#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gyr n PRO 38 N 0.00 1.16 -0.49 0.00 -0.04 -1.26 -2.08 135.00 132.29 3gyr n PRO 38 Ca 0.00 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 63.88 3gyr n PRO 38 Cb 0.00 -2.01 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 3gyr n PRO 38 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gyr n GLY 39 N 2.34 0.75 3.87 0.55 0.00 -1.26 -5.08 105.19 106.36 3gyr n GLY 39 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 3gyr n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gyr s GLU 40 N -0.51 3.37 0.47 1.61 2.02 -0.88 -4.82 118.70 119.96 3gyr s GLU 40 Ca 0.00 -0.26 -0.22 0.00 0.02 0.00 0.00 54.97 54.51 3gyr s GLU 40 Cb 0.00 -3.09 -0.08 0.00 0.10 0.00 0.00 34.13 31.06 3gyr s GLU 40 CO 0.00 0.72 1.12 -0.51 0.02 0.00 0.00 175.26 176.61 3gyr s LEU 41 N -1.44 3.97 -0.25 1.80 1.43 -1.26 -4.93 118.68 118.00 3gyr s LEU 41 Ca 0.20 2.18 -0.21 0.00 -1.03 0.00 0.00 54.13 55.28 3gyr s LEU 41 Cb -0.12 -4.34 -0.02 0.00 0.03 0.00 0.00 46.19 41.74 3gyr s LEU 41 CO 0.11 -0.87 0.64 -0.89 0.23 0.00 0.00 176.35 175.56 3gyr s THR 42 N -1.67 4.98 0.54 5.49 2.01 -1.26 -5.03 115.64 120.70 3gyr s THR 42 Ca 0.65 1.15 -0.22 0.00 0.31 0.00 0.00 61.69 63.58 3gyr s THR 42 Cb -0.25 -3.94 -0.05 0.00 0.01 0.00 0.00 72.50 68.27 3gyr s THR 42 CO 0.30 0.03 1.31 -2.65 -0.69 0.00 0.00 174.62 172.92 3gyr n PRO 43 N 5.70 1.65 -2.91 4.92 -0.02 -1.26 -3.69 135.00 139.39 3gyr n PRO 43 Ca -0.00 0.61 -0.12 0.00 -2.02 0.00 0.00 63.50 61.97 3gyr n PRO 43 Cb 0.49 -2.52 0.03 0.00 -0.02 0.00 0.00 33.50 31.48 3gyr n PRO 43 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3gyr n PHE 44 N -0.99 -1.31 0.27 6.00 0.99 0.31 -4.91 117.46 117.82 3gyr n PHE 44 Ca 0.10 0.43 0.11 0.00 -0.00 0.00 0.00 57.45 58.09 3gyr n PHE 44 Cb 0.44 -2.96 -0.03 0.00 -1.00 0.00 0.00 39.48 35.94 3gyr n PHE 44 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3gyr n ALA 45 N -3.40 2.94 -2.68 4.37 0.00 -1.24 -4.71 120.51 115.79 3gyr n ALA 45 Ca -0.02 -0.37 -0.19 0.00 0.00 0.00 0.00 53.44 52.87 3gyr n ALA 45 Cb 0.54 -0.97 -0.12 0.00 0.00 0.00 0.00 19.45 18.90 3gyr n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gyr s ALA 46 N -3.33 1.25 0.58 0.00 0.00 -1.26 -4.94 121.76 114.06 3gyr s ALA 46 Ca -0.00 -1.02 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 3gyr s ALA 46 Cb 0.13 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 3gyr s ALA 46 CO 0.82 0.19 1.07 -1.25 0.00 0.00 0.00 175.76 176.59 3gyr s PRO 47 N -1.72 3.33 0.37 0.00 0.04 -1.26 -1.18 135.00 134.57 3gyr s PRO 47 Ca -0.01 1.29 -0.28 0.00 0.04 0.00 0.00 61.00 62.04 3gyr s PRO 47 Cb -0.10 -2.03 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 3gyr s PRO 47 CO 0.02 -0.81 1.36 -1.17 0.04 0.00 0.00 177.00 176.44 3gyr s LEU 48 N -4.33 4.34 0.32 -3.56 2.96 0.18 -4.66 118.68 113.93 3gyr s LEU 48 Ca 0.65 2.79 0.09 0.00 -0.22 0.00 0.00 54.13 57.44 3gyr s LEU 48 Cb -0.17 -3.72 -0.04 0.00 0.50 0.00 0.00 46.19 42.75 3gyr s LEU 48 CO 0.34 -0.73 0.07 0.42 -1.32 0.00 0.00 176.35 175.14 3gyr s THR 49 N -1.16 3.06 0.10 3.68 -4.23 -1.26 -4.95 115.64 110.88 3gyr s THR 49 Ca 0.52 -1.81 0.10 0.00 -1.18 0.00 0.00 61.69 59.31 3gyr s THR 49 Cb -0.41 -2.91 -0.04 0.00 1.34 0.00 0.00 72.50 70.48 3gyr s THR 49 CO 0.55 -0.24 -0.24 0.68 -0.54 0.00 0.00 174.62 174.83 3gyr s VAL 50 N -2.42 2.02 0.72 2.29 -7.23 -1.26 -4.76 120.40 109.76 3gyr s VAL 50 Ca 0.35 -1.60 -0.15 0.00 -1.81 0.00 0.00 61.98 58.77 3gyr s VAL 50 Cb -0.03 -1.79 0.03 0.00 0.56 0.00 0.00 36.38 35.15 3gyr s VAL 50 CO 0.21 0.08 1.19 -2.84 -0.31 0.00 0.00 175.10 173.44 3gyr s PRO 51 N -1.84 2.26 0.57 4.82 0.02 -1.26 -4.96 135.00 134.60 3gyr s PRO 51 Ca 0.11 1.71 -0.19 0.00 0.02 0.00 0.00 61.00 62.64 3gyr s PRO 51 Cb -0.10 -1.85 -0.05 0.00 0.02 0.00 0.00 34.50 32.52 3gyr s PRO 51 CO 0.05 -1.73 1.18 -1.25 -0.33 0.00 0.00 177.00 174.91 3gyr s PRO 52 N -3.92 3.16 0.05 5.54 0.04 -1.26 -4.50 135.00 134.11 3gyr s PRO 52 Ca 0.73 1.74 -0.23 0.00 0.04 0.00 0.00 61.00 63.29 3gyr s PRO 52 Cb -0.28 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.22 3gyr s PRO 52 CO 0.44 -1.03 0.69 0.08 0.04 0.00 0.00 177.00 177.22 3gyr s VAL 53 N -1.66 4.75 -0.13 -0.36 1.01 -1.26 -1.19 120.40 121.56 3gyr s VAL 53 Ca 0.75 1.47 0.02 0.00 0.00 0.00 0.00 61.98 64.22 3gyr s VAL 53 Cb -0.28 -4.04 0.01 0.00 0.00 0.00 0.00 36.38 32.08 3gyr s VAL 53 CO 0.31 0.42 -0.19 -0.22 0.00 0.00 0.00 175.10 175.41 3gyr s LEU 54 N -0.33 1.96 -0.47 3.92 2.96 0.13 -4.89 118.68 121.96 3gyr s LEU 54 Ca 0.35 -0.54 -0.05 0.00 -0.22 0.00 0.00 54.13 53.66 3gyr s LEU 54 Cb -0.20 -1.32 0.12 0.00 0.50 0.00 0.00 46.19 45.30 3gyr s LEU 54 CO 0.21 0.05 0.29 -0.13 -1.32 0.00 0.00 176.35 175.45 3gyr s ARG 55 N 0.93 2.27 0.13 1.98 0.52 -1.26 -0.66 118.95 122.85 3gyr s ARG 55 Ca -0.06 -1.90 0.07 0.00 -0.52 0.00 0.00 55.73 53.31 3gyr s ARG 55 Cb -0.15 -3.74 -0.16 0.00 0.52 0.00 0.00 34.95 31.42 3gyr s ARG 55 CO -0.03 -1.13 1.30 -1.00 0.02 0.00 0.00 175.30 174.46 3gyr h PRO 56 N 8.06 0.02 -6.20 3.54 0.13 -1.99 -3.47 132.00 132.09 3gyr h PRO 56 Ca -0.14 -0.03 -0.72 0.00 -0.87 0.00 0.00 66.00 64.25 3gyr h PRO 56 Cb 1.04 0.01 0.04 0.00 0.13 0.00 0.00 31.00 32.22 3gyr h PRO 56 CO 0.76 0.98 0.58 0.00 -0.23 0.00 0.00 178.00 180.08 3gyr n ALA 57 N -2.37 -0.95 -2.28 -0.56 0.00 -1.26 -4.90 120.51 108.20 3gyr n ALA 57 Ca -0.01 0.48 -0.15 0.00 0.00 0.00 0.00 53.44 53.77 3gyr n ALA 57 Cb 0.91 -2.09 -0.09 0.00 0.00 0.00 0.00 19.45 18.18 3gyr n ALA 57 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3gyr s SER 58 N 1.54 0.77 0.00 0.00 1.04 -1.26 -5.04 113.70 110.74 3gyr s SER 58 Ca 0.90 -1.53 0.29 0.00 0.48 0.00 0.00 55.95 56.10 3gyr s SER 58 Cb -1.04 0.46 1.30 0.00 0.10 0.00 0.00 66.02 66.84 3gyr s SER 58 CO 0.55 -0.95 1.92 0.47 0.98 0.00 0.00 173.24 176.22 3gyr n ASP 59 N -0.81 0.16 -4.13 7.02 8.00 -1.26 -4.24 116.55 121.29 3gyr n ASP 59 Ca 0.04 -0.09 -0.38 0.00 0.71 0.00 0.00 54.79 55.07 3gyr n ASP 59 Cb 0.64 -0.24 -0.09 0.00 -0.02 0.00 0.00 41.12 41.40 3gyr n ASP 59 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3gyr s GLU 60 N -2.69 2.48 0.58 -1.24 2.02 -1.26 -4.95 118.70 113.64 3gyr s GLU 60 Ca 0.23 -2.26 0.27 0.00 0.02 0.00 0.00 54.97 53.24 3gyr s GLU 60 Cb 0.20 -3.76 1.62 0.00 0.10 0.00 0.00 34.13 32.29 3gyr s GLU 60 CO 0.50 -1.16 2.13 -0.24 0.02 0.00 0.00 175.26 176.51 3gyr h VAL 61 N 5.61 0.56 0.00 2.63 3.04 -1.91 0.36 116.25 126.54 3gyr h VAL 61 Ca -0.06 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.63 3gyr h VAL 61 Cb 1.00 0.88 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 3gyr h VAL 61 CO 0.73 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 177.64 3gyr n THR 62 N -3.94 0.15 -3.10 3.17 -2.24 -1.26 -4.47 114.28 102.59 3gyr n THR 62 Ca 0.01 0.04 -0.44 0.00 -2.27 0.00 0.00 64.05 61.39 3gyr n THR 62 Cb 0.28 -0.60 -0.06 0.00 -2.10 0.00 