#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 4.21 -2.75 7.82 0.00 -1.26 -5.06 120.51 123.47 2gfu n ALA 69 Ca 0.00 -3.78 -0.16 0.00 0.00 0.00 0.00 53.44 49.50 2gfu n ALA 69 Cb 0.00 -0.74 -0.14 0.00 0.00 0.00 0.00 19.45 18.57 2gfu n ALA 69 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2gfu s LYS 70 N -3.31 0.55 -0.05 0.00 2.36 -1.26 -5.15 119.74 112.88 2gfu s LYS 70 Ca 0.38 -0.37 -0.24 0.00 -2.55 0.00 0.00 55.97 53.19 2gfu s LYS 70 Cb 0.42 -0.49 -0.04 0.00 -1.05 0.00 0.00 37.83 36.67 2gfu s LYS 70 CO -0.08 0.13 0.74 0.54 1.55 0.00 0.00 175.35 178.23 2gfu s ASN 71 N -0.50 7.06 -0.10 1.43 4.22 -1.26 -5.08 114.94 120.70 2gfu s ASN 71 Ca -0.00 1.28 -0.05 0.00 -2.14 0.00 0.00 52.86 51.95 2gfu s ASN 71 Cb -0.04 -2.44 0.05 0.00 1.28 0.00 0.00 41.25 40.10 2gfu s ASN 71 CO -0.00 -0.12 0.23 -1.48 -2.04 0.00 0.00 177.10 173.69 2gfu s LEU 72 N 0.73 0.23 -0.03 3.54 2.34 -1.26 -5.03 118.68 119.21 2gfu s LEU 72 Ca 0.39 0.50 0.05 0.00 0.06 0.00 0.00 54.13 55.13 2gfu s LEU 72 Cb -0.18 0.64 0.12 0.00 -0.56 0.00 0.00 46.19 46.20 2gfu s LEU 72 CO 0.20 -0.19 1.08 0.59 -1.06 0.00 0.00 176.35 176.97 2gfu n ASN 73 N 4.59 2.29 0.00 1.48 4.13 -1.26 -5.01 115.26 121.48 2gfu n ASN 73 Ca -0.19 -2.19 0.00 0.00 1.68 0.00 0.00 54.58 53.87 2gfu n ASN 73 Cb 0.52 -0.12 0.00 0.00 -1.54 0.00 0.00 39.78 38.63 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 -0.46 3.30 2.60 7.41 0.00 -1.26 -4.71 105.19 112.07 2gfu n GLY 74 Ca 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.75 -0.17 1.02 -0.02 0.00 -1.26 -5.05 105.19 97.97 2gfu n GLY 75 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2gfu n GLY 75 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2gfu n LEU 76 N -0.54 2.66 0.02 0.99 -0.00 -1.26 -4.19 117.00 114.68 2gfu n LEU 76 Ca -0.20 -1.32 -0.10 0.00 -0.00 0.00 0.00 56.01 54.39 2gfu n LEU 76 Cb 0.69 -0.45 0.04 0.00 -0.00 0.00 0.00 43.42 43.71 2gfu n LEU 76 CO -0.10 0.45 0.43 0.03 -0.00 0.00 0.00 177.39 178.20 2gfu h ARG 77 N 0.31 0.51 -1.14 1.47 3.08 -2.01 -3.33 114.38 113.28 2gfu h ARG 77 Ca 0.00 -0.35 -0.41 0.00 0.07 0.00 0.00 59.98 59.29 2gfu h ARG 77 Cb 0.86 0.05 -0.40 0.00 0.08 0.00 0.00 29.97 30.56 2gfu h ARG 77 CO 0.00 0.97 -1.10 2.89 -1.07 0.00 0.00 179.97 181.66 2gfu n ARG 78 N -3.92 1.60 -0.39 0.04 1.85 -1.26 -5.03 116.66 109.54 2gfu n ARG 78 Ca -0.04 -3.51 -0.05 0.00 -1.00 0.00 0.00 57.85 53.26 2gfu n ARG 78 Cb 0.64 -1.46 -0.06 0.00 -1.05 0.00 0.00 32.46 30.53 2gfu n ARG 78 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2gfu n SER 79 N -0.13 2.16 -4.39 2.89 2.88 -1.25 -4.81 113.62 110.97 2gfu n SER 79 Ca 0.16 -1.88 -0.45 0.00 -1.33 0.00 0.00 58.87 55.37 2gfu n SER 79 Cb 0.78 -0.57 -0.00 0.00 -0.75 0.00 0.00 64.21 63.67 2gfu n SER 79 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2gfu s VAL 80 N 2.09 5.63 -0.27 2.46 1.01 -1.26 -5.02 120.40 125.04 2gfu s VAL 80 Ca 0.25 -3.13 -0.13 0.00 0.00 0.00 0.00 61.98 58.98 2gfu s VAL 80 Cb 0.12 -4.73 -0.04 0.00 0.00 0.00 0.00 36.38 31.73 2gfu s VAL 80 CO 0.00 -1.36 0.28 0.00 0.00 0.00 0.00 175.10 174.02 2gfu s ALA 81 N -0.15 3.55 -0.10 5.51 0.00 -1.26 -5.02 121.76 124.28 2gfu s ALA 81 Ca 0.36 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 51.36 2gfu s ALA 81 Cb -0.07 -2.59 0.06 0.00 0.00 0.00 0.00 23.12 20.53 2gfu s ALA 81 CO -0.05 -0.59 2.05 -0.35 0.00 0.00 0.00 175.76 176.82 2gfu n PRO 82 N 5.15 1.28 -1.58 0.00 -0.04 -1.26 -4.80 135.00 133.76 2gfu n PRO 82 Ca -0.11 -0.53 0.00 0.00 -0.04 0.00 0.00 63.50 62.82 2gfu n PRO 82 Cb 0.51 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 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 1.16 0.00 -2.58 0.55 0.00 -1.26 -5.12 120.51 113.25 2gfu n ALA 83 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.14 2gfu n ALA 83 Cb 0.53 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.90 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 -1.00 3.52 -0.10 0.00 0.00 -1.26 -5.00 121.76 117.93 2gfu s ALA 84 Ca 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 51.96 51.02 2gfu s ALA 84 Cb 0.00 -2.90 -0.13 0.00 0.00 0.00 0.00 23.12 20.09 2gfu s ALA 84 CO 0.00 -0.97 3.07 -0.35 0.00 0.00 0.00 175.76 177.52 2gfu n PRO 85 N 5.57 1.87 -2.85 0.00 -0.04 -1.26 -4.22 135.00 134.07 2gfu n PRO 85 Ca -0.06 -1.09 -0.15 0.00 -0.04 0.00 0.00 63.50 62.16 2gfu n PRO 85 Cb 0.50 -1.81 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 2gfu n PRO 85 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2gfu