#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 5.60 -3.64 7.82 0.00 -1.26 -4.82 120.51 124.21 2gfu n ALA 69 Ca 0.00 -2.44 -0.09 0.00 0.00 0.00 0.00 53.44 50.91 2gfu n ALA 69 Cb 0.00 -1.54 -0.02 0.00 0.00 0.00 0.00 19.45 17.89 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 -2.69 1.43 -0.12 0.00 -2.85 -1.26 -5.17 119.74 109.09 2gfu s LYS 70 Ca 0.46 -0.68 -0.06 0.00 -1.00 0.00 0.00 55.97 54.69 2gfu s LYS 70 Cb 0.36 0.56 -0.04 0.00 -2.06 0.00 0.00 37.83 36.65 2gfu s LYS 70 CO -0.00 -0.64 0.09 -0.80 0.10 0.00 0.00 175.35 174.10 2gfu s ASN 71 N -2.81 5.97 -0.49 0.03 0.01 -1.26 -5.08 114.94 111.31 2gfu s ASN 71 Ca 0.06 0.33 -0.20 0.00 -0.71 0.00 0.00 52.86 52.35 2gfu s ASN 71 Cb -0.03 -1.88 0.05 0.00 0.41 0.00 0.00 41.25 39.80 2gfu s ASN 71 CO -0.03 0.37 0.64 -0.22 -1.51 0.00 0.00 177.10 176.35 2gfu s LEU 72 N -0.82 4.78 0.12 0.60 2.96 -1.26 -4.94 118.68 120.11 2gfu s LEU 72 Ca 0.13 -0.71 0.06 0.00 -0.22 0.00 0.00 54.13 53.39 2gfu s LEU 72 Cb -0.12 -2.54 -0.21 0.00 0.50 0.00 0.00 46.19 43.82 2gfu s LEU 72 CO 0.03 -0.87 1.27 0.78 -1.32 0.00 0.00 176.35 176.24 2gfu h ASN 73 N 8.97 0.02 0.00 3.68 4.21 -1.98 -3.48 115.58 127.00 2gfu h ASN 73 Ca -0.27 -0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.22 2gfu h ASN 73 Cb 1.09 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 38.29 2gfu h ASN 73 CO 0.94 1.02 0.00 0.61 -1.29 0.00 0.00 177.43 178.71 2gfu n GLY 74 N 1.36 3.03 3.18 2.83 0.00 -1.26 -5.05 105.19 109.28 2gfu n GLY 74 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 2gfu n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gfu s GLY 75 N -2.76 0.91 0.00 -0.02 0.00 -1.26 -4.61 107.32 99.58 2gfu s GLY 75 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.85 2gfu s GLY 75 CO 0.00 -0.80 0.00 1.04 0.00 0.00 0.00 173.10 173.34 2gfu n LEU 76 N 2.11 0.00 0.06 0.66 4.77 -0.70 -4.52 117.00 119.38 2gfu n LEU 76 Ca -0.17 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.76 2gfu n LEU 76 Cb 0.54 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.76 2gfu n LEU 76 CO 0.23 0.00 0.52 0.03 -1.33 0.00 0.00 177.39 176.84 2gfu h ARG 77 N 0.00 0.32 -0.02 3.23 2.47 -1.94 -2.91 114.38 115.53 2gfu h ARG 77 Ca 0.00 -0.20 0.00 0.00 -1.26 0.00 0.00 59.98 58.52 2gfu h ARG 77 Cb 0.00 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.34 2gfu h ARG 77 CO 0.00 0.78 -0.19 -2.13 0.56 0.00 0.00 179.97 178.99 2gfu n ARG 78 N -3.93 1.59 0.00 0.04 3.00 -1.26 -5.06 116.66 111.03 2gfu n ARG 78 Ca -0.02 -1.20 0.00 0.00 -0.00 0.00 0.00 57.85 56.63 2gfu n ARG 78 Cb 0.58 -1.48 0.00 0.00 0.00 0.00 0.00 32.46 31.56 2gfu n ARG 78 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2gfu n SER 79 N 0.34 0.00 -3.64 6.15 3.41 -1.10 -4.49 113.62 114.29 2gfu n SER 79 Ca 0.13 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.45 2gfu n SER 79 Cb 0.47 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.28 2gfu n SER 79 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2gfu s VAL 80 N 0.00 0.70 -0.35 -3.33 1.01 -1.26 -1.72 120.40 115.45 2gfu s VAL 80 Ca 0.00 -1.65 -0.17 0.00 0.00 0.00 0.00 61.98 60.16 2gfu s VAL 80 Cb 0.00 -1.52 -0.00 0.00 0.00 0.00 0.00 36.38 34.85 2gfu s VAL 80 CO 0.00 -0.80 0.47 0.00 0.00 0.00 0.00 175.10 174.77 2gfu s ALA 81 N 1.27 3.48 -0.97 5.51 0.00 -1.26 -5.04 121.76 124.75 2gfu s ALA 81 Ca 0.13 -1.08 -0.23 0.00 0.00 0.00 0.00 51.96 50.78 2gfu s ALA 81 Cb -0.20 -2.97 0.06 0.00 0.00 0.00 0.00 23.12 20.01 2gfu s ALA 81 CO -0.15 -1.20 1.38 -1.25 0.00 0.00 0.00 175.76 174.54 2gfu s PRO 82 N 2.29 3.54 0.00 0.00 0.04 -1.26 -4.87 135.00 134.73 2gfu s PRO 82 Ca 0.17 -1.12 0.00 0.00 0.04 0.00 0.00 61.00 60.09 2gfu s PRO 82 Cb -0.16 -5.16 0.00 0.00 0.04 0.00 0.00 34.50 29.22 2gfu s PRO 82 CO 0.13 -2.13 0.00 0.00 0.04 0.00 0.00 177.00 175.03 2gfu n ALA 83 N 8.58 0.00 -2.96 8.56 0.00 -1.26 -5.02 120.51 128.41 2gfu n ALA 83 Ca 0.28 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.33 2gfu n ALA 83 Cb 0.50 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.84 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 -4.00 3.20 -2.17 0.00 0.00 -1.26 -5.00 121.76 112.53 2gfu s ALA 84 Ca 0.00 -1.66 0.19 0.00 0.00 0.00 0.00 51.96 50.49 2gfu s ALA 84 Cb 0.00 -2.45 0.81 0.00 0.00 0.00 0.00 23.12 21.48 2gfu s ALA 84 CO 0.00 -1.27 1.56 -0.35 0.00 0.00 0.00 175.76 175.70 2gfu n PRO 85 N 4.94 1.49 -2.12 0.00 -0.04 -1.26 -3.44 135.00 134.57 2gfu n PRO 85 Ca -0.12 -0.73 -0.22 0.00 -0.04 0.00 0.00 63.50 62.38 2gfu n PRO 85 Cb 0.46 -1.34 0.02 0.00 -0.04 0.00 0.00 33.50 32.60 2gfu n PRO 85 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 2gfu n THR 86 N -0.03 2.41 0.61 0.52 5.66 -1.26 -4.64 114.28 117.54 2gfu n THR 86 Ca 0.15 -4.16 0.10 0.00 -3.05 0.00 0.00 64.05 57.09 2gfu n THR 86 Cb 0.23 -0.94 -0.13 0.00 -1.55 0.00 0.00 70.33 67.94 2gfu n THR 86 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2gfu n SER 87 N -0.68 0.72 -2.83 1.09 3.41 -1.22 -5.06 113.62 109.05 2gfu n SER 87 Ca 0.41 -0.63 -0.05 0.00 -0.26 0.00 0.00 58.87 58.33 2gfu n SER 87 Cb 0.93 1.33 0.01 0.00 -0.26 0.00 0.00 64.21 66.22 2gfu n SER 87 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2gfu n SER 88 N -1.73 -7.53 -3.42 4.04 7.64 -1.26 -4.91 113.62 106.44 2gfu n SER 88 Ca 0.01 0.31 -0.27 0.00 1.01 0.00 0.00 58.87 59.94 2gfu n SER 88 Cb 0.39 -5.10 -0.10 0.00 -1.01 0.00 0.00 64.21 58.40 2gfu n SER 88 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2gfu n ASP 89 N -0.78 0.23 -4.09 6.43 8.00 -1.26 -3.91 116.55 121.17 2gfu n ASP 89 Ca 0.07 -2.58 -0.30 0.00 0.71 0.00 0.00 54.79 52.70 2gfu n ASP 89 Cb 0.45 -0.60 -0.17 0.00 -0.02 0.00 0.00 41.12 40.79 2gfu n ASP 89 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2gfu s PHE 90 N -0.45 2.21 0.42 1.24 0.08 -1.26 -5.13 117.98 115.08 2gfu s PHE 90 Ca 0.33 -1.07 0.07 0.00 0.12 0.00 0.00 56.93 56.38 2gfu s PHE 90 Cb 0.06 -1.56 -0.04 0.00 -0.57 0.00 0.00 43.02 40.91 2gfu s PHE 90 CO -0.17 -0.53 0.24 -1.54 -0.10 0.00 0.00 175.22 173.12 2gfu s SER 91 N 0.94 4.59 -0.01 1.36 1.04 -1.26 -5.01 113.70 115.34 2gfu s SER 91 Ca -0.07 -1.01 -0.40 0.00 0.48 0.00 0.00 55.95 54.96 2gfu s SER 91 Cb -0.15 -0.45 -0.19 0.00 0.10 0.00 0.00 66.02 65.33 2gfu s SER 91 CO -0.02 -0.60 1.16 -2.65 0.98 0.00 0.00 173.24 172.11 2gfu n PRO 92 N -1.34 0.24 -0.44 4.02 -0.02 -1.26 -3.08 135.00 133.12 2gfu n PRO 92 Ca -0.00 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2gfu n PRO 92 Cb 0.64 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 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 1.88 0.72 3.91 -1.23 0.00 -0.17 -4.92 105.19 105.38 2gfu n GLY 93 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.99 6.42 0.15 1.61 1.01 -1.18 -4.82 116.67 116.88 2gfu s ASP 94 Ca 0.00 0.59 0.07 0.00 0.71 0.00 0.00 52.55 53.92 2gfu s ASP 94 Cb 0.00 -2.09 -0.04 0.00 1.01 0.00 0.00 42.92 41.80 2gfu s ASP 94 CO 0.00 -0.14 -0.00 -0.76 0.21 0.00 0.00 175.17 174.48 2gfu s LEU 95 N -3.48 3.34 0.21 1.23 2.01 -1.26 -2.45 118.68 118.28 2gfu s LEU 95 Ca 0.42 -0.35 -0.03 0.00 0.01 0.00 0.00 54.13 54.18 2gfu s LEU 95 Cb -0.11 -2.02 -0.03 0.00 0.01 0.00 0.00 46.19 44.04 2gfu s LEU 95 CO 0.30 0.11 0.20 0.68 1.01 0.00 0.00 176.35 178.65 2gfu s VAL 96 N -1.62 0.00 -0.24 -1.59 -7.23 -1.05 -2.60 120.40 106.06 2gfu s VAL 96 Ca 0.27 -1.88 -0.02 0.00 -1.81 0.00 0.00 61.98 58.54 2gfu s VAL 96 Cb -0.10 -2.44 0.02 0.00 0.56 0.00 0.00 36.38 34.42 2gfu s VAL 96 CO 0.18 0.00 -0.06 0.26 -0.31 0.00 0.00 175.10 175.17 2gfu s TRP 97 N -4.13 3.04 -0.19 2.82 0.52 0.15 -0.84 118.94 120.31 2gfu s TRP 97 Ca 0.36 -1.46 -0.07 0.00 0.02 0.00 0.00 56.10 54.95 2gfu s TRP 97 Cb 0.05 -2.06 -0.04 0.00 -1.15 0.00 0.00 33.47 30.27 2gfu s TRP 97 CO 0.11 -0.71 0.05 0.00 0.02 0.00 0.00 176.95 176.43 2gfu s ALA 98 N 1.35 3.29 0.00 0.98 0.00 0.43 -0.53 121.76 127.29 2gfu s ALA 98 Ca 0.01 -0.83 -0.09 0.00 0.00 0.00 0.00 51.96 51.05 2gfu s ALA 98 Cb -0.16 -1.90 -0.05 0.00 0.00 0.00 0.00 23.12 21.01 2gfu s ALA 98 CO -0.04 0.05 0.30 0.21 0.00 0.00 0.00 175.76 176.28 2gfu s LYS 99 N 0.62 3.66 0.09 0.00 2.36 -1.07 -2.37 119.74 123.04 2gfu s LYS 99 Ca 0.02 0.06 0.06 0.00 -2.55 0.00 0.00 55.97 53.57 2gfu s LYS 99 Cb -0.13 -3.10 -0.03 0.00 -1.05 0.00 0.00 37.83 33.51 2gfu s LYS 99 CO 0.02 0.66 -0.16 1.41 1.55 0.00 0.00 175.35 178.82 2gfu s MET 100 N -1.56 0.96 -0.79 4.03 -2.45 -1.26 -4.91 119.30 113.31 2gfu s MET 100 Ca 0.26 -1.08 -0.26 0.00 -1.25 0.00 0.00 55.69 53.37 2gfu s MET 100 Cb -0.14 -1.02 -0.00 0.00 1.25 0.00 0.00 34.83 34.92 2gfu s MET 100 CO 0.14 0.22 1.65 -2.00 1.05 0.00 0.00 175.02 176.09 2gfu s GLU 101 N -1.99 2.94 0.00 4.11 2.12 -1.26 -2.59 118.70 122.03 2gfu s GLU 101 Ca 0.03 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.21 2gfu s GLU 101 Cb -0.09 -4.68 0.00 0.00 0.26 0.00 0.00 34.13 29.62 2gfu s GLU 101 CO 0.03 -2.63 0.00 0.41 -0.54 0.00 0.00 175.26 172.53 2gfu n GLY 102 N 6.11 0.90 3.61 -1.50 0.00 -1.26 -5.12 105.19 107.93 2gfu n GLY 102 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 