#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gfu n ALA 69 N 0.00 4.97 -3.39 3.14 0.00 -1.26 -4.94 120.51 119.03 2gfu n ALA 69 Ca 0.00 -4.49 -0.45 0.00 0.00 0.00 0.00 53.44 48.49 2gfu n ALA 69 Cb 0.00 -2.74 -0.03 0.00 0.00 0.00 0.00 19.45 16.67 2gfu n ALA 69 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2gfu s LYS 70 N -0.60 3.40 -0.15 0.00 1.02 -1.26 -5.06 119.74 117.10 2gfu s LYS 70 Ca 0.37 -2.42 -0.07 0.00 0.02 0.00 0.00 55.97 53.87 2gfu s LYS 70 Cb 0.04 -4.32 -0.04 0.00 -0.52 0.00 0.00 37.83 33.00 2gfu s LYS 70 CO 0.03 -1.28 0.08 -0.80 -0.92 0.00 0.00 175.35 172.46 2gfu s ASN 71 N 2.05 5.80 -1.50 2.83 -0.87 -1.26 -5.04 114.94 116.95 2gfu s ASN 71 Ca 0.17 0.20 -0.13 0.00 -1.57 0.00 0.00 52.86 51.53 2gfu s ASN 71 Cb -0.13 -1.92 -0.00 0.00 -0.02 0.00 0.00 41.25 39.18 2gfu s ASN 71 CO -0.07 0.26 2.45 -0.11 -2.57 0.00 0.00 177.10 177.06 2gfu n LEU 72 N 2.94 7.39 0.00 0.60 -0.00 -1.26 -4.41 117.00 122.27 2gfu n LEU 72 Ca -0.18 -4.18 0.11 0.00 -0.00 0.00 0.00 56.01 51.76 2gfu n LEU 72 Cb 0.53 -1.62 -0.13 0.00 -0.00 0.00 0.00 43.42 42.20 2gfu n LEU 72 CO 0.33 1.38 -0.51 0.59 -0.00 0.00 0.00 177.39 179.18 2gfu n ASN 73 N 5.35 0.29 0.00 1.96 4.13 -1.26 -4.98 115.26 120.75 2gfu n ASN 73 Ca 0.60 -0.16 0.00 0.00 1.68 0.00 0.00 54.58 56.70 2gfu n ASN 73 Cb 0.34 1.60 0.00 0.00 -1.54 0.00 0.00 39.78 40.18 2gfu n ASN 73 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gfu n GLY 74 N 1.30 0.61 0.00 7.41 0.00 -1.26 -4.48 105.19 108.77 2gfu n GLY 74 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2gfu n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gfu n GLY 75 N -1.74 0.58 2.38 -0.02 0.00 -1.26 -4.52 105.19 100.62 2gfu n GLY 75 Ca 0.00 -1.17 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 2gfu n GLY 75 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gfu n LEU 76 N 0.00 5.72 0.00 0.99 4.77 -1.26 -4.80 117.00 122.42 2gfu n LEU 76 Ca 0.00 -4.86 -0.10 0.00 -0.03 0.00 0.00 56.01 51.02 2gfu n LEU 76 Cb 0.00 -0.60 0.05 0.00 -2.33 0.00 0.00 43.42 40.54 2gfu n LEU 76 CO 0.00 2.00 0.48 -0.09 -1.33 0.00 0.00 177.39 178.45 2gfu h ARG 77 N 2.43 0.57 -0.47 3.23 2.43 -1.79 -3.16 114.38 117.62 2gfu h ARG 77 Ca 0.42 -0.36 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2gfu h ARG 77 Cb 0.95 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2gfu h ARG 77 CO 1.04 0.97 0.00 0.54 -1.51 0.00 0.00 179.97 181.00 2gfu n ARG 78 N -3.96 3.11 0.00 0.20 5.12 -1.26 -5.09 116.66 114.77 2gfu n ARG 78 Ca -0.03 -2.51 0.00 0.00 -1.93 0.00 0.00 57.85 53.38 2gfu n ARG 78 Cb 0.60 -1.59 0.00 0.00 -1.16 0.00 0.00 32.46 30.32 2gfu n ARG 78 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2gfu n SER 79 N 0.65 -0.26 -3.76 0.55 2.88 -1.20 -4.95 113.62 107.54 2gfu n SER 79 Ca 0.19 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.60 2gfu n SER 79 Cb 0.67 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.03 2gfu n SER 79 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2gfu s VAL 80 N 0.00 0.04 0.23 2.46 0.11 -1.26 -4.88 120.40 117.10 2gfu s VAL 80 Ca 0.00 -0.30 -0.09 0.00 -2.93 0.00 0.00 61.98 58.66 2gfu s VAL 80 Cb 0.00 -0.57 -0.07 0.00 -1.53 0.00 0.00 36.38 34.21 2gfu s VAL 80 CO 0.00 -0.16 0.55 0.00 -3.33 0.00 0.00 175.10 172.15 2gfu s ALA 81 N -0.78 3.57 0.17 1.54 0.00 -1.26 -5.03 121.76 119.97 2gfu s ALA 81 Ca -0.09 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.53 2gfu s ALA 81 Cb -0.04 -2.42 0.05 0.00 0.00 0.00 0.00 23.12 20.71 2gfu s ALA 81 CO 0.03 0.48 1.45 -1.00 0.00 0.00 0.00 175.76 176.72 2gfu h PRO 82 N 2.46 0.54 0.00 0.00 0.13 -2.03 -3.47 132.00 129.63 2gfu h PRO 82 Ca -0.47 -0.39 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 2gfu h PRO 82 Cb 1.17 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2gfu h PRO 82 CO 0.69 1.01 0.00 0.00 -0.23 0.00 0.00 178.00 179.47 2gfu n ALA 83 N -2.53 0.00 -2.77 -0.56 0.00 -1.26 -5.12 120.51 108.28 2gfu n ALA 83 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.05 2gfu n ALA 83 Cb 0.66 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.02 2gfu n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gfu s ALA 84 N -1.65 3.36 -1.43 0.00 0.00 -1.26 -5.04 121.76 115.74 2gfu s ALA 84 Ca 0.00 -0.77 -0.14 0.00 0.00 0.00 0.00 51.96 51.05 2gfu s ALA 84 Cb 0.00 -1.64 0.06 0.00 0.00 0.00 0.00 23.12 21.53 2gfu s ALA 84 CO 0.00 0.47 2.16 -0.35 0.00 0.00 0.00 175.76 178.05 2gfu n PRO 85 N 2.55 2.96 -3.60 0.00 -0.04 -1.26 -4.80 135.00 130.81 2gfu n PRO 85 Ca -0.18 -2.74 -0.11 0.00 -0.04 0.00 0.00 63.50 60.42 2gfu n PRO 85 Cb 0.53 -3.26 -0.06 0.00 -0.04 0.00 0.00 