n THR 86 N 1.89 0.84 0.00 0.52 -2.24 -1.26 -5.07 114.28 108.97 2gfu n THR 86 Ca 0.35 -3.95 0.00 0.00 -2.27 0.00 0.00 64.05 58.18 2gfu n THR 86 Cb 0.76 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 2gfu n THR 86 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2gfu n SER 87 N 0.01 0.00 -4.92 3.42 2.88 -1.26 -4.75 113.62 109.00 2gfu n SER 87 Ca 0.19 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.44 2gfu n SER 87 Cb 0.72 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.14 2gfu n SER 87 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2gfu s SER 88 N -1.58 6.31 -0.46 -3.46 0.01 -1.26 -5.08 113.70 108.19 2gfu s SER 88 Ca 0.00 0.21 0.07 0.00 1.31 0.00 0.00 55.95 57.54 2gfu s SER 88 Cb 0.00 -1.92 0.29 0.00 0.21 0.00 0.00 66.02 64.60 2gfu s SER 88 CO 0.00 0.12 0.98 -0.90 0.41 0.00 0.00 173.24 173.85 2gfu n ASP 89 N -0.06 -2.21 -4.25 2.44 5.68 -1.26 -4.70 116.55 112.19 2gfu n ASP 89 Ca -0.06 -3.47 -0.33 0.00 -0.50 0.00 0.00 54.79 50.43 2gfu n ASP 89 Cb 0.52 1.60 -0.15 0.00 -1.14 0.00 0.00 41.12 41.95 2gfu n ASP 89 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 2gfu s PHE 90 N 0.17 2.80 0.34 2.11 0.08 -1.26 -4.97 117.98 117.25 2gfu s PHE 90 Ca 0.27 -1.12 0.08 0.00 0.12 0.00 0.00 56.93 56.29 2gfu s PHE 90 Cb 0.27 -1.91 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 2gfu s PHE 90 CO -0.13 -0.53 0.13 -1.54 -0.10 0.00 0.00 175.22 173.05 2gfu s SER 91 N 0.95 4.60 0.28 1.36 1.04 -1.26 -5.02 113.70 115.64 2gfu s SER 91 Ca -0.03 -0.82 -0.29 0.00 0.48 0.00 0.00 55.95 55.29 2gfu s SER 91 Cb -0.15 -0.69 -0.14 0.00 0.10 0.00 0.00 66.02 65.15 2gfu s SER 91 CO -0.02 -0.30 1.18 -2.65 0.98 0.00 0.00 173.24 172.43 2gfu n PRO 92 N -1.13 1.67 0.00 4.02 -0.02 -1.26 -3.63 135.00 134.65 2gfu n PRO 92 Ca -0.03 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2gfu n PRO 92 Cb 0.62 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 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 1.39 1.18 3.98 -1.23 0.00 -0.59 -4.96 105.19 104.97 2gfu n GLY 93 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.85 5.34 -0.01 1.61 2.15 -1.24 -4.93 116.67 117.74 2gfu s ASP 94 Ca 0.00 -0.10 -0.02 0.00 0.43 0.00 0.00 52.55 52.86 2gfu s ASP 94 Cb 0.00 -0.81 -0.04 0.00 -0.30 0.00 0.00 42.92 41.77 2gfu s ASP 94 CO 0.00 -1.07 0.15 -0.76 -0.17 0.00 0.00 175.17 173.32 2gfu s LEU 95 N -4.68 4.23 0.05 -1.34 2.01 -1.26 -1.35 118.68 116.34 2gfu s LEU 95 Ca 0.57 0.29 -0.05 0.00 0.01 0.00 0.00 54.13 54.95 2gfu s LEU 95 Cb -0.10 -2.51 -0.02 0.00 0.01 0.00 0.00 46.19 43.57 2gfu s LEU 95 CO 0.37 0.27 0.07 0.68 1.01 0.00 0.00 176.35 178.75 2gfu s VAL 96 N -1.28 0.16 -0.21 -1.59 -7.23 -0.80 -2.00 120.40 107.44 2gfu s VAL 96 Ca 0.26 -1.32 -0.05 0.00 -1.81 0.00 0.00 61.98 59.05 2gfu s VAL 96 Cb -0.12 -1.15 -0.02 0.00 0.56 0.00 0.00 36.38 35.64 2gfu s VAL 96 CO 0.17 -0.73 0.01 0.26 -0.31 0.00 0.00 175.10 174.50 2gfu s TRP 97 N -3.22 3.04 -0.05 2.82 0.52 0.21 -1.33 118.94 120.94 2gfu s TRP 97 Ca 0.00 -0.50 0.06 0.00 0.02 0.00 0.00 56.10 55.69 2gfu s TRP 97 Cb 0.02 -2.12 -0.01 0.00 -1.15 0.00 0.00 33.47 30.22 2gfu s TRP 97 CO -0.07 -0.29 -0.24 0.00 0.02 0.00 0.00 176.95 176.36 2gfu s ALA 98 N 1.16 2.21 0.02 0.98 0.00 0.05 -0.05 121.76 126.13 2gfu s ALA 98 Ca 0.03 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 50.96 2gfu s ALA 98 Cb -0.14 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.26 2gfu s ALA 98 CO 0.01 0.45 -0.03 0.21 0.00 0.00 0.00 175.76 176.40 2gfu s LYS 99 N -0.30 2.62 0.08 0.00 2.47 -0.94 -1.23 119.74 122.45 2gfu s LYS 99 Ca 0.01 -0.71 0.06 0.00 -1.56 0.00 0.00 55.97 53.77 2gfu s LYS 99 Cb -0.13 -2.56 -0.03 0.00 -1.46 0.00 0.00 37.83 33.65 2gfu s LYS 99 CO 0.02 0.60 -0.16 1.41 0.16 0.00 0.00 175.35 177.38 2gfu s MET 100 N -1.62 0.91 -0.83 4.03 -2.45 -1.26 -4.85 119.30 113.22 2gfu s MET 100 Ca 0.19 -1.02 -0.25 0.00 -1.25 0.00 0.00 55.69 53.36 2gfu s MET 100 Cb -0.11 -0.98 -0.10 0.00 1.25 0.00 0.00 34.83 34.89 2gfu s MET 100 CO 0.10 0.22 2.21 -2.00 1.05 0.00 0.00 175.02 176.60 2gfu s GLU 101 N -1.83 2.01 0.00 4.11 2.12 -1.26 -1.59 118.70 122.26 2gfu s GLU 101 Ca 0.01 0.17 0.00 0.00 0.36 0.00 0.00 54.97 55.51 2gfu s GLU 101 Cb -0.10 -4.90 0.00 0.00 0.26 0.00 0.00 34.13 29.40 2gfu s GLU 101 CO 0.03 -3.99 0.00 0.41 -0.54 0.00 0.00 175.26 171.17 2gfu n GLY 102 N 6.82 0.90 3.76 -1.50 0.00 -1.26 -5.12 105.19 108.79 2gfu n GLY 102 Ca 0.44 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.24 