0.00 70.33 67.85 3gyr n THR 62 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3gyr s ARG 63 N -2.55 3.13 0.42 -0.78 3.52 0.11 -5.04 118.95 117.76 3gyr s ARG 63 Ca 0.25 -0.88 -0.22 0.00 -0.13 0.00 0.00 55.73 54.76 3gyr s ARG 63 Cb 0.18 -4.12 -0.11 0.00 -1.56 0.00 0.00 34.95 29.34 3gyr s ARG 63 CO 0.40 -1.32 0.96 -1.21 -0.81 0.00 0.00 175.30 173.31 3gyr s GLU 64 N 2.85 4.24 -0.25 5.12 2.02 -1.26 -4.80 118.70 126.62 3gyr s GLU 64 Ca 0.17 1.18 -0.21 0.00 0.02 0.00 0.00 54.97 56.13 3gyr s GLU 64 Cb -0.19 -2.27 -0.02 0.00 0.10 0.00 0.00 34.13 31.75 3gyr s GLU 64 CO 0.12 -0.03 0.64 0.99 0.02 0.00 0.00 175.26 177.00 3gyr s THR 65 N -2.07 4.98 -0.23 3.63 2.01 -0.12 -4.91 115.64 118.93 3gyr s THR 65 Ca 0.61 1.16 -0.25 0.00 0.31 0.00 0.00 61.69 63.51 3gyr s THR 65 Cb -0.11 -3.94 -0.00 0.00 0.01 0.00 0.00 72.50 68.45 3gyr s THR 65 CO 0.15 0.03 0.87 -0.70 -0.69 0.00 0.00 174.62 174.28 3gyr s GLU 66 N 2.50 4.21 -0.36 4.92 2.12 -1.26 -0.04 118.70 130.78 3gyr s GLU 66 Ca 0.27 1.03 -0.08 0.00 0.36 0.00 0.00 54.97 56.54 3gyr s GLU 66 Cb -0.15 -3.63 0.05 0.00 0.26 0.00 0.00 34.13 30.65 3gyr s GLU 66 CO 0.08 -0.51 0.16 0.42 -0.54 0.00 0.00 175.26 174.88 3gyr s ILE 67 N 2.80 4.05 -0.23 -3.70 1.01 -0.43 -4.91 121.20 119.79 3gyr s ILE 67 Ca 0.37 -1.14 -0.16 0.00 0.00 0.00 0.00 60.65 59.72 3gyr s ILE 67 Cb -0.15 -3.33 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 3gyr s ILE 67 CO 0.08 -0.27 0.41 0.00 0.00 0.00 0.00 174.94 175.17 3gyr s ALA 68 N 1.44 3.56 0.08 9.38 0.00 -1.26 -0.97 121.76 133.99 3gyr s ALA 68 Ca 0.00 -0.61 -0.31 0.00 0.00 0.00 0.00 51.96 51.05 3gyr s ALA 68 Cb -0.20 -2.70 -0.07 0.00 0.00 0.00 0.00 23.12 20.15 3gyr s ALA 68 CO 0.03 -0.46 1.34 -0.51 0.00 0.00 0.00 175.76 176.16 3gyr s LEU 69 N 1.67 4.36 -0.05 0.00 1.02 0.02 0.14 118.68 125.84 3gyr s LEU 69 Ca 0.18 2.20 -0.05 0.00 0.02 0.00 0.00 54.13 56.49 3gyr s LEU 69 Cb -0.15 -3.58 0.02 0.00 0.02 0.00 0.00 46.19 42.49 3gyr s LEU 69 CO 0.09 -0.62 0.14 -0.13 0.02 0.00 0.00 176.35 175.85 3gyr s ARG 70 N 1.33 0.16 0.49 1.70 0.52 -0.42 -1.43 118.95 121.29 3gyr s ARG 70 Ca 0.63 0.21 -0.22 0.00 -0.52 0.00 0.00 55.73 55.83 3gyr s ARG 70 Cb -0.34 0.06 -0.08 0.00 0.52 0.00 0.00 34.95 35.11 3gyr s ARG 70 CO 0.29 -0.03 1.08 -2.30 0.02 0.00 0.00 175.30 174.36 3gyr n PRO 71 N 3.12 1.36 -3.68 3.54 -0.02 -1.26 -1.65 135.00 136.41 3gyr n PRO 71 Ca -0.14 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 61.70 3gyr n PRO 71 Cb 0.58 -2.19 -0.07 0.00 -0.02 0.00 0.00 33.50 31.80 3gyr n PRO 71 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3gyr s THR 72 N -1.34 0.05 -0.21 3.45 -1.32 0.14 -4.85 115.64 111.56 3gyr s THR 72 Ca 0.67 -0.41 -0.07 0.00 -1.21 0.00 0.00 61.69 60.67 3gyr s THR 72 Cb -0.49 -0.85 -0.03 0.00 -1.51 0.00 0.00 72.50 69.61 3gyr s THR 72 CO 0.54 -0.23 0.04 0.26 -2.21 0.00 0.00 174.62 173.02 3gyr s TRP 73 N -1.96 3.12 0.01 9.09 0.52 -1.26 -0.87 118.94 127.59 3gyr s TRP 73 Ca -0.09 -0.26 0.06 0.00 0.02 0.00 0.00 56.10 55.83 3gyr s TRP 73 Cb -0.02 -2.13 -0.03 0.00 -1.15 0.00 0.00 33.47 30.14 3gyr s TRP 73 CO 0.01 -0.15 -0.18 0.08 0.02 0.00 0.00 176.95 176.74 3gyr s VAL 74 N 1.00 2.79 -0.81 4.03 1.01 0.24 -4.85 120.40 123.82 3gyr s VAL 74 Ca 0.03 -1.05 -0.15 0.00 0.00 0.00 0.00 61.98 60.81 3gyr s VAL 74 Cb -0.14 -2.14 0.20 0.00 0.00 0.00 0.00 36.38 34.30 3gyr s VAL 74 CO 0.03 0.43 0.78 -0.60 0.00 0.00 0.00 175.10 175.73 3gyr s ARG 75 N -1.16 3.54 0.42 2.72 6.06 -1.26 -0.02 118.95 129.24 3gyr s ARG 75 Ca 0.13 -2.31 0.21 0.00 -2.50 0.00 0.00 55.73 51.26 3gyr s ARG 75 Cb -0.10 -4.46 1.17 0.00 0.06 0.00 0.00 34.95 31.61 3gyr s ARG 75 CO 0.03 -1.34 1.78 -0.07 -2.50 0.00 0.00 175.30 173.20 3gyr h LEU 76 N 8.16 0.38 -7.00 -0.88 3.38 -1.83 -3.46 115.31 114.06 3gyr h LEU 76 Ca 0.07 0.07 0.16 0.00 0.09 0.00 0.00 57.88 58.27 3gyr h LEU 76 Cb 1.05 0.01 -0.31 0.00 0.09 0.00 0.00 40.66 41.50 3gyr h LEU 76 CO 0.82 0.07 0.65 -2.28 0.09 0.00 0.00 178.44 177.79 3gyr s HIS 77 N -5.41 -0.25 0.54 1.13 5.04 -1.26 -1.31 115.29 113.77 3gyr s HIS 77 Ca -0.08 0.54 0.34 0.00 -1.54 0.00 0.00 55.06 54.32 3gyr s HIS 77 Cb 0.25 0.29 1.51 0.00 0.04 0.00 0.00 32.58 34.66 3gyr s HIS 77 CO 0.80 -0.12 1.85 -1.35 -2.34 0.00 0.00 174.74 173.58 3gyr h PRO 78 N 4.67 0.00 -0.07 2.88 0.11 -1.92 0.36 132.00 138.03 3gyr h PRO 78 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3gyr h PRO 78 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3gyr h PRO 78 CO 0.19 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.02 3gyr n GLN 79 N -4.20 1.32 -4.24 1.05 6.02 -1.26 -4.85 117.38 111.22 3gyr n GLN 79 Ca 0.21 -0.48 -0.24 0.00 -0.01 0.00 0.00 57.00 56.48 3gyr n GLN 79 Cb 1.07 -1.35 -0.07 0.00 1.02 0.00 0.00 30.24 30.92 3gyr n GLN 79 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3gyr s LEU 80 N -1.60 3.31 0.99 1.08 1.43 0.13 -5.05 118.68 118.95 3gyr s LEU 80 Ca 0.31 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.77 3gyr s LEU 80 Cb 0.15 -1.88 0.18 0.00 0.03 0.00 0.00 46.19 44.68 3gyr s LEU 80 CO 0.24 0.03 1.10 -2.16 0.23 0.00 0.00 176.35 175.80 3gyr s PRO 81 N -3.43 0.51 0.64 1.29 0.04 -1.26 -4.80 135.00 127.99 3gyr s PRO 81 Ca 0.30 0.44 -0.17 0.00 0.04 0.00 0.00 61.00 61.61 3gyr s PRO 81 Cb -0.08 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 32.70 3gyr s PRO 81 CO 0.20 -2.66 1.19 -2.14 0.04 0.00 0.00 177.00 173.63 3gyr s PRO 82 N -5.04 2.73 -0.17 0.56 0.02 -1.26 -4.68 135.00 127.15 3gyr s PRO 82 Ca 0.65 1.72 -0.01 0.00 0.02 0.00 0.00 61.00 63.38 3gyr s PRO 82 Cb -0.18 -1.91 -0.00 0.00 0.02 0.00 0.00 34.50 32.43 3gyr s PRO 82 CO 0.57 -1.37 -0.12 0.99 -0.33 0.00 0.00 177.00 176.73 3gyr s THR 83 N -1.85 2.86 0.08 0.99 2.01 0.97 -4.88 115.64 115.82 3gyr s THR 83 Ca 0.74 -0.69 -0.31 0.00 0.31 0.00 0.00 61.69 61.74 3gyr s THR 83 Cb -0.28 -2.24 -0.07 0.00 0.01 0.00 0.00 72.50 69.92 3gyr s THR 83 CO 0.38 0.49 1.42 -0.22 -0.69 0.00 0.00 174.62 176.00 3gyr s LEU 84 N 0.98 4.35 0.16 4.42 2.96 -1.26 -0.59 118.68 129.70 3gyr s LEU 84 Ca -0.02 2.28 0.00 0.00 -0.22 0.00 0.00 54.13 56.18 3gyr s LEU 84 Cb -0.15 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 3gyr s LEU 84 CO -0.02 -0.70 0.05 -0.04 -1.32 0.00 0.00 176.35 174.32 3gyr s MET 85 N 1.67 1.06 -0.19 1.98 -1.94 -0.05 -4.80 119.30 117.03 3gyr s MET 85 Ca 0.65 -1.52 -0.05 0.00 -1.71 0.00 0.00 55.69 53.07 3gyr s MET 85 Cb -0.36 0.03 -0.03 0.00 2.01 0.00 0.00 34.83 36.48 3gyr s MET 85 CO 0.29 -0.23 -0.01 -1.58 -0.01 0.00 0.00 175.02 173.49 3gyr s TRP 86 N -3.90 3.05 0.00 -0.03 0.51 0.16 -0.68 118.94 118.05 3gyr s TRP 86 Ca 0.27 -0.39 0.04 0.00 -2.12 0.00 0.00 56.10 53.89 3gyr s TRP 86 Cb 0.07 -2.05 -0.01 0.00 -0.81 0.00 0.00 33.47 30.66 3gyr s TRP 86 CO 0.04 -0.17 -0.12 0.20 -0.51 0.00 0.00 176.95 176.39 3gyr s GLY 87 N 0.81 0.62 0.18 0.98 0.00 -0.66 -3.02 107.32 106.24 3gyr s GLY 87 Ca 0.00 -0.58 -0.32 0.00 0.00 0.00 