#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 -1.99 3.14 0.00 -1.26 -4.88 120.51 115.52 2gfu n ALA 69 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 2gfu n ALA 69 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.54 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 1.91 -0.08 0.00 -2.85 -1.26 -5.12 119.74 112.34 2gfu s LYS 70 Ca 0.00 -1.05 -0.04 0.00 -1.00 0.00 0.00 55.97 53.89 2gfu s LYS 70 Cb 0.00 -2.38 -0.04 0.00 -2.06 0.00 0.00 37.83 33.35 2gfu s LYS 70 CO 0.00 -1.25 0.09 1.21 0.10 0.00 0.00 175.35 175.50 2gfu s ASN 71 N -4.66 5.87 0.58 0.03 3.84 -1.26 -5.03 114.94 114.31 2gfu s ASN 71 Ca 0.64 0.29 0.35 0.00 0.21 0.00 0.00 52.86 54.35 2gfu s ASN 71 Cb -0.07 -1.78 1.77 0.00 -0.55 0.00 0.00 41.25 40.62 2gfu s ASN 71 CO 0.43 0.36 2.15 -0.07 -2.79 0.00 0.00 177.10 177.18 2gfu h LEU 72 N 4.78 0.00 -2.01 3.21 3.38 -2.00 -1.94 115.31 120.74 2gfu h LEU 72 Ca -0.52 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.45 2gfu h LEU 72 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2gfu h LEU 72 CO 0.58 0.04 0.00 -3.20 0.09 0.00 0.00 178.44 175.95 2gfu n ASN 73 N -3.27 2.99 0.00 -0.43 5.15 -1.26 -4.97 115.26 113.47 2gfu n ASN 73 Ca -0.01 -1.92 0.00 0.00 -0.60 0.00 0.00 54.58 52.04 2gfu n ASN 73 Cb 0.20 -0.08 0.00 0.00 -0.53 0.00 0.00 39.78 39.37 2gfu n ASN 73 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2gfu n GLY 74 N 1.27 2.62 0.31 8.20 0.00 -0.73 -4.41 105.19 112.45 2gfu n GLY 74 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.47 -0.46 0.76 -0.02 0.00 -1.26 -4.66 105.19 98.08 2gfu n GLY 75 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2gfu n GLY 75 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2gfu n LEU 76 N -0.03 -1.01 0.01 0.99 7.94 -1.26 -5.07 117.00 118.57 2gfu n LEU 76 Ca 0.00 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.78 2gfu n LEU 76 Cb 0.00 -0.51 -0.09 0.00 0.53 0.00 0.00 43.42 43.35 2gfu n LEU 76 CO 0.00 0.00 0.48 -0.09 -1.11 0.00 0.00 177.39 176.67 2gfu h ARG 77 N 0.00 -0.10 -2.48 1.96 2.43 -1.98 -3.47 114.38 110.74 2gfu h ARG 77 Ca 0.00 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 2gfu h ARG 77 Cb 0.00 0.02 -0.18 0.00 -0.42 0.00 0.00 29.97 29.40 2gfu h ARG 77 CO 0.00 0.45 0.08 0.50 -1.51 0.00 0.00 179.97 179.49 2gfu s ARG 78 N -3.50 1.02 -1.14 0.20 6.06 -1.26 -4.93 118.95 115.40 2gfu s ARG 78 Ca -0.15 -0.03 -0.06 0.00 -2.50 0.00 0.00 55.73 53.00 2gfu s ARG 78 Cb 0.00 0.47 0.27 0.00 0.06 0.00 0.00 34.95 35.75 2gfu s ARG 78 CO 0.58 -0.35 1.59 -1.13 -2.50 0.00 0.00 175.30 173.49 2gfu n SER 79 N 0.67 6.02 -4.36 -2.12 3.41 -1.26 -4.95 113.62 111.03 2gfu n SER 79 Ca -0.19 -3.32 -0.45 0.00 -0.26 0.00 0.00 58.87 54.65 2gfu n SER 79 Cb 0.59 -1.34 -0.06 0.00 -0.26 0.00 0.00 64.21 63.14 2gfu n SER 79 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2gfu s VAL 80 N -1.81 5.17 0.04 -3.33 0.11 -1.26 -5.04 120.40 114.28 2gfu s VAL 80 Ca 0.34 -1.21 0.01 0.00 -2.93 0.00 0.00 61.98 58.18 2gfu s VAL 80 Cb 0.06 -4.26 -0.02 0.00 -1.53 0.00 0.00 36.38 30.63 2gfu s VAL 80 CO 0.07 -0.76 -0.06 0.00 -3.33 0.00 0.00 175.10 171.03 2gfu s ALA 81 N 1.76 0.40 -1.41 1.54 0.00 -1.26 -5.08 121.76 117.71 2gfu s ALA 81 Ca 0.05 -0.73 -0.14 0.00 0.00 0.00 0.00 51.96 51.14 2gfu s ALA 81 Cb -0.26 0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.97 2gfu s ALA 81 CO 0.05 -0.09 2.24 -0.35 0.00 0.00 0.00 175.76 177.61 2gfu n PRO 82 N 1.43 2.77 -0.16 0.00 -0.04 -1.26 -4.87 135.00 132.87 2gfu n PRO 82 Ca -0.23 -2.52 0.00 0.00 -0.04 0.00 0.00 63.50 60.72 2gfu n PRO 82 Cb 0.55 -3.24 0.00 0.00 -0.04 0.00 0.00 33.50 30.78 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 6.10 0.00 -2.52 0.55 0.00 -1.26 -5.12 120.51 118.25 2gfu n ALA 83 Ca 0.53 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.55 2gfu n ALA 83 Cb 0.38 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.75 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 -2.00 3.45 0.41 0.00 0.00 -1.26 -5.09 121.76 117.27 2gfu s ALA 84 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.68 2gfu s ALA 84 Cb 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.12 2gfu s ALA 84 CO 0.00 -1.37 0.00 -0.35 0.00 0.00 0.00 175.76 174.04 2gfu n PRO 85 N 5.63 1.94 -4.12 0.00 -0.04 -1.26 -5.10 135.00 132.05 2gfu n PRO 85 Ca -0.07 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.04 2gfu n PRO 85 Cb 0.48 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.85 2gfu n PRO 85 