#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 0.00 -2.28 7.82 0.00 -1.26 -4.79 120.51 120.00 2gfu n ALA 69 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2gfu n ALA 69 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2gfu n ALA 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2gfu s LYS 70 N 0.00 1.31 -0.13 0.00 -2.85 -1.26 -5.16 119.74 111.65 2gfu s LYS 70 Ca 0.00 -1.69 -0.06 0.00 -1.00 0.00 0.00 55.97 53.22 2gfu s LYS 70 Cb 0.00 -0.17 -0.04 0.00 -2.06 0.00 0.00 37.83 35.56 2gfu s LYS 70 CO 0.00 -0.28 0.07 1.21 0.10 0.00 0.00 175.35 176.45 2gfu s ASN 71 N -3.26 5.81 0.01 0.03 3.84 -1.26 -5.08 114.94 115.03 2gfu s ASN 71 Ca 0.35 0.24 -0.29 0.00 0.21 0.00 0.00 52.86 53.37 2gfu s ASN 71 Cb 0.07 -1.86 0.10 0.00 -0.55 0.00 0.00 41.25 39.01 2gfu s ASN 71 CO 0.11 0.32 1.12 -0.22 -2.79 0.00 0.00 177.10 175.64 2gfu s LEU 72 N -0.48 -0.15 0.19 3.21 2.96 -1.26 -5.08 118.68 118.07 2gfu s LEU 72 Ca 0.10 -0.18 0.20 0.00 -0.22 0.00 0.00 54.13 54.03 2gfu s LEU 72 Cb -0.12 1.72 -0.00 0.00 0.50 0.00 0.00 46.19 48.29 2gfu s LEU 72 CO 0.02 -0.53 1.07 0.78 -1.32 0.00 0.00 176.35 176.37 2gfu h ASN 73 N 2.00 0.00 0.00 3.68 4.21 -1.91 -3.49 115.58 120.07 2gfu h ASN 73 Ca -0.24 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.27 2gfu h ASN 73 Cb 1.21 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.41 2gfu h ASN 73 CO 0.27 0.22 0.00 0.61 -1.29 0.00 0.00 177.43 177.24 2gfu n GLY 74 N 1.24 1.00 1.28 2.83 0.00 -1.26 -4.83 105.19 105.45 2gfu n GLY 74 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.01 -1.73 3.01 -0.02 0.00 -1.26 -4.78 105.19 98.39 2gfu n GLY 75 Ca 0.00 0.49 -0.42 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.01 6.05 -0.32 0.99 4.77 -1.26 -4.83 117.00 119.38 2gfu n LEU 76 Ca 0.00 -3.96 0.15 0.00 -0.03 0.00 0.00 56.01 52.16 2gfu n LEU 76 Cb 0.00 -1.65 0.38 0.00 -2.33 0.00 0.00 43.42 39.82 2gfu n LEU 76 CO 0.00 0.67 1.21 -0.09 -1.33 0.00 0.00 177.39 177.84 2gfu h ARG 77 N 6.66 0.64 -0.36 3.23 2.43 -1.97 -0.07 114.38 124.95 2gfu h ARG 77 Ca 0.52 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 2gfu h ARG 77 Cb 0.71 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2gfu h ARG 77 CO 1.76 0.43 0.00 0.54 -1.51 0.00 0.00 179.97 181.19 2gfu n ARG 78 N -4.68 2.70 0.00 0.20 5.12 -1.26 -4.91 116.66 113.82 2gfu n ARG 78 Ca 0.22 -2.05 0.00 0.00 -1.93 0.00 0.00 57.85 54.09 2gfu n ARG 78 Cb 0.61 -1.29 0.00 0.00 -1.16 0.00 0.00 32.46 30.62 2gfu n ARG 78 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2gfu n SER 79 N 0.63 0.00 -4.26 0.55 3.41 -0.04 -4.43 113.62 109.48 2gfu n SER 79 Ca 0.12 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.30 2gfu n SER 79 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2gfu n SER 79 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2gfu n VAL 80 N 0.00 4.22 -3.83 -3.33 0.31 -1.26 -4.86 118.33 109.57 2gfu n VAL 80 Ca 0.00 -4.49 -0.36 0.00 -0.01 0.00 0.00 64.34 59.48 2gfu n VAL 80 Cb 0.00 -2.43 -0.07 0.00 -0.91 0.00 0.00 33.84 30.44 2gfu n VAL 80 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gfu s ALA 81 N 1.54 3.82 -1.37 3.52 0.00 -1.26 -5.03 121.76 122.98 2gfu s ALA 81 Ca 0.43 -0.65 -0.12 0.00 0.00 0.00 0.00 51.96 51.62 2gfu s ALA 81 Cb 0.02 -2.03 -0.05 0.00 0.00 0.00 0.00 23.12 21.06 2gfu s ALA 81 CO 0.01 0.48 2.51 -0.35 0.00 0.00 0.00 175.76 178.41 2gfu n PRO 82 N 2.44 2.97 0.00 0.00 -0.04 -1.26 -4.11 135.00 135.00 2gfu n PRO 82 Ca -0.19 -2.14 0.00 0.00 -0.04 0.00 0.00 63.50 61.13 2gfu n PRO 82 Cb 0.54 -2.88 0.00 0.00 -0.04 0.00 0.00 33.50 31.12 2gfu n PRO 82 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gfu n ALA 83 N 4.77 1.24 -2.93 0.55 0.00 -1.26 -5.09 120.51 117.78 2gfu n ALA 83 Ca 0.62 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.67 2gfu n ALA 83 Cb 0.27 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.61 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 -1.57 3.22 -0.01 0.00 0.00 -1.26 -5.00 121.76 117.14 2gfu s ALA 84 Ca 0.00 -1.57 -0.19 0.00 0.00 0.00 0.00 51.96 50.20 2gfu s ALA 84 Cb 0.00 -2.42 -0.33 0.00 0.00 0.00 0.00 23.12 20.37 2gfu s ALA 84 CO 0.00 -1.14 0.95 -1.00 0.00 0.00 0.00 175.76 174.57 2gfu h PRO 85 N 8.35 0.42 -1.55 0.00 0.13 -1.96 -3.45 132.00 133.95 2gfu h PRO 85 Ca -0.28 -0.70 0.08 0.00 -0.87 0.00 0.00 66.00 64.23 2gfu h PRO 85 Cb 1.12 0.26 -0.24 0.00 0.13 0.00 0.00 31.00 32.26 2gfu h PRO 85 CO 0.63 1.33 0.53 0.99 -0.23 0.00 0.00 178.00 181.25 2gfu s THR 86 N -2.55 0.00 0.00 1.56 2.01 -1.26 -5.06 115.64 110.34 2gfu s THR 86 Ca -0.12 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.88 2gfu s THR 86 Cb 0.02 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.53 2gfu s THR 86 CO 0.88 0.00 0.00 -1.20 -0.69 0.00 0.00 174.62 173.61 2gfu n SER 87 N 1.28 0.00 -1.88 3.53 7.64 -1.26 -5.13 113.62 117.81 2gfu n SER 87 Ca -0.11 -0.87 -0.01 0.00 1.01 0.00 0.00 58.87 58.89 2gfu n SER 87 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2gfu n SER 87 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2gfu n SER 88 N -0.10 -3.50 -3.27 6.43 3.41 -1.26 -4.95 113.62 110.38 2gfu n SER 88 Ca 0.00 0.05 -0.07 0.00 -0.26 0.00 0.00 58.87 58.59 2gfu n SER 88 Cb 0.00 -2.11 -0.04 0.00 -0.26 0.00 0.00 64.21 61.80 2gfu n SER 88 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2gfu s ASP 89 N -1.90 -0.24 -0.12 4.04 -4.77 -1.26 -4.14 116.67 108.28 2gfu s ASP 89 Ca 0.03 -0.78 0.02 0.00 -3.30 0.00 0.00 52.55 48.52 2gfu s ASP 89 Cb -0.01 1.33 0.01 0.00 -1.09 0.00 0.00 42.92 43.17 2gfu s ASP 89 CO 0.19 -0.26 -0.19 -0.36 0.70 0.00 0.00 175.17 175.25 2gfu s PHE 90 N 2.05 2.30 0.42 2.11 0.08 -1.26 -5.14 117.98 118.53 2gfu s PHE 90 Ca 0.14 -1.11 0.07 0.00 0.12 0.00 0.00 56.93 56.15 2gfu s PHE 90 Cb -0.10 -1.60 -0.04 0.00 -0.57 0.00 0.00 43.02 40.70 2gfu s PHE 90 CO -0.15 -0.53 0.24 -1.54 -0.10 0.00 0.00 175.22 173.14 2gfu s SER 91 N 0.87 4.60 0.31 1.36 1.04 -1.26 -5.01 113.70 115.61 2gfu s SER 91 Ca -0.08 -1.00 -0.28 0.00 0.48 0.00 0.00 55.95 55.07 2gfu s SER 91 Cb -0.15 -0.47 -0.13 0.00 0.10 0.00 0.00 66.02 65.36 2gfu s SER 91 CO -0.01 -0.59 1.18 -0.81 0.98 0.00 0.00 173.24 173.99 2gfu n PRO 92 N -1.34 1.79 0.00 4.02 -0.04 -1.26 -3.89 135.00 134.28 2gfu n PRO 92 Ca 0.00 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 2gfu n PRO 92 Cb 0.64 -2.13 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 2gfu n PRO 92 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2gfu n GLY 93 N 1.08 1.46 3.96 0.55 0.00 -0.23 -4.99 105.19 107.02 2gfu n GLY 93 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 2gfu n GLY 93 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gfu s ASP 94 N -1.73 5.26 -0.09 1.61 2.15 -1.25 -4.81 116.67 117.81 2gfu s ASP 94 Ca 0.00 0.16 -0.10 0.00 0.43 0.00 0.00 52.55 53.04 2gfu s ASP 94 Cb 0.00 -1.04 -0.05 0.00 -0.30 0.00 0.00 42.92 41.53 2gfu s ASP 94 CO 0.00 -1.18 0.23 -0.76 -0.17 0.00 0.00 175.17 173.29 2gfu s LEU 95 N -4.85 4.39 0.20 -1.34 2.01 -1.26 -0.99 118.68 116.84 2gfu s LEU 95 Ca 0.57 0.61 0.02 0.00 0.01 0.00 0.00 54.13 55.33 2gfu s LEU 95 Cb -0.10 -2.25 -0.05 0.00 0.01 0.00 0.00 46.19 43.80 2gfu s LEU 95 CO 0.40 0.35 0.02 0.68 1.01 0.00 0.00 176.35 178.80 2gfu s VAL 96 N -0.85 0.73 -0.20 -1.59 -7.23 -0.60 -1.47 120.40 109.19 2gfu s VAL 96 Ca 0.17 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.36 2gfu s VAL 96 Cb -0.13 -2.25 0.03 0.00 0.56 0.00 0.00 36.38 34.59 2gfu s VAL 96 CO 0.06 -0.36 -0.16 0.26 -0.31 0.00 0.00 175.10 174.60 2gfu s TRP 97 N -3.63 2.77 -0.14 2.82 0.52 0.09 -1.02 118.94 120.35 2gfu s TRP 97 Ca 0.27 -1.76 -0.01 0.00 0.02 0.00 0.00 56.10 54.63 2gfu s TRP 97 Cb 0.06 -1.84 -0.01 0.00 -1.15 0.00 0.00 33.47 30.53 2gfu s TRP 97 CO 0.07 -0.80 -0.11 0.00 0.02 0.00 0.00 176.95 176.12 2gfu s ALA 98 N 1.28 2.67 -0.14 0.98 0.00 -0.11 -0.02 121.76 126.43 2gfu s ALA 98 Ca 0.01 -0.92 -0.09 0.00 0.00 0.00 0.00 51.96 50.96 2gfu s ALA 98 Cb -0.15 -1.30 -0.04 0.00 0.00 0.00 0.00 23.12 21.63 2gfu s ALA 98 CO -0.10 0.16 0.17 0.21 0.00 0.00 0.00 175.76 176.20 2gfu s LYS 99 N 0.49 3.73 0.09 0.00 2.47 -0.92 -2.55 119.74 123.06 2gfu s LYS 99 Ca -0.08 -0.10 0.10 0.00 -1.56 0.00 0.00 55.97 54.32 2gfu s LYS 99 Cb -0.16 -3.27 -0.03 0.00 -1.46 0.00 0.00 37.83 32.91 2gfu s LYS 99 CO 0.04 0.61 -0.25 1.41 0.16 0.00 0.00 175.35 177.32 2gfu s MET 100 N -0.55 1.43 -0.86 4.03 -2.45 -1.26 -4.77 119.30 114.87 2gfu s MET 100 Ca 0.14 -1.20 -0.22 0.00 -1.25 0.00 0.00 55.69 53.15 2gfu s MET 100 Cb -0.12 -1.76 -0.19 0.00 1.25 0.00 0.00 34.83 34.01 2gfu s MET 100 CO 0.03 0.43 2.09 0.39 1.05 0.00 0.00 175.02 179.01 2gfu n GLU 101 N 1.26 0.22 0.00 4.11 1.02 -1.26 -2.07 120.64 123.93 2gfu n GLU 101 Ca -0.18 -1.11 0.00 0.00 -0.02 0.00 0.00 57.16 55.85 2gfu n GLU 101 Cb 0.53 -3.32 0.00 0.00 -0.02 0.00 0.00 31.44 28.63 2gfu n GLU 101 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gfu n GLY 102 N 6.12 0.92 3.92 0.62 0.00 -1.26 -5.07 105.19 110.45 2gfu n GLY 102 Ca 0.40 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 