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 2.51 0.92 1.61 2.02 -1.07 -5.15 117.35 116.18 2gfu s TYR 103 Ca 0.00 -0.45 -0.12 0.00 -0.37 0.00 0.00 57.07 56.13 2gfu s TYR 103 Cb 0.00 -1.46 0.14 0.00 -0.40 0.00 0.00 41.96 40.24 2gfu s TYR 103 CO 0.00 0.50 1.10 -2.14 -1.57 0.00 0.00 175.55 173.45 2gfu s PRO 104 N -3.69 1.09 -0.21 -1.71 0.02 -1.26 -4.53 135.00 124.71 2gfu s PRO 104 Ca 0.34 0.59 -0.34 0.00 0.02 0.00 0.00 61.00 61.61 2gfu s PRO 104 Cb 0.01 -1.81 -0.11 0.00 0.02 0.00 0.00 34.50 32.61 2gfu s PRO 104 CO 0.19 -2.30 2.02 0.91 -0.33 0.00 0.00 177.00 177.49 2gfu n TRP 105 N -3.89 2.02 -4.01 6.54 7.02 -1.26 -4.48 117.44 119.38 2gfu n TRP 105 Ca 0.06 0.12 -0.34 0.00 -1.02 0.00 0.00 57.50 56.32 2gfu n TRP 105 Cb 0.57 -2.61 -0.15 0.00 -2.42 0.00 0.00 31.31 26.70 2gfu n TRP 105 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 2gfu s TRP 106 N 5.72 2.95 0.25 -5.99 0.52 -1.00 -4.84 118.94 116.55 2gfu s TRP 106 Ca 1.00 -1.47 -0.31 0.00 0.02 0.00 0.00 56.10 55.34 2gfu s TRP 106 Cb -0.73 -2.01 -0.13 0.00 -1.15 0.00 0.00 33.47 29.45 2gfu s TRP 106 CO 0.50 -0.72 1.51 -0.35 0.02 0.00 0.00 176.95 177.91 2gfu n PRO 107 N 4.67 2.32 -3.96 4.98 -0.04 -1.26 -0.42 135.00 141.29 2gfu n PRO 107 Ca -0.18 0.83 -0.10 0.00 -0.04 0.00 0.00 63.50 64.01 2gfu n PRO 107 Cb 0.49 -2.55 -0.07 0.00 -0.04 0.00 0.00 33.50 31.33 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 0.48 0.03 -0.09 3.54 0.01 -0.02 -2.93 113.70 114.72 2gfu s SER 108 Ca 0.68 -0.87 0.03 0.00 1.31 0.00 0.00 55.95 57.10 2gfu s SER 108 Cb -0.59 0.44 0.01 0.00 0.21 0.00 0.00 66.02 66.09 2gfu s SER 108 CO 0.47 -0.90 -0.18 -0.22 0.41 0.00 0.00 173.24 172.82 2gfu s LEU 109 N -2.97 1.87 -0.24 2.44 0.20 -0.54 -2.55 118.68 116.90 2gfu s LEU 109 Ca 0.17 -0.45 -0.17 0.00 0.69 0.00 0.00 54.13 54.38 2gfu s LEU 109 Cb 0.03 -1.15 -0.03 0.00 -0.43 0.00 0.00 46.19 44.61 2gfu s LEU 109 CO 0.00 0.09 0.48 -0.69 -0.29 0.00 0.00 176.35 175.93 2gfu s VAL 110 N 0.59 5.11 0.08 1.68 1.01 -1.03 -2.26 120.40 125.58 2gfu s VAL 110 Ca -0.15 0.82 0.03 0.00 0.00 0.00 0.00 61.98 62.69 2gfu s VAL 110 Cb -0.17 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 2gfu s VAL 110 CO 0.05 0.14 -0.09 -0.47 0.00 0.00 0.00 175.10 174.73 2gfu s TYR 111 N 1.96 0.95 -0.30 5.22 6.14 -1.26 -1.00 117.35 129.07 2gfu s TYR 111 Ca 0.21 -0.63 -0.29 0.00 0.64 0.00 0.00 57.07 57.00 2gfu s TYR 111 Cb -0.15 -0.54 -0.01 0.00 0.42 0.00 0.00 41.96 41.68 2gfu s TYR 111 CO 0.09 -0.04 1.58 0.54 0.64 0.00 0.00 175.55 178.36 2gfu s ASN 112 N -2.21 6.29 0.63 4.32 4.22 -1.26 -4.68 114.94 122.24 2gfu s ASN 112 Ca 0.01 1.33 -0.12 0.00 -2.14 0.00 0.00 52.86 51.94 2gfu s ASN 112 Cb -0.05 -2.53 -0.03 0.00 1.28 0.00 0.00 41.25 39.92 2gfu s ASN 112 CO -0.00 -1.38 1.04 -2.28 -2.04 0.00 0.00 177.10 172.43 2gfu s HIS 113 N 5.55 3.33 -1.45 1.54 2.46 -1.26 -4.84 115.29 120.62 2gfu s HIS 113 Ca 0.69 1.39 0.00 0.00 0.47 0.00 0.00 55.06 57.62 2gfu s HIS 113 Cb -0.21 -2.83 0.00 0.00 -0.13 0.00 0.00 32.58 29.41 2gfu s HIS 113 CO 0.30 -0.88 0.44 -2.30 -2.47 0.00 0.00 174.74 169.83 2gfu n PRO 114 N -2.60 0.00 0.00 2.88 -0.02 -1.26 0.09 135.00 134.10 2gfu n PRO 114 Ca 0.07 0.04 0.11 0.00 -2.02 0.00 0.00 63.50 61.71 2gfu n PRO 114 Cb 0.54 -1.51 0.12 0.00 -0.02 0.00 0.00 33.50 32.62 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 -0.94 0.00 -0.12 6.00 3.72 -1.26 -5.07 117.46 119.79 2gfu n PHE 115 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2gfu n PHE 115 Cb 0.01 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 2gfu n PHE 115 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2gfu n ASP 116 N -0.89 0.00 0.00 4.37 9.92 0.11 -2.81 116.55 127.26 2gfu n ASP 116 Ca 0.08 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.34 2gfu n ASP 116 Cb 0.37 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.85 2gfu n ASP 116 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2gfu n GLY 117 N 0.35 2.31 3.50 0.44 0.00 -1.26 -5.04 105.19 105.50 2gfu n GLY 117 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2gfu n GLY 117 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gfu s THR 118 N -2.36 4.70 0.00 2.61 2.01 -1.12 -4.97 115.64 116.51 2gfu s THR 118 Ca 0.00 -0.04 0.00 0.00 0.31 0.00 0.00 61.69 61.96 2gfu s THR 118 Cb 0.00 -3.21 0.00 0.00 0.01 0.00 0.00 72.50 69.30 2gfu s THR 118 CO 0.00 0.31 0.00 0.33 -0.69 0.00 0.00 174.62 174.57 2gfu n PHE 119 N 4.96 0.00 -4.25 4.92 7.35 -1.26 -4.68 117.46 124.49 2gfu n PHE 119 Ca -0.15 0.00 -0.26 0.00 -0.76 0.00 0.00 57.45 56.28 2gfu n PHE 119 Cb 0.52 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.27 2gfu n PHE 119 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 2gfu s ILE 120 N -0.68 3.51 0.01 -2.13 -4.36 -1.26 -3.93 121.20 112.36 2gfu s ILE 120 Ca 0.00 -1.60 -0.02 0.00 -0.26 0.00 0.00 60.65 58.77 2gfu s ILE 120 Cb 0.00 -2.79 -0.01 0.00 1.25 0.00 0.00 42.46 40.91 2gfu s ILE 120 CO 0.00 -0.17 0.02 -0.13 0.24 0.00 0.00 174.94 174.90 2gfu s ARG 121 N -3.08 0.35 -0.11 0.37 0.52 -1.20 -5.05 118.95 110.75 2gfu s ARG 121 Ca 0.28 -0.54 -0.14 0.00 -0.52 0.00 0.00 55.73 54.81 2gfu s ARG 121 Cb -0.08 0.13 0.03 0.00 0.52 0.00 0.00 34.95 35.55 2gfu s ARG 121 CO 0.18 -0.07 0.37 -1.83 0.02 0.00 0.00 175.30 173.97 2gfu s GLU 122 N -1.41 0.50 -0.48 3.54 -1.05 -1.26 -2.12 118.70 116.42 2gfu s GLU 122 Ca -0.15 0.35 0.02 0.00 -0.15 0.00 0.00 54.97 55.04 2gfu s GLU 122 Cb -0.09 0.24 0.13 0.00 -0.44 0.00 0.00 34.13 33.96 2gfu s GLU 122 CO -0.00 -0.09 0.23 -1.59 0.95 0.00 0.00 175.26 174.76 2gfu s LYS 123 N -0.18 1.94 0.00 -4.83 -2.85 -1.24 -5.02 119.74 107.56 2gfu s LYS 123 Ca -0.03 -2.34 0.00 0.00 -1.00 0.00 0.00 55.97 52.59 2gfu s LYS 123 Cb -0.03 -3.38 0.00 0.00 -2.06 0.00 0.00 37.83 32.36 2gfu s LYS 123 CO 0.02 -1.07 0.00 0.41 0.10 0.00 0.00 175.35 174.80 2gfu n GLY 124 N 3.60 0.43 2.72 0.59 0.00 -1.26 -3.76 105.19 107.52 2gfu n GLY 124 Ca 0.05 -0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 2gfu n GLY 124 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2gfu n LYS 125 N 0.00 1.35 -3.56 1.61 2.85 -1.26 -5.09 118.16 114.06 2gfu n LYS 125 Ca 0.00 -2.96 -0.06 0.00 -1.05 0.00 0.00 58.31 54.23 2gfu n LYS 125 Cb 0.00 -1.05 -0.02 0.00 -0.65 0.00 0.00 35.03 33.31 2gfu n LYS 125 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2gfu s SER 126 N -2.90 -0.25 -0.00 -5.58 0.01 -1.25 -5.19 113.70 98.54 2gfu s SER 126 Ca 0.25 0.03 0.01 0.00 1.31 0.00 0.00 55.95 57.54 2gfu s SER 126 Cb 0.41 0.25 -0.00 0.00 0.21 0.00 0.00 66.02 66.89 2gfu s SER 126 CO -0.02 -0.40 -0.02 0.54 0.41 0.00 0.00 173.24 173.75 2gfu s VAL 127 N -2.58 0.18 0.28 3.43 0.11 -1.26 -3.60 120.40 116.96 2gfu s VAL 127 Ca 0.07 -0.12 0.11 0.00 -2.93 0.00 0.00 61.98 59.10 2gfu s VAL 127 Cb -0.01 -0.17 -0.05 0.00 -1.53 0.00 0.00 36.38 34.63 2gfu s VAL 127 CO -0.06 0.04 -0.11 -0.13 -3.33 0.00 0.00 175.10 171.51 2gfu s ARG 128 N -0.09 1.97 0.16 1.54 0.52 -0.90 -0.11 118.95 122.04 2gfu s ARG 128 Ca 0.00 -1.61 -0.10 0.00 -0.52 0.00 0.00 55.73 53.50 2gfu s ARG 128 Cb -0.01 -1.95 -0.00 0.00 0.52 0.00 0.00 34.95 33.51 2gfu s ARG 128 CO -0.00 0.34 0.31 0.14 0.02 0.00 0.00 175.30 176.10 2gfu s VAL 129 N -2.43 0.07 -0.31 3.52 -7.23 -0.80 -3.24 120.40 109.97 2gfu s VAL 129 Ca 0.31 -1.29 -0.19 0.00 -1.81 0.00 0.00 61.98 58.99 2gfu s VAL 129 Cb -0.05 -1.77 -0.01 0.00 0.56 0.00 0.00 36.38 35.11 2gfu s VAL 129 CO 0.17 -0.30 0.58 -1.00 -0.31 0.00 0.00 175.10 174.25 2gfu s HIS 130 N -3.95 3.21 0.13 2.82 0.09 -1.25 -1.70 115.29 114.64 2gfu s HIS 130 Ca 0.15 0.47 0.04 0.00 -0.00 0.00 0.00 55.06 55.72 2gfu s HIS 130 Cb 0.03 -2.95 -0.04 0.00 -0.00 0.00 0.00 32.58 29.62 2gfu s HIS 130 CO -0.01 -0.47 -0.10 0.54 -0.00 0.00 0.00 174.74 174.69 2gfu s VAL 131 N 2.52 1.13 -0.02 -0.90 0.11 -1.23 -4.38 120.40 117.62 2gfu s VAL 131 Ca 0.23 -1.96 0.05 0.00 -2.93 0.00 0.00 61.98 57.37 2gfu s VAL 131 Cb -0.15 -1.73 -0.01 0.00 -1.53 0.00 0.00 36.38 32.96 2gfu s VAL 131 CO 0.12 -0.69 -0.18 0.00 -3.33 0.00 0.00 175.10 171.01 2gfu s GLN 132 N -3.50 1.62 -0.14 1.54 1.03 -0.96 -3.22 119.66 116.02 2gfu s GLN 132 Ca 0.14 -0.65 -0.16 0.00 0.04 0.00 0.00 55.36 54.73 2gfu s GLN 132 Cb 0.01 -1.50 -0.04 0.00 0.03 0.00 0.00 33.01 31.51 2gfu s GLN 132 CO 0.00 0.35 0.39 -0.06 -2.54 0.00 0.00 175.29 173.43 2gfu s PHE 133 N -0.27 3.48 -1.25 9.60 0.40 0.29 -1.46 117.98 128.77 2gfu s PHE 133 Ca 0.03 0.74 -0.11 0.00 -0.60 0.00 0.00 56.93 56.99 2gfu s PHE 133 Cb -0.09 -2.46 -0.06 0.00 0.51 0.00 0.00 43.02 40.92 2gfu s PHE 133 CO 0.00 0.19 2.41 1.19 0.70 0.00 0.00 175.22 179.71 2gfu n PHE 134 N 3.69 2.21 0.00 0.36 3.72 -1.15 -2.59 117.46 123.70 2gfu n PHE 134 Ca -0.09 -2.53 0.00 0.00 -0.05 0.00 0.00 57.45 54.78 2gfu n PHE 134 Cb 0.52 -2.13 0.00 0.00 -0.94 0.00 0.00 39.48 36.92 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 4.81 0.00 -0.07 4.37 5.75 -1.26 -4.71 116.55 125.44 2gfu n ASP 135 Ca 0.59 0.00 -0.13 0.00 -0.01 0.00 0.00 54.79 55.23 2gfu n ASP 135 Cb 0.25 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.30 