Cb -0.11 -2.58 1.02 0.00 -1.46 0.00 0.00 42.92 39.79 2wnu s ASP 198 CO 0.26 -0.77 2.09 1.55 0.52 0.00 0.00 175.17 178.82 2wnu h PRO 199 N 7.16 0.33 -0.00 4.34 0.13 -1.95 -2.75 132.00 139.26 2wnu h PRO 199 Ca -0.42 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2wnu h PRO 199 Cb 1.20 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2wnu h PRO 199 CO 0.90 0.22 -0.30 1.63 -0.23 0.00 0.00 178.00 180.22 2wnu n LYS 200 N -4.50 0.11 -3.26 0.86 4.76 -1.26 -4.60 118.16 110.27 2wnu n LYS 200 Ca 0.01 -0.05 -0.16 0.00 -2.87 0.00 0.00 58.31 55.25 2wnu n LYS 200 Cb 0.09 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.71 2wnu n LYS 200 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2wnu s LYS 201 N -2.92 0.77 -0.31 1.97 1.02 -1.04 -5.02 119.74 114.20 2wnu s LYS 201 Ca 0.14 -1.10 0.17 0.00 0.02 0.00 0.00 55.97 55.21 2wnu s LYS 201 Cb 0.18 -0.69 0.46 0.00 -0.52 0.00 0.00 37.83 37.26 2wnu s LYS 201 CO 0.62 -1.25 1.24 0.41 -0.92 0.00 0.00 175.35 175.44 2wnu n GLY 202 N 3.77 1.75 3.63 -3.33 0.00 -1.12 -1.32 105.19 108.58 2wnu n GLY 202 Ca 0.16 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 2wnu n GLY 202 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wnu s HIS 203 N -2.00 3.19 -0.11 1.61 5.04 -0.49 -5.01 115.29 117.52 2wnu s HIS 203 Ca 0.21 1.12 0.02 0.00 -1.54 0.00 0.00 55.06 54.87 2wnu s HIS 203 Cb 0.39 -3.50 -0.01 0.00 0.04 0.00 0.00 32.58 29.50 2wnu s HIS 203 CO -0.06 -0.67 -0.18 0.42 -2.34 0.00 0.00 174.74 171.91 2wnu s ILE 204 N 3.39 2.58 0.24 0.89 1.01 -1.26 -4.42 121.20 123.63 2wnu s ILE 204 Ca 0.41 -0.84 -0.31 0.00 0.00 0.00 0.00 60.65 59.91 2wnu s ILE 204 Cb -0.13 -2.04 -0.12 0.00 0.01 0.00 0.00 42.46 40.18 2wnu s ILE 204 CO 0.13 0.54 1.65 0.00 0.00 0.00 0.00 174.94 177.27 2wnu n TYR 205 N 3.44 2.72 -4.10 3.97 9.36 0.38 -4.97 117.16 127.96 2wnu n TYR 205 Ca -0.18 0.16 -0.33 0.00 3.32 0.00 0.00 57.90 60.86 2wnu n TYR 205 Cb 0.53 -2.62 -0.16 0.00 -0.63 0.00 0.00 39.34 36.46 2wnu n TYR 205 CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 2wnu s GLN 206 N 0.45 2.94 0.00 2.98 2.00 -1.26 -4.95 119.66 121.82 2wnu s GLN 206 Ca 0.71 -0.87 0.00 0.00 -2.00 0.00 0.00 55.36 53.20 2wnu s GLN 206 Cb -0.52 -2.64 0.00 0.00 0.80 0.00 0.00 33.01 30.65 2wnu s GLN 206 CO 0.40 -0.25 0.00 0.41 -0.50 0.00 0.00 175.29 175.35 2wnu n GLY 207 N 4.61 -1.77 0.05 2.59 0.00 -1.26 -5.03 105.19 104.39 2wnu n GLY 207 Ca -0.20 -1.21 0.06 0.00 0.00 0.00 0.00 46.02 44.67 2wnu n GLY 207 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wnu n SER 208 N 2.63 0.74 -0.13 1.61 3.41 -1.26 -4.61 113.62 116.01 2wnu n SER 208 Ca 0.00 -0.87 -0.09 0.00 -0.26 0.00 0.00 58.87 57.65 2wnu n SER 208 Cb 0.00 0.90 -0.00 0.00 -0.26 0.00 0.00 64.21 64.85 2wnu n SER 208 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2wnu h GLU 209 N 0.26 0.58 -4.01 4.33 5.08 -2.02 -3.47 114.58 115.33 2wnu h GLU 209 Ca 0.00 -0.08 -0.20 0.00 -1.00 0.00 0.00 59.36 58.08 2wnu h GLU 209 Cb 0.32 -0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.38 2wnu h GLU 209 CO 0.00 0.50 -0.21 0.00 -1.00 0.00 0.00 179.01 178.30 2wnu s ALA 210 N -5.71 0.47 0.17 3.43 0.00 -1.26 -5.18 121.76 113.66 2wnu s ALA 210 Ca -0.13 -1.32 0.11 0.00 0.00 0.00 0.00 51.96 50.62 2wnu s ALA 210 Cb 0.10 1.15 -0.04 0.00 0.00 0.00 0.00 23.12 24.33 2wnu s ALA 210 CO 0.74 -0.79 -0.24 -0.51 0.00 0.00 0.00 175.76 174.97 2wnu s ASP 211 N -3.15 3.24 -0.02 0.00 1.01 -1.26 -4.83 116.67 111.66 2wnu s ASP 211 Ca 0.29 -0.83 0.06 0.00 0.71 0.00 0.00 52.55 52.78 2wnu s ASP 211 Cb 0.00 -0.22 -0.03 0.00 1.01 0.00 0.00 42.92 43.68 2wnu s ASP 211 CO 0.15 0.11 -0.18 -0.44 0.21 0.00 0.00 175.17 175.03 2wnu s SER 212 N -2.47 3.76 0.02 0.27 0.01 -1.26 -4.37 113.70 109.65 2wnu s SER 212 Ca 0.17 -0.32 0.02 0.00 1.31 0.00 0.00 55.95 57.14 2wnu s SER 212 Cb -0.08 -0.68 -0.01 0.00 0.21 0.00 0.00 66.02 65.46 2wnu s SER 212 CO 0.08 0.31 -0.07 0.54 0.41 0.00 0.00 173.24 174.52 2wnu s VAL 213 N -0.76 0.48 -0.10 3.43 0.11 0.57 -2.82 120.40 121.30 2wnu s VAL 213 Ca 0.12 -0.64 -0.00 0.00 -2.93 0.00 0.00 61.98 58.52 2wnu s VAL 213 Cb -0.10 -0.48 0.02 0.00 -1.53 0.00 0.00 36.38 34.29 2wnu s VAL 213 CO 0.02 -0.12 -0.07 0.12 -3.33 0.00 0.00 175.10 171.71 2wnu s PHE 214 N -0.74 1.40 0.16 1.54 5.36 -0.65 -1.13 117.98 123.93 2wnu s PHE 214 Ca -0.04 -0.66 0.05 0.00 -0.96 0.00 0.00 56.93 55.33 2wnu s PHE 214 Cb -0.06 -1.17 -0.04 0.00 -0.34 0.00 0.00 43.02 41.41 2wnu s PHE 214 CO 0.00 -0.47 -0.11 -1.12 -1.46 0.00 0.00 175.22 172.06 2wnu s SER 215 N 1.60 2.03 -0.05 6.13 0.01 0.14 -1.71 113.70 121.85 2wnu s SER 215 Ca 0.02 -1.01 -0.29 0.00 1.31 0.00 0.00 55.95 55.98 2wnu s SER 215 Cb -0.13 -0.05 0.10 0.00 0.21 0.00 0.00 66.02 66.15 2wnu s SER 215 CO -0.07 -0.28 0.83 -0.83 0.41 0.00 0.00 173.24 173.31 2wnu s GLY 216 N -3.20 -0.45 -0.05 3.44 0.00 -1.03 -0.91 107.32 105.11 2wnu s GLY 216 Ca 0.18 1.37 -0.29 0.00 0.00 0.00 0.00 44.72 45.98 2wnu s GLY 216 CO 0.02 0.71 0.64 -0.11 0.00 0.00 0.00 173.10 174.36 2wnu s PHE 217 N -2.01 -0.61 0.26 1.90 -0.12 -0.29 -1.22 117.98 115.88 2wnu s PHE 217 Ca -0.02 1.06 -0.30 0.00 -0.05 0.00 0.00 56.93 57.62 2wnu s PHE 217 Cb -0.01 0.37 -0.10 0.00 -0.63 0.00 0.00 43.02 42.65 2wnu s PHE 217 CO -0.01 -0.58 1.40 -1.17 -0.05 0.00 0.00 175.22 174.81 2wnu s LEU 218 N -1.14 4.40 -0.20 -1.99 2.96 -0.89 -0.10 118.68 121.71 2wnu s LEU 218 Ca -0.11 2.63 -0.17 0.00 -0.22 0.00 0.00 54.13 56.27 2wnu s LEU 218 Cb -0.01 -3.63 -0.12 0.00 0.50 0.00 0.00 46.19 42.93 2wnu s LEU 218 CO 0.09 -0.65 -0.07 -0.38 -1.32 0.00 0.00 176.35 174.02 2wnu n ILE 219 N 2.12 1.50 -3.58 6.68 5.41 0.16 -4.83 119.36 126.82 2wnu n ILE 219 Ca 0.05 -0.03 -0.16 0.00 1.00 0.00 0.00 62.75 63.61 2wnu n ILE 219 Cb 0.41 -2.13 -0.07 0.00 -0.71 0.00 0.00 39.64 37.15 2wnu n ILE 219 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 2wnu s PHE 220 N -2.43 -0.62 0.65 1.39 -0.12 -1.08 -5.01 117.98 110.77 2wnu s PHE 220 Ca -0.28 1.19 -0.14 0.00 -0.05 0.00 0.00 56.93 57.65 2wnu s PHE 220 Cb 0.07 0.33 -0.01 0.00 -0.63 0.00 0.00 43.02 42.78 2wnu s PHE 220 CO 0.46 -0.52 1.07 -2.14 -0.05 0.00 0.00 175.22 174.05 2wnu s PRO 221 N -0.82 2.98 0.00 1.99 0.02 -1.26 -0.65 135.00 137.26 2wnu s PRO 221 Ca -0.09 1.19 0.09 0.00 0.02 0.00 0.00 61.00 62.22 2wnu s PRO 221 Cb -0.02 -1.99 0.07 0.00 0.02 0.00 0.00 34.50 32.59 2wnu s PRO 221 CO 0.07 -1.08 0.79 -1.13 -0.33 0.00 0.00 177.00 175.31