33.50 30.68 2gfu n PRO 85 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2gfu s THR 86 N 2.91 0.00 -0.37 0.52 2.01 -1.26 -5.09 115.64 114.37 2gfu s THR 86 Ca 0.46 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.52 2gfu s THR 86 Cb 0.13 -1.00 0.25 0.00 0.01 0.00 0.00 72.50 71.89 2gfu s THR 86 CO -0.07 0.00 1.23 -1.20 -0.69 0.00 0.00 174.62 173.88 2gfu n SER 87 N 1.45 -1.61 -4.33 3.53 7.64 -1.26 -5.12 113.62 113.92 2gfu n SER 87 Ca -0.13 -2.23 -0.46 0.00 1.01 0.00 0.00 58.87 57.07 2gfu n SER 87 Cb 0.57 1.12 -0.05 0.00 -1.01 0.00 0.00 64.21 64.83 2gfu n SER 87 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2gfu s SER 88 N -0.74 6.18 -0.37 6.43 1.04 -1.26 -4.93 113.70 120.06 2gfu s SER 88 Ca 0.15 -1.65 0.06 0.00 0.48 0.00 0.00 55.95 54.99 2gfu s SER 88 Cb 0.25 -2.22 0.17 0.00 0.10 0.00 0.00 66.02 64.32 2gfu s SER 88 CO -0.07 -0.87 0.53 -1.81 0.98 0.00 0.00 173.24 172.00 2gfu s ASP 89 N 3.44 -0.60 -0.09 7.02 1.01 -1.26 -4.78 116.67 121.41 2gfu s ASP 89 Ca 0.05 -0.84 0.02 0.00 0.71 0.00 0.00 52.55 52.49 2gfu s ASP 89 Cb -0.28 1.50 0.01 0.00 1.01 0.00 0.00 42.92 45.16 2gfu s ASP 89 CO 0.04 -0.23 -0.16 -0.36 0.21 0.00 0.00 175.17 174.68 2gfu s PHE 90 N 1.93 1.90 0.37 4.23 0.08 -1.26 -5.10 117.98 120.12 2gfu s PHE 90 Ca 0.15 -0.82 0.08 0.00 0.12 0.00 0.00 56.93 56.46 2gfu s PHE 90 Cb -0.09 -1.36 -0.04 0.00 -0.57 0.00 0.00 43.02 40.96 2gfu s PHE 90 CO -0.11 -0.41 0.19 -1.54 -0.10 0.00 0.00 175.22 173.25 2gfu s SER 91 N 0.79 4.64 0.34 1.36 1.04 -1.26 -4.97 113.70 115.64 2gfu s SER 91 Ca -0.11 -0.87 -0.29 0.00 0.48 0.00 0.00 55.95 55.16 2gfu s SER 91 Cb -0.16 -0.62 -0.11 0.00 0.10 0.00 0.00 66.02 65.23 2gfu s SER 91 CO 0.02 -0.43 1.53 -2.65 0.98 0.00 0.00 173.24 172.69 2gfu n PRO 92 N -1.23 2.67 0.00 4.02 -0.02 -1.26 -3.13 135.00 136.05 2gfu n PRO 92 Ca -0.01 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 2gfu n PRO 92 Cb 0.62 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2gfu n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gfu n GLY 93 N 1.28 3.35 3.86 -1.23 0.00 -0.21 -4.95 105.19 107.29 2gfu n GLY 93 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2gfu n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gfu s ASP 94 N -0.48 6.17 -0.15 1.61 1.11 -1.18 -4.67 116.67 119.07 2gfu s ASP 94 Ca 0.00 1.46 -0.06 0.00 0.18 0.00 0.00 52.55 54.13 2gfu s ASP 94 Cb 0.00 -2.48 -0.04 0.00 1.07 0.00 0.00 42.92 41.47 2gfu s ASP 94 CO 0.00 -0.91 0.06 -0.76 1.18 0.00 0.00 175.17 174.74 2gfu s LEU 95 N -5.09 3.86 0.05 1.23 2.01 -1.26 -0.87 118.68 118.60 2gfu s LEU 95 Ca 0.56 0.15 0.01 0.00 0.01 0.00 0.00 54.13 54.87 2gfu s LEU 95 Cb -0.11 -1.95 -0.03 0.00 0.01 0.00 0.00 46.19 44.11 2gfu s LEU 95 CO 0.51 0.25 -0.06 0.68 1.01 0.00 0.00 176.35 178.74 2gfu s VAL 96 N -0.08 0.45 -0.27 -1.59 -7.23 -0.90 -1.89 120.40 108.88 2gfu s VAL 96 Ca 0.07 -1.27 -0.10 0.00 -1.81 0.00 0.00 61.98 58.87 2gfu s VAL 96 Cb -0.12 -0.82 -0.04 0.00 0.56 0.00 0.00 36.38 35.96 2gfu s VAL 96 CO 0.01 -0.55 0.16 0.26 -0.31 0.00 0.00 175.10 174.67 2gfu s TRP 97 N -2.04 3.18 0.09 2.82 0.52 0.09 -0.99 118.94 122.62 2gfu s TRP 97 Ca -0.06 -0.04 0.05 0.00 0.02 0.00 0.00 56.10 56.08 2gfu s TRP 97 Cb -0.06 -2.34 -0.04 0.00 -1.15 0.00 0.00 33.47 29.88 2gfu s TRP 97 CO -0.02 -0.22 -0.03 0.00 0.02 0.00 0.00 176.95 176.70 2gfu s ALA 98 N 1.72 3.18 -0.02 0.98 0.00 0.05 0.23 121.76 127.89 2gfu s ALA 98 Ca 0.07 -1.15 0.06 0.00 0.00 0.00 0.00 51.96 50.94 2gfu s ALA 98 Cb -0.16 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.83 2gfu s ALA 98 CO 0.09 0.68 -0.20 0.21 0.00 0.00 0.00 175.76 176.54 2gfu s LYS 99 N -2.22 2.25 0.04 0.00 2.47 -0.73 -0.89 119.74 120.65 2gfu s LYS 99 Ca 0.24 -0.85 0.06 0.00 -1.56 0.00 0.00 55.97 53.86 2gfu s LYS 99 Cb -0.11 -2.19 -0.02 0.00 -1.46 0.00 0.00 37.83 34.04 2gfu s LYS 99 CO 0.16 0.58 -0.18 1.41 0.16 0.00 0.00 175.35 177.48 2gfu s MET 100 N -0.80 1.22 -0.76 4.03 -2.45 -1.26 -4.79 119.30 114.49 2gfu s MET 100 Ca 0.11 -0.88 -0.16 0.00 -1.25 0.00 0.00 55.69 53.52 2gfu s MET 100 Cb -0.10 -1.31 -0.20 0.00 1.25 0.00 0.00 34.83 34.48 2gfu s MET 100 CO 0.01 0.33 2.01 0.39 1.05 0.00 0.00 175.02 178.80 2gfu n GLU 101 N 1.87 0.19 0.00 4.11 -0.58 -1.26 -1.20 120.64 123.76 2gfu n GLU 101 Ca -0.17 -0.57 0.00 0.00 -0.42 0.00 0.00 57.16 55.99 2gfu n GLU 101 Cb 0.54 -2.