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 1.50 -0.00 -1.12 8.00 -1.26 -4.89 116.55 118.78 2gfu n ASP 136 Ca 0.00 0.25 -0.12 0.00 0.71 0.00 0.00 54.79 55.63 2gfu n ASP 136 Cb 0.00 -0.58 -0.07 0.00 -0.02 0.00 0.00 41.12 40.44 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 0.07 -4.15 -2.24 0.02 -1.95 -3.48 113.55 101.14 2gfu h SER 137 Ca -0.24 -0.21 -0.46 0.00 -0.84 0.00 0.00 61.79 60.04 2gfu h SER 137 Cb 1.05 -0.02 0.10 0.00 0.14 0.00 0.00 62.40 63.68 2gfu h SER 137 CO -0.15 0.26 0.35 -2.16 -1.14 0.00 0.00 176.83 173.99 2gfu s PRO 138 N -5.37 1.78 0.23 3.45 0.04 -1.26 -4.13 135.00 129.74 2gfu s PRO 138 Ca -0.14 -0.15 -0.02 0.00 0.04 0.00 0.00 61.00 60.74 2gfu s PRO 138 Cb 0.05 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2gfu s PRO 138 CO 0.68 -1.63 0.44 -0.08 0.04 0.00 0.00 177.00 176.44 2gfu s THR 139 N -3.52 5.15 0.01 1.26 -1.32 -1.07 -4.91 115.64 111.25 2gfu s THR 139 Ca 0.64 -0.25 -0.13 0.00 -1.21 0.00 0.00 61.69 60.74 2gfu s THR 139 Cb -0.09 -3.73 0.02 0.00 -1.51 0.00 0.00 72.50 67.18 2gfu s THR 139 CO 0.48 -0.22 0.28 -0.60 -2.21 0.00 0.00 174.62 172.35 2gfu s ARG 140 N -3.40 0.70 -0.05 7.08 3.52 -1.26 -0.55 118.95 125.00 2gfu s ARG 140 Ca 0.40 -0.37 -0.22 0.00 -0.13 0.00 0.00 55.73 55.40 2gfu s ARG 140 Cb -0.11 0.30 0.07 0.00 -1.56 0.00 0.00 34.95 33.66 2gfu s ARG 140 CO 0.29 -0.20 1.00 0.41 -0.81 0.00 0.00 175.30 175.99 2gfu n GLY 141 N 0.98 0.23 3.56 8.12 0.00 -1.20 -5.04 105.19 111.85 2gfu n GLY 141 Ca -0.20 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.14 2.70 0.34 1.61 0.52 -1.26 -3.49 118.94 117.22 2gfu s TRP 142 Ca 0.24 0.25 0.00 0.00 0.02 0.00 0.00 56.10 56.61 2gfu s TRP 142 Cb -0.00 -4.31 -0.03 0.00 -1.15 0.00 0.00 33.47 27.97 2gfu s TRP 142 CO -0.01 -1.46 0.54 0.14 0.02 0.00 0.00 176.95 176.18 2gfu s VAL 143 N 4.49 5.11 -0.45 4.03 -7.23 -0.69 -4.89 120.40 120.76 2gfu s VAL 143 Ca 0.38 -0.46 -0.25 0.00 -1.81 0.00 0.00 61.98 59.84 2gfu s VAL 143 Cb -0.10 -3.86 0.03 0.00 0.56 0.00 0.00 36.38 33.01 2gfu s VAL 143 CO 0.23 -0.55 0.90 -0.44 -0.31 0.00 0.00 175.10 174.93 2gfu s SER 144 N -4.01 6.50 0.51 4.85 0.01 -1.26 -1.91 113.70 118.39 2gfu s SER 144 Ca 0.40 0.11 0.26 0.00 1.31 0.00 0.00 55.95 58.02 2gfu s SER 144 Cb -0.10 -2.44 1.40 0.00 0.21 0.00 0.00 66.02 65.09 2gfu s SER 144 CO 0.36 -1.02 2.07 0.50 0.41 0.00 0.00 173.24 175.56 2gfu h LYS 145 N 9.02 0.00 0.00 12.44 3.64 -0.81 -0.37 116.57 140.49 2gfu h LYS 145 Ca -0.24 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2gfu h LYS 145 Cb 1.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2gfu h LYS 145 CO 1.01 0.13 0.00 -2.13 -2.27 0.00 0.00 179.45 176.19 2gfu n ARG 146 N -3.75 0.09 -0.25 1.90 0.00 -1.25 -2.22 116.66 111.18 2gfu n ARG 146 Ca -0.02 0.42 0.09 0.00 -0.00 0.00 0.00 57.85 58.34 2gfu n ARG 146 Cb 0.23 -1.70 0.22 0.00 0.00 0.00 0.00 32.46 31.22 2gfu n ARG 146 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.63 179.10 2gfu n LEU 147 N -1.87 3.37 -4.70 6.15 -0.00 -0.15 -4.86 117.00 114.94 2gfu n LEU 147 Ca 0.02 -1.85 -0.37 0.00 -0.00 0.00 0.00 56.01 53.80 2gfu n LEU 147 Cb 0.14 -0.32 -0.07 0.00 -0.00 0.00 0.00 43.42 43.16 2gfu n LEU 147 CO 0.13 0.82 0.04 -0.76 -0.00 0.00 0.00 177.39 177.61 2gfu s LEU 148 N -1.08 4.20 0.35 1.47 1.43 -0.94 -2.59 118.68 121.51 2gfu s LEU 148 Ca 0.36 0.51 0.09 0.00 -1.03 0.00 0.00 54.13 54.05 2gfu s LEU 148 Cb 0.19 -2.44 -0.05 0.00 0.03 0.00 0.00 46.19 43.92 2gfu s LEU 148 CO 0.25 0.02 0.08 -0.54 0.23 0.00 0.00 176.35 176.38 2gfu s LYS 149 N 0.87 2.20 0.40 1.70 -0.14 0.31 -4.67 119.74 120.41 2gfu s LYS 149 Ca 0.18 -1.68 -0.16 0.00 -1.36 0.00 0.00 55.97 52.95 2gfu s LYS 149 Cb -0.14 -2.03 -0.09 0.00 -1.68 0.00 0.00 37.83 33.90 2gfu s LYS 149 CO 0.06 0.11 0.84 -1.25 -0.76 0.00 0.00 175.35 174.35 2gfu s PRO 150 N -3.78 3.99 0.51 -1.68 0.04 -1.26 -0.67 135.00 132.15 2gfu s PRO 150 Ca 0.36 0.78 0.01 0.00 0.04 0.00 0.00 61.00 62.19 2gfu s PRO 150 Cb -0.01 -2.31 0.02 0.00 0.04 0.00 0.00 34.50 32.25 2gfu s PRO 150 CO 0.21 -0.01 0.74 -0.47 0.04 0.00 0.00 177.00 177.50 2gfu s TYR 151 N -2.24 3.01 0.00 0.56 5.04 -1.07 -4.74 117.35 117.91 2gfu s TYR 151 Ca 0.56 0.10 0.00 0.00 -2.44 0.00 0.00 57.07 55.29 2gfu s TYR 151 Cb -0.10 -2.59 0.00 0.00 0.35 0.00 0.00 41.96 39.63 2gfu s TYR 151 CO 0.22 -0.68 0.00 -2.37 -1.34 0.00 0.00 175.55 171.39 2gfu n THR 152 N -2.25 0.00 0.00 4.34 5.66 -1.26 -4.96 114.28 115.80 2gfu n THR 152 Ca 0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 