0.00 44.72 43.82 3gyr s GLY 87 CO 0.02 -0.51 1.63 -0.19 0.00 0.00 0.00 173.10 174.04 3gyr s TYR 88 N -0.42 3.00 -0.80 1.90 2.02 -1.20 -1.29 117.35 120.55 3gyr s TYR 88 Ca 0.04 0.52 0.00 0.00 -0.37 0.00 0.00 57.07 57.26 3gyr s TYR 88 Cb -0.05 -4.01 0.00 0.00 -0.40 0.00 0.00 41.96 37.50 3gyr s TYR 88 CO -0.00 -3.76 0.00 -0.25 -1.57 0.00 0.00 175.55 169.97 3gyr n ASP 89 N 3.93 -2.91 -1.56 2.29 8.00 0.38 -1.16 116.55 125.51 3gyr n ASP 89 Ca 0.14 0.27 -0.17 0.00 0.71 0.00 0.00 54.79 55.74 3gyr n ASP 89 Cb 0.37 -2.59 -0.05 0.00 -0.02 0.00 0.00 41.12 38.83 3gyr n ASP 89 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gyr n GLY 90 N -0.59 0.83 3.47 0.44 0.00 -0.41 -4.98 105.19 103.95 3gyr n GLY 90 Ca -0.10 -0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 3gyr n GLY 90 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gyr s GLN 91 N -4.03 2.21 -0.12 1.61 -1.52 -0.31 -4.85 119.66 112.66 3gyr s GLN 91 Ca 0.00 -0.89 -0.01 0.00 -1.95 0.00 0.00 55.36 52.51 3gyr s GLN 91 Cb 0.00 -2.25 0.03 0.00 -0.22 0.00 0.00 33.01 30.57 3gyr s GLN 91 CO 0.00 0.56 -0.05 0.08 -0.25 0.00 0.00 175.29 175.64 3gyr s VAL 92 N -0.88 0.89 1.01 1.09 1.01 -1.26 -2.81 120.40 119.45 3gyr s VAL 92 Ca 0.14 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.70 3gyr s VAL 92 Cb -0.11 -1.00 0.20 0.00 0.00 0.00 0.00 36.38 35.47 3gyr s VAL 92 CO 0.04 0.25 1.09 -2.84 0.00 0.00 0.00 175.10 173.65 3gyr s PRO 93 N 1.75 0.28 1.27 2.72 0.02 -1.26 -4.21 135.00 135.57 3gyr s PRO 93 Ca 0.04 1.20 -0.18 0.00 0.02 0.00 0.00 61.00 62.08 3gyr s PRO 93 Cb -0.13 -1.67 0.29 0.00 0.02 0.00 0.00 34.50 33.01 3gyr s PRO 93 CO -0.07 -3.02 0.75 0.41 -0.33 0.00 0.00 177.00 174.73 3gyr n GLY 94 N 0.30 -2.88 3.75 0.52 0.00 0.35 -4.81 105.19 102.42 3gyr n GLY 94 Ca 0.08 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.43 3gyr n GLY 94 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gyr s PRO 95 N -4.40 3.09 -0.43 1.61 0.02 -1.26 -4.57 135.00 129.06 3gyr s PRO 95 Ca 0.63 2.06 -0.29 0.00 0.02 0.00 0.00 61.00 63.42 3gyr s PRO 95 Cb -0.17 -2.14 0.03 0.00 0.02 0.00 0.00 34.50 32.24 3gyr s PRO 95 CO 0.59 -1.18 1.12 0.99 -0.33 0.00 0.00 177.00 178.20 3gyr s THR 96 N -1.41 4.29 0.09 0.99 2.01 -0.33 -4.29 115.64 116.99 3gyr s THR 96 Ca 0.74 1.37 -0.29 0.00 0.31 0.00 0.00 61.69 63.82 3gyr s THR 96 Cb -0.36 -4.55 -0.06 0.00 0.01 0.00 0.00 72.50 67.54 3gyr s THR 96 CO 0.42 -0.86 0.91 -0.63 -0.69 0.00 0.00 174.62 173.76 3gyr s ILE 97 N 4.23 4.58 -0.10 1.82 1.01 -0.76 0.17 121.20 132.16 3gyr s ILE 97 Ca 0.47 1.96 0.01 0.00 0.00 0.00 0.00 60.65 63.09 3gyr s ILE 97 Cb -0.08 -4.27 0.02 0.00 0.01 0.00 0.00 42.46 38.13 3gyr s ILE 97 CO 0.27 0.32 -0.12 -0.70 0.00 0.00 0.00 174.94 174.71 3gyr s GLU 98 N 0.05 1.86 0.21 2.79 2.12 0.17 0.30 118.70 126.20 3gyr s GLU 98 Ca 0.45 -0.42 0.02 0.00 0.36 0.00 0.00 54.97 55.37 3gyr s GLU 98 Cb -0.22 -1.66 -0.05 0.00 0.26 0.00 0.00 34.13 32.45 3gyr s GLU 98 CO 0.28 -0.11 0.04 0.14 -0.54 0.00 0.00 175.26 175.08 3gyr s VAL 99 N 1.13 0.62 0.07 3.70 -7.23 -0.19 -4.36 120.40 114.14 3gyr s VAL 99 Ca -0.05 -1.99 0.04 0.00 -1.81 0.00 0.00 61.98 58.17 3gyr s VAL 99 Cb -0.14 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 3gyr s VAL 99 CO -0.03 -0.26 -0.00 -0.13 -0.31 0.00 0.00 175.10 174.37 3gyr s ARG 100 N -3.97 2.60 -0.03 4.82 0.52 -1.26 -0.04 118.95 121.58 3gyr s ARG 100 Ca 0.30 -0.79 -0.39 0.00 -0.52 0.00 0.00 55.73 54.34 3gyr s ARG 100 Cb 0.07 -2.57 -0.17 0.00 0.52 0.00 0.00 34.95 32.80 3gyr s ARG 100 CO 0.08 0.56 1.38 -2.13 0.02 0.00 0.00 175.30 175.21 3gyr n ARG 101 N 0.77 0.86 -0.33 3.54 0.63 0.97 -1.22 116.66 121.89 3gyr n ARG 101 Ca -0.12 0.31 0.00 0.00 -0.92 0.00 0.00 57.85 57.13 3gyr n ARG 101 Cb 0.52 -1.93 0.00 0.00 0.45 0.00 0.00 32.46 31.50 3gyr n ARG 101 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3gyr n GLY 102 N 2.71 0.91 3.54 5.14 0.00 0.14 -4.98 105.19 112.65 3gyr n GLY 102 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 3gyr n GLY 102 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gyr s GLN 103 N -0.54 3.37 -0.02 1.61 -0.21 -0.35 -4.95 119.66 118.56 3gyr s GLN 103 Ca 0.00 -0.14 -0.30 0.00 0.02 0.00 0.00 55.36 54.94 3gyr s GLN 103 Cb 0.00 -4.05 -0.06 0.00 1.00 0.00 0.00 33.01 29.90 3gyr s GLN 103 CO 0.00 -1.58 1.60 0.50 -2.12 0.00 0.00 175.29 173.70 3gyr s ARG 104 N 4.30 4.20 0.09 2.91 3.52 -1.24 -4.53 118.95 128.20 3gyr s ARG 104 Ca 0.34 2.17 0.07 0.00 -0.13 0.00 0.00 55.73 58.18 3gyr s ARG 104 Cb -0.11 -3.82 -0.03 0.00 -1.56 0.00 0.00 34.95 29.42 3gyr s ARG 104 CO 0.20 -0.77 -0.19 0.14 -0.81 0.00 0.00 175.30 173.87 3gyr s VAL 105 N 3.44 1.56 -0.12 7.11 -7.23 -0.31 -4.77 120.40 120.07 3gyr s VAL 105 Ca 0.71 -1.48 0.03 0.00 -1.81 0.00 0.00 61.98 59.44 3gyr s VAL 105 Cb -0.34 -1.43 0.01 0.00 0.56 0.00 0.00 36.38 35.18 3gyr s VAL 105 CO 0.29 -0.10 -0.22 -0.13 -0.31 0.00 0.00 175.10 174.63 3gyr s ARG 106 N -1.86 2.89 -0.05 4.82 0.52 -1.26 -0.54 118.95 123.48 3gyr s ARG 106 Ca 0.04 -0.82 0.06 0.00 -0.52 0.00 0.00 55.73 54.50 3gyr s ARG 106 Cb -0.10 -2.28 -0.02 0.00 0.52 0.00 0.00 34.95 33.07 3gyr s ARG 106 CO 0.04 0.06 -0.24 0.42 0.02 0.00 0.00 175.30 175.59 3gyr s ILE 107 N 0.64 2.17 -0.46 1.52 1.01 -0.26 -0.94 121.20 124.89 3gyr s ILE 107 Ca -0.12 -1.04 -0.10 0.00 0.00 0.00 0.00 60.65 59.39 3gyr s ILE 107 Cb -0.16 -1.78 0.10 0.00 0.01 0.00 0.00 42.46 40.62 3gyr s ILE 107 CO 0.03 0.57 0.33 0.00 0.00 0.00 0.00 174.94 175.87 3gyr s ALA 108 N -0.36 3.39 -0.65 9.38 0.00 0.94 -1.16 121.76 133.29 3gyr s ALA 108 Ca 0.02 -2.35 -0.27 0.00 0.00 0.00 0.00 51.96 49.36 3gyr s ALA 108 Cb -0.12 -2.81 0.02 0.00 0.00 0.00 0.00 23.12 20.21 3gyr s ALA 108 CO 0.02 -1.80 1.41 -1.58 0.00 0.00 0.00 175.76 173.81 3gyr s TRP 109 N 1.43 2.20 -0.23 0.00 0.52 0.18 -1.32 118.94 121.73 3gyr s TRP 109 Ca 0.04 0.28 -0.03 0.00 0.02 0.00 0.00 56.10 56.41 3gyr s TRP 109 Cb -0.25 -4.46 0.01 0.00 -1.15 0.00 0.00 33.47 27.61 3gyr s TRP 109 CO 0.01 -2.05 -0.06 0.99 0.02 0.00 0.00 176.95 175.86 3gyr s THR 110 N 6.33 3.07 -0.55 2.01 2.01 -0.14 -0.80 115.64 127.57 3gyr s THR 110 Ca 0.46 -0.73 -0.28 0.00 0.31 0.00 0.00 61.69 61.45 3gyr s THR 110 Cb -0.10 -2.45 0.02 0.00 0.01 0.00 0.00 72.50 69.99 3gyr s THR 110 CO 0.20 0.35 1.37 0.21 -0.69 0.00 0.00 174.62 176.06 3gyr s ASN 111 N 1.41 6.21 -0.34 3.53 3.84 -0.74 -0.80 114.94 128.05 3gyr s ASN 111 Ca 0.04 0.31 0.07 0.00 0.21 0.00 0.00 52.86 53.49 3gyr s ASN 111 Cb -0.15 -2.55 0.47 0.00 -0.55 0.00 0.00 41.25 38.48 3gyr s ASN 111 CO -0.05 -1.63 1.42 0.54 -2.79 0.00 0.00 177.10 174.59 3gyr n ARG 112 N 8.55 2.65 -3.23 0.43 5.12 -0.52 0.05 116.66 129.72 3gyr n ARG 112 Ca 0.12 -3.61 -0.43 0.00 -1.93 0.00 0.00 57.85 52.00 3gyr n ARG 112 Cb 0.49 -2.05 -0.08 0.00 -1.16 0.00 0.00 32.46 29.66 3gyr n ARG 112 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3gyr s ILE 113 N -4.03 4.98 0.34 0.55 1.01 -1.19 -4.63 121.20 118.23 3gyr s ILE 113 Ca 0.50 -0.09 -0.28 0.00 0.00 0.00 0.00 60.65 60.77 3gyr s ILE 113 Cb 0.42 -4.10 -0.12 0.00 0.01 0.00 0.00 42.46 38.67 3gyr s ILE 113 CO 0.01 -0.47 1.29 -2.65 0.00 0.00 0.00 174.94 173.12 3gyr n PRO 114 N 5.88 2.11 -1.51 2.79 -0.02 -1.26 -4.54 135.00 138.45 3gyr n PRO 114 Ca -0.05 0.74 -0.41 0.00 -2.02 0.00 0.00 63.50 61.76 3gyr n PRO 114 Cb 0.48 -2.32 0.01 0.00 -0.02 0.00 0.00 33.50 31.65 3gyr n PRO 114 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3gyr n LYS 115 N 0.60 0.82 -0.93 -0.52 5.02 -1.26 -2.09 118.16 119.80 3gyr n LYS 115 Ca 0.05 0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.64 3gyr n LYS 115 Cb 0.36 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 3gyr n LYS 115 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gyr n GLY 116 N 1.58 0.84 3.76 0.72 0.00 -1.26 -5.02 105.19 105.81 3gyr n GLY 116 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3gyr n GLY 116 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3gyr n SER 117 N -0.00 3.32 -4.75 1.61 7.64 -0.89 -4.94 113.62 115.61 3gyr n SER 117 Ca 0.00 1.13 -0.41 0.00 1.01 0.00 0.00 58.87 60.60 3gyr n SER 117 Cb 0.00 -1.60 -0.02 0.00 -1.01 0.00 0.00 64.21 61.58 3gyr n SER 117 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3gyr s GLU 118 N -2.38 4.22 -0.03 1.43 2.12 -1.26 -4.94 118.70 117.86 3gyr s GLU 118 Ca 0.60 2.38 -0.30 0.00 0.36 0.00 0.00 54.97 58.01 3gyr s GLU 118 Cb -0.46 -3.08 -0.05 0.00 0.26 0.00 0.00 34.13 30.80 3gyr s GLU 118 CO 0.58 -0.48 1.43 -0.47 -0.54 0.00 0.00 175.26 175.78 3gyr s TYR 119 N -0.00 2.69 0.07 5.30 5.04 -1.26 -4.92 117.35 124.26 3gyr s TYR 119 Ca 0.60 0.73 0.33 0.00 -2.44 0.00 0.00 57.07 56.30 3gyr s TYR 119 Cb -0.44 -3.69 1.42 0.00 0.35 0.00 0.00 41.96 39.60 3gyr s TYR 119 CO 0.45 -2.60 1.98 -1.35 -1.34 0.00 0.00 175.55 172.69 3gyr h PRO 120 N 8.20 0.00 -5.07 4.97 0.11 -1.93 -3.42 132.00 134.86 3gyr h PRO 120 Ca -0.36 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.09 3gyr h PRO 120 Cb 1.17 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.99 3gyr h PRO 120 CO 0.92 0.00 -0.75 0.08 -0.21 0.00 0.00 178.00 178.05 3gyr s VAL 121 N -3.66 3.16 -0.04 3.15 1.01 -1.26 -4.04 120.40 118.72 3gyr s VAL 121 Ca 0.01 -0.58 -0.25 0.00 0.00 0.00 0.00 61.98 61.17 3gyr s VAL 121 Cb 0.09 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3gyr s VAL 121 CO 0.50 0.46 0.75 -0.89 0.00 0.00 0.00 175.10 175.92 3gyr s THR 122 N 1.21 4.97 -0.13 3.92 2.01 -0.05 -4.76 115.64 122.81 3gyr s THR 122 Ca 0.02 1.56 -0.01 0.00 0.31 0.00 0.00 61.69 63.58 3gyr s THR 122 Cb -0.14 -4.09 -0.02 0.00 0.01 0.00 0.00 72.50 68.26 3gyr s THR 122 CO -0.03 0.26 -0.10 -0.55 -0.69 0.00 0.00 174.62 173.51 3gyr s SER 123 N 0.69 4.27 0.05 3.53 0.15 -1.26 -0.47 113.70 120.66 3gyr s SER 123 Ca 0.40 -0.24 0.02 0.00 0.70 0.00 0.00 55.95 56.82 3gyr s SER 123 Cb -0.19 -1.59 -0.03 0.00 -1.71 0.00 0.00 66.02 62.51 3gyr s SER 123 CO 0.20 0.19 -0.08 0.68 1.20 0.00 0.00 173.24 175.44 3gyr s VAL 124 N 0.21 0.58 -0.18 4.45 -7.23 -0.66 0.14 120.40 117.71 3gyr s VAL 124 Ca -0.06 -1.24 -0.00 0.00 -1.81 0.00 0.00 61.98 58.86 3gyr s VAL 124 Cb -0.15 -0.81 0.01 0.00 0.56 0.00 0.00 36.38 35.98 3gyr s VAL 124 CO 0.04 -0.47 -0.15 -1.61 -0.31 0.00 0.00 175.10 172.61 3gyr s GLU 125 N -1.99 3.14 0.25 4.82 2.02 -1.26 -2.12 118.70 123.56 3gyr s GLU 125 Ca -0.06 -0.76 0.07 0.00 0.02 0.00 0.00 54.97 54.24 3gyr s GLU 125 Cb -0.07 -2.68 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 3gyr s GLU 125 CO -0.00 -0.14 0.20 0.14 0.02 0.00 0.00 175.26 175.48 3gyr s VAL 126 N 1.19 4.49 0.70 2.63 -7.23 -0.19 -4.86 120.40 117.11 3gyr s VAL 126 Ca 0.02 -1.38 -0.12 0.00 -1.81 0.00 0.00 61.98 58.69 3gyr s VAL 126 Cb -0.14 -3.42 0.01 0.00 0.56 0.00 0.00 36.38 33.39 3gyr s VAL 126 CO -0.07 -0.35 1.07 -2.84 -0.31 0.00 0.00 175.10 172.61 3gyr s PRO 127 N -3.84 2.81 0.36 4.82 0.02 -1.26 0.33 135.00 138.24 3gyr s PRO 127 Ca 0.33 1.07 0.13 0.00 0.02 0.00 0.00 61.00 62.54 3gyr s PRO 127 Cb -0.08 -1.97 0.94 0.00 0.02 0.00 0.00 34.50 33.41 3gyr s PRO 127 CO 0.25 -1.20 1.79 -0.07 -0.33 0.00 0.00 177.00 177.44 3gyr h LEU 128 N -0.62 0.59 -0.21 -5.54 3.38 -1.94 -3.45 115.31 107.52 3gyr h LEU 128 Ca -0.44 0.08 0.20 0.00 0.09 0.00 0.00 57.88 57.81 3gyr h LEU 128 Cb 1.22 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.88 3gyr h LEU 128 CO 0.55 0.18 -0.43 0.61 0.09 0.00 0.00 178.44 179.45 3gyr n GLY 129 N -1.42 -2.13 3.74 0.83 0.00 -1.26 -4.61 105.19 100.35 3gyr n GLY 129 Ca 0.23 -1.30 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 3gyr n GLY 129 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gyr s PRO 130 N -2.40 4.59 0.77 1.61 0.05 -1.26 -4.98 135.00 133.38 3gyr s PRO 130 Ca 0.00 1.77 -0.12 0.00 0.05 0.00 0.00 61.00 62.70 3gyr s PRO 130 Cb 0.00 -3.25 0.06 0.00 0.05 0.00 0.00 34.50 31.36 3gyr s PRO 130 CO 0.00 0.08 1.12 -1.25 0.05 0.00 0.00 177.00 177.00 3gyr s PRO 131 N -0.62 2.12 -0.77 0.56 0.04 -1.26 -2.59 135.00 132.48 3gyr s PRO 131 Ca 0.49 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.91 3gyr s PRO 131 Cb -0.31 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.37 3gyr s PRO 131 CO 0.37 -1.78 0.00 0.41 0.04 0.00 0.00 177.00 176.04 3gyr n GLY 132 N -0.54 0.69 3.62 0.56 0.00 -1.26 -4.99 105.19 103.26 3gyr n GLY 132 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 3gyr n GLY 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gyr s THR 133 N -1.52 3.39 0.03 2.61 -4.23 -1.07 -5.08 115.64 109.76 3gyr s THR 133 Ca 0.00 -1.72 -0.33 0.00 -1.18 0.00 0.00 61.69 58.46 3gyr s THR 133 Cb 0.00 -2.74 -0.12 0.00 1.34 0.00 0.00 72.50 70.98 3gyr s THR 133 CO 0.00 -0.22 1.80 -2.65 -0.54 0.00 0.00 174.62 173.01 3gyr n PRO 134 N -0.37 2.34 -1.20 3.99 -0.02 -1.26 -4.90 135.00 133.58 3gyr n PRO 134 Ca -0.09 0.85 -0.37 0.00 -2.02 0.00 0.00 63.50 61.87 3gyr n PRO 134 Cb 0.57 -2.69 0.03 0.00 -0.02 0.00 0.00 33.50 31.39 3gyr n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr n ALA 135 N 5.67 -3.18 0.26 3.55 0.00 -1.26 -4.86 120.51 120.69 3gyr n ALA 135 Ca 0.20 -0.26 0.14 0.00 0.00 0.00 0.00 53.44 53.53 3gyr n ALA 135 Cb 0.32 -1.48 0.83 0.00 0.00 0.00 0.00 19.45 19.11 3gyr n ALA 135 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3gyr h PRO 136 N -0.35 0.00 0.00 0.00 0.11 -1.89 -2.36 132.00 127.52 3gyr h PRO 136 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3gyr h PRO 136 Cb 1.