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 2.90 0.92 1.61 1.51 -0.62 -5.15 117.35 116.52 2gfu s TYR 103 Ca 0.00 -0.21 -0.12 0.00 -1.01 0.00 0.00 57.07 55.73 2gfu s TYR 103 Cb 0.00 -1.42 0.14 0.00 -0.11 0.00 0.00 41.96 40.57 2gfu s TYR 103 CO 0.00 0.48 1.10 -1.25 -1.11 0.00 0.00 175.55 174.77 2gfu s PRO 104 N -3.81 1.08 0.01 -1.71 0.04 -1.26 -4.57 135.00 124.77 2gfu s PRO 104 Ca 0.34 0.57 -0.32 0.00 0.04 0.00 0.00 61.00 61.63 2gfu s PRO 104 Cb -0.06 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.56 2gfu s PRO 104 CO 0.23 -2.30 1.89 0.91 0.04 0.00 0.00 177.00 177.77 2gfu n TRP 105 N -3.89 2.44 -3.99 0.56 7.02 -1.26 -4.46 117.44 113.86 2gfu n TRP 105 Ca 0.06 -0.15 -0.31 0.00 -1.02 0.00 0.00 57.50 56.08 2gfu n TRP 105 Cb 0.57 -2.72 -0.16 0.00 -2.42 0.00 0.00 31.31 26.58 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 3.80 2.61 0.08 -5.99 0.23 -0.36 -4.84 118.94 114.48 2gfu s TRP 106 Ca 0.89 -1.83 -0.32 0.00 -2.03 0.00 0.00 56.10 52.81 2gfu s TRP 106 Cb -0.56 -1.69 -0.11 0.00 0.03 0.00 0.00 33.47 31.14 2gfu s TRP 106 CO 0.45 -0.79 1.84 -2.30 0.96 0.00 0.00 176.95 177.11 2gfu n PRO 107 N 4.62 2.64 -4.19 4.98 -0.02 -1.26 -0.77 135.00 140.99 2gfu n PRO 107 Ca -0.14 0.96 -0.12 0.00 -2.02 0.00 0.00 63.50 62.19 2gfu n PRO 107 Cb 0.45 -2.84 -0.10 0.00 -0.02 0.00 0.00 33.50 30.98 2gfu n PRO 107 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2gfu s SER 108 N 2.99 0.68 -0.08 2.55 1.04 -0.44 -1.66 113.70 118.78 2gfu s SER 108 Ca 0.84 -1.21 0.05 0.00 0.48 0.00 0.00 55.95 56.11 2gfu s SER 108 Cb -0.53 0.23 -0.01 0.00 0.10 0.00 0.00 66.02 65.81 2gfu s SER 108 CO 0.40 -0.68 -0.24 -0.22 0.98 0.00 0.00 173.24 173.48 2gfu s LEU 109 N -3.11 2.08 -0.26 2.42 2.96 -0.48 -1.91 118.68 120.38 2gfu s LEU 109 Ca 0.25 -0.53 -0.26 0.00 -0.22 0.00 0.00 54.13 53.37 2gfu s LEU 109 Cb 0.07 -1.39 0.00 0.00 0.50 0.00 0.00 46.19 45.37 2gfu s LEU 109 CO 0.04 0.20 0.90 0.54 -1.32 0.00 0.00 176.35 176.71 2gfu s VAL 110 N 0.09 4.75 0.03 1.68 0.11 -0.45 -0.99 120.40 125.61 2gfu s VAL 110 Ca -0.11 1.61 0.08 0.00 -2.93 0.00 0.00 61.98 60.63 2gfu s VAL 110 Cb -0.16 -4.20 -0.02 0.00 -1.53 0.00 0.00 36.38 30.47 2gfu s VAL 110 CO 0.06 -0.18 -0.23 -0.47 -3.33 0.00 0.00 175.10 170.95 2gfu s TYR 111 N 3.04 2.02 -0.30 1.54 5.04 -1.03 -1.54 117.35 126.12 2gfu s TYR 111 Ca 0.38 -0.39 -0.13 0.00 -2.44 0.00 0.00 57.07 54.49 2gfu s TYR 111 Cb -0.15 -1.23 -0.03 0.00 0.35 0.00 0.00 41.96 40.90 2gfu s TYR 111 CO 0.09 0.07 0.29 0.54 -1.34 0.00 0.00 175.55 175.20 2gfu s ASN 112 N -1.02 6.13 0.74 4.32 4.22 -1.26 -4.29 114.94 123.78 2gfu s ASN 112 Ca 0.09 -0.00 -0.11 0.00 -2.14 0.00 0.00 52.86 50.70 2gfu s ASN 112 Cb -0.09 -2.17 0.04 0.00 1.28 0.00 0.00 41.25 40.31 2gfu s ASN 112 CO 0.01 -0.17 1.08 -1.00 -2.04 0.00 0.00 177.10 174.98 2gfu s HIS 113 N 1.91 2.78 -0.83 1.54 3.76 -1.26 -4.89 115.29 118.31 2gfu s HIS 113 Ca 0.10 1.50 0.00 0.00 -0.15 0.00 0.00 55.06 56.52 2gfu s HIS 113 Cb -0.16 -2.99 0.00 0.00 1.11 0.00 0.00 32.58 30.54 2gfu s HIS 113 CO 0.11 -1.57 0.83 -2.30 -0.85 0.00 0.00 174.74 170.96 2gfu n PRO 114 N -3.33 0.00 0.27 8.40 -0.02 -1.26 -0.72 135.00 138.35 2gfu n PRO 114 Ca 0.09 0.34 0.18 0.00 -2.02 0.00 0.00 63.50 62.09 2gfu n PRO 114 Cb 0.53 -1.61 0.91 0.00 -0.02 0.00 0.00 33.50 33.31 2gfu n PRO 114 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2gfu h PHE 115 N 0.00 0.00 -0.44 6.00 0.04 -1.91 -3.49 116.94 117.14 2gfu h PHE 115 Ca 0.00 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.46 2gfu h PHE 115 Cb 0.22 0.00 0.04 0.00 2.20 0.00 0.00 35.95 38.41 2gfu h PHE 115 CO 0.00 0.00 -0.14 -0.40 -0.60 0.00 0.00 178.31 177.17 2gfu n ASP 116 N -2.84 -0.36 0.00 2.17 5.68 0.10 -3.77 116.55 117.53 2gfu n ASP 116 Ca -0.01 0.50 0.00 0.00 -0.50 0.00 0.00 54.79 54.78 2gfu n ASP 116 Cb 0.13 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 39.70 2gfu n ASP 116 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gfu n GLY 117 N 0.80 2.82 2.76 6.12 0.00 -1.26 -4.96 105.19 111.47 2gfu n GLY 117 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.49 -0.20 -0.01 2.61 2.01 -1.25 -5.04 115.64 111.27 2gfu s THR 118 Ca 0.00 0.37 0.01 0.00 0.31 0.00 0.00 61.69 62.38 2gfu s THR 118 Cb 0.00 -0.25 0.02 0.00 0.01 0.00 0.00 72.50 72.28 2gfu s THR 118 CO 0.00 0.15 0.91 2.22 -0.69 0.00 0.00 174.62 177.21 2gfu n PHE 119 N 5.31 0.00 -4.42 4.92 -1.74 -1.26 -4.83 117.46 115.44 2gfu n PHE 119 Ca -0.04 -0.43 -0.24 0.00 -0.56 0.00 