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.05 2gfu n GLU 101 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gfu n GLY 102 N 5.83 0.48 3.99 0.62 0.00 -1.26 -5.10 105.19 109.75 2gfu n GLY 102 Ca 0.44 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.27 2gfu n GLY 102 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gfu s TYR 103 N -2.00 3.09 0.88 1.61 1.51 -0.34 -5.13 117.35 116.97 2gfu s TYR 103 Ca 0.00 -0.23 -0.12 0.00 -1.01 0.00 0.00 57.07 55.71 2gfu s TYR 103 Cb 0.00 -2.03 0.12 0.00 -0.11 0.00 0.00 41.96 39.94 2gfu s TYR 103 CO 0.00 -0.05 1.10 -2.14 -1.11 0.00 0.00 175.55 173.34 2gfu s PRO 104 N -4.19 1.37 -0.26 -1.71 0.02 -1.26 -4.57 135.00 124.39 2gfu s PRO 104 Ca 0.46 0.71 -0.28 0.00 0.02 0.00 0.00 61.00 61.90 2gfu s PRO 104 Cb -0.10 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 2gfu s PRO 104 CO 0.31 -2.13 2.02 -1.58 -0.33 0.00 0.00 177.00 175.29 2gfu s TRP 105 N -3.02 1.46 -0.36 6.54 0.52 -1.26 -4.43 118.94 118.40 2gfu s TRP 105 Ca 0.63 0.57 -0.07 0.00 0.02 0.00 0.00 56.10 57.25 2gfu s TRP 105 Cb -0.17 -4.02 0.05 0.00 -1.15 0.00 0.00 33.47 28.18 2gfu s TRP 105 CO 0.56 -3.59 0.14 -1.58 0.02 0.00 0.00 176.95 172.49 2gfu s TRP 106 N 7.60 3.29 -0.03 -1.98 0.23 -0.07 -4.89 118.94 123.09 2gfu s TRP 106 Ca 0.91 -1.49 -0.35 0.00 -2.03 0.00 0.00 56.10 53.14 2gfu s TRP 106 Cb -0.28 -2.45 -0.13 0.00 0.03 0.00 0.00 33.47 30.64 2gfu s TRP 106 CO 0.34 -0.76 1.78 -0.35 0.96 0.00 0.00 176.95 178.92 2gfu n PRO 107 N 4.82 2.07 -3.94 4.98 -0.04 -1.26 -0.77 135.00 140.84 2gfu n PRO 107 Ca -0.11 0.75 -0.10 0.00 -0.04 0.00 0.00 63.50 64.01 2gfu n PRO 107 Cb 0.44 -2.56 -0.07 0.00 -0.04 0.00 0.00 33.50 31.27 2gfu n PRO 107 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2gfu s SER 108 N 3.09 -0.00 -0.06 3.54 1.04 -0.16 -3.32 113.70 117.83 2gfu s SER 108 Ca 0.89 -0.85 0.03 0.00 0.48 0.00 0.00 55.95 56.51 2gfu s SER 108 Cb -0.72 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 65.84 2gfu s SER 108 CO 0.49 -0.93 -0.15 -0.22 0.98 0.00 0.00 173.24 173.41 2gfu s LEU 109 N -2.97 2.70 -0.09 2.42 2.96 -0.92 -2.12 118.68 120.67 2gfu s LEU 109 Ca 0.17 -0.23 -0.25 0.00 -0.22 0.00 0.00 54.13 53.61 2gfu s LEU 109 Cb 0.03 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 45.13 2gfu s LEU 109 CO 0.01 0.32 0.78 -0.69 -1.32 0.00 0.00 176.35 175.45 2gfu s VAL 110 N -0.56 4.97 0.03 1.68 1.01 -0.05 -0.97 120.40 126.51 2gfu s VAL 110 Ca 0.08 1.59 -0.00 0.00 0.00 0.00 0.00 61.98 63.65 2gfu s VAL 110 Cb -0.11 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 2gfu s VAL 110 CO 0.01 0.16 -0.03 -0.47 0.00 0.00 0.00 175.10 174.77 2gfu s TYR 111 N 1.27 0.39 -0.32 5.22 5.04 -0.77 -1.04 117.35 127.13 2gfu s TYR 111 Ca 0.40 -0.73 -0.10 0.00 -2.44 0.00 0.00 57.07 54.19 2gfu s TYR 111 Cb -0.18 -0.28 -0.00 0.00 0.35 0.00 0.00 41.96 41.85 2gfu s TYR 111 CO 0.18 -0.25 0.17 0.54 -1.34 0.00 0.00 175.55 174.84 2gfu s ASN 112 N -2.04 5.62 0.84 4.32 4.22 -1.26 -4.29 114.94 122.34 2gfu s ASN 112 Ca -0.07 -0.60 -0.11 0.00 -2.14 0.00 0.00 52.86 49.94 2gfu s ASN 112 Cb -0.03 -2.01 0.09 0.00 1.28 0.00 0.00 41.25 40.58 2gfu s ASN 112 CO -0.04 -0.23 1.10 -2.28 -2.04 0.00 0.00 177.10 173.60 2gfu s HIS 113 N 1.61 2.31 -0.95 1.54 2.46 -1.26 -4.88 115.29 116.12 2gfu s HIS 113 Ca 0.04 1.53 0.00 0.00 0.47 0.00 0.00 55.06 57.10 2gfu s HIS 113 Cb -0.17 -3.13 0.00 0.00 -0.13 0.00 0.00 32.58 29.15 2gfu s HIS 113 CO 0.07 -2.17 0.31 -2.30 -2.47 0.00 0.00 174.74 168.17 2gfu n PRO 114 N -3.77 0.00 -0.80 2.88 -0.02 -1.26 -1.67 135.00 130.35 2gfu n PRO 114 Ca 0.09 0.03 -0.16 0.00 -2.02 0.00 0.00 63.50 61.44 2gfu n PRO 114 Cb 0.53 -1.53 0.08 0.00 -0.02 0.00 0.00 33.50 32.56 2gfu n PRO 114 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2gfu n PHE 115 N -0.81 1.75 -2.10 6.00 3.01 -1.26 -5.03 117.46 119.03 2gfu n PHE 115 Ca 0.00 -1.63 -0.32 0.00 1.01 0.00 0.00 57.45 56.51 2gfu n PHE 115 Cb 0.03 -0.81 -0.00 0.00 -0.01 0.00 0.00 39.48 38.69 2gfu n PHE 115 CO 0.00 0.00 0.00 0.16 1.01 0.00 0.00 176.76 177.93 2gfu s ASP 116 N -0.21 6.18 0.00 4.37 -4.77 -0.67 -4.23 116.67 117.34 2gfu s ASP 116 Ca 0.34 1.61 0.00 0.00 -3.30 0.00 0.00 52.55 51.19 2gfu s ASP 116 Cb 0.27 -2.51 0.00 0.00 -1.09 0.00 0.00 42.92 39.60 2gfu s ASP 116 CO 0.03 -0.90 0.00 0.61 0.70 0.00 0.00 175.17 175.61 2gfu n GLY 117 N -1.72 0.80 3.17 2.12 0.00 -1.26 -5.03 105.19 103.26 2gfu n GLY 117 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 2gfu n GLY 117 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2gfu s THR 118 N -2.02 0.08 0.00 2.61 -1.32 -1.26 -5.09 115.64 108.63 2gfu s THR 118 Ca 0.00 -0.64 0.00 0.00 -1.21 0.00 0.00 61.69 59.84 2gfu s THR 118 Cb 0.00 -0.57 0.00 0.00 -1.51 0.00 0.00 72.50 70.42 2gfu s THR 118 CO 0.00 -0.35 0.25 2.22 -2.21 0.00 0.00 174.62 174.53 2gfu n PHE 119 N 1.27 0.00 -4.43 9.09 -1.74 -1.26 -4.92 117.46 115.47 2gfu n PHE 