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.49 3gyr h PRO 136 CO 0.38 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.44 3gyr n ASN 137 N -4.01 0.00 -0.82 -2.05 0.23 -1.26 -1.65 115.26 105.71 3gyr n ASN 137 Ca -0.01 -1.54 0.12 0.00 -0.53 0.00 0.00 54.58 52.62 3gyr n ASN 137 Cb 0.16 0.00 0.08 0.00 -2.08 0.00 0.00 39.78 37.94 3gyr n ASN 137 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 3gyr n THR 138 N -0.56 0.00 -4.26 5.53 -1.04 -0.89 -4.00 114.28 109.07 3gyr n THR 138 Ca 0.02 -0.43 -0.19 0.00 -2.04 0.00 0.00 64.05 61.42 3gyr n THR 138 Cb 0.01 1.41 -0.13 0.00 -1.82 0.00 0.00 70.33 69.80 3gyr n THR 138 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3gyr s GLU 139 N -2.14 0.84 1.04 -2.82 2.02 -0.66 -4.79 118.70 112.20 3gyr s GLU 139 Ca 0.25 -0.80 -0.14 0.00 0.02 0.00 0.00 54.97 54.30 3gyr s GLU 139 Cb 0.19 -0.82 0.21 0.00 0.10 0.00 0.00 34.13 33.81 3gyr s GLU 139 CO 0.38 0.19 1.11 -1.25 0.02 0.00 0.00 175.26 175.71 3gyr s PRO 140 N -1.34 0.05 0.00 0.39 0.04 -1.26 -4.93 135.00 127.95 3gyr s PRO 140 Ca -0.01 0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.31 3gyr s PRO 140 Cb -0.09 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.74 3gyr s PRO 140 CO 0.01 -2.93 0.00 0.41 0.04 0.00 0.00 177.00 174.53 3gyr n GLY 141 N -1.31 -1.30 0.90 0.56 0.00 -0.29 -4.75 105.19 98.99 3gyr n GLY 141 Ca 0.08 -1.59 0.12 0.00 0.00 0.00 0.00 46.02 44.63 3gyr n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gyr n ARG 142 N -1.27 2.21 0.00 1.61 1.74 -1.26 -4.93 116.66 114.75 3gyr n ARG 142 Ca 0.00 -1.79 0.00 0.00 -0.77 0.00 0.00 57.85 55.29 3gyr n ARG 142 Cb 0.00 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 3gyr n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gyr n GLY 143 N 1.35 2.33 0.02 -0.13 0.00 -1.26 -1.76 105.19 105.74 3gyr n GLY 143 Ca 0.17 0.05 0.01 0.00 0.00 0.00 0.00 46.02 46.25 3gyr n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 144 N 0.00 1.96 3.72 -0.02 0.00 -1.26 -5.07 105.19 104.53 3gyr n GLY 144 Ca 0.00 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 3gyr n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gyr s VAL 145 N -0.97 3.91 0.34 1.61 1.01 -0.72 -4.99 120.40 120.58 3gyr s VAL 145 Ca 0.03 1.45 -0.29 0.00 0.00 0.00 0.00 61.98 63.18 3gyr s VAL 145 Cb 0.03 -3.93 -0.11 0.00 0.00 0.00 0.00 36.38 32.36 3gyr s VAL 145 CO 0.00 0.16 1.52 -0.62 0.00 0.00 0.00 175.10 176.16 3gyr n GLU 146 N 3.38 2.64 -1.73 2.72 -0.58 -1.26 -4.89 120.64 120.93 3gyr n GLU 146 Ca 0.07 0.93 -0.40 0.00 -0.42 0.00 0.00 57.16 57.34 3gyr n GLU 146 Cb 0.46 -2.67 0.02 0.00 -0.57 0.00 0.00 31.44 28.68 3gyr n GLU 146 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 3gyr n PRO 147 N 1.11 1.96 -1.67 3.49 -0.02 -1.26 -4.82 135.00 133.79 3gyr n PRO 147 Ca 0.04 0.70 -0.42 0.00 -2.02 0.00 0.00 63.50 61.80 3gyr n PRO 147 Cb 0.38 -2.49 -0.03 0.00 -0.02 0.00 0.00 33.50 31.34 3gyr n PRO 147 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3gyr n ASN 148 N -0.16 4.11 0.11 2.55 2.85 0.12 -4.89 115.26 119.94 3gyr n ASN 148 Ca 0.07 0.93 -0.03 0.00 -0.11 0.00 0.00 54.58 55.44 3gyr n ASN 148 Cb 0.41 -1.53 0.06 0.00 1.24 0.00 0.00 39.78 39.97 3gyr n ASN 148 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 3gyr h LYS 149 N 9.91 0.00 -0.35 1.20 6.56 -1.91 -2.55 116.57 129.43 3gyr h LYS 149 Ca -0.49 0.00 -0.11 0.00 -1.06 0.00 0.00 60.65 59.00 3gyr h LYS 149 Cb 1.24 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.89 3gyr h LYS 149 CO 0.94 0.75 -0.20 -0.44 -2.06 0.00 0.00 179.45 178.45 3gyr h ASP 150 N 0.00 0.78 -0.11 0.86 3.45 -1.98 -0.98 116.42 118.44 3gyr h ASP 150 Ca -0.01 -0.42 0.01 0.00 0.43 0.00 0.00 57.03 57.04 3gyr h ASP 150 Cb 1.36 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.90 3gyr h ASP 150 CO 0.10 1.03 0.04 0.58 -1.57 0.00 0.00 179.24 179.41 3gyr h VAL 151 N 0.53 0.98 0.00 -1.35 2.07 -1.94 -3.03 116.25 113.50 3gyr h VAL 151 Ca 0.07 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.56 3gyr h VAL 151 Cb 0.75 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 3gyr h VAL 151 CO 0.06 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.66 3gyr h ALA 152 N 1.07 1.00 -0.03 1.67 0.00 -1.18 -0.94 119.26 120.85 3gyr h ALA 152 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3gyr h ALA 152 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3gyr h ALA 152 CO -0.05 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.20 3gyr n ALA 153 N -1.98 2.55 -1.86 0.00 0.00 -0.40 -4.42 120.51 114.41 3gyr n ALA 153 Ca -0.01 -0.50 -0.42 0.00 0.00 0.00 0.00 53.44 52.52 3gyr n ALA 153 Cb 0.18 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 3gyr n ALA 153 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gyr s LEU 154 N -1.97 4.37 0.68 0.00 1.43 -0.36 -5.02 118.68 117.82 3gyr s LEU 154 Ca 0.36 2.72 -0.06 0.00 -1.03 0.00 0.00 54.13 56.12 3gyr s LEU 154 Cb 0.21 -3.60 0.05 0.00 0.03 0.00 0.00 46.19 42.88 3gyr s LEU 154 CO 0.32 -0.87 0.99 -2.16 0.23 0.00 0.00 176.35 174.87 3gyr s PRO 155 N 0.95 2.31 -0.25 1.29 0.04 -1.26 -4.64 135.00 133.45 3gyr s PRO 155 Ca 0.70 -0.23 -0.29 0.00 0.04 0.00 0.00 61.00 61.22 3gyr s PRO 155 Cb -0.46 -2.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.86 3gyr s PRO 155 CO 0.33 -1.15 1.77 0.00 0.04 0.00 0.00 177.00 177.99 3gyr s ALA 156 N -3.20 3.08 -0.28 8.56 0.00 -1.26 -4.93 121.76 123.74 3gyr s ALA 156 Ca 0.59 0.47 -0.00 0.00 0.00 0.00 0.00 51.96 53.02 3gyr s ALA 156 Cb -0.11 -3.94 0.14 0.00 0.00 0.00 0.00 23.12 19.21 3gyr s ALA 156 CO 0.45 -2.27 0.32 -0.46 0.00 0.00 0.00 175.76 173.79 3gyr s TRP 157 N 6.11 -0.58 0.00 0.00 -0.00 -1.26 -4.04 118.94 119.18 3gyr s TRP 157 Ca 0.79 0.04 0.01 0.00 -0.00 0.00 0.00 56.10 56.93 3gyr s TRP 157 Cb -0.26 -0.36 -0.01 0.00 -0.00 0.00 0.00 33.47 32.85 3gyr s TRP 157 CO 0.32 -0.89 -0.04 0.45 -0.00 0.00 0.00 176.95 176.80 3gyr s SER 158 N 2.41 0.44 -0.00 5.86 0.15 -1.03 -4.78 113.70 116.74 3gyr s SER 158 Ca 0.09 -0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.62 3gyr s SER 158 Cb -0.14 -0.03 -0.00 0.00 -1.71 0.00 0.00 66.02 64.14 3gyr s SER 158 CO -0.29 -0.01 -0.05 0.54 1.20 0.00 0.00 173.24 174.63 3gyr s VAL 159 N -0.31 0.39 -0.10 4.45 0.11 -1.26 -1.12 120.40 122.55 3gyr s VAL 159 Ca -0.01 -0.21 0.00 0.00 -2.93 0.00 0.00 61.98 58.83 3gyr s VAL 159 Cb -0.03 -0.33 -0.02 0.00 -1.53 0.00 0.00 36.38 34.47 3gyr s VAL 159 CO -0.00 0.11 -0.09 -0.89 -3.33 0.00 0.00 175.10 170.90 3gyr s THR 160 N -0.11 3.43 -0.11 5.04 2.01 -1.26 0.14 115.64 124.79 3gyr s THR 160 Ca 0.02 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 61.49 3gyr s THR 160 Cb -0.02 -2.43 0.01 0.00 0.01 0.00 0.00 72.50 70.07 3gyr s THR 160 CO -0.00 0.55 -0.20 -2.28 -0.69 0.00 0.00 174.62 172.00 3gyr s HIS 161 N -0.18 2.38 -0.72 4.92 5.04 -0.66 -3.90 115.29 122.17 3gyr s HIS 161 Ca 0.01 -1.10 -0.21 0.00 -1.54 0.00 0.00 55.06 52.22 3gyr s HIS 161 Cb -0.13 -1.63 0.09 0.00 0.04 0.00 0.00 32.58 30.94 3gyr s HIS 161 CO 0.03 -0.50 0.97 -1.17 -2.34 0.00 0.00 174.74 171.73 3gyr s LEU 162 N 0.70 4.70 -0.07 8.88 2.96 -1.26 -2.20 118.68 132.38 3gyr s LEU 162 Ca -0.11 -1.31 -0.30 0.00 -0.22 0.00 0.00 54.13 52.19 3gyr s LEU 162 Cb -0.16 -2.40 -0.05 0.00 0.50 0.00 0.00 46.19 44.08 3gyr s LEU 162 CO 0.02 -1.30 1.63 -2.28 -1.32 0.00 0.00 176.35 173.09 3gyr