0.00 57.45 56.18 2gfu n PHE 119 Cb 0.50 -0.05 -0.11 0.00 1.52 0.00 0.00 39.48 41.34 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 -0.90 2.24 0.03 1.97 -4.36 -1.26 -3.38 121.20 115.54 2gfu s ILE 120 Ca 0.02 -2.17 0.01 0.00 -0.26 0.00 0.00 60.65 58.25 2gfu s ILE 120 Cb 0.01 -2.13 -0.02 0.00 1.25 0.00 0.00 42.46 41.57 2gfu s ILE 120 CO 0.00 -0.31 -0.06 -0.13 0.24 0.00 0.00 174.94 174.69 2gfu s ARG 121 N -3.10 0.44 -0.10 0.37 0.52 -0.84 -5.04 118.95 111.20 2gfu s ARG 121 Ca 0.23 -0.65 -0.09 0.00 -0.52 0.00 0.00 55.73 54.70 2gfu s ARG 121 Cb -0.06 -0.16 0.03 0.00 0.52 0.00 0.00 34.95 35.27 2gfu s ARG 121 CO 0.11 0.02 0.26 -1.83 0.02 0.00 0.00 175.30 173.88 2gfu s GLU 122 N -1.41 0.30 -0.48 3.54 1.03 -1.26 -2.32 118.70 118.10 2gfu s GLU 122 Ca -0.11 0.36 0.02 0.00 0.03 0.00 0.00 54.97 55.27 2gfu s GLU 122 Cb -0.09 0.14 0.12 0.00 -0.80 0.00 0.00 34.13 33.50 2gfu s GLU 122 CO -0.00 -0.04 0.22 0.15 -1.33 0.00 0.00 175.26 174.27 2gfu s LYS 123 N 0.15 1.93 0.00 -4.83 -0.14 -0.42 -5.01 119.74 111.43 2gfu s LYS 123 Ca -0.00 -2.34 0.00 0.00 -1.36 0.00 0.00 55.97 52.27 2gfu s LYS 123 Cb -0.02 -3.37 0.00 0.00 -1.68 0.00 0.00 37.83 32.76 2gfu s LYS 123 CO 0.00 -1.07 0.00 0.41 -0.76 0.00 0.00 175.35 173.93 2gfu n GLY 124 N 3.60 0.91 0.76 -3.33 0.00 -1.26 -2.03 105.19 103.85 2gfu n GLY 124 Ca 0.05 0.32 0.01 0.00 0.00 0.00 0.00 46.02 46.39 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 0.00 -4.68 1.61 2.85 -1.26 -5.06 118.16 111.62 2gfu n LYS 125 Ca 0.00 -1.21 -0.27 0.00 -1.05 0.00 0.00 58.31 55.78 2gfu n LYS 125 Cb 0.00 -0.34 -0.17 0.00 -0.65 0.00 0.00 35.03 33.88 2gfu n LYS 125 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2gfu s SER 126 N -1.21 2.25 -0.22 -5.58 0.15 -0.86 -5.10 113.70 103.14 2gfu s SER 126 Ca 0.09 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.36 2gfu s SER 126 Cb 0.10 -1.03 0.03 0.00 -1.71 0.00 0.00 66.02 63.42 2gfu s SER 126 CO -0.04 0.05 -0.15 0.68 1.20 0.00 0.00 173.24 174.98 2gfu s VAL 127 N 0.70 2.23 -0.13 4.45 -7.23 -1.26 -1.30 120.40 117.86 2gfu s VAL 127 Ca -0.13 -1.17 -0.00 0.00 -1.81 0.00 0.00 61.98 58.87 2gfu s VAL 127 Cb -0.16 -2.09 -0.02 0.00 0.56 0.00 0.00 36.38 34.67 2gfu s VAL 127 CO 0.03 0.30 -0.13 -0.13 -0.31 0.00 0.00 175.10 174.87 2gfu s ARG 128 N 1.24 3.34 0.22 4.82 0.52 -0.98 -0.90 118.95 127.20 2gfu s ARG 128 Ca -0.00 -0.68 0.09 0.00 -0.52 0.00 0.00 55.73 54.62 2gfu s ARG 128 Cb -0.16 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.64 2gfu s ARG 128 CO -0.09 0.24 -0.16 0.14 0.02 0.00 0.00 175.30 175.46 2gfu s VAL 129 N 0.27 1.87 -0.11 3.52 -7.23 -1.06 -1.98 120.40 115.68 2gfu s VAL 129 Ca -0.09 -2.23 -0.20 0.00 -1.81 0.00 0.00 61.98 57.65 2gfu s VAL 129 Cb -0.15 -2.08 -0.04 0.00 0.56 0.00 0.00 36.38 34.67 2gfu s VAL 129 CO 0.05 -0.55 0.54 -1.38 -0.31 0.00 0.00 175.10 173.45 2gfu s HIS 130 N -2.84 3.52 0.16 2.82 -3.43 -1.22 -1.62 115.29 112.68 2gfu s HIS 130 Ca 0.23 0.98 -0.08 0.00 -0.80 0.00 0.00 55.06 55.39 2gfu s HIS 130 Cb -0.02 -2.62 -0.01 0.00 -1.43 0.00 0.00 32.58 28.50 2gfu s HIS 130 CO 0.08 0.14 0.25 0.14 -2.00 0.00 0.00 174.74 173.35 2gfu s VAL 131 N 0.71 0.07 0.02 -5.38 -7.23 -1.22 -2.48 120.40 104.89 2gfu s VAL 131 Ca 0.29 -1.46 0.06 0.00 -1.81 0.00 0.00 61.98 59.06 2gfu s VAL 131 Cb -0.16 -1.87 -0.02 0.00 0.56 0.00 0.00 36.38 34.89 2gfu s VAL 131 CO 0.12 -0.32 -0.19 0.00 -0.31 0.00 0.00 175.10 174.41 2gfu s GLN 132 N -3.98 1.34 -0.22 4.82 -2.07 -0.16 -3.22 119.66 116.16 2gfu s GLN 132 Ca 0.18 -0.80 -0.15 0.00 -1.82 0.00 0.00 55.36 52.77 2gfu s GLN 132 Cb 0.04 -1.38 -0.04 0.00 -1.09 0.00 0.00 33.01 30.54 2gfu s GLN 132 CO 0.00 0.36 0.36 -0.06 -1.32 0.00 0.00 175.29 174.63 2gfu s PHE 133 N -0.67 3.33 -1.15 9.60 0.08 0.22 -1.38 117.98 128.01 2gfu s PHE 133 Ca 0.06 0.50 -0.18 0.00 0.12 0.00 0.00 56.93 57.44 2gfu s PHE 133 Cb -0.08 -2.50 -0.05 0.00 -0.57 0.00 0.00 43.02 39.83 2gfu s PHE 133 CO 0.01 -0.05 2.08 1.19 -0.10 0.00 0.00 175.22 178.34 2gfu n PHE 134 N 4.66 2.84 0.00 0.36 3.72 -0.66 -2.45 117.46 125.93 2gfu n PHE 134 Ca -0.09 -2.44 0.00 0.00 -0.05 0.00 0.00 57.45 54.87 2gfu n PHE 134 Cb 0.51 -2.20 0.00 0.00 -0.94 0.00 0.00 39.48 36.85 2gfu n PHE 134 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2gfu n ASP 135 N 6.97 0.00 -0.08 4.37 2.03 -1.26 -4.23 116.55 124.34 2gfu n ASP 135 Ca 0.51 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.65 2gfu n ASP 135 Cb 0.40 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.74 