119 Ca -0.22 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.38 2gfu n PHE 119 Cb 0.56 0.07 -0.12 0.00 1.52 0.00 0.00 39.48 41.51 2gfu n PHE 119 CO 0.00 0.00 0.00 0.96 -0.56 0.00 0.00 176.76 177.16 2gfu s ILE 120 N 0.00 2.63 -0.01 1.97 -4.36 -1.26 -3.51 121.20 116.67 2gfu s ILE 120 Ca 0.00 -1.51 0.01 0.00 -0.26 0.00 0.00 60.65 58.89 2gfu s ILE 120 Cb 0.00 -2.17 0.00 0.00 1.25 0.00 0.00 42.46 41.54 2gfu s ILE 120 CO 0.00 0.15 -0.03 -0.13 0.24 0.00 0.00 174.94 175.18 2gfu s ARG 121 N -1.94 0.25 -0.13 0.37 1.81 -0.70 -5.03 118.95 113.57 2gfu s ARG 121 Ca 0.16 -0.09 -0.07 0.00 -1.72 0.00 0.00 55.73 54.01 2gfu s ARG 121 Cb -0.10 -0.27 0.05 0.00 -0.45 0.00 0.00 34.95 34.18 2gfu s ARG 121 CO 0.08 0.04 0.30 -1.83 -0.68 0.00 0.00 175.30 173.21 2gfu s GLU 122 N 0.05 0.27 -0.48 3.54 1.03 -1.26 -1.85 118.70 119.99 2gfu s GLU 122 Ca -0.00 0.63 0.02 0.00 0.03 0.00 0.00 54.97 55.64 2gfu s GLU 122 Cb -0.03 -0.08 0.13 0.00 -0.80 0.00 0.00 34.13 33.35 2gfu s GLU 122 CO -0.00 -0.16 0.23 0.15 -1.33 0.00 0.00 175.26 174.15 2gfu s LYS 123 N 1.34 1.96 0.00 -4.83 1.02 -1.24 -5.02 119.74 112.97 2gfu s LYS 123 Ca -0.09 -2.32 0.00 0.00 0.02 0.00 0.00 55.97 53.57 2gfu s LYS 123 Cb -0.10 -3.40 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 2gfu s LYS 123 CO -0.10 -1.07 0.00 0.41 -0.92 0.00 0.00 175.35 173.67 2gfu n GLY 124 N 3.64 1.03 2.42 -3.33 0.00 -1.26 -3.83 105.19 103.87 2gfu n GLY 124 Ca 0.04 0.12 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 2gfu n GLY 124 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2gfu n LYS 125 N 0.00 1.01 -3.60 1.61 4.81 -1.26 -5.09 118.16 115.64 2gfu n LYS 125 Ca 0.00 -2.84 -0.04 0.00 -0.87 0.00 0.00 58.31 54.55 2gfu n LYS 125 Cb 0.00 -1.39 -0.03 0.00 0.02 0.00 0.00 35.03 33.64 2gfu n LYS 125 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2gfu s SER 126 N -2.06 -0.13 -0.02 3.14 0.01 -1.25 -5.18 113.70 108.21 2gfu s SER 126 Ca 0.33 0.03 -0.00 0.00 1.31 0.00 0.00 55.95 57.61 2gfu s SER 126 Cb 0.34 0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.72 2gfu s SER 126 CO -0.06 -0.20 0.03 0.54 0.41 0.00 0.00 173.24 173.96 2gfu s VAL 127 N -2.11 -0.03 -0.12 3.43 0.11 -1.26 -3.65 120.40 116.77 2gfu s VAL 127 Ca 0.09 0.11 0.01 0.00 -2.93 0.00 0.00 61.98 59.25 2gfu s VAL 127 Cb -0.01 -0.07 -0.01 0.00 -1.53 0.00 0.00 36.38 34.76 2gfu s VAL 127 CO -0.05 0.04 -0.15 -0.13 -3.33 0.00 0.00 175.10 171.49 2gfu s ARG 128 N 0.55 3.29 0.06 1.54 0.52 -0.77 -0.34 118.95 123.80 2gfu s ARG 128 Ca -0.05 -0.72 0.07 0.00 -0.52 0.00 0.00 55.73 54.51 2gfu s ARG 128 Cb -0.06 -2.56 -0.03 0.00 0.52 0.00 0.00 34.95 32.82 2gfu s ARG 128 CO -0.02 0.22 -0.19 0.14 0.02 0.00 0.00 175.30 175.47 2gfu s VAL 129 N 0.31 1.57 0.15 3.52 -7.23 -1.25 -1.73 120.40 115.74 2gfu s VAL 129 Ca -0.12 -1.25 -0.28 0.00 -1.81 0.00 0.00 61.98 58.52 2gfu s VAL 129 Cb -0.16 -1.39 -0.07 0.00 0.56 0.00 0.00 36.38 35.32 2gfu s VAL 129 CO 0.06 0.09 0.89 -1.38 -0.31 0.00 0.00 175.10 174.45 2gfu s HIS 130 N -0.91 3.87 0.16 2.82 -3.43 -1.23 -3.92 115.29 112.65 2gfu s HIS 130 Ca 0.06 1.75 -0.08 0.00 -0.80 0.00 0.00 55.06 56.00 2gfu s HIS 130 Cb -0.09 -2.94 -0.01 0.00 -1.43 0.00 0.00 32.58 28.11 2gfu s HIS 130 CO 0.02 0.36 0.24 0.14 -2.00 0.00 0.00 174.74 173.50 2gfu s VAL 131 N -0.60 0.08 0.11 -5.38 -7.23 -1.24 -1.85 120.40 104.29 2gfu s VAL 131 Ca 0.42 -1.47 0.06 0.00 -1.81 0.00 0.00 61.98 59.17 2gfu s VAL 131 Cb -0.24 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.81 2gfu s VAL 131 CO 0.29 -0.34 -0.15 0.00 -0.31 0.00 0.00 175.10 174.59 2gfu s GLN 132 N -3.98 1.00 -0.20 4.82 -2.07 -0.14 -3.56 119.66 115.53 2gfu s GLN 132 Ca 0.18 -1.18 -0.04 0.00 -1.82 0.00 0.00 55.36 52.49 2gfu s GLN 132 Cb 0.04 -0.94 -0.01 0.00 -1.09 0.00 0.00 33.01 31.01 2gfu s GLN 132 CO -0.00 0.19 -0.03 -0.06 -1.32 0.00 0.00 175.29 174.06 2gfu s PHE 133 N -1.90 2.97 -1.20 9.60 0.08 -0.01 -2.16 117.98 125.36 2gfu s PHE 133 Ca 0.07 -0.73 -0.08 0.00 0.12 0.00 0.00 56.93 56.31 2gfu s PHE 133 Cb -0.06 -2.07 -0.07 0.00 -0.57 0.00 0.00 43.02 40.25 2gfu s PHE 133 CO 0.03 -0.40 2.44 1.19 -0.10 0.00 0.00 175.22 178.38 2gfu n PHE 134 N 4.47 1.84 0.00 0.36 3.72 -1.21 -2.64 117.46 124.01 2gfu n PHE 134 Ca -0.18 -2.42 0.00 0.00 -0.05 0.00 0.00 57.45 54.80 2gfu n PHE 134 Cb 0.51 -2.01 0.00 0.00 -0.94 0.00 0.00 39.48 37.04 2gfu n PHE 134 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2gfu n ASP 135 N 4.12 0.00 -0.02 4.37 5.75 -1.26 -3.95 116.55 125.56 2gfu n ASP 135 Ca 0.58 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 55.34 2gfu n ASP 135 Cb 0.18 