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2gfu s THR 86 N 1.03 4.74 -1.39 0.52 -1.32 -1.26 -5.04 115.64 112.92 2gfu s THR 86 Ca 0.00 -0.07 -0.14 0.00 -1.21 0.00 0.00 61.69 60.27 2gfu s THR 86 Cb 0.00 -3.07 0.07 0.00 -1.51 0.00 0.00 72.50 67.99 2gfu s THR 86 CO 0.00 0.55 2.06 -1.54 -2.21 0.00 0.00 174.62 173.48 2gfu n SER 87 N 2.71 4.30 -4.08 8.08 3.41 -1.26 -4.84 113.62 121.93 2gfu n SER 87 Ca -0.18 -2.90 -0.32 0.00 -0.26 0.00 0.00 58.87 55.21 2gfu n SER 87 Cb 0.53 -1.64 -0.15 0.00 -0.26 0.00 0.00 64.21 62.69 2gfu n SER 87 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2gfu s SER 88 N 3.01 4.53 -0.25 4.04 0.01 -1.26 -5.08 113.70 118.69 2gfu s SER 88 Ca 0.47 -1.45 -0.02 0.00 1.31 0.00 0.00 55.95 56.26 2gfu s SER 88 Cb 0.11 -1.58 0.12 0.00 0.21 0.00 0.00 66.02 64.89 2gfu s SER 88 CO -0.04 -0.22 0.30 1.51 0.41 0.00 0.00 173.24 175.20 2gfu s ASP 89 N 1.11 1.13 -0.09 2.44 -4.77 -1.26 -3.42 116.67 111.80 2gfu s ASP 89 Ca -0.07 -0.32 0.03 0.00 -3.30 0.00 0.00 52.55 48.89 2gfu s ASP 89 Cb -0.20 0.67 0.01 0.00 -1.09 0.00 0.00 42.92 42.31 2gfu s ASP 89 CO -0.05 -0.35 -0.17 -0.36 0.70 0.00 0.00 175.17 174.94 2gfu s PHE 90 N 2.41 2.01 0.33 2.11 0.08 -1.26 -5.14 117.98 118.52 2gfu s PHE 90 Ca 0.10 -0.85 0.08 0.00 0.12 0.00 0.00 56.93 56.38 2gfu s PHE 90 Cb -0.15 -1.41 -0.04 0.00 -0.57 0.00 0.00 43.02 40.86 2gfu s PHE 90 CO -0.22 -0.40 0.16 -1.12 -0.10 0.00 0.00 175.22 173.54 2gfu s SER 91 N 0.67 4.81 0.15 1.36 0.01 -1.26 -4.99 113.70 114.45 2gfu s SER 91 Ca -0.13 -0.70 -0.33 0.00 1.31 0.00 0.00 55.95 56.10 2gfu s SER 91 Cb -0.16 -0.80 -0.17 0.00 0.21 0.00 0.00 66.02 65.10 2gfu s SER 91 CO 0.03 -0.28 1.00 -2.65 0.41 0.00 0.00 173.24 171.76 2gfu n PRO 92 N -1.17 0.69 0.00 12.44 -0.02 -1.26 -3.55 135.00 142.13 2gfu n PRO 92 Ca -0.03 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2gfu n PRO 92 Cb 0.61 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.46 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 1.87 0.28 3.98 -1.23 0.00 0.19 -4.89 105.19 105.38 2gfu n GLY 93 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.26 5.36 -0.12 1.61 2.15 -1.23 -4.94 116.67 117.23 2gfu s ASP 94 Ca 0.00 -0.06 -0.06 0.00 0.43 0.00 0.00 52.55 52.86 2gfu s ASP 94 Cb 0.00 -0.88 -0.04 0.00 -0.30 0.00 0.00 42.92 41.70 2gfu s ASP 94 CO 0.00 -1.06 0.10 -0.76 -0.17 0.00 0.00 175.17 173.28 2gfu s LEU 95 N -4.69 4.11 -0.04 -1.34 2.01 -1.26 -1.11 118.68 116.36 2gfu s LEU 95 Ca 0.56 0.34 -0.02 0.00 0.01 0.00 0.00 54.13 55.02 2gfu s LEU 95 Cb -0.10 -1.99 0.03 0.00 0.01 0.00 0.00 46.19 44.13 2gfu s LEU 95 CO 0.38 0.37 0.08 0.68 1.01 0.00 0.00 176.35 178.87 2gfu s VAL 96 N -0.79 -0.04 -0.21 -1.59 -7.23 -0.06 -1.82 120.40 108.65 2gfu s VAL 96 Ca 0.13 0.15 -0.20 0.00 -1.81 0.00 0.00 61.98 60.25 2gfu s VAL 96 Cb -0.12 -0.15 -0.02 0.00 0.56 0.00 0.00 36.38 36.65 2gfu s VAL 96 CO 0.03 0.06 0.62 0.26 -0.31 0.00 0.00 175.10 175.76 2gfu s TRP 97 N 0.86 3.35 -0.16 2.82 0.52 0.07 -1.30 118.94 125.09 2gfu s TRP 97 Ca -0.07 0.88 -0.05 0.00 0.02 0.00 0.00 56.10 56.88 2gfu s TRP 97 Cb -0.09 -2.80 -0.03 0.00 -1.15 0.00 0.00 33.47 29.39 2gfu s TRP 97 CO -0.03 -0.22 0.02 0.00 0.02 0.00 0.00 176.95 176.74 2gfu s ALA 98 N 2.07 3.24 -0.14 0.98 0.00 0.07 -0.67 121.76 127.31 2gfu s ALA 98 Ca 0.28 -0.78 -0.07 0.00 0.00 0.00 0.00 51.96 51.39 2gfu s ALA 98 Cb -0.16 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 2gfu s ALA 98 CO 0.10 0.26 0.09 0.21 0.00 0.00 0.00 175.76 176.42 2gfu s LYS 99 N 0.15 3.63 0.08 0.00 2.36 -1.02 -2.51 119.74 122.44 2gfu s LYS 99 Ca 0.02 -0.26 0.09 0.00 -2.55 0.00 0.00 55.97 53.27 2gfu s LYS 99 Cb -0.13 -3.16 -0.03 0.00 -1.05 0.00 0.00 37.83 33.46 2gfu s LYS 99 CO 0.02 0.54 -0.24 1.41 1.55 0.00 0.00 175.35 178.63 2gfu s MET 100 N -0.38 1.40 -0.34 4.03 -2.45 -1.26 -4.82 119.30 115.48 2gfu s MET 100 Ca 0.10 -1.15 -0.28 0.00 -1.25 0.00 0.00 55.69 53.11 2gfu s MET 100 Cb -0.12 -1.68 -0.03 0.00 1.25 0.00 0.00 34.83 34.25 2gfu s MET 100 CO 0.02 0.41 2.01 -2.00 1.05 0.00 0.00 175.02 176.50 2gfu s GLU 101 N -1.64 3.07 0.00 4.11 2.56 -1.26 -2.31 118.70 123.23 2gfu s GLU 101 Ca 0.10 1.54 0.00 0.00 0.00 0.00 0.00 54.97 56.61 2gfu s GLU 101 Cb -0.10 -4.31 0.00 0.00 2.00 0.00 0.00 34.13 31.72 2gfu s GLU 101 CO 0.04 -2.17 0.00 0.41 -0.56 0.00 0.00 175.26 172.97 2gfu n GLY 102 N 5.62 1.85 3.96 -1.50 0.00 -1.26 -5.06 105.19 108.80 2gfu n GLY 102 Ca 0.26 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.39 2.87 0.70 1.61 -0.85 -0.98 -5.13 117.35 113.18 2gfu s TYR 103 Ca 0.00 -0.37 -0.12 0.00 -0.52 0.00 0.00 57.07 56.06 2gfu s TYR 103 Cb 0.00 -2.17 0.01 0.00 0.38 0.00 0.00 41.96 40.18 2gfu s TYR 103 CO 0.00 -0.19 1.07 -1.25 -1.52 0.00 0.00 175.55 173.67 2gfu s PRO 104 N -4.22 2.79 0.14 -3.49 0.05 -1.26 -4.69 135.00 124.32 2gfu s PRO 104 Ca 0.49 1.11 -0.34 0.00 0.05 0.00 0.00 61.00 62.31 2gfu s PRO 104 Cb -0.08 -1.97 -0.14 0.00 0.05 0.00 0.00 34.50 32.37 2gfu s PRO 104 CO 0.31 -1.23 1.58 0.91 0.05 0.00 0.00 177.00 178.62 2gfu n TRP 105 N -2.97 2.24 -4.07 0.56 7.02 -1.26 -4.70 117.44 114.26 2gfu n TRP 105 Ca 0.08 0.27 -0.21 0.00 -1.02 0.00 0.00 57.50 56.62 2gfu n TRP 105 Cb 0.53 -2.54 -0.17 0.00 -2.42 0.00 0.00 31.31 26.71 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 1.08 0.81 -0.12 -5.99 0.23 -1.04 -4.92 118.94 108.99 2gfu s TRP 106 Ca 0.80 -0.25 -0.29 0.00 -2.03 0.00 0.00 56.10 54.32 2gfu s TRP 106 Cb -0.69 -0.76 -0.05 0.00 0.03 0.00 0.00 33.47 32.00 2gfu s TRP 106 CO 0.39 -0.25 1.69 -2.14 0.96 0.00 0.00 176.95 177.60 2gfu s PRO 107 N 1.22 3.98 0.32 4.98 0.02 -1.26 -0.75 135.00 143.50 2gfu s PRO 107 Ca -0.06 2.01 0.09 0.00 0.02 0.00 0.00 61.00 63.06 2gfu s PRO 107 Cb -0.14 -4.03 -0.06 0.00 0.02 0.00 0.00 34.50 30.29 2gfu s PRO 107 CO -0.02 -1.08 -0.09 -1.12 -0.33 0.00 0.00 177.00 174.36 2gfu s SER 108 N 4.00 3.39 -0.07 2.53 0.01 -0.42 -2.40 113.70 120.73 2gfu s SER 108 Ca 0.75 -1.18 0.05 0.00 1.31 0.00 0.00 55.95 56.88 2gfu s SER 108 Cb -0.31 -0.28 -0.00 0.00 0.21 0.00 0.00 66.02 65.64 2gfu s SER 108 CO 0.30 -0.23 -0.23 -0.22 0.41 0.00 0.00 173.24 173.27 2gfu s LEU 109 N -3.54 2.04 -0.12 2.44 2.96 0.05 -0.88 118.68 121.63 2gfu s LEU 109 Ca 0.31 -0.51 -0.18 0.00 -0.22 0.00 0.00 54.13 53.53 2gfu s LEU 109 Cb 0.02 -1.32 -0.04 0.00 0.50 0.00 0.00 46.19 45.35 2gfu s LEU 109 CO 0.15 0.19 0.49 0.54 -1.32 0.00 0.00 176.35 176.40 2gfu s VAL 110 N 0.11 5.18 0.04 1.68 0.11 -0.27 -0.91 120.40 126.34 2gfu s VAL 110 Ca -0.11 0.98 0.00 0.00 -2.93 0.00 0.00 61.98 59.93 2gfu s VAL 110 Cb -0.15 -3.83 -0.03 0.00 -1.53 0.00 0.00 36.38 30.84 2gfu s VAL 110 CO 0.06 0.32 -0.04 -0.72 -3.33 0.00 0.00 175.10 171.38 2gfu s TYR 111 N 0.67 0.48 -0.41 1.54 1.13 -0.72 -0.64 117.35 119.41 2gfu s TYR 111 Ca 0.27 -0.68 -0.23 0.00 -1.41 0.00 0.00 57.07 55.01 2gfu s TYR 111 Cb -0.15 -0.32 0.02 0.00 -1.10 0.00 0.00 41.96 40.41 2gfu s TYR 111 CO 0.11 -0.20 0.78 0.54 -2.51 0.00 0.00 175.55 174.27 2gfu s ASN 112 N -1.98 6.48 0.20 -0.18 2.20 -1.26 -4.64 114.94 115.76 2gfu s ASN 112 Ca -0.07 0.13 0.00 0.00 -0.94 0.00 0.00 52.86 51.99 2gfu s ASN 112 Cb -0.04 -2.39 -0.04 0.00 -2.00 0.00 0.00 41.25 36.77 2gfu s ASN 112 CO -0.03 -0.82 0.38 -2.28 -2.94 0.00 0.00 177.10 171.41 2gfu s HIS 113 N 3.20 3.48 -1.59 1.54 2.46 -1.26 -4.94 115.29 118.18 2gfu s HIS 113 Ca 0.31 0.29 0.00 0.00 0.47 0.00 0.00 55.06 56.13 2gfu s HIS 113 Cb -0.13 -1.81 0.00 0.00 -0.13 0.00 0.00 32.58 30.51 2gfu s HIS 113 CO 0.20 0.39 0.47 -2.30 -2.47 0.00 0.00 174.74 171.03 2gfu n PRO 114 N -0.71 0.00 0.00 2.88 -0.02 -1.26 0.03 135.00 135.92 2gfu n PRO 114 Ca -0.05 0.04 0.13 0.00 -2.02 0.00 0.00 63.50 61.60 2gfu n PRO 114 Cb 0.54 -1.51 0.47 0.00 -0.02 0.00 0.00 33.50 32.98 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 -0.97 0.00 -0.71 6.00 3.72 -1.26 -5.03 117.46 119.21 2gfu n PHE 115 Ca 0.00 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.16 2gfu n PHE 115 Cb 0.01 -0.28 -0.02 0.00 -0.94 0.00 0.00 39.48 38.26 2gfu n PHE 115 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2gfu n ASP 116 N -1.24 -0.64 0.00 4.37 5.68 0.10 -4.09 116.55 120.74 2gfu n ASP 116 Ca 0.09 0.58 0.00 0.00 -0.50 0.00 0.00 54.79 54.96 2gfu n ASP 116 Cb 0.32 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 39.81 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 1.02 2.88 2.99 6.12 0.00 -1.26 -4.95 105.19 111.99 2gfu n GLY 117 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2gfu n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gfu s THR 118 N -2.53 1.47 0.00 2.61 -4.23 -1.26 -5.04 115.64 106.67 2gfu s THR 118 Ca 0.00 -0.64 0.00 0.00 -1.18 0.00 0.00 61.69 59.87 2gfu s THR 118 Cb 0.00 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.40 2gfu s THR 118 CO 0.00 0.38 0.64 2.22 -0.54 0.00 0.00 174.62 177.31 2gfu n PHE 119 N 4.79 0.00 -3.97 3.99 -1.74 -1.26 -4.88 117.46 114.39 2gfu n PHE 119 Ca -0.16 -0.19 -0.23 0.00 -0.56 0.00 0.00 57.45 56.32 2gfu n PHE 119 Cb 0.49 -0.02 -0.05 0.00 1.52 0.00 