2gfu n GLY 102 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2gfu s TYR 103 N -2.00 2.40 0.87 1.61 1.13 -0.88 -5.14 117.35 115.35 2gfu s TYR 103 Ca 0.00 -0.56 -0.12 0.00 -1.41 0.00 0.00 57.07 54.99 2gfu s TYR 103 Cb 0.00 -2.17 0.11 0.00 -1.10 0.00 0.00 41.96 38.80 2gfu s TYR 103 CO 0.00 -0.35 1.10 -1.25 -2.51 0.00 0.00 175.55 172.54 2gfu s PRO 104 N -4.25 1.47 -0.12 -3.49 0.04 -1.26 -4.73 135.00 122.66 2gfu s PRO 104 Ca 0.49 0.68 -0.29 0.00 0.04 0.00 0.00 61.00 61.92 2gfu s PRO 104 Cb -0.04 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.60 2gfu s PRO 104 CO 0.29 -2.06 1.82 -1.58 0.04 0.00 0.00 177.00 175.52 2gfu s TRP 105 N -3.05 1.70 -0.14 0.56 0.52 -1.26 -4.63 118.94 112.64 2gfu s TRP 105 Ca 0.63 0.21 -0.00 0.00 0.02 0.00 0.00 56.10 56.96 2gfu s TRP 105 Cb -0.16 -4.03 -0.01 0.00 -1.15 0.00 0.00 33.47 28.12 2gfu s TRP 105 CO 0.56 -4.01 -0.14 -1.58 0.02 0.00 0.00 176.95 171.80 2gfu s TRP 106 N 5.32 2.80 0.49 -1.98 0.23 -1.06 -4.84 118.94 119.91 2gfu s TRP 106 Ca 0.81 -0.82 -0.24 0.00 -2.03 0.00 0.00 56.10 53.83 2gfu s TRP 106 Cb -0.33 -1.87 -0.07 0.00 0.03 0.00 0.00 33.47 31.23 2gfu s TRP 106 CO 0.33 -0.34 1.35 -0.35 0.96 0.00 0.00 176.95 178.91 2gfu n PRO 107 N 3.81 1.92 -3.72 4.98 -0.04 -1.26 -0.93 135.00 139.75 2gfu n PRO 107 Ca -0.18 0.69 -0.10 0.00 -0.04 0.00 0.00 63.50 63.87 2gfu n PRO 107 Cb 0.52 -2.54 -0.03 0.00 -0.04 0.00 0.00 33.50 31.40 2gfu n PRO 107 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2gfu s SER 108 N -0.69 -0.28 -0.03 3.54 0.01 -0.19 -3.12 113.70 112.94 2gfu s SER 108 Ca 0.66 -0.45 0.04 0.00 1.31 0.00 0.00 55.95 57.51 2gfu s SER 108 Cb -0.45 0.59 -0.01 0.00 0.21 0.00 0.00 66.02 66.37 2gfu s SER 108 CO 0.54 -1.07 -0.16 -0.22 0.41 0.00 0.00 173.24 172.74 2gfu s LEU 109 N -2.87 1.94 -0.30 2.44 0.20 -0.21 -1.56 118.68 118.32 2gfu s LEU 109 Ca 0.09 -0.32 -0.19 0.00 0.69 0.00 0.00 54.13 54.40 2gfu s LEU 109 Cb -0.01 -0.89 -0.01 0.00 -0.43 0.00 0.00 46.19 44.84 2gfu s LEU 109 CO -0.03 0.16 0.56 0.54 -0.29 0.00 0.00 176.35 177.29 2gfu s VAL 110 N -0.09 5.00 0.09 1.68 0.11 -0.16 -2.63 120.40 124.40 2gfu s VAL 110 Ca -0.00 0.76 0.09 0.00 -2.93 0.00 0.00 61.98 59.90 2gfu s VAL 110 Cb -0.10 -3.93 -0.03 0.00 -1.53 0.00 0.00 36.38 30.80 2gfu s VAL 110 CO 0.01 -0.07 -0.25 -0.47 -3.33 0.00 0.00 175.10 171.00 2gfu s TYR 111 N 2.45 2.12 -0.27 1.54 5.04 -1.23 -1.07 117.35 125.92 2gfu s TYR 111 Ca 0.22 -0.39 -0.12 0.00 -2.44 0.00 0.00 57.07 54.34 2gfu s TYR 111 Cb -0.15 -1.20 -0.05 0.00 0.35 0.00 0.00 41.96 40.91 2gfu s TYR 111 CO 0.11 0.22 0.23 0.54 -1.34 0.00 0.00 175.55 175.31 2gfu s ASN 112 N -1.70 6.08 0.87 4.32 2.20 -1.26 -4.70 114.94 120.75 2gfu s ASN 112 Ca 0.11 0.06 -0.11 0.00 -0.94 0.00 0.00 52.86 51.99 2gfu s ASN 112 Cb -0.10 -2.14 0.12 0.00 -2.00 0.00 0.00 41.25 37.13 2gfu s ASN 112 CO 0.04 -0.07 1.14 -1.00 -2.94 0.00 0.00 177.10 174.27 2gfu s HIS 113 N 1.77 1.83 -1.49 1.54 3.76 -1.26 -4.86 115.29 116.58 2gfu s HIS 113 Ca 0.09 1.73 0.00 0.00 -0.15 0.00 0.00 55.06 56.73 2gfu s HIS 113 Cb -0.16 -3.30 0.00 0.00 1.11 0.00 0.00 32.58 30.23 2gfu s HIS 113 CO 0.10 -2.61 0.42 -2.30 -0.85 0.00 0.00 174.74 169.50 2gfu n PRO 114 N -3.96 0.00 -1.45 8.40 -0.02 -1.26 -1.26 135.00 135.45 2gfu n PRO 114 Ca 0.12 0.02 -0.27 0.00 -2.02 0.00 0.00 63.50 61.35 2gfu n PRO 114 Cb 0.52 -1.51 0.09 0.00 -0.02 0.00 0.00 33.50 32.58 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 -0.92 2.84 -2.33 6.00 3.72 -1.26 -5.09 117.46 120.42 2gfu n PHE 115 Ca 0.00 -2.53 -0.36 0.00 -0.05 0.00 0.00 57.45 54.51 2gfu n PHE 115 Cb 0.01 -0.99 -0.01 0.00 -0.94 0.00 0.00 39.48 37.55 2gfu n PHE 115 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2gfu s ASP 116 N -2.35 6.04 0.00 4.37 1.47 -0.39 -3.99 116.67 121.82 2gfu s ASP 116 Ca 0.58 2.16 0.00 0.00 1.18 0.00 0.00 52.55 56.47 2gfu s ASP 116 Cb 0.47 -2.58 0.00 0.00 -0.34 0.00 0.00 42.92 40.46 2gfu s ASP 116 CO 0.02 -1.00 0.00 0.61 0.68 0.00 0.00 175.17 175.47 2gfu n GLY 117 N 0.19 0.72 3.07 2.12 0.00 -1.26 -5.07 105.19 104.96 2gfu n GLY 117 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.00 0.49 0.00 2.61 -1.32 -1.26 -5.09 115.64 109.08 2gfu s THR 118 Ca 0.00 -1.19 0.00 0.00 -1.21 0.00 0.00 61.69 59.29 2gfu s THR 118 Cb 0.00 -0.73 0.00 0.00 -1.51 0.00 0.00 72.50 70.26 2gfu s THR 118 CO 0.00 -0.48 0.00 0.33 -2.21 0.00 0.00 174.62 172.26 2gfu n PHE 119 N 1.24 -0.42 -4.22 9.09 -0.00 -1.26 -4.85 117.46 117.04 2gfu n PHE 119 Ca -0.21 0.00 -0.32 0.00 -0.00 0.00 0.00 57.45 56.92 