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.27 2gfu n ASP 135 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2gfu n ASP 136 N 0.00 0.71 0.09 -1.12 8.00 -1.26 -4.79 116.55 118.18 2gfu n ASP 136 Ca 0.00 0.11 -0.19 0.00 0.71 0.00 0.00 54.79 55.42 2gfu n ASP 136 Cb 0.00 -0.45 -0.11 0.00 -0.02 0.00 0.00 41.12 40.54 2gfu n ASP 136 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2gfu h SER 137 N -0.28 0.72 -3.18 -2.24 4.64 -1.97 -3.48 113.55 107.76 2gfu h SER 137 Ca 0.00 -0.66 -0.21 0.00 -0.47 0.00 0.00 61.79 60.45 2gfu h SER 137 Cb 0.28 -0.23 0.08 0.00 -0.31 0.00 0.00 62.40 62.22 2gfu h SER 137 CO 0.00 1.48 0.17 -0.81 -0.87 0.00 0.00 176.83 176.80 2gfu n PRO 138 N -3.73 -0.45 -3.76 4.77 -0.04 -1.26 -4.57 135.00 125.95 2gfu n PRO 138 Ca -0.11 -1.06 -0.28 0.00 -0.04 0.00 0.00 63.50 62.01 2gfu n PRO 138 Cb 0.96 -0.60 -0.03 0.00 -0.04 0.00 0.00 33.50 33.79 2gfu n PRO 138 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2gfu s THR 139 N -2.20 5.24 0.18 0.52 -1.32 -1.08 -4.92 115.64 112.05 2gfu s THR 139 Ca 0.36 -0.41 -0.21 0.00 -1.21 0.00 0.00 61.69 60.22 2gfu s THR 139 Cb -0.01 -3.72 0.05 0.00 -1.51 0.00 0.00 72.50 67.31 2gfu s THR 139 CO 0.25 -0.12 0.58 -0.60 -2.21 0.00 0.00 174.62 172.51 2gfu s ARG 140 N -3.21 1.33 0.00 7.08 3.52 -1.26 -0.83 118.95 125.58 2gfu s ARG 140 Ca 0.38 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 55.34 2gfu s ARG 140 Cb -0.11 0.57 0.00 0.00 -1.56 0.00 0.00 34.95 33.84 2gfu s ARG 140 CO 0.29 -0.58 0.00 0.41 -0.81 0.00 0.00 175.30 174.61 2gfu n GLY 141 N -0.36 0.96 3.35 8.12 0.00 -1.23 -5.02 105.19 111.00 2gfu n GLY 141 Ca -0.14 -0.71 -0.45 0.00 0.00 0.00 0.00 46.02 44.72 2gfu n GLY 141 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gfu s TRP 142 N -2.63 3.09 0.94 1.61 0.52 -1.26 -3.59 118.94 117.62 2gfu s TRP 142 Ca 0.00 -1.09 -0.14 0.00 0.02 0.00 0.00 56.10 54.89 2gfu s TRP 142 Cb 0.00 -3.94 0.20 0.00 -1.15 0.00 0.00 33.47 28.58 2gfu s TRP 142 CO 0.00 -1.20 1.29 0.14 0.02 0.00 0.00 176.95 177.21 2gfu s VAL 143 N 2.29 2.01 -0.15 4.03 -7.23 -1.25 -5.01 120.40 115.08 2gfu s VAL 143 Ca 0.08 -0.08 -0.15 0.00 -1.81 0.00 0.00 61.98 60.02 2gfu s VAL 143 Cb -0.26 -2.93 -0.04 0.00 0.56 0.00 0.00 36.38 33.71 2gfu s VAL 143 CO 0.05 0.00 0.35 -0.44 -0.31 0.00 0.00 175.10 174.75 2gfu s SER 144 N -4.90 6.51 0.00 4.85 0.01 -1.26 -3.93 113.70 114.97 2gfu s SER 144 Ca 0.74 0.60 0.28 0.00 1.31 0.00 0.00 55.95 58.88 2gfu s SER 144 Cb -0.03 -2.21 1.24 0.00 0.21 0.00 0.00 66.02 65.22 2gfu s SER 144 CO 0.52 0.07 1.92 2.29 0.41 0.00 0.00 173.24 178.45 2gfu n LYS 145 N 3.60 0.04 0.10 12.44 2.85 0.54 -2.57 118.16 135.16 2gfu n LYS 145 Ca -0.10 0.01 0.11 0.00 -1.05 0.00 0.00 58.31 57.28 2gfu n LYS 145 Cb 0.52 -1.50 0.46 0.00 -0.65 0.00 0.00 35.03 33.85 2gfu n LYS 145 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 2gfu n ARG 146 N -1.48 0.17 -0.04 -1.58 1.85 -1.25 -2.60 116.66 111.73 2gfu n ARG 146 Ca 0.07 0.34 0.12 0.00 -1.00 0.00 0.00 57.85 57.39 2gfu n ARG 146 Cb 0.32 -1.79 0.24 0.00 -1.05 0.00 0.00 32.46 30.19 2gfu n ARG 146 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2gfu n LEU 147 N -2.10 2.62 -4.86 2.89 4.77 -1.06 -4.92 117.00 114.35 2gfu n LEU 147 Ca 0.03 -0.94 -0.37 0.00 -0.03 0.00 0.00 56.01 54.71 2gfu n LEU 147 Cb 0.26 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 2gfu n LEU 147 CO 0.21 0.47 0.03 -0.76 -1.33 0.00 0.00 177.39 176.01 2gfu s LEU 148 N -1.89 4.42 0.25 2.23 1.43 -1.07 -1.78 118.68 122.27 2gfu s LEU 148 Ca 0.32 0.79 0.10 0.00 -1.03 0.00 0.00 54.13 54.32 2gfu s LEU 148 Cb 0.20 -2.61 -0.05 0.00 0.03 0.00 0.00 46.19 43.77 2gfu s LEU 148 CO 0.31 0.29 -0.10 -0.54 0.23 0.00 0.00 176.35 176.54 2gfu s LYS 149 N -1.35 2.00 0.46 1.70 1.02 0.14 -4.78 119.74 118.92 2gfu s LYS 149 Ca 0.25 -1.51 -0.20 0.00 0.02 0.00 0.00 55.97 54.53 2gfu s LYS 149 Cb -0.15 -2.01 -0.10 0.00 -0.52 0.00 0.00 37.83 35.05 2gfu s LYS 149 CO 0.13 0.37 0.96 -1.25 -0.92 0.00 0.00 175.35 174.64 2gfu s PRO 150 N -3.40 4.14 -0.19 -1.68 0.04 -1.26 -0.73 135.00 131.92 2gfu s PRO 150 Ca 0.29 1.07 0.01 0.00 0.04 0.00 0.00 61.00 62.41 2gfu s PRO 150 Cb -0.06 -2.17 0.03 0.00 0.04 0.00 0.00 34.50 32.34 2gfu s PRO 150 CO 0.17 -0.11 -0.16 -0.47 0.04 0.00 0.00 177.00 176.47 2gfu s TYR 151 N -2.32 2.68 0.00 0.56 5.04 -0.79 -4.65 117.35 117.86 2gfu s TYR 151 Ca 0.61 -1.67 0.00 0.00 -2.44 0.00 0.00 57.07 53.57 2gfu s TYR 151 Cb -0.09 -1.81 0.00 0.00 0.35 0.00 0.00 41.96 40.41 2gfu s TYR 151 CO 0.19 -0.78 0.66 -2.37 -1.34 0.00 0.00 175.55 171.90 2gfu n THR 152 N 4.63 0.00 -2.92 4.34 5.66 -1.26 -4.71 114.28 120.02 2gfu n THR 152 Ca -0.18 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.68 2gfu n THR 152 Cb 0.48 0.18 0.00 0.00 -1.55 0.00 0.00 70.33 69.44 2gfu n THR 152 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2gfu n GLY 153 N 0.00 1.07 0.03 1.09 0.00 -1.26 -4.97 105.19 101.15 2gfu n GLY 153 Ca -0.10 -0.49 0.04 0.00 0.00 0.00 0.00 46.02 45.47 2gfu n GLY 153 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2gfu n SER 154 N 1.61 0.13 -0.90 1.61 7.64 -1.26 -1.52 113.62 120.93 2gfu n SER 154 Ca 0.14 0.55 0.05 0.00 1.01 0.00 0.00 58.87 60.62 2gfu n SER 154 Cb 0.59 -0.57 0.15 0.00 -1.01 0.00 0.00 64.21 63.37 2gfu n SER 154 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2gfu n LYS 155 N -1.66 1.05 -3.62 1.43 2.85 -1.26 -4.65 118.16 112.31 2gfu n LYS 155 Ca 0.01 -2.86 -0.37 0.00 -1.05 0.00 0.00 58.31 54.03 2gfu n LYS 155 Cb 0.07 -1.08 -0.06 0.00 -0.65 0.00 0.00 35.03 33.31 2gfu n LYS 155 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2gfu s SER 156 N -2.82 6.57 0.35 -5.58 0.15 -0.58 -4.98 113.70 106.81 2gfu s SER 156 Ca 0.37 0.67 0.13 0.00 0.70 0.00 0.00 55.95 57.82 2gfu s SER 156 Cb 0.38 -2.18 0.99 0.00 -1.71 0.00 0.00 66.02 63.50 2gfu s SER 156 CO -0.10 0.27 1.73 0.50 1.20 0.00 0.00 173.24 176.83 2gfu h LYS 157 N 5.46 0.47 0.00 5.44 1.63 -1.95 0.53 116.57 128.15 2gfu h LYS 157 Ca -0.49 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 2gfu h LYS 157 Cb 1.20 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.73 2gfu h LYS 157 CO 0.65 0.31 0.00 1.05 -3.45 0.00 0.00 179.45 178.01 2gfu h GLU 158 N 0.48 0.00 -0.02 1.90 9.09 -1.92 -3.15 114.58 120.96 2gfu h GLU 158 Ca 0.65 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.06 2gfu h GLU 158 Cb 1.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.51 2gfu h GLU 158 CO -0.44 0.00 -0.11 0.00 0.05 0.00 0.00 179.01 178.50 2gfu n ALA 159 N -1.99 2.76 -4.26 1.06 0.00 0.18 -2.05 120.51 116.21 2gfu n ALA 159 Ca 0.03 -0.60 -0.12 0.00 0.00 0.00 0.00 53.44 52.75 2gfu n ALA 159 Cb 0.39 -0.92 -0.02 0.00 0.00 0.00 0.00 19.45 18.90 2gfu n ALA 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gfu n GLN 160 N 0.63 1.54 -2.24 0.00 -0.00 -0.96 -4.80 117.38 111.55 2gfu n GLN 160 Ca 0.14 -1.35 -0.42 0.00 -0.00 0.00 0.00 57.00 55.37 2gfu n GLN 160 Cb 0.49 0.35 -0.03 0.00 -0.00 0.00 0.00 30.24 31.06 2gfu n GLN 160 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 2gfu s LYS 161 N -2.68 4.25 0.00 2.61 2.20 -1.26 -1.22 119.74 123.64 2gfu s LYS 161 Ca 0.00 1.92 0.00 0.00 -0.36 0.00 0.00 55.97 57.53 2gfu s LYS 161 Cb -0.00 -3.73 0.00 0.00 -1.51 0.00 0.00 37.83 32.59 2gfu s LYS 161 CO 0.00 -0.67 0.00 0.41 -0.36 0.00 0.00 175.35 174.73 2gfu n GLY 162 N 3.74 0.18 3.90 5.54 0.00 -1.26 -5.08 105.19 112.21 2gfu n GLY 162 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2gfu n GLY 162 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gfu s GLY 163 N -1.79 1.70 0.22 -0.02 0.00 -0.36 -4.94 107.32 102.13 2gfu s GLY 163 Ca 0.00 -0.43 -0.08 0.00 0.00 0.00 0.00 44.72 44.21 2gfu s GLY 163 CO 0.00 -0.27 1.86 0.45 0.00 0.00 0.00 173.10 175.14 2gfu h HIS 164 N 0.85 0.91 -0.18 1.90 3.86 -1.75 -3.29 115.15 117.45 2gfu h HIS 164 Ca -0.47 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 2gfu h HIS 164 Cb 1.20 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 29.37 2gfu h HIS 164 CO 0.59 0.51 0.00 1.97 0.86 0.00 0.00 177.93 181.86 2gfu n PHE 165 N -4.62 0.22 -4.00 2.45 1.16 -0.87 -4.95 117.46 106.85 2gfu n PHE 165 Ca 0.09 -0.16 -0.34 0.00 -1.87 0.00 0.00 57.45 55.17 2gfu n PHE 165 Cb 0.10 -0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.90 2gfu n PHE 165 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 2gfu s TYR 166 N -1.25 3.45 -0.18 2.97 6.14 -1.23 -4.78 117.35 122.48 2gfu s TYR 166 Ca 0.24 0.33 -0.29 0.00 0.64 0.00 0.00 57.07 58.00 2gfu s TYR 166 Cb 0.15 -1.82 0.12 0.00 0.42 0.00 0.00 41.96 40.82 2gfu s TYR 166 CO 0.21 0.62 0.95 -1.12 0.64 0.00 0.00 175.55 176.85 2gfu s SER 167 N -1.60 -0.45 -0.46 4.32 0.01 -1.26 -4.78 113.70 109.48 2gfu s SER 167 Ca 0.22 0.61 -0.08 0.00 1.31 0.00 0.00 55.95 58.01 2gfu s SER 167 Cb -0.12 0.53 0.12 0.00 0.21 0.00 0.00 66.02 66.75 2gfu s SER 167 CO 0.13 -0.33 0.31 0.00 0.41 0.00 0.00 173.24 173.76 2gfu s ALA 168 N -0.73 3.34 -0.06 1.44 0.00 -1.26 -4.57 121.76 119.91 2gfu s ALA 168 Ca -0.02 -2.55 0.06 0.00 0.00 0.00 0.00 51.96 49.45 2gfu s ALA 168 Cb -0.02 -2.73 -0.01 0.00 0.00 0.00 0.00 23.12 20.37 2gfu s ALA 168 CO 0.01 -1.88 -0.24 0.21 0.00 0.00 0.00 175.76 173.86 2gfu s LYS 169 N 1.29 2.52 0.62 0.00 2.20 -1.26 -5.07 119.74 120.04 2gfu s LYS 169 Ca 