2gfu n ASP 135 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2gfu n ASP 136 N 0.00 1.34 -0.03 1.67 5.75 -1.26 -4.87 116.55 119.15 2gfu n ASP 136 Ca 0.00 0.23 -0.15 0.00 -0.01 0.00 0.00 54.79 54.86 2gfu n ASP 136 Cb 0.00 -0.54 -0.10 0.00 -1.03 0.00 0.00 41.12 39.45 2gfu n ASP 136 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2gfu h SER 137 N -0.65 0.39 -3.23 -1.12 0.02 -1.97 -3.48 113.55 103.51 2gfu h SER 137 Ca -0.37 -0.67 -0.46 0.00 -0.84 0.00 0.00 61.79 59.46 2gfu h SER 137 Cb 1.25 -0.12 0.12 0.00 0.14 0.00 0.00 62.40 63.80 2gfu h SER 137 CO -0.22 0.99 0.28 -2.16 -1.14 0.00 0.00 176.83 174.58 2gfu s PRO 138 N -3.57 1.18 -0.27 3.45 0.04 -1.26 -5.12 135.00 129.45 2gfu s PRO 138 Ca -0.14 -0.69 -0.15 0.00 0.04 0.00 0.00 61.00 60.05 2gfu s PRO 138 Cb 0.03 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 2gfu s PRO 138 CO 0.77 -1.93 0.40 0.99 0.04 0.00 0.00 177.00 177.27 2gfu s THR 139 N -3.54 5.15 0.05 1.26 2.01 -1.03 -4.95 115.64 114.60 2gfu s THR 139 Ca 0.70 0.63 0.04 0.00 0.31 0.00 0.00 61.69 63.36 2gfu s THR 139 Cb -0.05 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.71 2gfu s THR 139 CO 0.49 0.14 -0.12 -0.60 -0.69 0.00 0.00 174.62 173.84 2gfu s ARG 140 N 2.11 0.75 0.00 4.92 3.00 -1.26 -0.61 118.95 127.87 2gfu s ARG 140 Ca 0.16 -0.79 0.00 0.00 -1.00 0.00 0.00 55.73 54.10 2gfu s ARG 140 Cb -0.16 -0.70 0.00 0.00 0.00 0.00 0.00 34.95 34.09 2gfu s ARG 140 CO 0.10 0.16 0.00 0.41 0.00 0.00 0.00 175.30 175.97 2gfu n GLY 141 N 1.63 1.29 3.61 8.12 0.00 -1.20 -5.04 105.19 113.60 2gfu n GLY 141 Ca -0.20 -0.81 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 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 -4.16 2.92 0.44 1.61 0.52 -1.26 -3.43 118.94 115.59 2gfu s TRP 142 Ca 0.00 0.82 0.06 0.00 0.02 0.00 0.00 56.10 57.00 2gfu s TRP 142 Cb 0.00 -4.17 0.01 0.00 -1.15 0.00 0.00 33.47 28.16 2gfu s TRP 142 CO 0.00 -1.11 0.61 0.14 0.02 0.00 0.00 176.95 176.61 2gfu s VAL 143 N 4.15 2.99 -0.22 4.03 -7.23 -0.64 -4.95 120.40 118.54 2gfu s VAL 143 Ca 0.46 -0.92 -0.15 0.00 -1.81 0.00 0.00 61.98 59.56 2gfu s VAL 143 Cb -0.09 -3.03 -0.04 0.00 0.56 0.00 0.00 36.38 33.78 2gfu s VAL 143 CO 0.27 -0.01 0.34 -0.44 -0.31 0.00 0.00 175.10 174.95 2gfu s SER 144 N -4.36 6.34 0.00 4.85 0.01 -1.26 -2.57 113.70 116.71 2gfu s SER 144 Ca 0.55 0.40 0.15 0.00 1.31 0.00 0.00 55.95 58.36 2gfu s SER 144 Cb -0.10 -2.20 0.68 0.00 0.21 0.00 0.00 66.02 64.61 2gfu s SER 144 CO 0.34 -0.06 1.48 1.17 0.41 0.00 0.00 173.24 176.58 2gfu n LYS 145 N 4.55 0.05 0.00 12.44 4.81 -0.08 -2.55 118.16 137.38 2gfu n LYS 145 Ca -0.10 0.22 0.10 0.00 -0.87 0.00 0.00 58.31 57.66 2gfu n LYS 145 Cb 0.51 -1.50 0.50 0.00 0.02 0.00 0.00 35.03 34.56 2gfu n LYS 145 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2gfu n ARG 146 N -1.45 0.25 -0.17 1.64 1.85 -1.26 -2.51 116.66 115.01 2gfu n ARG 146 Ca 0.04 0.10 0.05 0.00 -1.00 0.00 0.00 57.85 57.05 2gfu n ARG 146 Cb 0.17 -1.50 0.14 0.00 -1.05 0.00 0.00 32.46 30.21 2gfu n ARG 146 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09 2gfu n LEU 147 N -1.31 2.85 -4.67 2.89 -0.00 -1.06 -4.80 117.00 110.90 2gfu n LEU 147 Ca 0.09 -2.17 -0.37 0.00 -0.00 0.00 0.00 56.01 53.56 2gfu n LEU 147 Cb 0.17 -0.23 -0.09 0.00 -0.00 0.00 0.00 43.42 43.27 2gfu n LEU 147 CO 0.16 0.68 -0.08 -0.76 -0.00 0.00 0.00 177.39 177.39 2gfu s LEU 148 N -1.30 4.13 0.29 1.47 1.43 -1.04 -2.21 118.68 121.45 2gfu s LEU 148 Ca 0.21 0.26 0.10 0.00 -1.03 0.00 0.00 54.13 53.67 2gfu s LEU 148 Cb 0.13 -2.25 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 2gfu s LEU 148 CO 0.11 0.02 -0.00 -0.54 0.23 0.00 0.00 176.35 176.17 2gfu s LYS 149 N 1.11 2.20 0.44 1.70 1.02 0.92 -4.73 119.74 122.39 2gfu s LYS 149 Ca 0.12 -1.53 -0.14 0.00 0.02 0.00 0.00 55.97 54.43 2gfu s LYS 149 Cb -0.14 -2.08 -0.08 0.00 -0.52 0.00 0.00 37.83 35.02 2gfu s LYS 149 CO 0.05 0.28 0.86 -1.25 -0.92 0.00 0.00 175.35 174.38 2gfu s PRO 150 N -3.69 3.91 0.00 -1.68 0.04 -1.26 -0.62 135.00 131.71 2gfu s PRO 150 Ca 0.33 0.73 0.00 0.00 0.04 0.00 0.00 61.00 62.10 2gfu s PRO 150 Cb -0.05 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2gfu s PRO 150 CO 0.20 -0.10 0.14 2.48 0.04 0.00 0.00 177.00 179.76 2gfu n TYR 151 N -1.22 0.00 0.00 0.56 4.11 -0.85 -4.53 117.16 115.24 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 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.88 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 -0.44 0.00 -0.08 -3.48 5.66 -1.26 -4.32 114.28 110.37 2gfu n THR 152 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 2gfu n THR 152 Cb 0.00 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 68.70 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 0.65 -0.35 0.18 1.09 0.00 -1.26 -4.73 105.19 100.78 2gfu n GLY 153 Ca 0.00 -0.14 0.05 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.02 1.61 0.02 -1.88 0.38 113.55 113.66 2gfu h SER 154 Ca -0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2gfu h SER 154 Cb 1.