2gfu n PHE 119 Cb 0.56 0.08 -0.08 0.00 -0.00 0.00 0.00 39.48 40.04 2gfu n PHE 119 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 176.76 177.72 2gfu s ILE 120 N -1.17 4.14 -0.01 -2.13 -4.36 -1.26 -4.05 121.20 112.36 2gfu s ILE 120 Ca 0.00 -0.73 0.04 0.00 -0.26 0.00 0.00 60.65 59.70 2gfu s ILE 120 Cb 0.00 -2.90 -0.01 0.00 1.25 0.00 0.00 42.46 40.80 2gfu s ILE 120 CO 0.00 0.28 -0.13 -0.60 0.24 0.00 0.00 174.94 174.72 2gfu s ARG 121 N -1.85 1.08 -0.10 0.37 6.06 -0.71 -5.05 118.95 118.74 2gfu s ARG 121 Ca 0.22 -0.50 -0.07 0.00 -2.50 0.00 0.00 55.73 52.88 2gfu s ARG 121 Cb -0.12 -1.04 0.03 0.00 0.06 0.00 0.00 34.95 33.88 2gfu s ARG 121 CO 0.14 0.28 0.25 -1.83 -2.50 0.00 0.00 175.30 171.64 2gfu s GLU 122 N -0.38 0.26 -0.49 5.12 -1.05 -1.26 -1.31 118.70 119.58 2gfu s GLU 122 Ca 0.05 0.42 0.02 0.00 -0.15 0.00 0.00 54.97 55.31 2gfu s GLU 122 Cb -0.05 0.03 0.13 0.00 -0.44 0.00 0.00 34.13 33.80 2gfu s GLU 122 CO -0.00 -0.09 0.25 0.15 0.95 0.00 0.00 175.26 176.51 2gfu s LYS 123 N 0.60 1.99 3.34 -4.83 1.02 -0.02 -5.02 119.74 116.82 2gfu s LYS 123 Ca -0.04 -2.37 0.00 0.00 0.02 0.00 0.00 55.97 53.58 2gfu s LYS 123 Cb -0.05 -3.40 0.00 0.00 -0.52 0.00 0.00 37.83 33.85 2gfu s LYS 123 CO -0.03 -1.08 0.00 0.41 -0.92 0.00 0.00 175.35 173.72 2gfu n GLY 124 N 3.57 0.52 0.59 -3.33 0.00 -1.26 -1.58 105.19 103.70 2gfu n GLY 124 Ca 0.05 0.57 0.07 0.00 0.00 0.00 0.00 46.02 46.71 2gfu n GLY 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gfu n LYS 125 N 0.00 2.63 -4.36 1.61 5.02 -1.26 -4.94 118.16 116.86 2gfu n LYS 125 Ca 0.00 -2.46 -0.30 0.00 -2.02 0.00 0.00 58.31 53.53 2gfu n LYS 125 Cb 0.00 -1.55 -0.17 0.00 -0.02 0.00 0.00 35.03 33.29 2gfu n LYS 125 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2gfu s SER 126 N -1.77 2.65 -0.05 4.39 0.15 -0.61 -5.08 113.70 113.37 2gfu s SER 126 Ca 0.31 -0.48 0.04 0.00 0.70 0.00 0.00 55.95 56.52 2gfu s SER 126 Cb 0.24 -1.19 -0.00 0.00 -1.71 0.00 0.00 66.02 63.36 2gfu s SER 126 CO 0.09 0.01 -0.18 0.54 1.20 0.00 0.00 173.24 174.89 2gfu s VAL 127 N 1.11 1.54 -0.08 4.45 0.11 -1.26 -0.84 120.40 125.43 2gfu s VAL 127 Ca -0.03 -0.76 0.04 0.00 -2.93 0.00 0.00 61.98 58.30 2gfu s VAL 127 Cb -0.14 -1.33 -0.01 0.00 -1.53 0.00 0.00 36.38 33.37 2gfu s VAL 127 CO -0.05 0.44 -0.21 -0.13 -3.33 0.00 0.00 175.10 171.82 2gfu s ARG 128 N 0.14 2.88 0.17 1.54 0.52 -0.43 -0.20 118.95 123.57 2gfu s ARG 128 Ca -0.07 -0.83 0.02 0.00 -0.52 0.00 0.00 55.73 54.33 2gfu s ARG 128 Cb -0.13 -2.33 -0.05 0.00 0.52 0.00 0.00 34.95 32.96 2gfu s ARG 128 CO 0.03 0.31 0.00 0.14 0.02 0.00 0.00 175.30 175.81 2gfu s VAL 129 N 0.04 0.69 -0.21 3.52 -7.23 -1.15 -1.74 120.40 114.31 2gfu s VAL 129 Ca -0.08 -1.98 -0.29 0.00 -1.81 0.00 0.00 61.98 57.81 2gfu s VAL 129 Cb -0.15 -2.12 -0.02 0.00 0.56 0.00 0.00 36.38 34.65 2gfu s VAL 129 CO 0.05 -0.47 1.46 -1.00 -0.31 0.00 0.00 175.10 174.83 2gfu s HIS 130 N -3.65 2.40 -0.05 2.82 0.09 -1.26 -1.25 115.29 114.40 2gfu s HIS 130 Ca 0.24 0.69 -0.05 0.00 -0.00 0.00 0.00 55.06 55.93 2gfu s HIS 130 Cb 0.06 -3.86 0.01 0.00 -0.00 0.00 0.00 32.58 28.79 2gfu s HIS 130 CO 0.04 -2.45 0.14 0.08 -0.00 0.00 0.00 174.74 172.55 2gfu s VAL 131 N 4.50 0.01 -0.03 -0.90 1.01 -1.22 -3.57 120.40 120.21 2gfu s VAL 131 Ca 0.64 -0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.57 2gfu s VAL 131 Cb -0.23 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 2gfu s VAL 131 CO 0.25 -0.06 -0.18 0.00 0.00 0.00 0.00 175.10 175.11 2gfu s GLN 132 N -0.14 2.33 -0.14 2.72 -2.07 -1.08 -3.54 119.66 117.74 2gfu s GLN 132 Ca -0.02 -0.80 -0.04 0.00 -1.82 0.00 0.00 55.36 52.68 2gfu s GLN 132 Cb -0.02 -2.26 -0.03 0.00 -1.09 0.00 0.00 33.01 29.60 2gfu s GLN 132 CO 0.00 0.59 -0.01 -0.06 -1.32 0.00 0.00 175.29 174.50 2gfu s PHE 133 N -0.74 3.10 -1.25 9.60 0.08 -0.00 -1.05 117.98 127.72 2gfu s PHE 133 Ca 0.12 -0.08 -0.20 0.00 0.12 0.00 0.00 56.93 56.89 2gfu s PHE 133 Cb -0.10 -1.92 0.00 0.00 -0.57 0.00 0.00 43.02 40.42 2gfu s PHE 133 CO 0.01 0.15 1.83 1.19 -0.10 0.00 0.00 175.22 178.30 2gfu n PHE 134 N 3.10 3.83 0.00 0.36 3.72 -1.18 -2.58 117.46 124.72 2gfu n PHE 134 Ca -0.18 -2.26 0.00 0.00 -0.05 0.00 0.00 57.45 54.96 2gfu n PHE 134 Cb 0.53 -2.63 0.00 0.00 -0.94 0.00 0.00 39.48 36.44 2gfu n PHE 134 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2gfu n ASP 135 N 10.88 0.00 -0.06 4.37 9.92 -1.26 -4.68 116.55 135.73 2gfu n ASP 135 Ca 0.47 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.64 2gfu n ASP 135 Cb 0.46 