2gfu n THR 152 Cb 0.59 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.37 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 0.30 0.19 1.09 0.00 -1.26 -4.51 105.19 101.00 2gfu n GLY 153 Ca 0.00 -1.21 0.13 0.00 0.00 0.00 0.00 46.02 44.94 2gfu n GLY 153 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2gfu h SER 154 N 0.00 0.00 -0.32 1.61 0.02 -1.86 -0.23 113.55 112.77 2gfu h SER 154 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2gfu h SER 154 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2gfu h SER 154 CO 0.00 0.00 0.00 2.29 -1.14 0.00 0.00 176.83 177.98 2gfu n LYS 155 N -2.38 2.26 -3.30 3.45 2.85 -1.26 -4.60 118.16 115.17 2gfu n LYS 155 Ca -0.02 -1.90 -0.39 0.00 -1.05 0.00 0.00 58.31 54.96 2gfu n LYS 155 Cb 0.07 -1.47 -0.06 0.00 -0.65 0.00 0.00 35.03 32.92 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 -1.51 7.04 0.53 -5.58 0.15 -0.10 -5.01 113.70 109.23 2gfu s SER 156 Ca 0.36 1.23 0.23 0.00 0.70 0.00 0.00 55.95 58.47 2gfu s SER 156 Cb 0.21 -2.35 1.44 0.00 -1.71 0.00 0.00 66.02 63.61 2gfu s SER 156 CO 0.30 0.28 2.14 0.50 1.20 0.00 0.00 173.24 177.66 2gfu h LYS 157 N 4.57 0.00 0.00 5.44 3.64 -1.91 0.25 116.57 128.55 2gfu h LYS 157 Ca -0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2gfu h LYS 157 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2gfu h LYS 157 CO 0.63 0.06 0.00 0.39 -2.27 0.00 0.00 179.45 178.26 2gfu n GLU 158 N -4.09 0.01 -0.61 1.90 1.02 -1.26 -3.32 120.64 114.29 2gfu n GLU 158 Ca -0.03 0.04 0.08 0.00 -0.02 0.00 0.00 57.16 57.24 2gfu n GLU 158 Cb 0.15 -1.51 0.33 0.00 -0.02 0.00 0.00 31.44 30.38 2gfu n GLU 158 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gfu n ALA 159 N -1.51 3.20 -2.42 0.62 0.00 0.86 -0.33 120.51 120.92 2gfu n ALA 159 Ca 0.06 -1.83 -0.21 0.00 0.00 0.00 0.00 53.44 51.46 2gfu n ALA 159 Cb 0.32 -0.91 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 2gfu n ALA 159 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2gfu s GLN 160 N -2.27 1.71 0.07 0.00 1.03 -1.18 -4.78 119.66 114.24 2gfu s GLN 160 Ca 0.47 -1.99 -0.30 0.00 0.04 0.00 0.00 55.36 53.57 2gfu s GLN 160 Cb 0.34 -0.43 -0.09 0.00 0.03 0.00 0.00 33.01 32.85 2gfu s GLN 160 CO 0.17 -0.40 1.91 0.21 -2.54 0.00 0.00 175.29 174.64 2gfu s LYS 161 N -3.81 4.14 0.00 9.60 2.20 -1.26 -1.06 119.74 129.55 2gfu s LYS 161 Ca 0.32 2.61 0.00 0.00 -0.36 0.00 0.00 55.97 58.53 2gfu s LYS 161 Cb 0.05 -3.92 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 2gfu s LYS 161 CO 0.16 -0.91 0.00 0.41 -0.36 0.00 0.00 175.35 174.65 2gfu n GLY 162 N 4.41 1.02 3.86 5.54 0.00 -1.26 -5.09 105.19 113.67 2gfu n GLY 162 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.24 2.23 0.24 -0.02 0.00 -0.22 -5.00 107.32 102.31 2gfu s GLY 163 Ca 0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 44.72 44.62 2gfu s GLY 163 CO 0.00 0.14 1.81 0.84 0.00 0.00 0.00 173.10 175.89 2gfu h HIS 164 N 2.03 1.09 0.00 1.90 2.76 -1.81 -3.18 115.15 117.94 2gfu h HIS 164 Ca -0.48 -0.08 -0.06 0.00 -2.20 0.00 0.00 60.37 57.56 2gfu h HIS 164 Cb 1.18 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 29.80 2gfu h HIS 164 CO 0.61 0.84 -0.93 0.74 -1.30 0.00 0.00 177.93 177.89 2gfu h PHE 165 N 1.04 0.00 -1.16 5.26 0.04 -1.61 -3.45 116.94 117.07 2gfu h PHE 165 Ca 0.24 0.00 -0.48 0.00 2.80 0.00 0.00 57.97 60.52 2gfu h PHE 165 Cb 0.23 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.30 2gfu h PHE 165 CO 0.02 0.20 1.19 -0.47 -0.60 0.00 0.00 178.31 178.65 2gfu s TYR 166 N -3.19 2.20 -0.28 -0.55 5.04 0.55 -4.79 117.35 116.33 2gfu s TYR 166 Ca 0.00 -0.16 0.03 0.00 -2.44 0.00 0.00 57.07 54.50 2gfu s TYR 166 Cb 0.08 -4.43 0.07 0.00 0.35 0.00 0.00 41.96 38.03 2gfu s TYR 166 CO 0.78 -1.91 -0.06 -1.12 -1.34 0.00 0.00 175.55 171.90 2gfu s SER 167 N 6.09 4.59 -0.63 4.32 0.01 -1.26 -4.79 113.70 122.03 2gfu s SER 167 Ca 0.54 -1.56 -0.22 0.00 1.31 0.00 0.00 55.95 56.02 2gfu s SER 167 Cb -0.04 -1.59 0.07 0.00 0.21 0.00 0.00 66.02 64.66 2gfu s SER 167 CO -0.02 -0.25 0.93 0.00 0.41 0.00 0.00 173.24 174.31 2gfu s ALA 168 N 1.08 3.15 -0.02 1.44 0.00 -1.26 -4.76 121.76 121.39 2gfu s ALA 168 Ca -0.04 -1.74 0.08 0.00 0.00 0.00 0.00 51.96 50.26 2gfu s ALA 168 Cb -0.20 -3.79 -0.02 0.00 0.00 0.00 0.00 23.12 19.11 2gfu s ALA 168 CO -0.05 -2.63 -0.26 0.21 0.00 0.00 0.00 175.76 173.03 2gfu s LYS 169 N 3.89 2.11 0.47 0.00 2.20 -1.26 -5.07 119.74 122.08 2gfu s LYS 169 Ca 0.23 -0.91 0.18 0.00 -0.36 0.00 0.00 55.97 55.11 2gfu s LYS 169 Cb -0.17 -2.02 1.18 0.00 -1.51 0.00 0.00 37.83 35.32 2gfu s LYS 169 CO 0.12 0.54 1.99 -1.00 -0.36 0.00 0.00 175.35 176.63 2gfu h PRO 170 N 5.54 0.23 -0.37 4.03 0.13 -1.99 -1.94 132.00 137.62 2gfu h PRO 170 Ca -0.42 -0.01 -0.08 0.00 -0.87 0.00 0.00 66.00 64.61 2gfu h PRO 170 Cb 1.13 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 2gfu h PRO 170 CO 0.47 0.15 -0.12 1.05 -0.23 0.00 0.00 178.00 179.32 2gfu h GLU 171 N 0.23 0.65 -0.45 0.86 4.11 -1.94 0.15 114.58 118.20 2gfu h GLU 171 Ca 0.27 -0.20 -0.13 0.00 0.07 0.00 0.00 59.36 59.36 2gfu h GLU 171 Cb 0.73 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2gfu h GLU 171 CO -0.05 0.75 -0.24 0.82 0.07 0.00 0.00 179.01 180.36 2gfu h ILE 172 N 0.59 1.27 0.08 -1.06 1.08 -1.66 -1.52 117.51 116.29 2gfu h ILE 172 Ca 0.10 -1.39 -0.00 0.00 -0.39 0.00 0.00 64.86 63.18 2gfu h ILE 172 Cb 0.55 1.18 0.00 0.00 -3.07 0.00 0.00 36.82 35.48 2gfu h ILE 172 CO 0.03 0.47 -0.04 -0.07 -0.69 0.00 0.00 178.15 177.86 2gfu h LEU 173 N 0.80 -0.09 -1.39 1.44 3.38 -1.32 -1.89 115.31 116.23 2gfu h LEU 173 Ca 0.10 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2gfu h LEU 173 Cb 0.80 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 2gfu h LEU 173 CO 0.07 0.35 0.27 -0.09 0.09 0.00 0.00 178.44 179.13 2gfu h ARG 174 N -0.55 0.69 -0.21 1.13 9.65 -0.75 0.82 114.38 125.16 2gfu h ARG 174 Ca -0.01 -0.07 -0.13 0.00 -1.10 0.00 0.00 59.98 58.68 2gfu h ARG 174 Cb 0.46 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 2gfu h ARG 174 CO 0.02 0.51 -0.40 0.00 2.80 0.00 0.00 179.97 182.89 2gfu h ALA 175 N 1.61 0.92 -0.22 2.80 0.00 -1.35 0.13 119.26 123.13 2gfu h ALA 175 Ca 0.18 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 2gfu h ALA 175 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2gfu h ALA 175 CO -0.03 0.63 -0.40 0.52 0.00 0.00 0.00 179.25 179.98 2gfu h MET 176 N 0.40 0.52 -0.12 0.00 2.86 -0.36 0.75 114.93 118.98 2gfu h MET 176 Ca 0.04 -0.26 -0.02 0.00 -2.06 0.00 0.00 59.70 57.40 2gfu h MET 176 Cb 0.88 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.54 2gfu h MET 176 CO 0.07 0.83 -0.01 1.96 1.06 0.00 0.00 176.91 180.82 2gfu h GLN 177 N 0.43 0.22 0.17 1.72 4.20 -0.52 0.18 115.11 121.51 2gfu h GLN 177 Ca 0.04 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2gfu h GLN 177 Cb 0.88 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.65 2gfu h GLN 177 CO 0.08 0.49 -0.08 -0.09 -0.67 0.00 0.00 178.83 178.55 2gfu h ARG 178 N -0.07 -0.22 -0.27 1.46 2.43 -0.86 -2.24 114.38 114.60 2gfu h ARG 178 Ca 0.03 0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2gfu h ARG 178 Cb 0.40 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 2gfu h ARG 178 CO 0.01 0.16 0.06 0.00 -1.51 0.00 0.00 179.97 178.69 2gfu h ALA 179 N 0.02 1.60 -0.28 2.80 0.00 -0.94 -2.29 119.26 120.16 2gfu h ALA 179 Ca -0.02 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2gfu h ALA 179 Cb 0.49 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2gfu h ALA 179 CO 0.04 0.31 -0.15 0.22 0.00 0.00 0.00 179.25 179.67 2gfu h ASP 180 N 0.39 0.62 -0.29 0.00 1.82 -1.03 -3.28 116.42 114.65 2gfu h ASP 180 Ca 0.09 -0.41 -0.10 0.00 -0.39 0.00 0.00 57.03 56.22 2gfu h ASP 180 Cb 0.17 -0.17 -0.02 0.00 0.68 0.00 0.00 39.33 39.99 2gfu h ASP 180 CO -0.00 0.90 -0.15 1.05 -1.61 0.00 0.00 179.24 179.42 2gfu h GLU 181 N 0.34 0.73 -0.21 0.28 4.11 -1.17 -2.98 114.58 115.68 2gfu h GLU 181 Ca 0.06 -0.26 -0.13 0.00 0.07 0.00 0.00 59.36 59.11 2gfu h GLU 181 Cb 0.67 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2gfu h GLU 181 CO 0.04 0.85 -0.41 0.00 0.07 0.00 0.00 179.01 179.56 2gfu h ALA 182 N 1.17 0.90 0.16 1.06 0.00 -1.50 -0.79 119.26 120.27 2gfu h ALA 182 Ca 0.11 -0.44 -0.30 0.00 0.00 0.00 0.00 54.91 54.28 2gfu h ALA 182 Cb 0.63 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2gfu h ALA 182 CO 0.04 0.64 -1.41 1.37 0.00 0.00 0.00 179.25 179.89 2gfu h LEU 183 N 0.40 0.54 0.00 0.00 -0.00 -1.64 -2.96 115.31 111.66 2gfu h LEU 183 Ca 0.03 -0.63 -0.15 0.00 -0.00 0.00 0.00 57.88 57.13 2gfu h LEU 183 Cb 0.89 -0.18 -0.03 0.00 -0.00 0.00 0.00 40.66 41.35 2gfu h LEU 183 CO 0.08 1.50 -1.16 0.78 -0.00 0.00 0.00 178.44 179.64 2gfu h ASN 184 N 0.09 0.00 0.00 0.17 2.35 -1.60 -3.44 115.58 113.15 2gfu h ASN 184 Ca -0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.54 2gfu h ASN 184 Cb 2.