#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uap n PRO 25 N 0.00 4.05 -3.21 1.43 -0.04 -1.26 -4.71 135.00 131.27 1uap n PRO 25 Ca 0.00 -2.94 -0.24 0.00 -0.04 0.00 0.00 63.50 60.28 1uap n PRO 25 Cb 0.00 -2.77 -0.07 0.00 -0.04 0.00 0.00 33.50 30.62 1uap n PRO 25 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1uap n ASP 26 N 2.92 0.54 -3.47 3.54 5.68 -1.26 -5.02 116.55 119.47 1uap n ASP 26 Ca 0.66 -2.77 -0.01 0.00 -0.50 0.00 0.00 54.79 52.16 1uap n ASP 26 Cb 0.26 -0.64 -0.04 0.00 -1.14 0.00 0.00 41.12 39.56 1uap n ASP 26 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1uap s ALA 27 N -1.36 -1.93 0.61 2.12 0.00 -1.26 -5.18 121.76 114.76 1uap s ALA 27 Ca 0.36 1.98 -0.12 0.00 0.00 0.00 0.00 51.96 54.18 1uap s ALA 27 Cb 0.18 -1.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 1uap s ALA 27 CO -0.10 -1.06 1.03 -1.25 0.00 0.00 0.00 175.76 174.38 1uap s PRO 28 N 2.83 3.57 0.83 0.00 0.04 -1.26 -5.07 135.00 135.94 1uap s PRO 28 Ca 0.04 0.84 -0.12 0.00 0.04 0.00 0.00 61.00 61.81 1uap s PRO 28 Cb -0.13 -2.08 0.09 0.00 0.04 0.00 0.00 34.50 32.42 1uap s PRO 28 CO -0.19 -0.59 1.10 0.99 0.04 0.00 0.00 177.00 178.35 1uap s THR 29 N -3.02 2.84 -0.41 1.26 2.01 -1.26 -5.01 115.64 112.05 1uap s THR 29 Ca 0.57 0.27 -0.26 0.00 0.31 0.00 0.00 61.69 62.58 1uap s THR 29 Cb -0.11 -2.96 0.02 0.00 0.01 0.00 0.00 72.50 69.45 1uap s THR 29 CO 0.49 -0.36 0.96 0.00 -0.69 0.00 0.00 174.62 175.02 1uap s PRO 31 N 3.70 -0.50 0.37 0.00 0.04 -1.26 -4.95 135.00 132.40 1uap s PRO 31 Ca 0.39 0.03 0.27 0.00 0.04 0.00 0.00 61.00 61.73 1uap s PRO 31 Cb -0.11 -1.67 1.19 0.00 0.04 0.00 0.00 34.50 33.95 1uap s PRO 31 CO 0.23 -3.25 1.82 0.87 0.04 0.00 0.00 177.00 176.71 1uap h LYS 32 N -2.25 0.00 -6.70 4.56 1.57 -2.04 -3.45 116.57 108.26 1uap h LYS 32 Ca -0.47 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.73 1uap h LYS 32 Cb 1.30 0.00 0.12 0.00 0.08 0.00 0.00 32.23 33.73 1uap h LYS 32 CO 0.42 0.00 0.32 0.94 -0.57 0.00 0.00 179.45 180.56 1uap n GLN 33 N -2.51 1.67 -2.67 3.15 -0.06 -1.26 -4.96 117.38 110.73 1uap n GLN 33 Ca 0.01 0.59 -0.08 0.00 -2.00 0.00 0.00 57.00 55.52 1uap n GLN 33 Cb 0.22 -2.17 0.04 0.00 -4.06 0.00 0.00 30.24 24.26 1uap n GLN 33 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1uap s ARG 35 N -3.50 0.69 0.15 0.00 3.52 -1.26 -4.94 118.95 113.61 1uap s ARG 35 Ca 0.31 -0.70 -0.14 0.00 -0.13 0.00 0.00 55.73 55.06 1uap s ARG 35 Cb 0.39 0.28 -0.07 0.00 -1.56 0.00 0.00 34.95 33.99 1uap s ARG 35 CO -0.01 -0.20 0.55 0.50 -0.81 0.00 0.00 175.30 175.33 1uap s ARG 36 N -2.76 3.97 0.31 5.12 3.52 -1.26 -5.04 118.95 122.81 1uap s ARG 36 Ca -0.04 0.48 0.03 0.00 -0.13 0.00 0.00 55.73 56.08 1uap s ARG 36 Cb -0.00 -2.91 -0.04 0.00 -1.56 0.00 0.00 34.95 30.44 1uap s ARG 36 CO -0.05 0.46 0.14 0.95 -0.81 0.00 0.00 175.30 175.99 1uap s THR 37 N -1.49 0.46 0.03 4.11 -4.23 -1.26 -5.11 115.64 108.15 1uap s THR 37 Ca 0.39 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.90 1uap s THR 37 Cb -0.15 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.16 1uap s THR 37 CO 0.19 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.88 1uap n GLY 38 N -0.62 -1.84 3.86 3.99 0.00 -1.26 -4.92 105.19 104.40 1uap n GLY 38 Ca -0.00 -1.32 -0.22 0.00 0.00 0.00 0.00 46.02 44.48 1uap n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uap s THR 39 N -0.39 2.50 0.10 2.61 -4.23 -1.26 -4.99 115.64 109.97 1uap s THR 39 Ca 0.00 -1.40 -0.19 0.00 -1.18 0.00 0.00 61.69 58.92 1uap s THR 39 Cb 0.00 -2.90 -0.07 0.00 1.34 0.00 0.00 72.50 70.87 1uap s THR 39 CO 0.00 0.00 1.61 0.25 -0.54 0.00 0.00 174.62 175.94 1uap h LEU 40 N 1.04 0.37 -0.14 4.79 6.46 -1.98 -1.42 115.31 124.42 1uap h LEU 40 Ca -0.41 -0.21 -0.01 0.00 -0.12 0.00 0.00 57.88 57.14 1uap h LEU 40 Cb 1.27 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 41.10 1uap h LEU 40 CO 0.59 0.48 0.07 1.56 -0.62 0.00 0.00 178.44 180.51 1uap h GLN 41 N 0.24 0.21 0.11 1.25 4.20 -1.99 0.55 115.11 119.68 1uap h GLN 41 Ca 0.08 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.78 1uap h GLN 41 Cb 0.24 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 1uap h GLN 41 CO -0.00 0.27 -0.27 0.77 -0.67 0.00 0.00 178.83 178.93 1uap h SER 42 N 0.10 -0.77 -0.75 1.46 0.02 -1.95 -2.24 113.55 109.42 1uap h SER 42 Ca 0.05 0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 61.05 1uap h SER 42 Cb 0.13 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 1uap h SER 42 CO -0.01 -0.36 0.32 0.78 -1.14 0.00 0.00 176.83 176.42 1uap h ASN 43 N -0.48 1.01 -0.65 3.07 2.35 -1.14 -1.06 115.58 118.68 1uap h ASN 43 Ca 0.03 -0.16 0.06 0.00 -0.55 0.00 0.00 56.30 55.68 1uap h ASN 43 Cb 0.51 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.56 1uap h ASN 43 CO -0.16 0.89 0.36 0.15 -1.65 0.00 0.00 177.43 177.02 1uap h PHE 44 N 1.07 0.66 -0.42 1.19 3.04 -0.67 -0.08 116.94 121.73 1uap h PHE 44 Ca 0.25 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.19 1uap h PHE 44 Cb 0.18 -0.20 -0.02 0.00 2.56 0.00 0.00 35.95 38.47 1uap h PHE 44 CO 0.01 0.32 0.13 0.00 -2.02 0.00 0.00 178.31 176.75 1uap h ALA 46 N 0.98 -1.02 -2.56 0.00 0.00 -0.68 -3.45 119.26 112.53 1uap h ALA 46 Ca 0.13 -0.23 -0.57 0.00 0.00 0.00 0.00 54.91 54.24 1uap h ALA 46 Cb 0.26 0.40 0.11 0.00 0.00 0.00 0.00 17.79 18.56 1uap h ALA 46 CO -0.00 -0.99 0.48 -1.13 0.00 0.00 0.00 179.25 177.61 1uap n SER 47 N -5.48 2.64 -0.07 0.00 3.41 -0.09 -4.93 113.62 109.10 1uap n SER 47 Ca -0.13 1.18 0.12 0.00 -0.26 0.00 0.00 58.87 59.77 1uap n SER 47 Cb 0.41 -1.48 0.15 0.00 -0.26 0.00 0.00 64.21 63.03 1uap n SER 47 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1uap n SER 48 N 0.64 0.81 -4.04 4.04 2.88 -0.40 -4.81 113.62 112.73 1uap n SER 48 Ca 0.05 -0.63 -0.29 0.00 -1.33 0.00 0.00 58.87 56.67 1uap n SER 48 Cb 0.37 0.46 -0.17 0.00 -0.75 0.00 0.00 64.21 64.12 1uap n SER 48 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1uap s LEU 49 N -2.90 1.72 -0.12 2.46 2.96 -0.64 -2.73 118.68 119.42 1uap s LEU 49 Ca 0.12 -0.46 -0.04 0.00 -0.22 0.00 0.00 54.13 53.53 1uap s LEU 49 Cb 0.17 -1.15 0.05 0.00 0.50 0.00 0.00 46.19 45.77 1uap s LEU 49 CO 0.71 -0.02 0.08 -0.69 -1.32 0.00 0.00 176.35 175.12 1uap s VAL 50 N 1.21 -0.09 0.26 1.68 1.01 0.02 -0.55 120.40 123.95 1uap s VAL 50 Ca -0.01 0.05 -0.09 0.00 0.00 0.00 0.00 61.98 61.92 1uap s VAL 50 Cb -0.14 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 1uap s VAL 50 CO -0.06 -0.11 0.44 0.68 0.00 0.00 0.00 175.10 176.05 1uap s VAL 51 N 2.15 0.00 0.01 2.92 -7.23 -0.52 -1.28 120.40 116.44 1uap s VAL 51 Ca 0.03 -1.51 0.03 0.00 -1.81 0.00 0.00 61.98 58.72 1uap s VAL 51 Cb -0.15 -2.34 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 1uap s VAL 51 CO -0.07 0.00 -0.09 0.42 -0.31 0.00 0.00 175.10 175.05 1uap s THR 52 N -3.82 0.69 0.09 5.32 -4.23 -0.21 -0.68 115.64 112.81 1uap s THR 52 Ca 0.26 -0.52 -0.26 0.00 -1.18 0.00 0.00 61.69 59.99 1uap s THR 52 Cb 0.00 -0.61 0.08 0.00 1.34 0.00 0.00 72.50 73.32 1uap s THR 52 CO 0.12 0.09 0.78 0.00 -0.54 0.00 0.00 174.62 175.06 1uap s ALA 53 N -0.41 -1.69 -0.18 3.99 0.00 -0.20 -0.26 121.76 123.01 1uap s ALA 53 Ca 0.01 0.67 -0.14 0.00 0.00 0.00 0.00 51.96 52.50 1uap s ALA 53 Cb -0.05 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 1uap s ALA 53 CO -0.00 -0.77 0.32 0.99 0.00 0.00 0.00 175.76 176.30 1uap s THR 54 N -3.42 5.27 -0.25 0.00 2.01 -1.26 -0.63 115.64 117.38 1uap s THR 54 Ca 0.04 0.58 -0.29 0.00 0.31 0.00 0.00 61.69 62.33 1uap s THR 54 Cb -0.01 -3.66 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 1uap s THR 54 CO -0.09 0.34 1.65 -0.69 -0.69 0.00 0.00 174.62 175.14 1uap s VAL 55 N 0.80 3.65 -0.06 3.82 1.01 -0.15 -2.29 120.40 127.18 1uap s VAL 55 Ca 0.17 0.72 -0.12 0.00 0.00 0.00 0.00 61.98 62.74 1uap s VAL 55 Cb -0.14 -3.70 -0.30 0.00 0.00 0.00 0.00 36.38 32.24 1uap s VAL 55 CO 0.05 -0.33 0.64 0.11 0.00 0.00 0.00 175.10 175.58 1uap h LYS 56 N 11.16 0.36 -3.97 2.72 1.79 -0.87 0.04 116.57 127.80 1uap h LYS 56 Ca -0.34 -0.61 -0.12 0.00 -2.18 0.00 0.00 60.65 57.40 1uap h LYS 56 Cb 1.16 0.23 -0.13 0.00 -1.58 0.00 0.00 32.23 31.91 1uap h LYS 56 CO 1.01 1.29 -0.36 -1.12 -1.08 0.00 0.00 179.45 179.19 1uap s SER 57 N -7.23 0.07 -0.05 0.86 0.01 -1.02 -4.65 113.70 101.69 1uap s SER 57 Ca -0.17 -0.94 -0.02 0.00 1.31 0.00 0.00 55.95 56.13 1uap s SER 57 Cb 0.05 0.42 0.03 0.00 0.21 0.00 0.00 66.02 66.74 1uap s SER 57 CO 0.83 -0.89 0.11 -0.04 0.41 0.00 0.00 173.24 173.66 1uap s MET 58 N -3.99 0.06 0.05 12.44 -1.94 -1.26 -0.72 