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.91 2gfu n ASP 135 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2gfu n ASP 136 N 0.00 1.61 0.09 -2.24 8.00 -1.26 -4.89 116.55 117.86 2gfu n ASP 136 Ca 0.00 0.26 -0.19 0.00 0.71 0.00 0.00 54.79 55.57 2gfu n ASP 136 Cb 0.00 -0.60 -0.15 0.00 -0.02 0.00 0.00 41.12 40.35 2gfu n ASP 136 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2gfu h SER 137 N -0.68 0.54 -3.97 -2.24 0.02 -1.97 -3.48 113.55 101.76 2gfu h SER 137 Ca -0.09 -0.67 -0.44 0.00 -0.84 0.00 0.00 61.79 59.74 2gfu h SER 137 Cb 0.82 -0.17 0.17 0.00 0.14 0.00 0.00 62.40 63.36 2gfu h SER 137 CO -0.06 1.55 0.42 -2.16 -1.14 0.00 0.00 176.83 175.44 2gfu s PRO 138 N -2.61 0.49 -0.06 3.45 0.04 -1.26 -4.87 135.00 130.17 2gfu s PRO 138 Ca -0.09 -0.43 -0.12 0.00 0.04 0.00 0.00 61.00 60.40 2gfu s PRO 138 Cb 0.06 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.72 2gfu s PRO 138 CO 0.88 -2.52 0.30 0.99 0.04 0.00 0.00 177.00 176.69 2gfu s THR 139 N -3.88 5.23 0.12 1.26 2.01 -1.06 -4.93 115.64 114.40 2gfu s THR 139 Ca 0.75 0.58 -0.19 0.00 0.31 0.00 0.00 61.69 63.14 2gfu s THR 139 Cb -0.04 -3.59 0.05 0.00 0.01 0.00 0.00 72.50 68.93 2gfu s THR 139 CO 0.53 0.57 0.47 -0.60 -0.69 0.00 0.00 174.62 174.90 2gfu s ARG 140 N -0.85 1.11 0.00 4.92 3.52 -1.26 -0.82 118.95 125.57 2gfu s ARG 140 Ca 0.20 -0.56 0.00 0.00 -0.13 0.00 0.00 55.73 55.24 2gfu s ARG 140 Cb -0.15 0.50 0.00 0.00 -1.56 0.00 0.00 34.95 33.74 2gfu s ARG 140 CO 0.09 -0.44 0.00 0.41 -0.81 0.00 0.00 175.30 174.55 2gfu n GLY 141 N -0.14 1.35 3.74 8.12 0.00 -1.23 -5.04 105.19 111.99 2gfu n GLY 141 Ca -0.17 -0.59 -0.38 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.10 3.59 0.50 1.61 0.52 -1.26 -3.43 118.94 118.37 2gfu s TRP 142 Ca 0.00 1.04 0.08 0.00 0.02 0.00 0.00 56.10 57.25 2gfu s TRP 142 Cb 0.00 -2.58 0.08 0.00 -1.15 0.00 0.00 33.47 29.83 2gfu s TRP 142 CO 0.00 0.26 0.69 1.33 0.02 0.00 0.00 176.95 179.25 2gfu n VAL 143 N 3.22 0.00 -3.74 4.03 0.24 -0.38 -4.94 118.33 116.76 2gfu n VAL 143 Ca -0.07 -1.66 -0.36 0.00 -2.04 0.00 0.00 64.34 60.21 2gfu n VAL 143 Cb 0.51 -0.58 -0.09 0.00 -1.47 0.00 0.00 33.84 32.21 2gfu n VAL 143 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2gfu s SER 144 N -4.10 6.01 0.52 -1.34 0.01 -1.26 -2.96 113.70 110.59 2gfu s SER 144 Ca 0.52 0.11 0.31 0.00 1.31 0.00 0.00 55.95 58.21 2gfu s SER 144 Cb -0.04 -2.07 1.14 0.00 0.21 0.00 0.00 66.02 65.26 2gfu s SER 144 CO 0.33 0.10 1.90 0.50 0.41 0.00 0.00 173.24 176.49 2gfu h LYS 145 N 7.24 0.00 0.00 12.44 3.64 -0.91 -2.73 116.57 136.25 2gfu h LYS 145 Ca -0.38 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 2gfu h LYS 145 Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2gfu h LYS 145 CO 0.68 0.01 0.00 2.89 -2.27 0.00 0.00 179.45 180.77 2gfu n ARG 146 N -3.11 0.23 -0.13 1.90 1.85 -1.26 -2.19 116.66 113.95 2gfu n ARG 146 Ca 0.01 0.12 0.12 0.00 -1.00 0.00 0.00 57.85 57.10 2gfu n ARG 146 Cb 0.36 -1.50 0.17 0.00 -1.05 0.00 0.00 32.46 30.44 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 -1.31 3.28 -4.77 2.89 4.77 -1.03 -4.89 117.00 115.93 2gfu n LEU 147 Ca 0.08 -1.35 -0.38 0.00 -0.03 0.00 0.00 56.01 54.33 2gfu n LEU 147 Cb 0.15 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2gfu n LEU 147 CO 0.14 0.66 0.17 -0.76 -1.33 0.00 0.00 177.39 176.28 2gfu s LEU 148 N -1.60 4.37 0.35 2.23 1.43 -0.93 -2.17 118.68 122.36 2gfu s LEU 148 Ca 0.34 0.93 0.09 0.00 -1.03 0.00 0.00 54.13 54.46 2gfu s LEU 148 Cb 0.21 -2.70 -0.05 0.00 0.03 0.00 0.00 46.19 43.68 2gfu s LEU 148 CO 0.30 0.14 0.06 -0.54 0.23 0.00 0.00 176.35 176.54 2gfu s LYS 149 N -0.14 2.17 0.47 1.70 1.02 0.97 -4.69 119.74 121.24 2gfu s LYS 149 Ca 0.26 -1.71 -0.12 0.00 0.02 0.00 0.00 55.97 54.42 2gfu s LYS 149 Cb -0.16 -2.00 -0.06 0.00 -0.52 0.00 0.00 37.83 35.09 2gfu s LYS 149 CO 0.13 0.11 0.87 -1.25 -0.92 0.00 0.00 175.35 174.28 2gfu s PRO 150 N -3.76 3.79 0.00 -1.68 0.04 -1.26 -0.73 135.00 131.39 2gfu s PRO 150 Ca 0.36 0.64 0.00 0.00 0.04 0.00 0.00 61.00 62.04 2gfu s PRO 150 Cb -0.00 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.27 2gfu s PRO 150 CO 0.20 -0.19 0.26 2.48 0.04 0.00 0.00 177.00 179.80 2gfu n TYR 151 N -1.63 0.00 0.00 0.56 4.11 -0.54 -4.56 117.16 115.09 2gfu n TYR 151 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.94 2gfu n TYR 151 Cb 0.54 -0.04 0.00 0.00 -0.00 0.00 0.00 39.34 39.84 2gfu n TYR 151 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 2gfu n THR 152 N -1.01 0.00 -0.13 -3.48 5.66 -1.26 -4.40 114.28 109.66 