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.42 2gfu h ASN 184 CO 0.21 0.56 0.00 0.29 -1.65 0.00 0.00 177.43 176.85 2gfu n LYS 185 N -2.99 0.00 -4.11 0.81 5.02 -0.30 -5.07 118.16 111.52 2gfu n LYS 185 Ca -0.06 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.08 2gfu n LYS 185 Cb 0.81 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.69 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 -0.91 0.73 0.43 4.39 1.01 -1.25 -5.03 116.67 116.04 2gfu s ASP 186 Ca 0.00 -0.32 0.19 0.00 0.71 0.00 0.00 52.55 53.13 2gfu s ASP 186 Cb 0.00 -0.02 1.12 0.00 1.01 0.00 0.00 42.92 45.04 2gfu s ASP 186 CO 0.00 -0.07 1.84 0.11 0.21 0.00 0.00 175.17 177.26 2gfu h LYS 187 N 5.26 0.36 -0.73 8.23 1.57 -1.85 -1.01 116.57 128.38 2gfu h LYS 187 Ca -0.32 -0.02 0.21 0.00 -1.87 0.00 0.00 60.65 58.65 2gfu h LYS 187 Cb 1.20 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.40 2gfu h LYS 187 CO 0.45 0.24 0.63 0.97 -0.57 0.00 0.00 179.45 181.17 2gfu h ILE 188 N 0.37 0.41 0.00 1.86 2.10 -1.96 0.25 117.51 120.53 2gfu h ILE 188 Ca 0.49 0.00 -0.14 0.00 1.08 0.00 0.00 64.86 66.28 2gfu h ILE 188 Cb 1.28 0.53 -0.02 0.00 -1.09 0.00 0.00 36.82 37.52 2gfu h ILE 188 CO -0.18 0.00 -0.69 0.11 -1.08 0.00 0.00 178.15 176.31 2gfu h LYS 189 N 0.00 0.00 -0.04 2.19 6.56 -1.49 -1.82 116.57 121.97 2gfu h LYS 189 Ca 0.35 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.77 2gfu h LYS 189 Cb 1.61 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 33.28 2gfu h LYS 189 CO -0.00 0.69 -0.64 -0.09 -2.06 0.00 0.00 179.45 177.34 2gfu h ARG 190 N 0.00 0.50 0.00 3.15 1.12 -0.71 -3.34 114.38 115.10 2gfu h ARG 190 Ca -0.01 -0.49 0.00 0.00 -1.11 0.00 0.00 59.98 58.37 2gfu h ARG 190 Cb 1.22 0.13 0.00 0.00 -0.01 0.00 0.00 29.97 31.31 2gfu h ARG 190 CO 0.09 1.13 0.00 -0.07 -3.11 0.00 0.00 179.97 178.01 2gfu h LEU 191 N 0.06 0.00 -1.12 3.80 3.38 -1.48 0.25 115.31 120.21 2gfu h LEU 191 Ca -0.07 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.95 2gfu h LEU 191 Cb 1.32 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.02 2gfu h LEU 191 CO 0.13 0.00 0.60 -0.08 0.09 0.00 0.00 178.44 179.18 2gfu h GLU 192 N 0.00 1.08 0.00 1.13 4.57 -1.45 -3.27 114.58 116.63 2gfu h GLU 192 Ca 0.00 -0.06 -0.30 0.00 -1.18 0.00 0.00 59.36 57.81 2gfu h GLU 192 Cb 0.72 -0.24 -0.05 0.00 -0.16 0.00 0.00 28.75 29.03 2gfu h GLU 192 CO 0.00 0.71 -1.72 1.28 -1.18 0.00 0.00 179.01 178.10 2gfu n LEU 193 N -4.46 1.90 0.00 1.64 7.99 -1.14 -5.01 117.00 117.92 2gfu n LEU 193 Ca 0.13 0.40 0.00 0.00 -0.01 0.00 0.00 56.01 56.53 2gfu n LEU 193 Cb 0.15 -0.89 0.00 0.00 -0.11 0.00 0.00 43.42 42.56 2gfu n LEU 193 CO 0.34 0.33 0.00 0.00 -1.51 0.00 0.00 177.39 176.54 2gfu n ALA 194 N -3.81 0.00 -3.25 -1.18 0.00 0.86 -1.46 120.51 111.67 2gfu n ALA 194 Ca -0.39 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 52.85 2gfu n ALA 194 Cb 0.73 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.11 2gfu n ALA 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2gfu s VAL 195 N 0.00 -0.11 -1.52 0.00 -7.23 -1.26 -4.94 120.40 105.34 2gfu s VAL 195 Ca 0.00 -1.90 -0.10 0.00 -1.81 0.00 0.00 61.98 58.17 2gfu s VAL 195 Cb 0.00 -0.85 -0.01 0.00 0.56 0.00 0.00 36.38 36.08 2gfu s VAL 195 CO 0.00 -0.82 2.67 -1.20 -0.31 0.00 0.00 175.10 175.43 2gfu n SER 196 N 3.20 7.55 -2.51 4.85 7.64 -0.54 -4.82 113.62 129.00 2gfu n SER 196 Ca 0.23 -2.76 -0.08 0.00 1.01 0.00 0.00 58.87 57.27 2gfu n SER 196 Cb 0.48 -1.54 -0.06 0.00 -1.01 0.00 0.00 64.21 62.09 2gfu n SER 196 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2gfu n ASP 197 N 3.71 2.72 -1.56 6.43 5.68 -1.26 -4.36 116.55 127.90 2gfu n ASP 197 Ca 0.69 -2.02 -0.00 0.00 -0.50 0.00 0.00 54.79 52.96 2gfu n ASP 197 Cb 0.27 -0.72 -0.00 0.00 -1.14 0.00 0.00 41.12 39.53 2gfu n ASP 197 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2gfu n GLU 198 N 3.21 -0.19 -1.73 0.11 4.71 -1.26 -4.94 120.64 120.55 2gfu n GLU 198 Ca 0.23 0.62 -0.42 0.00 -0.01 0.00 0.00 57.16 57.59 2gfu n GLU 198 Cb 0.32 -1.22 -0.02 0.00 -1.01 0.00 0.00 31.44 29.51 2gfu n GLU 198 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2gfu n PRO 199 N 0.04 2.46 0.00 3.49 -0.04 -1.26 -4.67 135.00 135.02 2gfu n PRO 199 Ca -0.00 -2.50 0.00 0.00 -0.04 0.00 0.00 63.50 60.96 2gfu n PRO 199 Cb 0.00 -3.26 0.00 0.00 -0.04 0.00 0.00 33.50 30.21 2gfu n PRO 199 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2gfu n SER 200 N 7.40 0.00 0.00 3.54 7.64 -1.26 -5.26 113.62 125.68 2gfu n SER 200 Ca 0.50 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.38 2gfu n SER 200 Cb 0.41 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 2gfu n SER 200 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19