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.17 2gfu h SER 154 CO -0.03 0.00 0.00 2.29 -1.14 0.00 0.00 176.83 177.95 2gfu n LYS 155 N -2.05 0.47 -4.05 3.45 2.85 -1.26 -4.63 118.16 112.95 2gfu n LYS 155 Ca -0.01 -1.13 -0.23 0.00 -1.05 0.00 0.00 58.31 55.89 2gfu n LYS 155 Cb 0.46 -1.20 -0.04 0.00 -0.65 0.00 0.00 35.03 33.60 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 -0.87 5.86 0.58 -5.58 0.15 0.13 -4.93 113.70 109.05 2gfu s SER 156 Ca 0.12 -0.08 0.32 0.00 0.70 0.00 0.00 55.95 57.01 2gfu s SER 156 Cb 0.09 -1.61 1.75 0.00 -1.71 0.00 0.00 66.02 64.54 2gfu s SER 156 CO 0.13 -0.02 1.97 0.50 1.20 0.00 0.00 173.24 177.03 2gfu h LYS 157 N 1.64 0.00 0.00 5.44 3.64 -1.90 0.47 116.57 125.87 2gfu h LYS 157 Ca -0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2gfu h LYS 157 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2gfu h LYS 157 CO 0.62 0.00 -0.54 -0.85 -2.27 0.00 0.00 179.45 176.41 2gfu n GLU 158 N -2.77 0.03 0.00 1.90 0.00 -1.26 -3.24 120.64 115.31 2gfu n GLU 158 Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.14 2gfu n GLU 158 Cb 0.21 -1.52 0.00 0.00 0.00 0.00 0.00 31.44 30.13 2gfu n GLU 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2gfu n ALA 159 N -1.54 2.21 -2.59 -1.84 0.00 0.16 -1.08 120.51 115.83 2gfu n ALA 159 Ca 0.05 -0.73 -0.23 0.00 0.00 0.00 0.00 53.44 52.53 2gfu n ALA 159 Cb 0.35 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.72 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 -0.47 2.27 -0.15 0.00 1.03 -0.67 -4.80 119.66 116.89 2gfu s GLN 160 Ca 0.00 -1.50 -0.38 0.00 0.04 0.00 0.00 55.36 53.52 2gfu s GLN 160 Cb 0.00 -2.12 -0.15 0.00 0.03 0.00 0.00 33.01 30.77 2gfu s GLN 160 CO 0.00 0.27 1.70 1.17 -2.54 0.00 0.00 175.29 175.88 2gfu n LYS 161 N -0.97 1.45 0.00 9.60 4.81 -1.26 -0.83 118.16 130.96 2gfu n LYS 161 Ca -0.05 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 2gfu n LYS 161 Cb 0.60 -2.25 0.00 0.00 0.02 0.00 0.00 35.03 33.40 2gfu n LYS 161 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2gfu n GLY 162 N 3.91 2.96 3.86 3.14 0.00 -1.26 -5.10 105.19 112.70 2gfu n GLY 162 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.69 1.76 0.26 -0.02 0.00 -0.01 -5.02 107.32 101.60 2gfu s GLY 163 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 44.72 44.70 2gfu s GLY 163 CO 0.00 0.27 1.76 0.45 0.00 0.00 0.00 173.10 175.58 2gfu h HIS 164 N -0.08 0.72 -0.53 1.90 3.86 -1.70 -3.12 115.15 116.20 2gfu h HIS 164 Ca -0.45 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.80 2gfu h HIS 164 Cb 1.19 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 29.47 2gfu h HIS 164 CO 0.65 0.17 0.00 1.97 0.86 0.00 0.00 177.93 181.58 2gfu n PHE 165 N -4.89 0.95 -3.08 2.45 1.16 -0.24 -4.87 117.46 108.94 2gfu n PHE 165 Ca 0.16 -0.57 -0.45 0.00 -1.87 0.00 0.00 57.45 54.72 2gfu n PHE 165 Cb 0.43 -0.12 -0.02 0.00 -1.61 0.00 0.00 39.48 38.15 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 -1.45 3.33 -0.23 2.97 5.04 -1.18 -4.80 117.35 121.04 2gfu s TYR 166 Ca 0.40 -1.56 -0.02 0.00 -2.44 0.00 0.00 57.07 53.45 2gfu s TYR 166 Cb 0.24 -4.10 0.01 0.00 0.35 0.00 0.00 41.96 38.46 2gfu s TYR 166 CO 0.22 -1.30 -0.08 -1.12 -1.34 0.00 0.00 175.55 171.93 2gfu s SER 167 N 3.12 4.10 -0.60 4.32 0.01 -1.26 -4.90 113.70 118.49 2gfu s SER 167 Ca 0.26 -0.69 -0.21 0.00 1.31 0.00 0.00 55.95 56.62 2gfu s SER 167 Cb -0.08 -1.66 0.08 0.00 0.21 0.00 0.00 66.02 64.57 2gfu s SER 167 CO -0.08 -0.07 0.81 0.00 0.41 0.00 0.00 173.24 174.31 2gfu s ALA 168 N 1.37 3.27 -0.04 1.44 0.00 -1.26 -4.75 121.76 121.78 2gfu s ALA 168 Ca 0.03 -1.88 0.07 0.00 0.00 0.00 0.00 51.96 50.18 2gfu s ALA 168 Cb -0.15 -3.64 -0.02 0.00 0.00 0.00 0.00 23.12 19.31 2gfu s ALA 168 CO -0.06 -2.45 -0.25 0.21 0.00 0.00 0.00 175.76 173.21 2gfu s LYS 169 N 3.34 2.28 0.58 0.00 2.20 -1.26 -5.06 119.74 121.81 2gfu s LYS 169 Ca 0.18 -0.90 0.28 0.00 -0.36 0.00 0.00 55.97 55.17 2gfu s LYS 169 Cb -0.19 -2.06 