0.00 39.48 41.42 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 -0.38 2.98 -0.05 1.97 -4.36 -1.26 -3.64 121.20 116.45 2gfu s ILE 120 Ca 0.00 -1.58 -0.16 0.00 -0.26 0.00 0.00 60.65 58.65 2gfu s ILE 120 Cb 0.00 -3.03 0.03 0.00 1.25 0.00 0.00 42.46 40.72 2gfu s ILE 120 CO 0.00 -0.13 0.37 -0.60 0.24 0.00 0.00 174.94 174.82 2gfu s ARG 121 N -3.92 0.66 -0.17 0.37 6.06 -1.01 -5.01 118.95 115.92 2gfu s ARG 121 Ca 0.40 0.05 -0.12 0.00 -2.50 0.00 0.00 55.73 53.56 2gfu s ARG 121 Cb -0.02 0.30 0.05 0.00 0.06 0.00 0.00 34.95 35.34 2gfu s ARG 121 CO 0.24 -0.17 0.43 -1.83 -2.50 0.00 0.00 175.30 171.48 2gfu s GLU 122 N -0.91 0.46 -0.48 5.12 1.03 -1.26 -2.19 118.70 120.46 2gfu s GLU 122 Ca -0.10 0.72 0.02 0.00 0.03 0.00 0.00 54.97 55.64 2gfu s GLU 122 Cb -0.04 0.11 0.13 0.00 -0.80 0.00 0.00 34.13 33.52 2gfu s GLU 122 CO 0.04 -0.11 0.23 0.15 -1.33 0.00 0.00 175.26 174.23 2gfu s LYS 123 N 0.86 1.94 0.00 -4.83 3.01 -1.17 -5.04 119.74 114.52 2gfu s LYS 123 Ca -0.05 -2.35 0.00 0.00 -1.01 0.00 0.00 55.97 52.56 2gfu s LYS 123 Cb -0.06 -3.38 0.00 0.00 -1.01 0.00 0.00 37.83 33.38 2gfu s LYS 123 CO -0.07 -1.07 0.00 0.41 0.51 0.00 0.00 175.35 175.13 2gfu n GLY 124 N 3.59 0.64 2.19 -3.33 0.00 -1.26 -3.48 105.19 103.54 2gfu n GLY 124 Ca 0.05 0.24 -0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 2.01 -3.55 1.61 5.02 -1.26 -5.07 118.16 116.92 2gfu n LYS 125 Ca 0.00 -3.46 -0.12 0.00 -2.02 0.00 0.00 58.31 52.71 2gfu n LYS 125 Cb 0.00 -1.57 -0.05 0.00 -0.02 0.00 0.00 35.03 33.40 2gfu n LYS 125 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2gfu s SER 126 N -3.43 -0.44 0.02 4.39 0.01 -1.23 -5.05 113.70 107.96 2gfu s SER 126 Ca 0.36 0.42 0.02 0.00 1.31 0.00 0.00 55.95 58.05 2gfu s SER 126 Cb 0.36 0.38 -0.01 0.00 0.21 0.00 0.00 66.02 66.96 2gfu s SER 126 CO -0.04 -0.46 -0.06 0.54 0.41 0.00 0.00 173.24 173.63 2gfu s VAL 127 N -1.46 0.42 0.07 3.43 0.11 -1.26 -3.03 120.40 118.68 2gfu s VAL 127 Ca -0.03 -0.59 0.02 0.00 -2.93 0.00 0.00 61.98 58.45 2gfu s VAL 127 Cb -0.00 -0.43 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 2gfu s VAL 127 CO 0.02 -0.13 -0.08 -0.13 -3.33 0.00 0.00 175.10 171.46 2gfu s ARG 128 N -0.78 0.69 0.25 1.54 0.52 -0.93 -3.51 118.95 116.73 2gfu s ARG 128 Ca -0.04 -1.04 0.07 0.00 -0.52 0.00 0.00 55.73 54.20 2gfu s ARG 128 Cb -0.06 -0.29 -0.05 0.00 0.52 0.00 0.00 34.95 35.08 2gfu s ARG 128 CO 0.00 0.03 -0.09 0.14 0.02 0.00 0.00 175.30 175.39 2gfu s VAL 129 N -2.43 1.66 -0.32 3.52 -7.23 -1.00 -2.41 120.40 112.19 2gfu s VAL 129 Ca 0.01 -2.16 -0.24 0.00 -1.81 0.00 0.00 61.98 57.78 2gfu s VAL 129 Cb -0.03 -2.27 0.00 0.00 0.56 0.00 0.00 36.38 34.64 2gfu s VAL 129 CO -0.02 -0.43 0.80 -1.00 -0.31 0.00 0.00 175.10 174.15 2gfu s HIS 130 N -3.01 3.17 0.03 2.82 0.09 -1.24 -2.55 115.29 114.60 2gfu s HIS 130 Ca 0.26 0.77 0.01 0.00 -0.00 0.00 0.00 55.06 56.10 2gfu s HIS 130 Cb 0.02 -3.30 -0.02 0.00 -0.00 0.00 0.00 32.58 29.28 2gfu s HIS 130 CO 0.10 -0.62 -0.05 0.08 -0.00 0.00 0.00 174.74 174.25 2gfu s VAL 131 N 3.04 0.25 0.05 -0.90 1.01 -1.22 -1.75 120.40 120.88 2gfu s VAL 131 Ca 0.33 -0.98 0.09 0.00 0.00 0.00 0.00 61.98 61.42 2gfu s VAL 131 Cb -0.14 -0.39 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 2gfu s VAL 131 CO 0.14 -0.47 -0.24 0.00 0.00 0.00 0.00 175.10 174.53 2gfu s GLN 132 N -1.53 1.87 -0.19 2.72 0.00 -0.09 -3.04 119.66 119.40 2gfu s GLN 132 Ca -0.14 -1.08 -0.10 0.00 -0.00 0.00 0.00 55.36 54.05 2gfu s GLN 132 Cb -0.10 -2.05 -0.05 0.00 0.00 0.00 0.00 33.01 30.82 2gfu s GLN 132 CO -0.01 0.52 0.13 -0.06 0.00 0.00 0.00 175.29 175.87 2gfu s PHE 133 N -0.86 3.42 -1.16 9.60 0.08 0.24 -0.77 117.98 128.52 2gfu s PHE 133 Ca 0.13 0.34 -0.18 0.00 0.12 0.00 0.00 56.93 57.33 2gfu s PHE 133 Cb -0.10 -2.13 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 2gfu s PHE 133 CO 0.03 0.33 2.02 1.19 -0.10 0.00 0.00 175.22 178.69 2gfu n PHE 134 N 3.36 3.03 0.00 0.36 3.72 -1.01 -2.64 117.46 124.27 2gfu n PHE 134 Ca -0.16 -2.38 0.00 0.00 -0.05 0.00 0.00 57.45 54.86 2gfu n PHE 134 Cb 0.52 -2.28 0.00 0.00 -0.94 0.00 0.00 39.48 36.78 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 7.86 0.00 -0.03 4.37 9.92 -1.26 -4.26 116.55 133.14 2gfu n ASP 135 Ca 0.50 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.71 2gfu n ASP 135 Cb 0.41 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.88 2gfu n ASP 135 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2gfu n ASP 136 N 0.00 1.26 0.01 -2.24 5.75 -1.26 -4.86 116.55 115.20 2gfu n ASP 136 Ca 0.00 0.20 -0.07 0.00 -0.01 0.00 0.00 54.79 54.92 2gfu n ASP 136 Cb 0.00 -0.54 -0.12 0.00 -1.03 0.00 0.00 41.12 39.43 2gfu n ASP 136 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2gfu h SER 137 N -0.51 0.00 -3.93 -1.12 4.64 -1.97 -3.48 113.55 107.17 2gfu h SER 137 Ca 0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 2gfu h SER 137 Cb 0.51 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 62.72 2gfu h SER 137 CO 0.00 0.91 0.27 -0.81 -0.87 0.00 0.00 176.83 176.33 2gfu n PRO 138 N -3.07 -0.74 -3.42 4.77 -0.04 -1.26 -4.50 135.00 126.73 2gfu n PRO 138 Ca -0.12 -1.80 -0.41 0.00 -0.04 0.00 0.00 63.50 61.12 2gfu n PRO 138 Cb 0.99 -0.94 -0.10 0.00 -0.04 0.00 0.00 33.50 33.41 2gfu n PRO 138 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2gfu s THR 139 N -3.08 5.19 0.29 0.52 2.01 -1.08 -4.83 115.64 114.66 2gfu s THR 139 Ca 0.58 -0.20 0.09 0.00 0.31 0.00 0.00 61.69 62.47 2gfu s THR 139 Cb -0.02 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 2gfu s THR 139 CO 0.40 -0.18 0.02 -0.60 -0.69 0.00 0.00 174.62 173.57 2gfu s ARG 140 N 1.93 2.26 0.01 4.92 3.52 -1.26 -0.60 118.95 129.73 2gfu s ARG 140 Ca 0.10 -1.50 -0.01 0.00 -0.13 0.00 0.00 55.73 54.19 2gfu s ARG 140 Cb -0.17 -2.12 0.00 0.00 -1.56 0.00 0.00 34.95 31.10 2gfu s ARG 140 CO 0.12 0.29 0.03 0.41 -0.81 0.00 0.00 175.30 175.34 2gfu n GLY 141 N -0.94 1.44 3.50 8.12 0.00 -1.17 -5.00 105.19 111.15 2gfu n GLY 141 Ca -0.05 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 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 -6.54 3.11 0.29 1.61 0.52 -1.26 -3.40 118.94 113.27 2gfu s TRP 142 Ca 0.01 -0.18 -0.01 0.00 0.02 0.00 0.00 56.10 55.94 2gfu s TRP 142 Cb -0.00 -3.14 -0.04 0.00 -1.15 0.00 0.00 33.47 29.14 2gfu s TRP 142 CO 0.00 -0.79 0.50 0.14 0.02 0.00 0.00 176.95 176.83 2gfu s VAL 143 N 2.52 5.11 -0.44 4.03 -7.23 -1.06 -4.94 120.40 118.39 2gfu s VAL 143 Ca 0.18 -0.31 -0.29 0.00 -1.81 0.00 0.00 61.98 59.75 2gfu s VAL 143 Cb -0.15 -3.79 0.02 0.00 0.56 0.00 0.00 36.38 33.02 2gfu s VAL 143 CO 0.17 -0.39 1.18 -0.55 -0.31 0.00 0.00 175.10 175.19 2gfu s SER 144 N -3.58 6.63 0.30 4.85 0.15 -1.26 -2.38 113.70 118.41 2gfu s SER 144 Ca 0.40 0.61 0.23 0.00 0.70 0.00 0.00 55.95 57.90 2gfu s SER 144 Cb -0.10 -2.55 1.08 0.00 -1.71 0.00 0.00 66.02 62.74 2gfu s SER 144 CO 0.32 -1.23 1.70 2.29 1.20 0.00 0.00 173.24 177.53 2gfu n LYS 145 N 7.75 0.18 0.00 5.44 0.00 -1.23 -0.88 118.16 129.42 2gfu n LYS 145 Ca 0.13 0.52 0.11 0.00 -0.00 0.00 0.00 58.31 59.07 2gfu n LYS 145 Cb 0.49 -1.92 0.61 0.00 -0.00 0.00 0.00 35.03 34.20 2gfu n LYS 145 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2gfu n ARG 146 N -2.28 0.45 -0.04 -1.58 0.63 -1.22 -2.59 116.66 110.03 2gfu n ARG 146 Ca 0.01 0.05 0.06 0.00 -0.92 0.00 0.00 57.85 57.05 2gfu n ARG 146 Cb 0.15 -1.50 0.08 0.00 0.45 0.00 0.00 32.46 31.64 2gfu n ARG 146 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2gfu n LEU 147 N -1.19 2.26 -4.92 6.15 4.77 -0.06 -4.63 117.00 119.38 2gfu n LEU 147 Ca 0.13 -1.23 -0.29 0.00 -0.03 0.00 0.00 56.01 54.59 2gfu n LEU 147 Cb 0.15 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.14 2gfu n LEU 147 CO 0.16 0.47 0.03 -0.76 -1.33 0.00 0.00 177.39 175.95 2gfu s LEU 148 N -1.02 4.23 0.21 2.23 1.43 -1.07 -2.44 118.68 122.25 2gfu s LEU 148 Ca 0.17 0.46 0.11 0.00 -1.03 0.00 0.00 54.13 53.84 2gfu s LEU 148 Cb 0.11 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 2gfu s LEU 148 CO 0.16 -0.02 -0.21 -0.54 0.23 0.00 0.00 176.35 175.97 2gfu s LYS 149 N -3.13 1.64 0.48 1.70 -0.14 0.15 -4.79 119.74 115.65 2gfu s LYS 149 Ca 0.39 -1.52 -0.13 0.00 -1.36 0.00 0.00 55.97 53.35 2gfu s LYS 149 Cb -0.11 -1.89 -0.07 0.00 -1.68 0.00 0.00 37.83 34.08 2gfu s LYS 149 CO 0.28 0.39 0.90 -1.25 -0.76 0.00 0.00 175.35 174.91 2gfu s PRO 150 N -2.84 3.82 0.00 -1.68 0.04 -1.26 -0.75 135.00 132.33 2gfu s PRO 150 Ca 0.23 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.97 2gfu s PRO 150 Cb -0.08 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.22 2gfu s PRO 150 CO 0.12 -0.21 0.08 2.48 0.04 0.00 0.00 177.00 179.50 2gfu n TYR 151 N -1.65 0.00 0.00 0.56 4.11 -0.76 -4.47 117.16 114.95 2gfu n TYR 151 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.95 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 -0.19 0.00 0.80 -3.48 5.66 -1.26 -4.47 114.28 111.34 2gfu n THR 152 Ca 0.00 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 61.10 2gfu n THR 