119.30 123.94 1uap s MET 58 Ca 0.19 0.30 -0.01 0.00 -1.71 0.00 0.00 55.69 54.46 1uap s MET 58 Cb 0.04 -0.17 -0.03 0.00 2.01 0.00 0.00 34.83 36.67 1uap s MET 58 CO 0.01 -0.15 -0.03 0.08 -0.01 0.00 0.00 175.02 174.92 1uap s VAL 59 N 1.02 0.23 0.57 -6.03 1.01 -0.22 -4.98 120.40 111.99 1uap s VAL 59 Ca -0.08 -1.58 -0.19 0.00 0.00 0.00 0.00 61.98 60.13 1uap s VAL 59 Cb -0.11 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 1uap s VAL 59 CO -0.04 -0.86 1.17 -0.13 0.00 0.00 0.00 175.10 175.23 1uap s ARG 60 N -3.26 3.18 0.23 2.72 0.52 -1.26 -0.25 118.95 120.84 1uap s ARG 60 Ca 0.01 1.71 0.01 0.00 -0.52 0.00 0.00 55.73 56.94 1uap s ARG 60 Cb 0.03 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.49 1uap s ARG 60 CO -0.07 -1.01 0.14 -1.21 0.02 0.00 0.00 175.30 173.17 1uap s GLU 61 N -3.30 1.33 0.97 3.54 0.41 -1.22 -4.60 118.70 115.83 1uap s GLU 61 Ca 0.75 -1.72 -0.11 0.00 -0.41 0.00 0.00 54.97 53.48 1uap s GLU 61 Cb -0.27 0.16 0.18 0.00 -1.78 0.00 0.00 34.13 32.41 1uap s GLU 61 CO 0.30 -0.41 1.10 -1.25 -0.49 0.00 0.00 175.26 174.50 1uap s PRO 62 N -4.03 0.60 3.52 0.39 0.04 -1.26 -4.37 135.00 129.88 1uap s PRO 62 Ca 0.39 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.61 1uap s PRO 62 Cb 0.06 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.90 1uap s PRO 62 CO 0.15 -2.80 0.00 0.41 0.04 0.00 0.00 177.00 174.80 1uap n GLY 63 N 0.01 0.46 0.35 0.56 0.00 -1.26 -2.58 105.19 102.72 1uap n GLY 63 Ca 0.08 -0.81 0.04 0.00 0.00 0.00 0.00 46.02 45.33 1uap n GLY 63 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uap n GLU 64 N 0.00 1.44 -1.20 1.61 4.07 -1.26 -4.95 120.64 120.36 1uap n GLU 64 Ca 0.00 -0.68 -0.29 0.00 -0.06 0.00 0.00 57.16 56.13 1uap n GLU 64 Cb 0.00 -1.18 0.19 0.00 -0.06 0.00 0.00 31.44 30.38 1uap n GLU 64 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1uap s GLY 65 N -1.10 1.57 -0.19 8.31 0.00 -1.07 -3.49 107.32 111.36 1uap s GLY 65 Ca 0.16 -0.52 -0.17 0.00 0.00 0.00 0.00 44.72 44.18 1uap s GLY 65 CO 0.11 0.15 0.50 -2.27 0.00 0.00 0.00 173.10 171.59 1uap s LEU 66 N -6.52 0.05 -0.24 0.66 1.98 0.17 -3.41 118.68 111.36 1uap s LEU 66 Ca 0.67 1.02 -0.11 0.00 -2.89 0.00 0.00 54.13 52.81 1uap s LEU 66 Cb -0.16 1.72 -0.05 0.00 0.66 0.00 0.00 46.19 48.36 1uap s LEU 66 CO 0.57 -0.18 0.19 0.00 -1.89 0.00 0.00 176.35 175.04 1uap s ALA 67 N 0.35 3.59 -0.25 5.97 0.00 0.66 -0.96 121.76 131.13 1uap s ALA 67 Ca -0.01 -0.89 -0.10 0.00 0.00 0.00 0.00 51.96 50.97 1uap s ALA 67 Cb -0.04 -2.38 -0.05 0.00 0.00 0.00 0.00 23.12 20.65 1uap s ALA 67 CO -0.00 -0.27 0.16 0.08 0.00 0.00 0.00 175.76 175.72 1uap s VAL 68 N 1.21 5.21 -0.23 0.00 1.01 -0.48 -1.05 120.40 126.07 1uap s VAL 68 Ca 0.09 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 1uap s VAL 68 Cb -0.14 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 1uap s VAL 68 CO 0.06 0.32 0.23 -0.89 0.00 0.00 0.00 175.10 174.81 1uap s THR 69 N 1.30 5.31 0.44 3.92 2.01 0.10 -0.62 115.64 128.11 1uap s THR 69 Ca 0.07 0.32 0.04 0.00 0.31 0.00 0.00 61.69 62.42 1uap s THR 69 Cb -0.14 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 1uap s THR 69 CO 0.06 0.31 0.03 0.68 -0.69 0.00 0.00 174.62 175.01 1uap s VAL 70 N 1.20 1.35 -0.31 3.82 -7.23 -0.26 -0.17 120.40 118.80 1uap s VAL 70 Ca 0.10 -2.00 0.18 0.00 -1.81 0.00 0.00 61.98 58.46 1uap s VAL 70 Cb -0.14 -2.52 0.47 0.00 0.56 0.00 0.00 36.38 34.75 1uap s VAL 70 CO 0.06 0.00 1.03 -0.24 -0.31 0.00 0.00 175.10 175.64 1uap n SER 71 N -1.11 1.91 -2.99 4.85 2.88 -0.97 -2.14 113.62 116.06 1uap n SER 71 Ca -0.11 -2.60 -0.28 0.00 -1.33 0.00 0.00 58.87 54.55 1uap n SER 71 Cb 0.67 -0.50 0.03 0.00 -0.75 0.00 0.00 64.21 63.66 1uap n SER 71 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1uap n LEU 72 N -0.31 -2.10 0.15 2.46 4.77 -0.81 -3.85 117.00 117.30 1uap n LEU 72 Ca 0.12 -0.08 0.02 0.00 -0.03 0.00 0.00 56.01 56.05 1uap n LEU 72 Cb 0.81 -1.28 0.17 0.00 -2.33 0.00 0.00 43.42 40.78 1uap n LEU 72 CO 0.21 -0.14 0.52 0.40 -1.33 0.00 0.00 177.39 177.05 1uap h ILE 73 N 1.88 1.06 -2.13 -0.08 1.08 -0.96 0.20 117.51 118.57 1uap h ILE 73 Ca -0.41 -2.06 0.16 0.00 -0.39 0.00 0.00 64.86 62.17 1uap h ILE 73 Cb 1.10 2.22 -0.14 0.00 -3.07 0.00 0.00 36.82 36.94 1uap h ILE 73 CO 0.16 0.52 0.56 -0.83 -0.69 0.00 0.00 178.15 177.87 1uap s GLY 74 N -4.45 -0.38 0.01 5.37 0.00 -0.25 -4.88 107.32 102.74 1uap s GLY 74 Ca 0.01 0.85 -0.01 0.00 0.00 0.00 0.00 44.72 45.57 1uap s GLY 74 CO 0.73 0.26 -0.01 0.00 0.00 0.00 0.00 173.10 174.09 1uap s ALA 75 N -3.02 0.05 0.02 3.20 0.00 -1.26 -1.04 121.76 119.71 1uap s ALA 75 Ca 0.08 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1uap s ALA 75 Cb -0.01 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1uap s ALA 75 CO -0.05 -0.15 0.00 0.66 0.00 0.00 0.00 175.76 176.22 1uap n TYR 76 N 1.75 -0.14 -4.04 0.00 4.01 -0.40 -4.97 117.16 113.37 1uap n TYR 76 Ca -0.22 0.02 -0.24 0.00 -0.16 0.00 0.00 57.90 57.30 1uap n TYR 76 Cb 0.56 0.24 -0.17 0.00 -0.31 0.00 0.00 39.34 39.66 1uap n TYR 76 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1uap s LYS 77 N -2.00 1.11 -0.39 -0.72 2.20 -0.52 -4.97 119.74 114.44 1uap s LYS 77 Ca 0.00 -0.14 0.11 0.00 -0.36 0.00 0.00 55.97 55.58 1uap s LYS 77 Cb 0.00 -1.19 0.33 0.00 -1.51 0.00 0.00 37.83 35.47 1uap s LYS 77 CO 0.00 -0.18 0.72 0.25 -0.36 0.00 0.00 175.35 175.78 1uap n THR 78 N 4.59 0.05 0.63 3.43 -2.24 -1.26 -0.80 114.28 118.67 1uap n THR 78 Ca -0.16 -4.60 -0.03 0.00 -2.27 0.00 0.00 64.05 57.00 1uap n THR 78 Cb 0.50 -0.61 0.04 0.00 -2.10 0.00 0.00 70.33 68.16 1uap n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uap n GLY 79 N 0.41 2.30 0.00 3.38 0.00 -1.11 -3.07 105.19 107.09 1uap n GLY 79 Ca 0.25 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1uap n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uap n GLY 80 N 0.19 0.84 3.48 -0.02 0.00 -1.26 -5.03 105.19 103.40 1uap n GLY 80 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1uap n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uap s LEU 81 N 0.00 2.74 -1.28 0.99 1.43 -1.18 -4.33 118.68 117.05 1uap s LEU 81 Ca 0.00 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.73 1uap s LEU 81 Cb 0.00 -1.58 0.15 0.00 0.03 0.00 0.00 46.19 44.79 1uap s LEU 81 CO 0.00 0.31 1.81 -0.90 0.23 0.00 0.00 176.35 177.79 1uap n ASP 82 N 1.98 4.99 -4.69 2.29 5.75 -1.26 -4.98 116.55 120.62 1uap n ASP 82 Ca -0.17 -3.05 -0.42 0.00 -0.01 0.00 0.00 54.79 51.15 1uap n ASP 82 Cb 0.52 -1.53 -0.03 0.00 -1.03 0.00 0.00 41.12 39.05 1uap n ASP 82 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1uap s LEU 83 N 0.68 4.40 0.00 -2.12 1.43 -1.26 -4.97 118.68 116.83 1uap s LEU 83 Ca 0.42 2.77 -0.06 0.00 -1.03 0.00 0.00 54.13 56.22 1uap s LEU 83 Cb 0.07 -3.57 0.10 0.00 0.03 0.00 0.00 46.19 42.83 1uap s LEU 83 CO -0.00 -1.01 0.63 -0.81 0.23 0.00 0.00 176.35 175.39 1uap n PRO 84 N 5.70 -0.45 -0.05 1.29 -0.04 -1.26 -4.99 135.00 135.20 1uap n PRO 84 Ca 0.18 -1.10 -0.10 0.00 -0.04 0.00 0.00 63.50 62.43 1uap n PRO 84 Cb 0.38 -0.61 -0.04 0.00 -0.04 0.00 0.00 33.50 33.20 1uap n PRO 84 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1uap h SER 85 N -0.75 -1.13 -2.71 3.54 0.87 -2.07 -3.35 113.55 107.95 1uap h SER 85 Ca -0.20 0.17 -0.56 0.00 -1.23 0.00 0.00 61.79 59.97 1uap h SER 85 Cb 0.60 0.49 -0.02 0.00 -0.44 0.00 0.00 62.40 63.03 1uap h SER 85 CO 0.16 -0.36 1.14 -2.16 -0.53 0.00 0.00 176.83 175.08 1uap s PRO 86 N -5.96 3.81 0.00 2.24 0.04 -1.26 -5.00 135.00 128.87 1uap s PRO 86 Ca -0.15 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.63 1uap s PRO 86 Cb 0.11 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1uap s PRO 86 CO 0.66 -1.28 0.00 -0.35 0.04 0.00 0.00 177.00 176.07 1uap n PRO 87 N 7.65 2.37 -1.22 0.56 -0.04 -1.26 -4.74 135.00 138.33 1uap n PRO 87 Ca 0.19 0.00 -0.47 0.00 -0.04 0.00 0.00 63.50 63.18 1uap n PRO 87 Cb 0.45 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.84 1uap n PRO 87 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1uap n THR 88 N -0.06 0.00 0.00 0.52 -1.04 -1.26 -3.17 114.28 109.27 1uap n THR 88 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1uap n THR 88 Cb 0.00 -0.21 0.00 0.00 -1.82 0.00 0.00 70.33 68.30 1uap n THR 88 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1uap n GLY 89 N 2.15 1.51 3.83 3.41 0.00 0.71 -4.98 105.19 111.82 1uap n GLY 89 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1uap n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uap s ALA 90 N -1.14 2.95 -0.15 4.61 0.00 -1.19 -4.45 121.76 122.38 1uap s ALA 90 Ca 0.00 0.25 -0.08 0.00 0.00 0.00 0.00 51.96 52.13 1uap s ALA 90 Cb 0.00 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 1uap s ALA 90 CO 0.00 -0.45 0.13 -1.54 0.00 0.00 0.00 175.76 173.91 1uap s SER 91 N -2.98 6.30 0.10 0.00 1.04 -1.26 -1.93 113.70 114.97 1uap s SER 91 Ca 0.61 0.36 0.05 0.00 0.48 0.00 0.00 55.95 57.45 1uap s SER 91 Cb -0.12 -2.07 -0.03 0.00 0.10 0.00 0.00 66.02 63.89 1uap s SER 91 CO 0.34 0.31 -0.13 -0.76 0.98 0.00 0.00 173.24 173.97 1uap s LEU 92 N -0.44 2.35 -0.30 2.42 1.43 -0.91 -4.97 118.68 118.26 1uap s LEU 92 Ca 0.12 -0.73 -0.07 0.00 -1.03 0.00 0.00 54.13 52.42 1uap s LEU 92 Cb -0.12 -0.49 0.01 0.00 0.03 0.00 0.00 46.19 45.63 1uap s LEU 92 CO 0.01 -0.14 0.09 -0.54 0.23 0.00 0.00 176.35 176.01 1uap s LYS 93 N -2.31 3.03 -0.26 1.70 1.02 -1.26 -1.11 119.74 120.56 1uap s LYS 93 Ca 0.04 -0.90 -0.20 0.00 0.02 0.00 0.00 55.97 54.92 1uap s LYS 93 Cb -0.07 -3.40 -0.02 0.00 -0.52 0.00 0.00 37.83 33.82 1uap s LYS 93 CO 0.02 -0.48 0.63 -0.06 -0.92 0.00 0.00 175.35 174.54 1uap s PHE 94 N 1.49 3.28 -0.34 3.18 0.40 0.21 -4.14 117.98 122.06 1uap s PHE 94 Ca 0.02 0.80 -0.29 0.00 -0.60 0.00 0.00 56.93 56.86 1uap s PHE 94 Cb -0.18 -2.85 0.00 0.00 0.51 0.00 0.00 43.02 40.51 1uap s PHE 94 CO 0.03 -0.33 1.33 -0.47 0.70 0.00 0.00 175.22 176.47 1uap s TYR 95 N 2.51 2.61 -0.32 0.36 5.04 -0.83 -1.38 117.35 125.34 1uap s TYR 95 Ca 0.26 0.81 -0.09 0.00 -2.44 0.00 0.00 57.07 55.61 1uap s TYR 95 Cb -0.15 -4.04 0.00 0.00 0.35 0.00 0.00 41.96 38.12 1uap s TYR 95 CO 0.09 -1.77 0.14 0.08 -1.34 0.00 0.00 175.55 172.75 1uap s VAL 96 N 4.66 4.43 -2.00 3.14 1.01 -0.13 0.11 120.40 131.61 1uap s VAL 96 Ca 0.57 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 62.04 1uap s VAL 96 Cb -0.16 -3.31 0.21 0.00 0.00 0.00 0.00 36.38 33.12 1uap s VAL 96 CO 0.26 0.01 0.89 -0.81 0.00 0.00 0.00 175.10 175.45 1uap n PRO 97 N 4.95 0.48 -4.04 2.72 -0.04 -1.26 -0.66 135.00 137.16 1uap n PRO 97 Ca -0.14 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.23 1uap n PRO 97 Cb 0.48 -1.24 -0.08 0.00 -0.04 0.00 0.00 33.50 32.62 1uap n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uap n LYS 99 N -0.22 1.64 -0.12 0.00 2.85 -1.23 -4.14 118.16 116.94 1uap n LYS 99 Ca -0.05 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.11 1uap n LYS 99 Cb 0.63 -0.91 -0.02 0.00 -0.65 0.00 0.00 35.03 34.08 1uap n LYS 99 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1uap h GLN 100 N 0.00 0.58 -4.08 -1.58 4.20 -1.98 -3.46 115.11 108.79 1uap h GLN 100 Ca 0.00 -0.16 -0.12 0.00 0.06 0.00 0.00 58.65 58.43 1uap h GLN 100 Cb 0.21 -0.07 -0.14 0.00 0.30 0.00 0.00 27.48 27.78 1uap h GLN 100 CO 0.00 0.65 -0.49 0.00 -0.67 0.00 0.00 178.83 178.33 1uap s PRO 102 N -3.95 1.77 -1.19 0.00 0.04 -1.26 -4.66 135.00 125.75 1uap s PRO 102 Ca 0.14 1.56 -0.22 0.00 0.04 0.00 0.00 61.00 62.52 1uap s PRO 102 Cb 0.06 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.71 1uap s PRO 102 CO -0.04 -2.07 1.92 -1.25 0.04 0.00 0.00 177.00 175.59 1uap s PRO 103 N -4.37 2.62 0.22 0.56 0.04 -1.26 -4.92 135.00 127.89 1uap s PRO 103 Ca 0.69 -1.23 -0.04 0.00 0.04 0.00 0.00 61.00 60.46 1uap s PRO 103 Cb -0.24 -5.27 -0.05 0.00 0.04 0.00 0.00 34.50 28.98 1uap s PRO 103 CO 0.52 -3.83 0.47 1.41 0.04 0.00 0.00 177.00 175.60 1uap s MET 104 N 6.28 3.62 0.01 4.56 1.75 -1.26 -4.95 119.30 129.31 1uap s MET 104 Ca 0.67 -0.08 0.01 0.00 -1.25 0.00 0.00 55.69 55.04 1uap s MET 104 Cb -0.00 -2.75 -0.01 0.00 2.84 0.00 0.00 34.83 34.91 1uap s MET 104 CO 0.13 0.34 -0.04 0.15 -0.65 0.00 0.00 175.02 174.94 1uap s LYS 105 N -3.19 0.34 0.36 4.11 1.02 -1.26 -5.11 119.74 116.01 1uap s LYS 105 Ca 0.42 -0.32 -0.27 0.00 0.02 0.00 0.00 55.97 55.83 1uap s LYS 105 Cb -0.11 -0.24 -0.09 0.00 -0.52 0.00 0.00 37.83 36.87 1uap s LYS 105 CO 0.27 0.06 1.20 0.21 -0.92 0.00 0.00 175.35 176.17 1uap s LYS 106 N -0.55 4.22 -0.64 1.68 2.20 -1.26 -3.74 119.74 121.64 1uap s LYS 106 Ca -0.03 1.95 -0.01 0.00 -0.36 0.00 0.00 55.97 57.52 1uap s LYS 106 Cb -0.04 -2.87 0.00 0.00 -1.51 0.00 0.00 37.83 33.41 1uap s LYS 106 CO -0.00 -0.21 0.09 0.41 -0.36 0.00 0.00 175.35 175.28 1uap n GLY 107 N 0.77 0.11 3.05 5.54 0.00 0.00 -5.01 105.19 109.66 1uap n GLY 107 