s HIS 163 N 3.53 2.04 0.00 5.38 5.65 0.16 -2.26 115.29 129.79 3gyr s HIS 163 Ca 0.23 0.27 0.00 0.00 0.25 0.00 0.00 55.06 55.81 3gyr s HIS 163 Cb -0.15 -3.89 0.00 0.00 -1.18 0.00 0.00 32.58 27.36 3gyr s HIS 163 CO 0.05 -3.65 0.00 0.41 -0.65 0.00 0.00 174.74 170.90 3gyr n GLY 164 N 4.13 3.07 3.73 1.59 0.00 -1.26 -3.14 105.19 113.29 3gyr n GLY 164 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3gyr n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 165 N -2.77 3.81 -0.50 4.61 0.00 -0.96 -4.85 121.76 121.11 3gyr s ALA 165 Ca 0.00 1.46 -0.27 0.00 0.00 0.00 0.00 51.96 53.15 3gyr s ALA 165 Cb 0.00 -3.64 0.03 0.00 0.00 0.00 0.00 23.12 19.51 3gyr s ALA 165 CO 0.00 -0.85 1.03 -1.14 0.00 0.00 0.00 175.76 174.80 3gyr s GLN 166 N 0.78 3.55 -0.11 0.00 0.74 -1.26 -4.26 119.66 119.10 3gyr s GLN 166 Ca 0.69 0.23 -0.31 0.00 0.05 0.00 0.00 55.36 56.03 3gyr s GLN 166 Cb -0.46 -3.95 0.12 0.00 1.10 0.00 0.00 33.01 29.82 3gyr s GLN 166 CO 0.35 -1.38 1.02 -0.08 -0.55 0.00 0.00 175.29 174.64 3gyr s THR 167 N 4.17 0.00 0.85 -0.34 -1.32 -1.26 -4.45 115.64 113.29 3gyr s THR 167 Ca 0.40 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.78 3gyr s THR 167 Cb -0.09 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 70.00 3gyr s THR 167 CO 0.27 0.00 1.11 -0.83 -2.21 0.00 0.00 174.62 172.96 3gyr s GLY 168 N -1.83 1.68 0.47 6.08 0.00 -1.26 -4.77 107.32 107.69 3gyr s GLY 168 Ca 0.03 0.38 0.25 0.00 0.00 0.00 0.00 44.72 45.39 3gyr s GLY 168 CO -0.04 0.77 1.84 -1.33 0.00 0.00 0.00 173.10 174.34 3gyr h GLY 169 N -1.50 0.55 2.00 0.20 0.00 -1.03 -0.27 103.07 103.01 3gyr h GLY 169 Ca -0.44 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.79 3gyr h GLY 169 CO 0.47 -0.04 0.00 -1.33 0.00 0.00 0.00 176.54 175.65 3gyr h GLY 170 N 0.21 0.00 0.07 4.60 0.00 -1.87 -2.63 103.07 103.44 3gyr h GLY 170 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.83 3gyr h GLY 170 CO -0.13 0.00 -1.18 0.70 0.00 0.00 0.00 176.54 175.93 3gyr n ASN 171 N -3.01 0.77 0.09 0.19 3.02 -0.14 -4.69 115.26 111.49 3gyr n ASN 171 Ca 0.02 -0.74 0.12 0.00 -0.03 0.00 0.00 54.58 53.95 3gyr n ASN 171 Cb 0.35 1.16 0.46 0.00 -0.61 0.00 0.00 39.78 41.13 3gyr n ASN 171 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3gyr n ASP 172 N -1.67 0.57 -1.20 6.41 4.64 -0.99 -4.77 116.55 119.54 3gyr n ASP 172 Ca 0.02 0.59 0.00 0.00 -1.38 0.00 0.00 54.79 54.02 3gyr n ASP 172 Cb 0.38 -0.73 0.00 0.00 -1.04 0.00 0.00 41.12 39.74 3gyr n ASP 172 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3gyr n GLY 173 N 0.80 0.79 3.71 0.27 0.00 -1.25 -4.24 105.19 105.27 3gyr n GLY 173 Ca 0.04 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 3gyr n GLY 173 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3gyr n TRP 174 N -1.20 2.72 -0.05 1.61 -0.00 -1.26 -4.71 117.44 114.55 3gyr n TRP 174 Ca 0.00 0.04 0.02 0.00 -0.00 0.00 0.00 57.50 57.57 3gyr n TRP 174 Cb 0.44 -2.67 0.35 0.00 -0.00 0.00 0.00 31.31 29.43 3gyr n TRP 174 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3gyr h ALA 175 N 6.79 1.58 0.00 5.87 0.00 -1.96 0.54 119.26 132.08 3gyr h ALA 175 Ca -0.43 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 3gyr h ALA 175 Cb 1.21 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3gyr h ALA 175 CO 0.95 0.36 -0.10 -0.44 0.00 0.00 0.00 179.25 180.02 3gyr h ASP 176 N 0.66 0.00 -0.78 0.00 3.32 -1.90 -0.18 116.42 117.53 3gyr h ASP 176 Ca 0.17 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.79 3gyr h ASP 176 Cb 0.00 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.31 3gyr h ASP 176 CO -0.03 0.10 0.55 0.59 -1.72 0.00 0.00 179.24 178.73 3gyr n ASN 177 N -3.37 4.27 -4.74 6.45 5.03 0.18 -4.92 115.26 118.16 3gyr n ASN 177 Ca -0.01 -3.30 -0.35 0.00 0.87 0.00 0.00 54.58 51.79 3gyr n ASN 177 Cb 0.29 -0.81 0.06 0.00 -1.02 0.00 0.00 39.78 38.29 3gyr n ASN 177 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3gyr s ALA 178 N -2.66 2.37 0.08 5.41 0.00 -1.25 -4.81 121.76 120.90 3gyr s ALA 178 Ca 0.46 0.93 0.08 0.00 0.00 0.00 0.00 51.96 53.43 3gyr s ALA 178 Cb 0.38 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 3gyr s ALA 178 CO 0.07 -1.46 -0.21 0.14 0.00 0.00 0.00 175.76 174.29 3gyr s VAL 179 N -1.79 1.73 0.39 0.00 -7.23 -0.28 -4.76 120.40 108.46 3gyr s VAL 179 Ca 0.76 -1.42 -0.01 0.00 -1.81 0.00 0.00 61.98 59.50 3gyr s VAL 179 Cb -0.29 -1.55 0.08 0.00 0.56 0.00 0.00 36.38 35.18 3gyr s VAL 179 CO 0.39 0.06 0.54 0.61 -0.31 0.00 0.00 175.10 176.39 3gyr n GLY 180 N 1.39 0.50 3.64 2.32 0.00 -1.26 -2.47 105.19 109.31 3gyr n GLY 180 Ca -0.18 -1.96 -0.55 0.00 0.00 0.00 0.00 46.02 43.32 3gyr n GLY 180 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3gyr n PHE 181 N -2.23 1.72 0.00 1.61 7.35 -1.26 -1.89 117.46 122.76 3gyr n PHE 181 Ca 0.09 0.63 0.00 0.00 -0.76 0.00 0.00 57.45 57.40 3gyr n PHE 181 Cb 0.31 -2.37 0.00 0.00 0.35 0.00 0.00 39.48 37.76 3gyr n PHE 181 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3gyr n GLY 182 N 3.26 1.01 3.86 7.13 0.00 0.11 -5.03 105.19 115.53 3gyr n GLY 182 Ca 0.22 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.03 3gyr n GLY 182 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gyr s ASP 183 N -2.50 5.42 0.16 1.61 1.01 -0.79 -4.92 116.67 116.65 3gyr s ASP 183 Ca 0.00 -0.41 0.09 0.00 0.71 0.00 0.00 52.55 52.94 3gyr s ASP 183 Cb 0.00 -1.09 -0.04 0.00 1.01 0.00 0.00 42.92 42.80 3gyr s ASP 183 CO 0.00 -0.30 -0.20 0.00 0.21 0.00 0.00 175.17 174.88 3gyr s ALA 184 N -2.26 2.06 -0.23 5.23 0.00 -1.26 -1.79 121.76 123.51 3gyr s ALA 184 Ca 0.40 -1.47 -0.05 0.00 0.00 0.00 0.00 51.96 50.84 3gyr s ALA 184 Cb -0.07 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 3gyr s ALA 184 CO 0.27 0.30 -0.01 -1.14 0.00 0.00 0.00 175.76 175.18 3gyr s GLN 185 N -2.59 3.41 -0.16 0.00 0.74 0.02 -4.95 119.66 116.13 3gyr s GLN 185 Ca 0.15 -0.62 -0.15 0.00 0.05 0.00 0.00 55.36 54.79 3gyr s GLN 185 Cb -0.07 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.88 3gyr s GLN 185 CO 0.07 -0.22 0.37 -0.51 -0.55 0.00 0.00 175.29 174.44 3gyr s LEU 186 N 1.51 4.23 -0.05 3.68 1.43 -1.26 -0.64 118.68 127.57 3gyr s LEU 186 Ca 0.06 0.58 0.05 0.00 -1.03 0.00 0.00 54.13 53.78 3gyr s LEU 186 Cb -0.15 -2.49 -0.00 0.00 0.03 0.00 0.00 46.19 43.58 3gyr s LEU 186 CO -0.01 0.03 -0.19 -0.44 0.23 0.00 0.00 176.35 175.97 3gyr s SER 187 N 0.66 2.37 -0.18 2.29 0.01 -0.31 -4.74 113.70 113.80 3gyr s SER 187 Ca 0.19 -0.39 -0.08 0.00 1.31 0.00 0.00 55.95 56.98 3gyr s SER 187 Cb -0.14 -0.70 -0.04 0.00 0.21 0.00 0.00 66.02 65.35 3gyr s SER 187 CO 0.06 0.17 0.09 -0.70 0.41 0.00 0.00 173.24 173.27 3gyr s GLU 188 N 0.04 4.02 -0.30 12.44 2.12 -1.26 -1.10 118.70 134.66 3gyr s GLU 188 Ca -0.05 -0.29 0.03 0.00 0.36 0.00 0.00 54.97 55.03 3gyr s GLU 188 Cb -0.12 -3.28 0.08 0.00 0.26 0.00 0.00 34.13 31.06 3gyr s GLU 188 CO 0.03 0.31 -0.04 0.71 -0.54 0.00 0.00 175.26 175.73 3gyr s TYR 