152 Cb 0.00 0.00 0.09 0.00 -1.55 0.00 0.00 70.33 68.87 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 0.14 0.70 0.18 1.09 0.00 -1.26 -4.60 105.19 101.44 2gfu n GLY 153 Ca 0.00 -0.59 0.13 0.00 0.00 0.00 0.00 46.02 45.56 2gfu n GLY 153 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2gfu h SER 154 N 3.98 0.00 0.28 1.61 4.64 -1.94 0.35 113.55 122.48 2gfu h SER 154 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gfu h SER 154 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2gfu h SER 154 CO 0.00 0.00 -0.38 2.29 -0.87 0.00 0.00 176.83 177.87 2gfu n LYS 155 N -2.37 0.58 -3.41 4.77 2.85 -1.26 -4.77 118.16 114.55 2gfu n LYS 155 Ca -0.01 -0.37 -0.33 0.00 -1.05 0.00 0.00 58.31 56.55 2gfu n LYS 155 Cb 0.09 -1.49 -0.06 0.00 -0.65 0.00 0.00 35.03 32.93 2gfu n LYS 155 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2gfu s SER 156 N -2.67 6.70 0.55 -5.58 1.04 0.11 -5.00 113.70 108.85 2gfu s SER 156 Ca 0.19 0.97 0.37 0.00 0.48 0.00 0.00 55.95 57.96 2gfu s SER 156 Cb 0.18 -2.25 1.90 0.00 0.10 0.00 0.00 66.02 65.96 2gfu s SER 156 CO 0.59 0.01 2.11 0.50 0.98 0.00 0.00 173.24 177.43 2gfu h LYS 157 N 2.99 0.00 0.00 4.02 3.64 -1.92 -0.63 116.57 124.67 2gfu h LYS 157 Ca -0.48 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 58.80 2gfu h LYS 157 Cb 1.18 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 2gfu h LYS 157 CO 0.68 0.00 -0.52 0.93 -2.27 0.00 0.00 179.45 178.27 2gfu h GLU 158 N 0.00 0.00 0.00 1.90 3.07 -1.90 -2.79 114.58 114.86 2gfu h GLU 158 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2gfu h GLU 158 Cb 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 2gfu h GLU 158 CO 0.00 0.52 -0.62 0.00 -1.40 0.00 0.00 179.01 177.51 2gfu n ALA 159 N -2.29 3.22 -4.28 3.43 0.00 -0.24 -2.73 120.51 117.62 2gfu n ALA 159 Ca 0.00 -0.31 -0.28 0.00 0.00 0.00 0.00 53.44 52.86 2gfu n ALA 159 Cb 0.65 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.85 0.80 -1.68 0.00 -0.00 -1.23 -4.88 117.38 108.55 2gfu n GLN 160 Ca 0.04 -3.30 -0.45 0.00 -0.00 0.00 0.00 57.00 53.30 2gfu n GLN 160 Cb 0.40 0.63 -0.04 0.00 -0.00 0.00 0.00 30.24 31.23 2gfu n GLN 160 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 2gfu n LYS 161 N -1.43 2.54 0.00 2.61 4.81 -1.26 -0.70 118.16 124.73 2gfu n LYS 161 Ca -0.11 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 2gfu n LYS 161 Cb 0.59 -2.81 0.00 0.00 0.02 0.00 0.00 35.03 32.83 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 4.28 0.40 3.89 3.14 0.00 -1.26 -5.03 105.19 110.61 2gfu n GLY 162 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.09 1.57 0.51 -0.02 0.00 0.12 -4.90 107.32 102.51 2gfu s GLY 163 Ca 0.00 -0.35 0.16 0.00 0.00 0.00 0.00 44.72 44.52 2gfu s GLY 163 CO 0.00 -0.14 2.13 0.45 0.00 0.00 0.00 173.10 175.54 2gfu h HIS 164 N -0.02 0.00 -0.44 1.90 3.86 -1.77 -2.90 115.15 115.77 2gfu h HIS 164 Ca -0.46 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.75 2gfu h HIS 164 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 2gfu h HIS 164 CO 0.60 0.02 0.00 1.19 0.86 0.00 0.00 177.93 180.60 2gfu n PHE 165 N -4.52 0.58 -2.59 2.45 3.72 -1.10 -5.02 117.46 110.98 2gfu n PHE 165 Ca -0.03 -0.39 -0.26 0.00 -0.05 0.00 0.00 57.45 56.71 2gfu n PHE 165 Cb 0.11 -0.01 0.01 0.00 -0.94 0.00 0.00 39.48 38.65 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 -1.10 3.38 0.00 1.38 5.04 -1.10 -4.70 117.35 120.26 2gfu s TYR 166 Ca 0.33 0.65 0.00 0.00 -2.44 0.00 0.00 57.07 55.62 2gfu s TYR 166 Cb 0.18 -2.48 0.00 0.00 0.35 0.00 0.00 41.96 40.01 2gfu s TYR 166 CO 0.24 -0.51 0.00 0.43 -1.34 0.00 0.00 175.55 174.37 2gfu n SER 167 N -2.37 0.00 -3.59 4.32 7.64 -1.26 -4.93 113.62 113.44 2gfu n SER 167 Ca 0.02 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.62 2gfu n SER 167 Cb 0.57 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.61 2gfu n SER 167 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gfu s ALA 168 N -2.00 0.72 -0.03 -0.43 0.00 -1.26 -5.00 121.76 113.75 2gfu s ALA 168 Ca 0.00 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 51.03 2gfu s ALA 168 Cb 0.00 -1.34 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 2gfu s ALA 168 CO 0.00 -1.54 -0.25 0.21 0.00 0.00 0.00 175.76 174.18 2gfu s LYS 169 N 2.03 2.29 0.56 0.00 2.20 -1.26 -5.07 119.74 120.49 2gfu s LYS 169 Ca 0.07 -0.91 0.24 0.00 -0.36 0.00 0.00 55.97 55.01 2gfu s LYS 169 Cb -0.16 -2.10 1.56 0.00 -1.51 0.00 0.00 37.83 35.62 2gfu s LYS 169 CO -0.29 0.50 2.19 -1.00 -0.36 0.00 