Ca 0.02 -0.51 -0.08 0.00 0.00 0.00 0.00 46.02 45.45 1uap n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uap s VAL 108 N -2.54 0.16 -0.16 1.61 1.01 -1.25 -4.93 120.40 114.31 1uap s VAL 108 Ca 0.04 -1.35 -0.12 0.00 0.00 0.00 0.00 61.98 60.55 1uap s VAL 108 Cb -0.02 -0.93 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 1uap s VAL 108 CO 0.05 -0.75 0.25 -0.44 0.00 0.00 0.00 175.10 174.22 1uap s SER 109 N -2.23 6.40 0.32 3.32 0.01 -1.26 -0.97 113.70 119.28 1uap s SER 109 Ca -0.04 0.46 0.04 0.00 1.31 0.00 0.00 55.95 57.72 1uap s SER 109 Cb -0.00 -2.16 -0.06 0.00 0.21 0.00 0.00 66.02 64.01 1uap s SER 109 CO -0.06 0.15 0.06 -0.31 0.41 0.00 0.00 173.24 173.50 1uap s TYR 110 N 0.26 1.94 -0.15 2.43 1.51 0.20 -1.49 117.35 122.05 1uap s TYR 110 Ca 0.15 -0.97 -0.01 0.00 -1.01 0.00 0.00 57.07 55.23 1uap s TYR 110 Cb -0.13 -1.26 -0.01 0.00 -0.11 0.00 0.00 41.96 40.45 1uap s TYR 110 CO 0.03 -0.01 -0.13 -1.17 -1.11 0.00 0.00 175.55 173.16 1uap s LEU 111 N -3.48 2.64 -0.22 -1.29 0.20 0.38 -1.03 118.68 115.89 1uap s LEU 111 Ca 0.37 -0.40 0.02 0.00 0.69 0.00 0.00 54.13 54.81 1uap s LEU 111 Cb 0.09 -1.61 0.04 0.00 -0.43 0.00 0.00 46.19 44.28 1uap s LEU 111 CO 0.15 0.10 -0.13 -0.76 -0.29 0.00 0.00 176.35 175.43 1uap s LEU 112 N 0.72 2.71 -0.26 -0.68 2.01 0.15 -2.89 118.68 120.44 1uap s LEU 112 Ca -0.06 -1.04 -0.00 0.00 0.01 0.00 0.00 54.13 53.04 1uap s LEU 112 Cb -0.15 -1.42 0.04 0.00 0.01 0.00 0.00 46.19 44.67 1uap s LEU 112 CO 0.02 -0.13 -0.07 -0.04 1.01 0.00 0.00 176.35 177.14 1uap s MET 113 N 1.25 2.61 0.00 1.70 -1.94 -0.66 -1.44 119.30 120.82 1uap s MET 113 Ca -0.03 -1.12 0.00 0.00 -1.71 0.00 0.00 55.69 52.83 1uap s MET 113 Cb -0.17 -2.97 0.00 0.00 2.01 0.00 0.00 34.83 33.70 1uap s MET 113 CO -0.08 -0.48 0.00 0.41 -0.01 0.00 0.00 175.02 174.86 1uap n GLY 114 N 4.60 4.03 3.35 -0.03 0.00 0.29 -1.68 105.19 115.74 1uap n GLY 114 Ca -0.15 -0.27 -0.19 0.00 0.00 0.00 0.00 46.02 45.41 1uap n GLY 114 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uap s GLN 115 N 4.91 1.56 0.05 1.61 1.11 -1.17 -1.28 119.66 126.45 1uap s GLN 115 Ca 0.00 -1.88 0.03 0.00 0.01 0.00 0.00 55.36 53.52 1uap s GLN 115 Cb 0.00 -0.23 -0.02 0.00 -1.01 0.00 0.00 33.01 31.75 1uap s GLN 115 CO 0.00 -0.39 -0.11 0.08 0.01 0.00 0.00 175.29 174.89 1uap s VAL 116 N -3.61 0.79 -0.26 1.09 1.01 -1.26 -2.02 120.40 116.15 1uap s VAL 116 Ca 0.35 -1.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.28 1uap s VAL 116 Cb 0.06 -0.79 0.04 0.00 0.00 0.00 0.00 36.38 35.69 1uap s VAL 116 CO 0.16 -0.22 -0.06 -1.61 0.00 0.00 0.00 175.10 173.36 1uap s GLU 117 N -1.41 2.59 -1.24 2.72 2.02 -0.15 -4.87 118.70 118.36 1uap s GLU 117 Ca -0.05 -1.14 -0.14 0.00 0.02 0.00 0.00 54.97 53.67 1uap s GLU 117 Cb -0.09 -2.99 0.15 0.00 0.10 0.00 0.00 34.13 31.30 1uap s GLU 117 CO 0.01 -0.49 1.57 -1.91 0.02 0.00 0.00 175.26 174.46 1uap n GLU 118 N 4.60 3.35 0.00 1.61 4.07 -1.26 -0.94 120.64 132.06 1uap n GLU 118 Ca -0.15 -3.67 0.00 0.00 -0.06 0.00 0.00 57.16 53.28 1uap n GLU 118 Cb 0.45 -3.13 0.00 0.00 -0.06 0.00 0.00 31.44 28.70 1uap n GLU 118 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1uap n ASN 119 N 6.01 0.00 0.00 4.31 4.05 -1.26 -4.99 115.26 123.38 1uap n ASN 119 Ca 0.40 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.43 1uap n ASN 119 Cb 0.43 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.44 1uap n ASN 119 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1uap n ARG 120 N 0.00 2.22 0.00 1.20 1.74 -0.30 -5.16 116.66 116.35 1uap n ARG 120 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1uap n ARG 120 Cb 0.00 -0.