2gfu n THR 152 Ca 0.00 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.74 2gfu n THR 152 Cb 0.00 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.68 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 0.54 -0.40 0.04 1.09 0.00 -1.26 -4.69 105.19 100.51 2gfu n GLY 153 Ca 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.98 0.05 -0.05 1.61 7.64 -1.26 0.01 113.62 117.65 2gfu n SER 154 Ca -0.49 0.23 0.03 0.00 1.01 0.00 0.00 58.87 59.64 2gfu n SER 154 Cb 0.88 -0.19 0.04 0.00 -1.01 0.00 0.00 64.21 63.93 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 -1.35 2.05 -4.20 1.43 2.85 -1.26 -4.73 118.16 112.95 2gfu n LYS 155 Ca -0.00 -1.70 -0.12 0.00 -1.05 0.00 0.00 58.31 55.44 2gfu n LYS 155 Cb 0.38 -1.08 -0.10 0.00 -0.65 0.00 0.00 35.03 33.59 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 -1.46 1.08 0.45 -5.58 0.15 0.10 -5.04 113.70 103.40 2gfu s SER 156 Ca 0.09 -1.12 0.11 0.00 0.70 0.00 0.00 55.95 55.74 2gfu s SER 156 Cb 0.08 0.13 0.58 0.00 -1.71 0.00 0.00 66.02 65.10 2gfu s SER 156 CO 0.01 -0.55 1.22 0.11 1.20 0.00 0.00 173.24 175.23 2gfu h LYS 157 N 2.81 0.00 -0.01 5.44 1.57 -1.96 0.68 116.57 125.11 2gfu h LYS 157 Ca -0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2gfu h LYS 157 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2gfu h LYS 157 CO 0.63 0.00 -0.59 0.39 -0.57 0.00 0.00 179.45 179.31 2gfu n GLU 158 N -2.21 0.51 -0.21 3.15 4.71 -1.26 -3.91 120.64 121.41 2gfu n GLU 158 Ca -0.01 -0.38 0.01 0.00 -0.01 0.00 0.00 57.16 56.78 2gfu n GLU 158 Cb 0.56 -1.49 0.02 0.00 -1.01 0.00 0.00 31.44 29.52 2gfu n GLU 158 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2gfu n ALA 159 N -0.92 1.70 -3.89 0.62 0.00 0.24 -1.56 120.51 116.71 2gfu n ALA 159 Ca 0.07 -1.06 -0.09 0.00 0.00 0.00 0.00 53.44 52.37 2gfu n ALA 159 Cb 0.37 -0.26 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 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 -0.26 1.43 -2.22 0.00 -0.00 -1.21 -4.74 117.38 110.38 2gfu n GLN 160 Ca 0.02 -1.04 -0.42 0.00 -0.00 0.00 0.00 57.00 55.56 2gfu n GLN 160 Cb 0.57 0.19 -0.03 0.00 -0.00 0.00 0.00 30.24 30.98 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 -2.60 4.24 0.00 2.61 2.20 -1.26 -1.63 119.74 123.30 2gfu s LYS 161 Ca 0.05 1.94 0.00 0.00 -0.36 0.00 0.00 55.97 57.60 2gfu s LYS 161 Cb -0.00 -3.75 0.00 0.00 -1.51 0.00 0.00 37.83 32.56 2gfu s LYS 161 CO 0.03 -0.69 0.00 0.41 -0.36 0.00 0.00 175.35 174.74 2gfu n GLY 162 N 3.77 0.42 3.79 5.54 0.00 -1.26 -5.10 105.19 112.35 2gfu n GLY 162 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.49 2.18 0.13 -0.02 0.00 -0.65 -4.95 107.32 102.53 2gfu s GLY 163 Ca 0.00 0.49 -0.13 0.00 0.00 0.00 0.00 44.72 45.08 2gfu s GLY 163 CO 0.00 0.83 1.52 0.45 0.00 0.00 0.00 173.10 175.90 2gfu h HIS 164 N 0.36 0.90 -0.01 1.90 3.86 -1.54 -3.24 115.15 117.37 2gfu h HIS 164 Ca -0.47 -0.20 0.00 0.00 -1.16 0.00 0.00 60.37 58.53 2gfu h HIS 164 Cb 1.23 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.49 2gfu h HIS 164 CO 0.56 0.94 -0.29 1.19 0.86 0.00 0.00 177.93 181.19 2gfu n PHE 165 N -4.30 0.00 -2.66 2.45 3.72 -0.60 -4.90 117.46 111.16 2gfu n PHE 165 Ca -0.01 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.97 2gfu n PHE 165 Cb 0.38 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 38.81 2gfu n PHE 165 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 2gfu s TYR 166 N -2.46 2.58 -0.28 1.38 5.04 -1.23 -4.79 117.35 117.59 2gfu s TYR 166 Ca 0.24 -0.68 0.02 0.00 -2.44 0.00 0.00 57.07 54.21 2gfu s TYR 166 Cb 0.19 -4.55 0.06 0.00 0.35 0.00 0.00 41.96 38.02 2gfu s TYR 166 CO 0.52 -1.86 -0.06 -1.12 -1.34 0.00 0.00 175.55 171.69 2gfu s SER 167 N 4.22 4.61 -0.62 4.32 0.01 -1.26 -4.85 113.70 120.12 2gfu s SER 167 Ca 0.37 -1.49 -0.22 0.00 1.31 0.00 0.00 55.95 55.92 2gfu s SER 167 Cb -0.05 -1.60 0.07 0.00 0.21 0.00 0.00 66.02 64.65 2gfu s SER 167 CO -0.00 -0.24 0.89 0.00 0.41 0.00 0.00 173.24 174.30 2gfu s ALA 168 N 1.11 3.19 0.07 1.44 0.00 -1.26 -4.55 121.76 121.76 2gfu s ALA 168 Ca -0.05 -1.83 0.10 0.00 0.00 0.00 0.00 51.96 50.17 2gfu s ALA 168 Cb -0.20 -3.75 -0.03 0.00 0.00 0.00 0.00 23.12 19.14 2gfu s ALA 168 CO -0.05 -2.60 -0.26 0.21 0.00 0.00 0.00 175.76 173.07 2gfu s LYS 169 N 3.70 1.70 0.32 0.00 2.20 -1.26 -5.00 119.74 121.39 2gfu s LYS 169 Ca 0.21 -1.18 0.05 0.00 -0.36 0.00 0.00 55.97 54.69 2gfu s LYS 169 Cb -0.18 -1.97 0.69 0.00 -1.51 0.00 0.00 37.83 34.86 2gfu s LYS 169 CO 0.11 0.49 1.84 -1.00 -0.36 0.00 0.00 175.35 176.43 2gfu h PRO 170 N 