0.06 -0.86 0.36 0.00 -0.36 0.00 0.00 55.97 55.18 2gfu s LYS 169 Cb -0.25 -2.10 2.05 0.00 -1.51 0.00 0.00 37.83 36.02 2gfu s LYS 169 CO -0.02 0.33 2.29 -1.00 -0.36 0.00 0.00 175.35 176.59 2gfu h PRO 170 N 6.19 0.00 -0.23 4.03 0.13 -1.99 -2.09 132.00 138.04 2gfu h PRO 170 Ca -0.30 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.69 2gfu h PRO 170 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2gfu h PRO 170 CO 0.47 0.01 -0.45 0.93 -0.23 0.00 0.00 178.00 178.73 2gfu h GLU 171 N 0.00 0.59 -0.26 0.86 4.39 -1.91 0.87 114.58 119.12 2gfu h GLU 171 Ca -0.00 -0.33 -0.19 0.00 0.34 0.00 0.00 59.36 59.18 2gfu h GLU 171 Cb 0.04 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2gfu h GLU 171 CO 0.00 0.92 -0.58 0.82 -1.16 0.00 0.00 179.01 179.01 2gfu h ILE 172 N 0.48 1.28 -0.09 3.13 1.08 -1.67 -2.43 117.51 119.28 2gfu h ILE 172 Ca 0.03 -1.77 -0.01 0.00 -0.39 0.00 0.00 64.86 62.72 2gfu h ILE 172 Cb 0.97 1.71 -0.00 0.00 -3.07 0.00 0.00 36.82 36.43 2gfu h ILE 172 CO 0.09 0.57 -0.00 -0.07 -0.69 0.00 0.00 178.15 178.05 2gfu h LEU 173 N 0.62 0.15 -1.59 1.44 3.38 -1.51 -2.72 115.31 115.09 2gfu h LEU 173 Ca 0.00 -0.32 0.06 0.00 0.09 0.00 0.00 57.88 57.71 2gfu h LEU 173 Cb 1.20 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 2gfu h LEU 173 CO 0.13 0.44 0.37 -0.09 0.09 0.00 0.00 178.44 179.37 2gfu h ARG 174 N -0.14 0.49 -0.20 1.13 1.12 -0.82 0.24 114.38 116.20 2gfu h ARG 174 Ca 0.02 -0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 58.81 2gfu h ARG 174 Cb 0.36 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 30.20 2gfu h ARG 174 CO 0.01 0.33 -0.10 0.00 -3.11 0.00 0.00 179.97 177.10 2gfu h ALA 175 N 1.70 0.28 -0.17 2.80 0.00 -1.48 0.94 119.26 123.32 2gfu h ALA 175 Ca 0.24 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2gfu h ALA 175 Cb 0.29 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2gfu h ALA 175 CO -0.07 0.11 -0.11 0.52 0.00 0.00 0.00 179.25 179.70 2gfu h MET 176 N 0.11 0.27 -0.07 0.00 2.86 -1.02 0.21 114.93 117.30 2gfu h MET 176 Ca 0.04 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2gfu h MET 176 Cb 0.58 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 2gfu h MET 176 CO 0.03 0.40 -0.04 1.96 1.06 0.00 0.00 176.91 180.31 2gfu h GLN 177 N 0.26 0.15 0.35 1.72 1.08 -0.86 0.31 115.11 118.11 2gfu h GLN 177 Ca 0.05 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 2gfu h GLN 177 Cb 0.37 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 2gfu h GLN 177 CO 0.02 0.55 -0.17 0.00 -0.95 0.00 0.00 178.83 178.28 2gfu h ARG 178 N -0.26 -0.45 -0.47 1.46 3.08 -0.81 -2.58 114.38 114.35 2gfu h ARG 178 Ca 0.01 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.10 2gfu h ARG 178 Cb 0.51 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 2gfu h ARG 178 CO 0.01 -0.29 0.31 0.00 -1.07 0.00 0.00 179.97 178.93 2gfu h ALA 179 N 0.16 0.59 -0.86 0.04 0.00 -1.06 -2.89 119.26 115.24 2gfu h ALA 179 Ca -0.05 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.92 2gfu h ALA 179 Cb 0.37 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 2gfu h ALA 179 CO 0.08 0.03 0.56 0.22 0.00 0.00 0.00 179.25 180.14 2gfu h ASP 180 N 0.62 0.79 -0.28 0.00 3.58 -0.93 -0.25 116.42 119.96 2gfu h ASP 180 Ca 0.17 0.02 -0.18 0.00 0.42 0.00 0.00 57.03 57.46 2gfu h ASP 180 Cb -0.06 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 40.84 2gfu h ASP 180 CO -0.04 0.48 -0.52 1.05 -2.88 0.00 0.00 179.24 177.33 2gfu h GLU 181 N 0.88 0.87 0.00 0.28 4.11 -1.29 -2.50 114.58 116.93 2gfu h GLU 181 Ca 0.39 -0.53 -0.17 0.00 0.07 0.00 0.00 59.36 59.12 2gfu h GLU 181 Cb 0.36 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2gfu h GLU 181 CO -0.16 1.17 -0.79 0.00 0.07 0.00 0.00 179.01 179.30 2gfu h ALA 182 N 0.73 0.63 0.02 1.06 0.00 -1.28 -1.98 119.26 118.43 2gfu h ALA 182 Ca 0.02 -0.72 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 2gfu h ALA 182 Cb 1.12 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2gfu h ALA 182 CO 0.12 0.99 -0.01 1.25 0.00 0.00 0.00 179.25 181.60 2gfu h LEU 183 N 0.00 -0.02 0.00 0.00 6.46 -1.13 -3.14 115.31 117.48 2gfu h LEU 183 Ca -0.01 -0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.56 2gfu h LEU 183 Cb 1.46 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.39 2gfu h LEU 183 CO 0.10 0.18 -0.91 -3.20 -0.62 0.00 0.00 178.44 173.99 2gfu n ASN 184 N -5.01 0.70 0.00 1.25 5.15 -0.94 -4.87 115.26 111.54 2gfu n ASN 184 Ca -0.08 0.09 0.00 0.00 -0.60 0.00 0.00 54.58 53.99 2gfu n ASN 184 Cb 0.12 0.49 0.00 0.00 -0.53 0.00 0.00 39.78 39.87 2gfu n ASN 184 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2gfu