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 1uap n ARG 120 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uap n GLY 121 N 2.39 -0.29 3.76 -0.13 0.00 -0.12 -5.00 105.19 105.79 1uap n GLY 121 Ca 0.00 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.47 1uap n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uap s PRO 122 N 0.00 4.59 0.16 1.61 0.04 -1.26 -0.97 135.00 139.17 1uap s PRO 122 Ca 0.00 1.88 0.09 0.00 0.04 0.00 0.00 61.00 63.02 1uap s PRO 122 Cb 0.00 -3.17 -0.04 0.00 0.04 0.00 0.00 34.50 31.33 1uap s PRO 122 CO 0.00 0.13 -0.16 0.54 0.04 0.00 0.00 177.00 177.55 1uap s VAL 123 N -1.13 2.88 -0.43 -0.36 0.11 -0.85 -1.97 120.40 118.65 1uap s VAL 123 Ca 0.45 -1.70 0.06 0.00 -2.93 0.00 0.00 61.98 57.87 1uap s VAL 123 Cb -0.33 -2.38 0.21 0.00 -1.53 0.00 0.00 36.38 32.35 1uap s VAL 123 CO 0.43 -0.04 0.55 -0.11 -3.33 0.00 0.00 175.10 172.60 1uap n LEU 124 N 0.34 -1.01 -4.64 2.54 -0.00 0.12 -3.03 117.00 111.32 1uap n LEU 124 Ca -0.13 -4.13 -0.29 0.00 -0.00 0.00 0.00 56.01 51.46 1uap n LEU 124 Cb 0.55 0.66 0.20 0.00 -0.00 0.00 0.00 43.42 44.82 1uap n LEU 124 CO 0.32 1.97 0.62 -2.16 -0.00 0.00 0.00 177.39 178.14 1uap s PRO 125 N -0.21 0.01 0.00 1.96 0.04 -1.26 -4.28 135.00 131.26 1uap s PRO 125 Ca 0.33 0.49 0.10 0.00 0.04 0.00 0.00 61.00 61.97 1uap s PRO 125 Cb 0.11 -1.69 0.44 0.00 0.04 0.00 0.00 34.50 33.41 1uap s PRO 125 CO -0.15 -3.01 1.32 -0.35 0.04 0.00 0.00 177.00 174.85 1uap n PRO 126 N -4.36 0.01 -0.45 0.56 -0.04 -1.26 -1.95 135.00 127.51 1uap n PRO 126 Ca 0.05 0.32 -0.04 0.00 -0.04 0.00 0.00 63.50 63.79 1uap n PRO 126 Cb 0.57 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.65 1uap n PRO 126 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1uap n GLU 127 N -1.49 2.05 -4.23 0.54 1.02 -1.26 -4.80 120.64 112.47 1uap n GLU 127 Ca 0.03 -1.28 -0.35 0.00 -0.02 0.00 0.00 57.16 55.54 1uap n GLU 127 Cb 0.12 -1.65 -0.09 0.00 -0.02 0.00 0.00 31.44 29.80 1uap n GLU 127 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1uap s SER 128 N -0.13 5.47 -0.38 1.62 0.01 -0.82 -4.94 113.70 114.53 1uap s SER 128 Ca 0.23 0.18 -0.26 0.00 1.31 0.00 0.00 55.95 57.41 1uap s SER 128 Cb 0.19 -1.67 0.02 0.00 0.21 0.00 0.00 66.02 64.76 1uap s SER 128 CO 0.06 0.34 0.92 0.12 0.41 0.00 0.00 173.24 175.08 1uap s PHE 129 N -0.64 3.06 -0.12 2.43 2.19 -0.68 -4.92 117.98 119.30 1uap s PHE 129 Ca 0.11 0.71 -0.02 0.00 0.33 0.00 0.00 56.93 58.06 1uap s PHE 129 Cb -0.12 -3.68 0.04 0.00 -1.31 0.00 0.00 43.02 37.95 1uap s PHE 129 CO 0.02 -0.86 -0.00 0.08 1.83 0.00 0.00 175.22 176.30 1uap s VAL 130 N 3.49 0.55 0.22 3.12 1.01 -1.26 -1.66 120.40 125.87 1uap s VAL 130 Ca 0.38 -0.18 -0.08 0.00 0.00 0.00 0.00 61.98 62.09 1uap s VAL 130 Cb -0.12 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 1uap s VAL 130 CO 0.20 0.12 0.32 0.68 0.00 0.00 0.00 175.10 176.41 1uap s VAL 131 N 1.88 0.01 0.32 2.92 -7.23 -1.14 -4.77 120.40 112.40 1uap s VAL 131 Ca 0.03 -1.63 -0.29 0.00 -1.81 0.00 0.00 61.98 58.28 1uap s VAL 131 Cb -0.14 -2.25 -0.11 0.00 0.56 0.00 0.00 36.38 34.44 1uap s VAL 131 CO -0.07 -0.05 1.42 -0.76 -0.31 0.00 0.00 175.10 175.33 1uap s LEU 132 N -3.06 4.38 0.12 1.32 1.43 -1.26 -0.47 118.68 121.14 1uap s LEU 132 Ca 0.28 2.82 -0.31 0.00 -1.03 0.00 0.00 54.13 55.88 1uap s LEU 132 Cb 0.03 -3.65 -0.09 0.00 0.03 0.00 0.00 46.19 42.51 1uap s LEU 132 CO 0.09 -0.71 1.58 -2.28 0.23 0.00 0.00 176.35 175.26 1uap s HIS 133 N -0.78 2.85 -0.00 0.29 5.65 -0.55 -4.58 115.29 118.16 1uap s HIS 133 Ca 0.54 0.55 -0.04 0.00 0.25 0.00 0.00 55.06 56.35 1uap s HIS 133 Cb -0.43 -3.92 -0.00 0.00 -1.18 0.00 0.00 32.58 27.05 1uap s HIS 133 CO 0.53 -3.48 0.08 1.03 -0.65 0.00 0.00 174.74 172.26 1uap s ARG 134 N 1.70 0.35 0.26 2.88 1.81 -1.26 -4.88 118.95 119.81 1uap s ARG 134 Ca 0.71 -0.35 -0.03 0.00 -1.72 0.00 0.00 55.73 54.33 1uap s ARG 134 Cb -0.42 0.14 0.32 0.00 -0.45 0.00 0.00 34.95 34.55 1uap s ARG 134 CO 0.31 -0.07 1.82 -1.00 -0.68 0.00 0.00 175.30 175.68 1uap h PRO 135 N 4.75 0.96 -0.32 3.54 0.13 -1.98 -1.01 132.00 138.07 1uap h PRO 135 Ca -0.30 -0.18 0.06 0.00 -0.87 0.00 0.00 66.00 64.71 1uap h PRO 135 Cb 1.20 -0.15 -0.05 0.00 0.13 0.00 0.00 31.00 32.12 1uap h PRO 135 CO 0.42 0.82 -0.03 -0.97 -0.23 0.00 0.00 178.00 178.01 1uap h ASN 136 N 0.94 -0.18 -0.38 1.44 -1.24 -2.00 -1.49 115.58 112.66 1uap h ASN 136 Ca 0.21 0.08 -0.06 0.00 0.71 0.00 0.00 56.30 57.24 1uap h ASN 136 Cb 0.25 0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.44 1uap h ASN 136 CO -0.01 -0.06 -0.01 1.56 -1.29 0.00 0.00 177.43 177.63 1uap h GLN 137 N 0.06 0.68 -0.31 6.67 4.20 -1.90 -2.65 115.11 121.86 1uap h GLN 137 Ca 0.15 -0.22 0.07 0.00 0.06 0.00 0.00 58.65 58.71 1uap h GLN 137 Cb 0.22 -0.06 -0.08 0.00 0.30 0.00 0.00 27.48 27.86 1uap h GLN 137 CO -0.28 0.78 -0.21 0.22 -0.67 0.00 0.00 178.83 178.68 1uap h ASP 138 N 0.50 -0.68 -0.21 