0.00 175.35 176.38 2gfu h PRO 170 N 5.69 0.00 -0.26 4.03 0.13 -1.99 -2.14 132.00 137.46 2gfu h PRO 170 Ca -0.39 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.59 2gfu h PRO 170 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2gfu h PRO 170 CO 0.47 0.00 -0.44 0.93 -0.23 0.00 0.00 178.00 178.73 2gfu h GLU 171 N 0.00 0.64 -0.17 0.86 4.39 -1.95 -2.70 114.58 115.65 2gfu h GLU 171 Ca 0.02 -0.35 -0.14 0.00 0.34 0.00 0.00 59.36 59.23 2gfu h GLU 171 Cb 0.10 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2gfu h GLU 171 CO -0.00 0.96 -0.49 0.82 -1.16 0.00 0.00 179.01 179.13 2gfu h ILE 172 N 0.52 1.32 0.31 3.13 2.04 -1.69 -2.60 117.51 120.55 2gfu h ILE 172 Ca 0.04 -1.72 -0.01 0.00 1.00 0.00 0.00 64.86 64.17 2gfu h ILE 172 Cb 0.97 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.78 2gfu h ILE 172 CO 0.09 0.53 -0.16 -0.07 0.00 0.00 0.00 178.15 178.53 2gfu h LEU 173 N 0.36 -0.39 -1.54 1.44 3.38 -1.47 -1.94 115.31 115.14 2gfu h LEU 173 Ca 0.02 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.07 2gfu h LEU 173 Cb 0.99 0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 2gfu h LEU 173 CO 0.09 -0.27 0.40 -0.09 0.09 0.00 0.00 178.44 178.65 2gfu h ARG 174 N -0.44 0.54 -0.37 1.13 2.43 -1.38 0.18 114.38 116.47 2gfu h ARG 174 Ca -0.04 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.01 2gfu h ARG 174 Cb 0.35 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 2gfu h ARG 174 CO 0.06 0.35 -0.12 0.00 -1.51 0.00 0.00 179.97 178.75 2gfu h ALA 175 N 1.68 0.51 -0.12 2.80 0.00 -1.41 0.77 119.26 123.49 2gfu h ALA 175 Ca 0.26 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2gfu h ALA 175 Cb 0.31 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2gfu h ALA 175 CO -0.08 0.40 -0.47 0.52 0.00 0.00 0.00 179.25 179.62 2gfu h MET 176 N 0.53 0.30 -0.08 0.00 2.86 -0.50 0.34 114.93 118.39 2gfu h MET 176 Ca 0.09 -0.17 -0.18 0.00 -2.06 0.00 0.00 59.70 57.39 2gfu h MET 176 Cb 0.65 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.33 2gfu h MET 176 CO 0.04 0.71 -0.64 1.96 1.06 0.00 0.00 176.91 180.05 2gfu h GLN 177 N 0.25 0.57 -0.02 1.72 4.20 -0.58 0.94 115.11 122.19 2gfu h GLN 177 Ca 0.01 -0.51 -0.00 0.00 0.06 0.00 0.00 58.65 58.21 2gfu h GLN 177 Cb 0.92 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.82 2gfu h GLN 177 CO 0.08 1.14 -0.01 -0.09 -0.67 0.00 0.00 178.83 179.27 2gfu h ARG 178 N 0.18 0.03 -0.73 1.46 2.43 -0.94 -2.61 114.38 114.21 2gfu h ARG 178 Ca -0.06 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 2gfu h ARG 178 Cb 1.30 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.82 2gfu h ARG 178 CO 0.13 0.45 0.34 0.00 -1.51 0.00 0.00 179.97 179.38 2gfu h ALA 179 N 0.58 0.94 -0.63 2.80 0.00 -1.01 -1.95 119.26 119.99 2gfu h ALA 179 Ca 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2gfu h ALA 179 Cb 0.44 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2gfu h ALA 179 CO 0.00 0.52 0.27 0.22 0.00 0.00 0.00 179.25 180.26 2gfu h ASP 180 N 1.03 0.82 -0.13 0.00 3.58 -0.87 0.43 116.42 121.28 2gfu h ASP 180 Ca 0.25 -0.10 -0.10 0.00 0.42 0.00 0.00 57.03 57.50 2gfu h ASP 180 Cb 0.14 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2gfu h ASP 180 CO -0.03 0.72 -0.33 -0.08 -2.88 0.00 0.00 179.24 176.64 2gfu h GLU 181 N 0.89 0.45 -0.16 0.28 4.57 -1.43 -3.14 114.58 116.04 2gfu h GLU 181 Ca 0.22 -0.31 -0.21 0.00 -1.18 0.00 0.00 59.36 57.88 2gfu h GLU 181 Cb 0.14 0.05 0.01 0.00 -0.16 0.00 0.00 28.75 28.78 2gfu h GLU 181 CO -0.02 0.92 -0.72 0.00 -1.18 0.00 0.00 179.01 178.01 2gfu h ALA 182 N 0.52 0.40 -0.31 2.92 0.00 -1.04 -2.72 119.26 119.04 2gfu h ALA 182 Ca -0.00 -0.58 -0.14 0.00 0.00 0.00 0.00 54.91 54.18 2gfu h ALA 182 Cb 0.94 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2gfu h ALA 182 CO 0.07 0.70 -0.36 1.37 0.00 0.00 0.00 179.25 181.03 2gfu h LEU 183 N 0.51 0.74 0.04 0.00 8.10 -0.29 -3.13 115.31 121.29 2gfu h LEU 183 Ca -0.04 -0.32 -0.26 0.00 0.11 0.00 0.00 57.88 57.37 2gfu h LEU 183 Cb 1.34 -0.21 -0.03 0.00 -0.44 0.00 0.00 40.66 41.32 2gfu h LEU 183 CO 0.15 1.03 -1.34 -1.13 -4.11 0.00 0.00 178.44 173.04 2gfu h ASN 184 N 0.59 0.14 0.00 0.17 -1.24 -1.68 -3.44 115.58 110.11 2gfu h ASN 184 Ca 0.06 -0.18 0.00 0.00 0.71 0.00 0.00 56.30 56.88 2gfu h ASN 184 Cb 0.89 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.90 2gfu h ASN 184 CO 0.08 1.15 0.00 0.29 -1.29 0.00 0.00 177.43 177.66 2gfu n LYS 185 N -3.32 0.00 -4.08 6.67 5.02 -1.02 -5.09 118.16 116.34 2gfu n LYS 