4.49 0.82 -0.31 4.03 0.13 -1.98 -1.47 132.00 137.70 2gfu h PRO 170 Ca -0.48 -0.05 -0.12 0.00 -0.87 0.00 0.00 66.00 64.48 2gfu h PRO 170 Cb 1.15 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 2gfu h PRO 170 CO 0.42 0.54 -0.26 1.05 -0.23 0.00 0.00 178.00 179.52 2gfu h GLU 171 N 0.84 0.72 -0.22 0.86 4.11 -1.95 -1.28 114.58 117.67 2gfu h GLU 171 Ca 0.49 -0.37 -0.02 0.00 0.07 0.00 0.00 59.36 59.53 2gfu h GLU 171 Cb 0.64 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2gfu h GLU 171 CO -0.25 0.98 0.05 0.82 0.07 0.00 0.00 179.01 180.68 2gfu h ILE 172 N 0.48 1.21 -0.11 -1.06 2.04 -1.76 -0.38 117.51 117.93 2gfu h ILE 172 Ca 0.05 -0.68 -0.10 0.00 1.00 0.00 0.00 64.86 65.13 2gfu h ILE 172 Cb 0.83 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2gfu h ILE 172 CO 0.07 0.22 -0.38 0.17 0.00 0.00 0.00 178.15 178.22 2gfu h LEU 173 N 0.18 0.25 -0.47 1.44 8.10 -1.36 -2.31 115.31 121.14 2gfu h LEU 173 Ca 0.07 -0.10 -0.15 0.00 0.11 0.00 0.00 57.88 57.81 2gfu h LEU 173 Cb 0.28 -0.07 -0.01 0.00 -0.44 0.00 0.00 40.66 40.42 2gfu h LEU 173 CO 0.00 0.61 -0.35 -0.09 -4.11 0.00 0.00 178.44 174.51 2gfu h ARG 174 N 0.20 0.89 -0.19 0.17 9.65 -1.11 -1.71 114.38 122.29 2gfu h ARG 174 Ca 0.02 -0.45 -0.12 0.00 -1.10 0.00 0.00 59.98 58.33 2gfu h ARG 174 Cb 0.77 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.34 2gfu h ARG 174 CO 0.06 1.09 -0.41 0.00 2.80 0.00 0.00 179.97 183.52 2gfu h ALA 175 N 0.86 0.95 -0.14 2.80 0.00 -1.05 0.20 119.26 122.86 2gfu h ALA 175 Ca 0.07 -0.43 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 2gfu h ALA 175 Cb 0.92 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2gfu h ALA 175 CO 0.09 0.63 -0.42 0.52 0.00 0.00 0.00 179.25 180.07 2gfu h MET 176 N 0.36 0.33 -0.10 0.00 2.86 -1.38 0.44 114.93 117.44 2gfu h MET 176 Ca 0.03 -0.16 -0.10 0.00 -2.06 0.00 0.00 59.70 57.41 2gfu h MET 176 Cb 0.87 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2gfu h MET 176 CO 0.07 0.69 -0.34 1.96 1.06 0.00 0.00 176.91 180.35 2gfu h GLN 177 N 0.27 0.42 -0.04 1.72 1.08 -0.29 0.04 115.11 118.31 2gfu h GLN 177 Ca 0.02 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 56.91 2gfu h GLN 177 Cb 0.85 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 28.33 2gfu h GLN 177 CO 0.07 0.93 -0.00 -0.09 -0.95 0.00 0.00 178.83 178.79 2gfu h ARG 178 N -0.02 0.06 -0.42 1.46 2.43 -0.76 -2.75 114.38 114.38 2gfu h ARG 178 Ca -0.01 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2gfu h ARG 178 Cb 0.97 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.47 2gfu h ARG 178 CO 0.07 0.37 0.20 0.00 -1.51 0.00 0.00 179.97 179.10 2gfu h ALA 179 N 0.69 0.52 -0.53 2.80 0.00 -1.02 -1.78 119.26 119.95 2gfu h ALA 179 Ca 0.01 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.03 2gfu h ALA 179 Cb 0.34 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 2gfu h ALA 179 CO 0.00 -0.17 0.12 0.22 0.00 0.00 0.00 179.25 179.43 2gfu h ASP 180 N 0.40 0.03 -0.02 0.00 3.58 -0.95 0.57 116.42 120.04 2gfu h ASP 180 Ca 0.18 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.72 2gfu h ASP 180 Cb 0.11 0.12 -0.00 0.00 1.72 0.00 0.00 39.33 41.28 2gfu h ASP 180 CO -0.14 0.04 -0.01 -0.08 -2.88 0.00 0.00 179.24 176.17 2gfu h GLU 181 N 0.26 0.04 -0.02 0.28 4.81 -1.45 -2.71 114.58 115.78 2gfu h GLU 181 Ca 0.27 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.38 2gfu h GLU 181 Cb 0.36 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 2gfu h GLU 181 CO -0.34 0.46 -0.48 0.00 -0.73 0.00 0.00 179.01 177.92 2gfu h ALA 182 N 0.58 1.18 0.03 2.92 0.00 -1.13 -2.64 119.26 120.21 2gfu h ALA 182 Ca 0.00 -0.44 -0.28 0.00 0.00 0.00 0.00 54.91 54.20 2gfu h ALA 182 Cb 0.44 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.18 2gfu h ALA 182 CO 0.00 0.60 -1.10 1.37 0.00 0.00 0.00 179.25 180.12 2gfu h LEU 183 N 0.03 0.91 0.00 0.00 8.10 0.04 -3.29 115.31 121.11 2gfu h LEU 183 Ca -0.00 -0.76 0.00 0.00 0.11 0.00 0.00 57.88 57.23 2gfu h LEU 183 Cb 0.85 -0.28 0.00 0.00 -0.44 0.00 0.00 40.66 40.79 2gfu h LEU 183 CO 0.06 1.56 -0.28 -0.46 -4.11 0.00 0.00 178.44 175.22 2gfu n ASN 184 N -3.84 0.40 0.00 0.17 0.23 -1.02 -4.79 115.26 106.40 2gfu n ASN 184 Ca -0.12 0.19 0.00 0.00 -0.53 0.00 0.00 54.58 54.13 2gfu n ASN 184 Cb 0.91 -0.17 0.00 0.00 -2.08 0.00 0.00 39.78 38.44 2gfu n ASN 184 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2gfu n LYS 185 N -1.71 0.00 -4.28 -3.83 5.02 -1.00 -5.07 118.16 107.30 2gfu n LYS 185 Ca 0.06 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.20 