1.70 0.00 -1.51 0.00 0.00 37.83 35.76 2gfu s LYS 169 CO 0.10 0.47 2.19 -1.35 -0.36 0.00 0.00 175.35 176.40 2gfu h PRO 170 N 5.77 0.00 -0.23 4.03 0.11 -2.00 -1.78 132.00 137.91 2gfu h PRO 170 Ca -0.37 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.60 2gfu h PRO 170 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2gfu h PRO 170 CO 0.47 0.00 -0.42 0.93 -0.21 0.00 0.00 178.00 178.77 2gfu h GLU 171 N 0.00 0.57 -0.02 1.05 4.39 -1.93 -0.44 114.58 118.20 2gfu h GLU 171 Ca 0.03 -0.30 -0.20 0.00 0.34 0.00 0.00 59.36 59.23 2gfu h GLU 171 Cb 0.17 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2gfu h GLU 171 CO -0.00 0.89 -0.85 0.82 -1.16 0.00 0.00 179.01 178.70 2gfu h ILE 172 N 0.46 1.42 -0.15 3.13 2.04 -1.60 -1.76 117.51 121.05 2gfu h ILE 172 Ca 0.04 -2.40 -0.05 0.00 1.00 0.00 0.00 64.86 63.45 2gfu h ILE 172 Cb 0.93 2.33 -0.00 0.00 -0.74 0.00 0.00 36.82 39.34 2gfu h ILE 172 CO 0.08 0.71 -0.10 -0.07 0.00 0.00 0.00 178.15 178.77 2gfu h LEU 173 N 0.20 0.36 -1.43 1.44 3.38 -1.47 -2.43 115.31 115.37 2gfu h LEU 173 Ca -0.05 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.54 2gfu h LEU 173 Cb 1.47 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 42.07 2gfu h LEU 173 CO 0.14 0.72 0.45 -0.09 0.09 0.00 0.00 178.44 179.75 2gfu h ARG 174 N -0.00 0.68 -0.54 1.13 2.43 -1.07 0.63 114.38 117.63 2gfu h ARG 174 Ca 0.03 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 2gfu h ARG 174 Cb 0.59 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 2gfu h ARG 174 CO 0.03 0.45 -0.10 0.00 -1.51 0.00 0.00 179.97 178.83 2gfu h ALA 175 N 1.63 0.74 -0.13 2.80 0.00 -1.35 1.00 119.26 123.96 2gfu h ALA 175 Ca 0.30 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 2gfu h ALA 175 Cb 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2gfu h ALA 175 CO -0.09 0.66 -0.45 0.52 0.00 0.00 0.00 179.25 179.88 2gfu h MET 176 N 0.90 0.30 -0.02 0.00 2.86 -0.74 0.70 114.93 118.93 2gfu h MET 176 Ca 0.14 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 2gfu h MET 176 Cb 0.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 2gfu h MET 176 CO 0.05 0.70 -0.15 1.96 1.06 0.00 0.00 176.91 180.52 2gfu h GLN 177 N 0.25 0.14 -0.26 1.72 4.20 -0.74 -0.63 115.11 119.78 2gfu h GLN 177 Ca 0.02 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.51 2gfu h GLN 177 Cb 0.89 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 2gfu h GLN 177 CO 0.07 0.81 -0.19 -0.09 -0.67 0.00 0.00 178.83 178.76 2gfu h ARG 178 N -0.49 0.59 -0.45 1.46 1.12 -0.90 -0.25 114.38 115.47 2gfu h ARG 178 Ca -0.01 -0.29 -0.04 0.00 -1.11 0.00 0.00 59.98 58.53 2gfu h ARG 178 Cb 0.85 -0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.79 2gfu h ARG 178 CO 0.03 0.87 0.12 0.00 -3.11 0.00 0.00 179.97 177.88 2gfu h ALA 179 N 0.71 0.59 0.13 2.80 0.00 -0.99 -2.85 119.26 119.65 2gfu h ALA 179 Ca 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2gfu h ALA 179 Cb 0.73 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2gfu h ALA 179 CO 0.05 0.26 -0.06 0.22 0.00 0.00 0.00 179.25 179.72 2gfu h ASP 180 N 0.59 -0.15 -0.75 0.00 3.58 -1.06 -0.31 116.42 118.32 2gfu h ASP 180 Ca 0.14 -0.03 0.12 0.00 0.42 0.00 0.00 57.03 57.68 2gfu h ASP 180 Cb 0.30 0.04 -0.05 0.00 1.72 0.00 0.00 39.33 41.34 2gfu h ASP 180 CO -0.00 -0.07 0.49 1.05 -2.88 0.00 0.00 179.24 177.84 2gfu h GLU 181 N -0.23 0.53 0.03 0.28 4.11 -1.08 0.24 114.58 118.46 2gfu h GLU 181 Ca -0.02 -0.03 -0.15 0.00 0.07 0.00 0.00 59.36 59.23 2gfu h GLU 181 Cb 0.18 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.32 2gfu h GLU 181 CO 0.03 0.35 -0.61 0.00 0.07 0.00 0.00 179.01 178.85 2gfu h ALA 182 N 1.64 0.03 -0.86 1.06 0.00 -1.44 -3.24 119.26 116.44 2gfu h ALA 182 Ca 0.36 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2gfu h ALA 182 Cb 0.64 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 2gfu h ALA 182 CO -0.13 0.33 0.52 1.25 0.00 0.00 0.00 179.25 181.22 2gfu h LEU 183 N -0.20 1.04 0.00 0.00 6.46 -0.61 -2.96 115.31 119.04 2gfu h LEU 183 Ca -0.09 -0.07 0.00 0.00 -0.12 0.00 0.00 57.88 57.61 2gfu h LEU 183 Cb 1.36 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 41.02 2gfu h LEU 183 CO 0.12 0.80 -0.64 -0.46 -0.62 0.00 0.00 178.44 177.64 2gfu n ASN 184 N -4.42 0.64 0.00 1.25 6.94 0.80 -4.86 115.26 115.60 2gfu n ASN 184 Ca 0.09 0.02 0.00 0.00 -0.02 0.00 0.00 54.58 54.67 2gfu n ASN 184 Cb 0.06 0.24 0.00 0.00 -2.36 0.00 0.00 39.78 37.72 2gfu n ASN 184 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2gfu