189 N 0.28 3.49 0.34 5.30 2.02 0.30 -4.79 117.35 124.29 3gyr s TYR 189 Ca 0.06 -2.63 0.19 0.00 -0.37 0.00 0.00 57.07 54.32 3gyr s TYR 189 Cb -0.12 -2.37 0.99 0.00 -0.40 0.00 0.00 41.96 40.06 3gyr s TYR 189 CO -0.01 -0.91 1.90 -1.35 -1.57 0.00 0.00 175.55 173.62 3gyr h PRO 190 N 7.70 0.00 -3.69 -1.71 0.11 -1.84 -0.82 132.00 131.75 3gyr h PRO 190 Ca -0.12 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.65 3gyr h PRO 190 Cb 1.03 0.00 0.05 0.00 0.11 0.00 0.00 31.00 32.19 3gyr h PRO 190 CO 0.49 0.27 -0.50 0.09 -0.21 0.00 0.00 178.00 178.13 3gyr n ASN 191 N -3.82 -5.36 -4.09 -2.05 5.03 -1.26 -3.71 115.26 100.00 3gyr n ASN 191 Ca -0.01 -0.22 -0.43 0.00 0.87 0.00 0.00 54.58 54.78 3gyr n ASN 191 Cb 0.36 -4.22 0.00 0.00 -1.02 0.00 0.00 39.78 34.90 3gyr n ASN 191 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3gyr n ASP 192 N -1.76 5.45 -3.56 6.41 4.64 -1.26 0.28 116.55 126.75 3gyr n ASP 192 Ca -0.10 -3.14 -0.17 0.00 -1.38 0.00 0.00 54.79 50.00 3gyr n ASP 192 Cb 0.61 -1.45 -0.06 0.00 -1.04 0.00 0.00 41.12 39.18 3gyr n ASP 192 CO 0.00 0.00 0.00 -2.28 -0.82 0.00 0.00 177.20 174.10 3gyr s HIS 193 N -0.18 -0.55 0.77 -0.67 2.46 -1.26 -4.98 115.29 110.86 3gyr s HIS 193 Ca 0.38 0.90 -0.12 0.00 0.47 0.00 0.00 55.06 56.68 3gyr s HIS 193 Cb 0.04 0.36 0.06 0.00 -0.13 0.00 0.00 32.58 32.90 3gyr s HIS 193 CO 0.02 -0.59 1.13 1.14 -2.47 0.00 0.00 174.74 173.97 3gyr s GLN 194 N -1.42 2.09 0.28 2.88 -2.07 -1.26 -4.65 119.66 115.51 3gyr s GLN 194 Ca -0.10 1.43 -0.28 0.00 -1.82 0.00 0.00 55.36 54.59 3gyr s GLN 194 Cb -0.01 -1.86 -0.14 0.00 -1.09 0.00 0.00 33.01 29.91 3gyr s GLN 194 CO 0.07 -1.81 0.92 0.00 -1.32 0.00 0.00 175.29 173.16 3gyr n ALA 195 N -3.24 -0.66 -3.76 2.60 0.00 -1.26 -4.87 120.51 109.32 3gyr n ALA 195 Ca 0.11 0.39 0.04 0.00 0.00 0.00 0.00 53.44 53.97 3gyr n ALA 195 Cb 0.52 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.02 3gyr n ALA 195 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3gyr s THR 196 N -1.06 0.00 -0.33 0.00 -1.32 -0.88 -4.19 115.64 107.86 3gyr s THR 196 Ca 0.60 -0.07 -0.13 0.00 -1.21 0.00 0.00 61.69 60.88 3gyr s THR 196 Cb -0.73 -2.40 -0.02 0.00 -1.51 0.00 0.00 72.50 67.84 3gyr s THR 196 CO 0.59 0.00 0.25 -1.58 -2.21 0.00 0.00 174.62 171.67 3gyr s GLN 197 N -2.08 3.57 0.51 7.08 0.74 -1.26 -0.79 119.66 127.43 3gyr s GLN 197 Ca 0.22 -0.56 0.09 0.00 0.05 0.00 0.00 55.36 55.15 3gyr s GLN 197 Cb 0.04 -3.79 0.05 0.00 1.10 0.00 0.00 33.01 30.42 3gyr s GLN 197 CO -0.04 -0.42 0.70 -1.58 -0.55 0.00 0.00 175.29 173.40 3gyr s TRP 198 N 1.77 2.02 0.03 1.67 0.51 0.82 -4.87 118.94 120.89 3gyr s TRP 198 Ca 0.07 -0.58 -0.10 0.00 -2.12 0.00 0.00 56.10 53.37 3gyr s TRP 198 Cb -0.17 -2.29 0.01 0.00 -0.81 0.00 0.00 33.47 30.20 3gyr s TRP 198 CO 0.11 -0.84 0.21 1.67 -0.51 0.00 0.00 176.95 177.59 3gyr s TRP 199 N -2.53 0.02 0.08 -1.98 1.48 -1.19 -0.83 118.94 113.99 3gyr s TRP 199 Ca 0.59 -0.20 0.10 0.00 -1.06 0.00 0.00 56.10 55.53 3gyr s TRP 199 Cb -0.08 -0.01 -0.03 0.00 -1.16 0.00 0.00 33.47 32.20 3gyr s TRP 199 CO 0.36 -0.43 -0.26 1.52 -4.06 0.00 0.00 176.95 174.08 3gyr s TYR 200 N -2.40 2.29 0.14 1.66 -0.85 0.67 0.37 117.35 119.24 3gyr s TYR 200 Ca -0.06 -0.40 -0.24 0.00 -0.52 0.00 0.00 57.07 55.85 3gyr s TYR 200 Cb -0.02 -1.32 0.07 0.00 0.38 0.00 0.00 41.96 41.08 3gyr s TYR 200 CO -0.03 0.21 0.64 -3.38 -1.52 0.00 0.00 175.55 171.47 3gyr s HIS 201 N -0.92 -0.52 0.65 -3.49 -3.43 -0.94 -0.19 115.29 106.45 3gyr s HIS 201 Ca 0.12 0.33 -0.18 0.00 -0.80 0.00 0.00 55.06 54.54 3gyr s HIS 201 Cb -0.10 0.55 -0.01 0.00 -1.43 0.00 0.00 32.58 31.59 3gyr s HIS 201 CO 0.04 -0.81 1.24 -3.47 -2.00 0.00 0.00 174.74 169.73 3gyr n ASP 202 N -0.34 1.83 -0.37 7.38 -0.08 -0.79 -1.65 116.55 122.52 3gyr n ASP 202 Ca -0.16 0.82 0.00 0.00 -1.51 0.00 0.00 54.79 53.94 3gyr n ASP 202 Cb 0.64 -1.53 0.00 0.00 2.34 0.00 0.00 41.12 42.58 3gyr n ASP 202 CO 0.00 0.00 0.00 1.57 0.12 0.00 0.00 177.20 178.89 3gyr n HIS 203 N -1.93 0.00 -1.69 -0.67 -0.00 0.12 -4.80 115.22 106.26 3gyr n HIS 203 Ca 0.16 -0.02 -0.44 0.00 0.46 0.00 0.00 57.72 57.88 3gyr n HIS 203 Cb 0.48 -0.04 -0.02 0.00 -0.12 0.00 0.00 29.99 30.29 3gyr n HIS 203 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3gyr n ALA 204 N -0.03 1.38 -1.71 1.57 0.00 -1.25 -4.33 120.51 116.14 3gyr n ALA 204 Ca 0.00 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.41 3gyr n ALA 204 Cb 0.65 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.77 3gyr n ALA 204 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 3gyr n MET 205 N 1.64 2.70 0.00 0.00 1.56 -0.08 -1.82 117.12 121.12 3gyr n MET 205 Ca 0.09 0.98 0.00 0.00 -0.27 0.00 0.00 57.70 58.50 3gyr n MET 205 Cb 0.34 -2.83 0.00 0.00 2.15 0.00 0.00 33.22 32.88 3gyr n MET 205 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3gyr n ASN 206 N 4.36 0.00 0.00 6.12 3.02 -1.26 -4.62 115.26 122.88 3gyr n ASN 206 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 3gyr n ASN 206 Cb 0.35 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 3gyr n ASN 206 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3gyr n ILE 207 N -1.83 0.47 -0.34 2.41 -5.35 -1.03 -4.76 119.36 108.93 3gyr n ILE 207 Ca 0.00 -0.62 0.19 0.00 -0.27 0.00 0.00 62.75 62.04 3gyr n ILE 207 Cb 0.00 0.85 0.40 0.00 -1.74 0.00 0.00 39.64 39.15 3gyr n ILE 207 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 3gyr h THR 208 N 0.50 0.49 -0.11 7.28 2.02 -1.62 -0.87 112.91 120.60 3gyr h THR 208 Ca 0.00 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.03 3gyr h THR 208 Cb 0.42 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.74 3gyr h THR 208 CO 0.00 0.10 0.09 0.08 0.37 0.00 0.00 175.52 176.15 3gyr h ARG 209 N 0.53 0.00 0.00 6.66 0.11 -1.86 -1.97 114.38 117.85 3gyr h ARG 209 Ca 0.66 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 60.46 3gyr h ARG 209 Cb 1.30 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.34 3gyr h ARG 209 CO -0.50 0.00 -1.62 0.91 0.10 0.00 0.00 179.97 178.86 3gyr n TRP 210 N -4.33 0.65 -0.20 4.08 8.01 -0.45 -3.68 117.44 121.53 3gyr n TRP 210 Ca -0.00 0.28 0.12 0.00 -1.31 0.00 0.00 57.50 56.59 3gyr n TRP 210 Cb 0.20 -1.02 0.42 0.00 -2.01 0.00 0.00 31.31 28.90 3gyr n TRP 210 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 3gyr h ASN 211 N -1.00 0.55 -0.15 -0.99 4.21 -1.27 0.13 115.58 117.06 3gyr h ASN 211 Ca -0.43 0.02 -0.15 0.00 1.21 0.00 0.00 56.30 56.96 3gyr h ASN 211 Cb 1.34 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 38.46 3gyr h ASN 211 CO -0.26 0.30 -0.48 0.58 -1.29 0.00 0.00 177.43 176.29 3gyr h VAL 212 N 0.59 1.34 -0.03 2.81 2.07 -1.56 -2.99 116.25 118.48 3gyr h VAL 212 Ca 0.38 -1.74 0.01 0.00 0.82 0.00 0.00 66.70 66.16 3gyr h VAL 212 Cb 0.64 2.02 -0.00 0.00 -1.52 0.00 0.00 31.29 32.43 3gyr h VAL 212 CO -0.14 0.53 0.03 -0.03 0.02 0.00 0.00 177.57 177.98 3gyr h MET 213 N 0.24 0.00 0.00 1.57 1.85 -1.43 -0.82 