185 Ca -0.09 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.07 2gfu n LYS 185 Cb 1.00 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.90 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 -0.49 0.93 0.39 4.39 1.01 -1.18 -5.04 116.67 116.68 2gfu s ASP 186 Ca 0.00 -0.59 0.14 0.00 0.71 0.00 0.00 52.55 52.82 2gfu s ASP 186 Cb 0.00 0.03 0.99 0.00 1.01 0.00 0.00 42.92 44.95 2gfu s ASP 186 CO 0.00 -0.21 1.83 0.50 0.21 0.00 0.00 175.17 177.50 2gfu h LYS 187 N 4.37 0.50 -0.51 8.23 3.64 -1.93 -1.55 116.57 129.31 2gfu h LYS 187 Ca -0.36 -0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.14 2gfu h LYS 187 Cb 1.20 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 2gfu h LYS 187 CO 0.42 0.33 0.45 0.97 -2.27 0.00 0.00 179.45 179.35 2gfu h ILE 188 N 0.51 0.50 -0.01 2.00 6.09 -1.96 -0.24 117.51 124.40 2gfu h ILE 188 Ca 0.51 0.00 -0.23 0.00 -1.37 0.00 0.00 64.86 63.76 2gfu h ILE 188 Cb 1.11 0.66 0.02 0.00 0.47 0.00 0.00 36.82 39.08 2gfu h ILE 188 CO -0.24 0.00 -0.90 0.11 -3.07 0.00 0.00 178.15 174.05 2gfu h LYS 189 N 0.00 0.62 -0.06 2.19 6.56 -1.62 -2.40 116.57 121.87 2gfu h LYS 189 Ca 0.24 -0.66 -0.22 0.00 -1.06 0.00 0.00 60.65 58.95 2gfu h LYS 189 Cb 1.14 0.19 0.00 0.00 -0.57 0.00 0.00 32.23 32.99 2gfu h LYS 189 CO -0.00 1.26 -0.86 0.07 -2.06 0.00 0.00 179.45 177.86 2gfu h ARG 190 N 0.26 0.54 0.00 3.15 0.11 -1.55 -3.24 114.38 113.64 2gfu h ARG 190 Ca -0.11 -0.50 -0.16 0.00 0.10 0.00 0.00 59.98 59.30 2gfu h ARG 190 Cb 1.57 0.12 -0.02 0.00 1.11 0.00 0.00 29.97 32.75 2gfu h ARG 190 CO 0.18 1.13 -0.78 1.25 0.10 0.00 0.00 179.97 181.85 2gfu h LEU 191 N 0.34 0.00 -0.29 0.08 5.85 -1.21 -2.18 115.31 117.90 2gfu h LEU 191 Ca -0.07 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.52 2gfu h LEU 191 Cb 1.47 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.49 2gfu h LEU 191 CO 0.16 0.78 -0.65 -0.33 -0.34 0.00 0.00 178.44 178.06 2gfu h GLU 192 N 0.00 0.00 -0.02 1.25 5.08 -1.56 -3.20 114.58 116.13 2gfu h GLU 192 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2gfu h GLU 192 Cb 1.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.85 2gfu h GLU 192 CO 0.10 0.65 -0.14 1.28 -1.00 0.00 0.00 179.01 179.90 2gfu n LEU 193 N -3.40 1.79 0.00 1.33 4.32 -1.22 -5.01 117.00 114.81 2gfu n LEU 193 Ca 0.01 -0.59 0.00 0.00 -0.02 0.00 0.00 56.01 55.41 2gfu n LEU 193 Cb 0.74 -0.03 0.00 0.00 -1.62 0.00 0.00 43.42 42.51 2gfu n LEU 193 CO 0.42 0.31 0.00 0.00 -1.22 0.00 0.00 177.39 176.90 2gfu n ALA 194 N 0.19 0.00 -0.01 -1.18 0.00 -0.82 -4.30 120.51 114.39 2gfu n ALA 194 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.65 2gfu n ALA 194 Cb 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.78 2gfu n ALA 194 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2gfu n VAL 195 N 0.00 0.01 0.00 0.00 3.14 -1.26 -4.96 118.33 115.27 2gfu n VAL 195 Ca 0.00 -0.29 0.00 0.00 -2.96 0.00 0.00 64.34 61.09 2gfu n VAL 195 Cb 0.00 0.19 0.00 0.00 -1.06 0.00 0.00 33.84 32.97 2gfu n VAL 195 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2gfu n SER 196 N -1.95 0.00 -3.32 6.55 2.88 -1.26 -4.33 113.62 112.19 2gfu n SER 196 Ca -0.03 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.13 2gfu n SER 196 Cb 0.34 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.78 2gfu n SER 196 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2gfu n ASP 197 N 0.00 8.29 -4.02 -3.46 8.00 -1.26 -4.84 116.55 119.25 2gfu n ASP 197 Ca 0.00 -2.84 -0.32 0.00 0.71 0.00 0.00 54.79 52.34 2gfu n ASP 197 Cb 0.00 -1.46 -0.14 0.00 -0.02 0.00 0.00 41.12 39.51 2gfu n ASP 197 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2gfu s GLU 198 N 0.55 1.81 -1.26 -1.24 2.12 -1.26 -5.04 118.70 114.38 2gfu s GLU 198 Ca 0.63 -2.14 -0.11 0.00 0.36 0.00 0.00 54.97 53.71 2gfu s GLU 198 Cb 0.19 -3.35 -0.06 0.00 0.26 0.00 0.00 34.13 31.16 2gfu s GLU 198 CO -0.08 -1.03 2.44 -0.35 -0.54 0.00 0.00 175.26 175.70 2gfu n PRO 199 N 3.91 2.76 0.00 4.30 -0.04 -1.26 -4.71 135.00 139.97 2gfu n PRO 199 Ca 0.04 -1.96 0.00 0.00 -0.04 0.00 0.00 63.50 61.53 2gfu n PRO 199 Cb 0.39 -2.77 0.00 0.00 -0.04 0.00 0.00 33.50 31.08 2gfu n PRO 199 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2gfu n SER 200 N 4.64 0.00 0.00 3.54 3.41 -1.26 -5.30 113.62 118.64 2gfu n SER 200 Ca 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 2gfu n SER 200 Cb 0.24 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2gfu n SER 200 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26