2gfu n LYS 185 Cb 0.37 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.28 2gfu n LYS 185 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2gfu s ASP 186 N 0.41 0.98 0.27 4.39 1.01 -1.24 -5.06 116.67 117.43 2gfu s ASP 186 Ca 0.00 -1.34 -0.02 0.00 0.71 0.00 0.00 52.55 51.91 2gfu s ASP 186 Cb 0.00 0.20 0.46 0.00 1.01 0.00 0.00 42.92 44.59 2gfu s ASP 186 CO 0.00 -0.72 1.84 0.11 0.21 0.00 0.00 175.17 176.61 2gfu h LYS 187 N 2.50 0.95 -0.36 8.23 1.79 -1.87 -2.57 116.57 125.24 2gfu h LYS 187 Ca -0.37 -0.06 0.06 0.00 -2.18 0.00 0.00 60.65 58.10 2gfu h LYS 187 Cb 1.24 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 31.66 2gfu h LYS 187 CO 0.60 0.63 0.24 0.97 -1.08 0.00 0.00 179.45 180.81 2gfu h ILE 188 N 0.98 0.95 -0.08 1.86 2.10 -1.96 -0.79 117.51 120.56 2gfu h ILE 188 Ca 0.45 -0.08 -0.22 0.00 1.08 0.00 0.00 64.86 66.08 2gfu h ILE 188 Cb 0.36 0.68 0.01 0.00 -1.09 0.00 0.00 36.82 36.79 2gfu h ILE 188 CO -0.23 0.04 -0.82 0.11 -1.08 0.00 0.00 178.15 176.17 2gfu h LYS 189 N 0.24 0.70 -0.06 2.19 6.56 -1.78 -1.96 116.57 122.46 2gfu h LYS 189 Ca 0.16 -0.64 -0.25 0.00 -1.06 0.00 0.00 60.65 58.86 2gfu h LYS 189 Cb 0.33 0.16 0.02 0.00 -0.57 0.00 0.00 32.23 32.16 2gfu h LYS 189 CO -0.03 1.24 -0.94 0.07 -2.06 0.00 0.00 179.45 177.74 2gfu h ARG 190 N 0.38 0.72 0.00 3.15 -0.00 -1.65 -3.35 114.38 113.63 2gfu h ARG 190 Ca -0.08 -0.70 -0.01 0.00 -0.00 0.00 0.00 59.98 59.19 2gfu h ARG 190 Cb 1.46 0.18 -0.00 0.00 -0.00 0.00 0.00 29.97 31.61 2gfu h ARG 190 CO 0.16 1.29 -0.05 -0.07 -0.00 0.00 0.00 179.97 181.30 2gfu h LEU 191 N 0.44 0.00 -1.20 0.08 4.07 -1.22 0.13 115.31 117.62 2gfu h LEU 191 Ca -0.10 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.79 2gfu h LEU 191 Cb 1.58 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.31 2gfu h LEU 191 CO 0.19 0.05 -0.27 -0.08 -1.08 0.00 0.00 178.44 177.25 2gfu h GLU 192 N 0.00 0.22 0.00 1.13 4.81 -1.48 -3.34 114.58 115.92 2gfu h GLU 192 Ca -0.00 -0.07 -0.32 0.00 -0.13 0.00 0.00 59.36 58.84 2gfu h GLU 192 Cb 0.50 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.81 2gfu h GLU 192 CO 0.01 0.47 -2.10 1.28 -0.73 0.00 0.00 179.01 177.94 2gfu n LEU 193 N -4.15 1.87 0.00 1.64 4.77 -1.08 -0.68 117.00 119.37 2gfu n LEU 193 Ca -0.01 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2gfu n LEU 193 Cb 0.37 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2gfu n LEU 193 CO 0.40 0.53 0.00 0.00 -1.33 0.00 0.00 177.39 176.99 2gfu n ALA 194 N -3.64 0.00 -0.63 -1.18 0.00 0.44 -1.13 120.51 114.37 2gfu n ALA 194 Ca -0.38 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.14 2gfu n ALA 194 Cb 0.80 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.49 2gfu n ALA 194 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2gfu n VAL 195 N 0.00 1.76 -0.65 0.00 0.24 -1.26 -4.93 118.33 113.50 2gfu n VAL 195 Ca 0.00 -1.44 0.00 0.00 -2.04 0.00 0.00 64.34 60.86 2gfu n VAL 195 Cb 0.00 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.45 2gfu n VAL 195 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2gfu n SER 196 N 0.15 -1.28 -4.39 -1.34 2.88 -0.28 -4.58 113.62 104.79 2gfu n SER 196 Ca 0.19 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.27 2gfu n SER 196 Cb 0.73 -0.26 -0.02 0.00 -0.75 0.00 0.00 64.21 63.92 2gfu n SER 196 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2gfu s ASP 197 N -2.51 6.82 -0.49 -3.46 2.15 -1.25 -4.39 116.67 113.54 2gfu s ASP 197 Ca 0.00 -2.62 -0.02 0.00 0.43 0.00 0.00 52.55 50.34 2gfu s ASP 197 Cb 0.00 -2.29 -0.02 0.00 -0.30 0.00 0.00 42.92 40.30 2gfu s ASP 197 CO 0.00 -0.72 0.44 -0.62 -0.17 0.00 0.00 175.17 174.10 2gfu n GLU 198 N 4.86 -0.99 -2.39 4.34 1.02 -1.26 -4.91 120.64 121.31 2gfu n GLU 198 Ca 0.21 0.69 -0.42 0.00 -0.02 0.00 0.00 57.16 57.62 2gfu n GLU 198 Cb 0.46 -3.78 -0.02 0.00 -0.02 0.00 0.00 31.44 28.08 2gfu n GLU 198 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2gfu s PRO 199 N -3.43 3.42 0.00 3.49 0.04 -1.25 -0.93 135.00 136.33 2gfu s PRO 199 Ca 0.14 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.80 2gfu s PRO 199 Cb -0.02 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.44 2gfu s PRO 199 CO 0.39 -1.78 0.00 0.45 0.04 0.00 0.00 177.00 176.10 2gfu n SER 200 N 9.22 -0.35 0.00 6.66 2.88 0.15 -4.94 113.62 127.24 2gfu n SER 200 Ca 0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 2gfu n SER 200 Cb 0.49 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2gfu n SER 200 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02