1.46 3.58 -0.39 0.73 116.42 121.41 1uap h ASP 138 Ca 0.11 0.14 -0.00 0.00 0.42 0.00 0.00 57.03 57.69 1uap h ASP 138 Cb 0.48 0.34 -0.01 0.00 1.72 0.00 0.00 39.33 41.86 1uap h ASP 138 CO 0.02 -0.24 0.12 -0.61 -2.88 0.00 0.00 179.24 175.65 1uap h GLN 139 N -0.17 0.29 -0.13 0.28 4.15 -1.35 -1.99 115.11 116.19 1uap h GLN 139 Ca 0.16 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.55 1uap h GLN 139 Cb 0.42 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 1uap h GLN 139 CO -0.42 0.28 0.08 0.82 -1.93 0.00 0.00 178.83 177.66 1uap h ILE 140 N 0.23 1.07 -0.63 2.39 2.04 -0.94 0.25 117.51 121.92 1uap h ILE 140 Ca 0.07 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 1uap h ILE 140 Cb 0.07 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1uap h ILE 140 CO -0.01 0.06 0.20 -0.07 0.00 0.00 0.00 178.15 178.32 1uap h LEU 141 N 0.14 0.89 -0.30 1.44 3.38 -0.87 0.83 115.31 120.81 1uap h LEU 141 Ca 0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1uap h LEU 141 Cb 0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1uap h LEU 141 CO -0.01 0.84 0.17 0.74 0.09 0.00 0.00 178.44 180.27 1uap h THR 142 N 0.93 1.13 -0.69 0.22 2.02 -0.94 0.40 112.91 115.98 1uap h THR 142 Ca 0.21 -0.33 0.02 0.00 0.77 0.00 0.00 66.41 67.08 1uap h THR 142 Cb 0.27 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 1uap h THR 142 CO -0.01 0.13 0.44 0.78 0.37 0.00 0.00 175.52 177.23 1uap h ASN 143 N 0.37 0.74 0.38 4.18 2.35 -0.32 -1.68 115.58 121.60 1uap h ASN 143 Ca 0.11 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.81 1uap h ASN 143 Cb 0.06 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1uap h ASN 143 CO -0.02 0.53 -0.18 -0.07 -1.65 0.00 0.00 177.43 176.04 1uap h LEU 144 N 0.88 0.00 -0.32 1.61 3.38 -0.48 0.16 115.31 120.55 1uap h LEU 144 Ca 0.26 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.05 1uap h LEU 144 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1uap h LEU 144 CO -0.08 0.18 -0.56 -1.28 0.09 0.00 0.00 178.44 176.79 1uap h SER 145 N 0.00 0.93 0.32 -0.43 0.87 -0.01 -3.30 113.55 111.93 1uap h SER 145 Ca -0.00 -0.51 -0.02 0.00 -1.23 0.00 0.00 61.79 60.04 1uap h SER 145 Cb 0.42 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 1uap h SER 145 CO 0.02 1.30 -0.15 0.11 -0.53 0.00 0.00 176.83 177.58 1uap h LYS 146 N 0.64 -0.42 -7.24 2.24 1.57 -0.96 -3.46 116.57 108.94 1uap h LYS 146 Ca 0.01 0.03 -0.49 0.00 -1.87 0.00 0.00 60.65 58.33 1uap h LYS 146 Cb 1.16 0.09 0.19 0.00 0.08 0.00 0.00 32.23 33.76 1uap h LYS 146 CO 0.12 -0.10 0.17 1.03 -0.57 0.00 0.00 179.45 180.10 1uap s ARG 147 N -3.82 0.55 0.10 3.15 0.52 0.00 -5.05 118.95 114.41 1uap s ARG 147 Ca -0.12 1.24 0.01 0.00 -0.52 0.00 0.00 55.73 56.35 1uap s ARG 147 Cb 0.01 -1.70 -0.04 0.00 0.52 0.00 0.00 34.95 33.75 1uap s ARG 147 CO 0.42 -2.85 0.23 -1.59 0.02 0.00 0.00 175.30 171.52 1uap s LYS 148 N -4.64 3.39 0.72 3.54 -2.85 -1.26 -4.83 119.74 113.81 1uap s LYS 148 Ca 0.66 -0.53 -0.13 0.00 -1.00 0.00 0.00 55.97 54.97 1uap s LYS 148 Cb -0.23 -2.98 0.03 0.00 -2.06 0.00 0.00 37.83 32.60 1uap s LYS 148 CO 0.60 0.57 1.12 0.00 0.10 0.00 0.00 175.35 177.73 1uap s PRO 150 N -4.38 3.34 -0.38 0.00 0.04 -1.26 -4.86 135.00 127.50 1uap s PRO 150 Ca 0.66 -0.01 0.10 0.00 0.04 0.00 0.00 61.00 61.79 1uap s PRO 150 Cb -0.21 -4.10 0.31 0.00 0.04 0.00 0.00 34.50 30.54 1uap s PRO 150 CO 0.48 -1.94 0.65 -1.13 0.04 0.00 0.00 177.00 175.10 1uap n SER 151 N 8.97 0.53 -3.88 6.66 3.41 -1.26 -5.09 113.62 122.95 1uap n SER 151 Ca 0.06 -2.88 -0.11 0.00 -0.26 0.00 0.00 58.87 55.67 1uap n SER 151 Cb 0.49 -0.61 -0.13 0.00 -0.26 0.00 0.00 64.21 63.71 1uap n SER 151 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1uap s GLN 152 N -1.89 0.14 1.05 4.33 0.74 -1.26 -5.17 119.66 117.60 1uap s GLN 152 Ca 0.38 -0.11 -0.16 0.00 0.05 0.00 0.00 55.36 55.51 1uap s GLN 152 Cb 0.27 0.06 0.22 0.00 1.10 0.00 0.00 33.01 34.66 1uap s GLN 152 CO -0.09 -0.02 1.20 -1.25 -0.55 0.00 0.00 175.29 174.58 1uap s PRO 153 N -0.39 0.02 0.00 1.67 0.04 -1.26 -5.29 135.00 129.79 1uap s PRO 153 Ca -0.04 -0.14 0.10 0.00 0.04 0.00 0.00 61.00 60.96 1uap s PRO 153 Cb -0.03 -1.75 0.08 0.00 0.04 0.00 0.00 34.50 32.84 1uap s PRO 153 CO -0.00 -2.88 0.82 1.33 0.04 0.00 0.00 177.00 176.32