n LYS 185 N -1.96 0.00 -4.27 -3.83 5.02 -1.18 -5.05 118.16 106.88 2gfu n LYS 185 Ca 0.04 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.18 2gfu n LYS 185 Cb 0.42 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.33 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 1.00 1.72 0.35 4.39 1.01 -1.13 -5.03 116.67 118.98 2gfu s ASP 186 Ca 0.00 -1.09 0.11 0.00 0.71 0.00 0.00 52.55 52.28 2gfu s ASP 186 Cb 0.00 0.01 0.88 0.00 1.01 0.00 0.00 42.92 44.82 2gfu s ASP 186 CO 0.00 -0.41 1.82 0.50 0.21 0.00 0.00 175.17 177.29 2gfu h LYS 187 N 2.69 0.61 -0.19 8.23 1.63 -1.92 -2.55 116.57 125.07 2gfu h LYS 187 Ca -0.37 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.39 2gfu h LYS 187 Cb 1.20 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 2gfu h LYS 187 CO 0.64 0.40 0.11 0.97 -3.45 0.00 0.00 179.45 178.13 2gfu h ILE 188 N 0.63 1.06 -0.23 2.00 2.10 -1.96 0.09 117.51 121.19 2gfu h ILE 188 Ca 0.52 -0.12 -0.13 0.00 1.08 0.00 0.00 64.86 66.21 2gfu h ILE 188 Cb 0.97 0.79 -0.00 0.00 -1.09 0.00 0.00 36.82 37.49 2gfu h ILE 188 CO -0.27 0.06 -0.36 0.11 -1.08 0.00 0.00 178.15 176.60 2gfu h LYS 189 N 0.26 0.65 -0.02 2.19 6.56 -1.80 -2.46 116.57 121.96 2gfu h LYS 189 Ca 0.07 -0.39 -0.15 0.00 -1.06 0.00 0.00 60.65 59.12 2gfu h LYS 189 Cb -0.01 0.04 0.01 0.00 -0.57 0.00 0.00 32.23 31.70 2gfu h LYS 189 CO -0.01 1.01 -0.57 0.07 -2.06 0.00 0.00 179.45 177.88 2gfu h ARG 190 N 0.36 0.42 0.00 3.15 0.11 -1.67 -3.38 114.38 113.37 2gfu h ARG 190 Ca 0.02 -0.43 0.00 0.00 0.10 0.00 0.00 59.98 59.68 2gfu h ARG 190 Cb 0.95 0.12 0.00 0.00 1.11 0.00 0.00 29.97 32.15 2gfu h ARG 190 CO 0.08 1.09 0.00 1.25 0.10 0.00 0.00 179.97 182.49 2gfu h LEU 191 N -0.09 0.00 -1.88 0.08 5.85 -1.08 -1.92 115.31 116.28 2gfu h LEU 191 Ca -0.07 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 2gfu h LEU 191 Cb 1.27 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.30 2gfu h LEU 191 CO 0.11 0.00 -0.12 -0.08 -0.34 0.00 0.00 178.44 178.02 2gfu h GLU 192 N 0.00 0.00 -0.68 1.25 4.81 -1.61 -2.90 114.58 115.46 2gfu h GLU 192 Ca 0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 2gfu h GLU 192 Cb 0.60 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.91 2gfu h GLU 192 CO 0.00 0.12 0.16 1.28 -0.73 0.00 0.00 179.01 179.84 2gfu n LEU 193 N -4.09 6.01 -2.65 1.64 7.99 -0.72 -4.86 117.00 120.33 2gfu n LEU 193 Ca -0.02 -3.10 -0.06 0.00 -0.01 0.00 0.00 56.01 52.81 2gfu n LEU 193 Cb 0.20 -0.73 -0.03 0.00 -0.11 0.00 0.00 43.42 42.75 2gfu n LEU 193 CO 0.33 0.73 1.16 0.00 -1.51 0.00 0.00 177.39 178.10 2gfu n ALA 194 N 0.19 2.64 0.00 -1.18 0.00 -1.10 -4.72 120.51 116.35 2gfu n ALA 194 Ca 0.36 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2gfu n ALA 194 Cb 1.32 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 18.32 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 3.55 0.00 -1.72 0.00 0.24 -1.26 -4.26 118.33 114.87 2gfu n VAL 195 Ca 0.16 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.44 2gfu n VAL 195 Cb 0.18 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.56 2gfu n VAL 195 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2gfu n SER 196 N 0.21 -2.48 -3.16 -1.34 3.41 -1.26 -4.93 113.62 104.07 2gfu n SER 196 Ca 0.00 -0.08 -0.14 0.00 -0.26 0.00 0.00 58.87 58.39 2gfu n SER 196 Cb 0.00 -1.02 -0.03 0.00 -0.26 0.00 0.00 64.21 62.90 2gfu n SER 196 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2gfu n ASP 197 N -1.66 1.00 0.00 4.04 5.68 -1.26 -4.92 116.55 119.43 2gfu n ASP 197 Ca -0.01 -2.18 0.00 0.00 -0.50 0.00 0.00 54.79 52.10 2gfu n ASP 197 Cb 0.51 -0.61 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 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 5.61 0.00 0.00 0.11 1.02 -1.26 -0.55 120.64 125.57 2gfu n GLU 198 Ca 0.18 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.44 2gfu n GLU 198 Cb 0.12 0.00 0.54 0.00 -0.02 0.00 0.00 31.44 32.09 2gfu n GLU 198 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2gfu n PRO 199 N 0.00 0.01 0.00 3.49 -0.04 -1.26 -4.96 135.00 132.24 2gfu n PRO 199 Ca 0.00 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2gfu n PRO 199 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 -1.49 0.00 -0.46 3.54 7.64 0.28 -5.25 113.62 117.88 2gfu n SER 200 Ca 0.06 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.08 2gfu n SER 200 Cb 0.29 0.00 0.54 0.00 -1.01 0.00 0.00 64.21 64.04 2gfu n SER 200 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19