n LYS 185 N -2.25 0.00 -4.08 1.20 5.02 -0.74 -5.06 118.16 112.25 2gfu n LYS 185 Ca 0.02 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.17 2gfu n LYS 185 Cb 0.48 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.37 2gfu n LYS 185 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2gfu s ASP 186 N 1.00 0.92 0.47 4.39 2.15 -1.19 -4.94 116.67 119.48 2gfu s ASP 186 Ca 0.00 -0.54 0.25 0.00 0.43 0.00 0.00 52.55 52.69 2gfu s ASP 186 Cb 0.00 0.02 1.29 0.00 -0.30 0.00 0.00 42.92 43.93 2gfu s ASP 186 CO 0.00 -0.18 1.86 0.07 -0.17 0.00 0.00 175.17 176.75 2gfu h LYS 187 N 4.55 0.20 -1.05 4.34 -0.00 -1.82 -3.02 116.57 119.76 2gfu h LYS 187 Ca -0.36 -0.01 0.30 0.00 -0.00 0.00 0.00 60.65 60.58 2gfu h LYS 187 Cb 1.20 -0.04 -0.05 0.00 -0.00 0.00 0.00 32.23 33.34 2gfu h LYS 187 CO 0.41 0.13 0.75 0.97 -0.00 0.00 0.00 179.45 181.71 2gfu h ILE 188 N 0.20 0.48 -0.58 0.07 2.10 -1.93 0.23 117.51 118.09 2gfu h ILE 188 Ca 0.47 -0.02 -0.00 0.00 1.08 0.00 0.00 64.86 66.39 2gfu h ILE 188 Cb 1.50 0.42 -0.03 0.00 -1.09 0.00 0.00 36.82 37.62 2gfu h ILE 188 CO -0.11 0.01 0.36 0.11 -1.08 0.00 0.00 178.15 177.44 2gfu h LYS 189 N 0.06 0.77 -0.02 2.19 6.56 -1.91 -2.44 116.57 121.77 2gfu h LYS 189 Ca 0.51 -0.06 -0.15 0.00 -1.06 0.00 0.00 60.65 59.90 2gfu h LYS 189 Cb 1.94 -0.17 0.01 0.00 -0.57 0.00 0.00 32.23 33.44 2gfu h LYS 189 CO -0.05 0.53 -0.57 0.00 -2.06 0.00 0.00 179.45 177.31 2gfu h ARG 190 N 0.79 0.42 0.00 3.15 2.47 -0.78 -3.37 114.38 117.06 2gfu h ARG 190 Ca 0.21 -0.43 0.00 0.00 -1.26 0.00 0.00 59.98 58.50 2gfu h ARG 190 Cb -0.05 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 2gfu h ARG 190 CO -0.04 1.08 0.00 -0.07 0.56 0.00 0.00 179.97 181.50 2gfu h LEU 191 N -0.07 0.00 -0.81 3.04 4.07 -1.41 0.55 115.31 120.68 2gfu h LEU 191 Ca -0.06 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.82 2gfu h LEU 191 Cb 1.26 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.98 2gfu h LEU 191 CO 0.11 0.00 0.09 -0.08 -1.08 0.00 0.00 178.44 177.48 2gfu h GLU 192 N 0.00 0.98 0.00 1.13 4.57 -1.59 -3.37 114.58 116.30 2gfu h GLU 192 Ca 0.00 -0.25 -0.37 0.00 -1.18 0.00 0.00 59.36 57.56 2gfu h GLU 192 Cb 0.39 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 28.81 2gfu h GLU 192 CO 0.00 0.91 -2.22 1.28 -1.18 0.00 0.00 179.01 177.81 2gfu n LEU 193 N -4.22 1.74 0.00 1.64 4.77 -0.51 -5.08 117.00 115.34 2gfu n LEU 193 Ca 0.04 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 2gfu n LEU 193 Cb 0.28 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 2gfu n LEU 193 CO 0.42 0.42 0.00 0.00 -1.33 0.00 0.00 177.39 176.90 2gfu n ALA 194 N -4.13 0.00 -2.94 -1.18 0.00 0.18 -3.56 120.51 108.88 2gfu n ALA 194 Ca -0.45 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.65 2gfu n ALA 194 Cb 0.80 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.23 2gfu n ALA 194 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2gfu n VAL 195 N 0.00 4.36 -2.61 0.00 3.14 -1.26 -4.84 118.33 117.11 2gfu n VAL 195 Ca 0.00 -5.72 -0.42 0.00 -2.96 0.00 0.00 64.34 55.24 2gfu n VAL 195 Cb 0.00 -1.70 0.01 0.00 -1.06 0.00 0.00 33.84 31.09 2gfu n VAL 195 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2gfu n SER 196 N 0.30 6.23 -3.54 6.55 3.41 -1.23 -4.94 113.62 120.40 2gfu n SER 196 Ca 0.35 -3.31 -0.40 0.00 -0.26 0.00 0.00 58.87 55.25 2gfu n SER 196 Cb 0.34 -1.34 -0.01 0.00 -0.26 0.00 0.00 64.21 62.93 2gfu n SER 196 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2gfu n ASP 197 N 2.11 5.97 -3.56 4.04 8.00 -1.26 -4.78 116.55 127.07 2gfu n ASP 197 Ca 0.37 -2.71 -0.11 0.00 0.71 0.00 0.00 54.79 53.05 2gfu n ASP 197 Cb 0.32 -1.60 -0.04 0.00 -0.02 0.00 0.00 41.12 39.79 2gfu n ASP 197 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2gfu s GLU 198 N 2.80 1.14 0.59 -1.24 -1.05 -1.26 -5.09 118.70 114.59 2gfu s GLU 198 Ca 0.57 -0.60 -0.09 0.00 -0.15 0.00 0.00 54.97 54.70 2gfu s GLU 198 Cb 0.16 0.51 0.13 0.00 -0.44 0.00 0.00 34.13 34.49 2gfu s GLU 198 CO -0.07 -0.46 0.80 -0.35 0.95 0.00 0.00 175.26 176.13 2gfu n PRO 199 N -0.24 -0.67 -2.02 -4.83 -0.04 -1.26 -4.99 135.00 120.95 2gfu n PRO 199 Ca -0.17 -1.36 -0.40 0.00 -0.04 0.00 0.00 63.50 61.54 2gfu n PRO 199 Cb 0.64 -0.79 -0.00 0.00 -0.04 0.00 0.00 33.50 33.30 2gfu n PRO 199 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2gfu n SER 200 N -3.45 8.02 0.00 3.54 2.88 -1.26 -5.22 113.62 118.14 2gfu n SER 200 Ca 0.10 -3.17 0.00 0.00 -1.33 0.00 0.00 58.87 54.48 2gfu n SER 200 Cb 0.36 -1.35 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 2gfu n SER 200 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97