114.93 116.34 3gyr h MET 213 Ca -0.02 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.07 3gyr h MET 213 Cb 1.10 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.13 3gyr h MET 213 CO 0.10 0.00 0.00 0.00 -0.40 0.00 0.00 176.91 176.61 3gyr h ALA 214 N 1.98 1.00 0.00 0.39 0.00 -0.85 -3.46 119.26 118.32 3gyr h ALA 214 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3gyr h ALA 214 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3gyr h ALA 214 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3gyr n GLY 215 N -0.38 0.75 2.92 0.00 0.00 -0.33 -0.66 105.19 107.49 3gyr n GLY 215 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3gyr n GLY 215 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gyr n LEU 216 N 0.00 6.48 -3.74 0.99 4.77 -1.15 -4.56 117.00 119.79 3gyr n LEU 216 Ca 0.00 -4.37 -0.14 0.00 -0.03 0.00 0.00 56.01 51.48 3gyr n LEU 216 Cb 0.00 -1.59 -0.09 0.00 -2.33 0.00 0.00 43.42 39.42 3gyr n LEU 216 CO 0.00 1.11 0.06 -0.72 -1.33 0.00 0.00 177.39 176.51 3gyr s TYR 217 N 1.94 -0.24 0.33 -1.77 -0.85 -1.26 -1.88 117.35 113.61 3gyr s TYR 217 Ca 0.44 0.39 -0.14 0.00 -0.52 0.00 0.00 57.07 57.23 3gyr s TYR 217 Cb 0.10 0.13 0.06 0.00 0.38 0.00 0.00 41.96 42.62 3gyr s TYR 217 CO -0.03 -0.39 0.75 0.41 -1.52 0.00 0.00 175.55 174.77 3gyr n GLY 218 N 1.36 1.01 3.41 5.49 0.00 0.73 -0.50 105.19 116.69 3gyr n GLY 218 Ca -0.21 -1.22 -0.21 0.00 0.00 0.00 0.00 46.02 44.38 3gyr n GLY 218 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3gyr s THR 219 N -2.17 2.08 -0.11 2.61 -1.32 -1.26 -0.24 115.64 115.24 3gyr s THR 219 Ca 0.15 -2.29 -0.04 0.00 -1.21 0.00 0.00 61.69 58.30 3gyr s THR 219 Cb -0.04 -2.20 0.05 0.00 -1.51 0.00 0.00 72.50 68.80 3gyr s THR 219 CO 0.10 -0.48 0.17 -0.47 -2.21 0.00 0.00 174.62 171.74 3gyr s TYR 220 N -2.76 -0.20 -0.15 9.09 6.14 -0.01 -1.83 117.35 127.64 3gyr s TYR 220 Ca 0.27 0.57 -0.02 0.00 0.64 0.00 0.00 57.07 58.52 3gyr s TYR 220 Cb -0.02 -0.27 -0.02 0.00 0.42 0.00 0.00 41.96 42.07 3gyr s TYR 220 CO 0.11 -0.33 -0.09 -0.51 0.64 0.00 0.00 175.55 175.38 3gyr s LEU 221 N 2.30 2.95 -0.18 6.97 1.43 0.15 -0.13 118.68 132.17 3gyr s LEU 221 Ca 0.03 -0.25 -0.09 0.00 -1.03 0.00 0.00 54.13 52.79 3gyr s LEU 221 Cb -0.13 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 3gyr s LEU 221 CO -0.07 0.16 0.13 -0.69 0.23 0.00 0.00 176.35 176.10 3gyr s VAL 222 N 0.42 5.38 0.10 -1.59 1.01 0.03 -1.02 120.40 124.73 3gyr s VAL 222 Ca -0.07 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.14 3gyr s VAL 222 Cb -0.15 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 3gyr s VAL 222 CO 0.04 0.48 -0.01 -0.13 0.00 0.00 0.00 175.10 175.48 3gyr s ARG 223 N 0.03 2.50 0.33 2.72 1.81 0.94 -2.07 118.95 125.21 3gyr s ARG 223 Ca 0.09 -0.87 -0.06 0.00 -1.72 0.00 0.00 55.73 53.17 3gyr s ARG 223 Cb -0.11 -2.51 0.01 0.00 -0.45 0.00 0.00 34.95 31.89 3gyr s ARG 223 CO -0.00 0.53 0.51 0.16 -0.68 0.00 0.00 175.30 175.82 3gyr s ASP 224 N -2.34 0.65 0.16 0.23 1.47 -1.26 -0.02 116.67 115.55 3gyr s ASP 224 Ca 0.25 -1.36 -0.06 0.00 1.18 0.00 0.00 52.55 52.56 3gyr s ASP 224 Cb -0.11 0.67 0.01 0.00 -0.34 0.00 0.00 42.92 43.15 3gyr s ASP 224 CO 0.18 -1.32 1.43 0.44 0.68 0.00 0.00 175.17 176.57 3gyr h ASP 225 N 2.12 0.73 -0.02 2.11 3.45 -1.99 -2.06 116.42 120.77 3gyr h ASP 225 Ca -0.29 -0.43 -0.00 0.00 0.43 0.00 0.00 57.03 56.75 3gyr h ASP 225 Cb 1.24 -0.21 -0.00 0.00 -0.56 0.00 0.00 39.33 39.80 3gyr h ASP 225 CO 0.39 1.18 0.01 -0.08 -1.57 0.00 0.00 179.24 179.17 3gyr h GLU 226 N 0.47 0.03 -0.64 3.56 4.81 -1.99 -0.53 114.58 120.29 3gyr h GLU 226 Ca -0.01 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 3gyr h GLU 226 Cb 1.22 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.57 3gyr h GLU 226 CO 0.12 0.07 0.12 1.49 -0.73 0.00 0.00 179.01 180.09 3gyr h GLU 227 N -0.03 1.05 -0.88 1.92 4.81 -1.98 -1.66 114.58 117.81 3gyr h GLU 227 Ca 0.01 -0.27 0.05 0.00 -0.13 0.00 0.00 59.36 59.02 3gyr h GLU 227 Cb 0.05 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.25 3gyr h GLU 227 CO -0.00 0.96 0.58 -0.44 -0.73 0.00 0.00 179.01 179.38 3gyr h ASP 228 N 0.96 0.90 0.31 1.04 3.32 -1.13 -1.87 116.42 119.94 3gyr h ASP 228 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 3gyr h ASP 228 Cb 0.41 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3gyr h ASP 228 CO 0.01 0.59 0.00 0.00 -1.72 0.00 0.00 179.24 178.12 3gyr h ALA 229 N 1.51 1.00 -0.00 3.45 0.00 -0.10 -1.17 119.26 123.94 3gyr h ALA 229 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3gyr h ALA 229 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3gyr h ALA 229 CO -0.13 0.00 -0.01 1.28 0.00 0.00 0.00 179.25 180.39 3gyr n LEU 230 N -2.60 0.11 -3.87 0.00 4.77 -0.70 -4.93 117.00 109.77 3gyr n LEU 230 Ca -0.01 0.10 -0.25 0.00 -0.03 0.00 0.00 56.01 55.83 3gyr n LEU 230 Cb 0.12 -0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3gyr n LEU 230 CO 0.17 0.02 -0.15 0.61 -1.33 0.00 0.00 177.39 176.71 3gyr n GLY 231 N 1.16 -0.27 3.78 -0.72 0.00 -0.44 -4.93 105.19 103.77 3gyr n GLY 231 Ca 0.19 0.14 -0.34 0.00 0.00 0.00 0.00 46.02 46.01 3gyr n GLY 231 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gyr s LEU 232 N -6.89 3.66 0.30 0.99 1.43 -1.26 -4.95 118.68 111.95 3gyr s LEU 232 Ca 0.07 2.01 -0.28 0.00 -1.03 0.00 0.00 54.13 54.90 3gyr s LEU 232 Cb -0.04 -4.56 -0.14 0.00 0.03 0.00 0.00 46.19 41.49 3gyr s LEU 232 CO 0.86 -1.18 1.09 -2.65 0.23 0.00 0.00 176.35 174.70 3gyr n PRO 233 N -1.57 1.55 -2.99 1.29 -0.02 -1.26 -4.96 135.00 127.04 3gyr n PRO 233 Ca 0.10 0.54 -0.09 0.00 -2.02 0.00 0.00 63.50 62.04 3gyr n PRO 233 Cb 0.52 -1.97 -0.03 0.00 -0.02 0.00 0.00 33.50 32.00 3gyr n PRO 233 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3gyr n SER 234 N 1.14 -0.52 0.00 2.55 3.41 -1.26 -4.44 113.62 114.50 3gyr n SER 234 Ca 0.08 -2.05 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 3gyr n SER 234 Cb 0.33 1.06 0.00 0.00 -0.26 0.00 0.00 64.21 65.34 3gyr n SER 234 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gyr n GLY 235 N -0.31 3.13 0.48 5.00 0.00 -1.26 -1.52 105.19 110.70 3gyr n GLY 235 Ca 0.02 -0.29 0.41 0.00 0.00 0.00 0.00 46.02 46.16 3gyr n GLY 235 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gyr h ASP 236 N 6.72 0.19 -0.15 1.61 3.32 -2.02 -1.17 116.42 124.92 3gyr h ASP 236 Ca 0.00 0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3gyr h ASP 236 Cb 0.00 0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3gyr h ASP 236 CO 0.00 -0.26 0.00 0.54 -1.72 0.00 0.00 179.24 177.80 3gyr n ARG 237 N -4.73 1.58 -4.07 3.56 5.12 -0.58 -4.66 116.66 112.88 3gyr n ARG 237 Ca 0.41 -0.88 -0.33 0.00 -1.93 0.00 0.00 57.85 55.12 3gyr n ARG 237 Cb 1.59 -1.35 -0.16 0.00 -1.16 0.00 0.00 32.46 31.39 3gyr n ARG 237 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3gyr s GLU 238 N -1.80 3.02 -0.17 5.56 2.12 -0.44 0.04 118.70 127.02 3gyr s GLU 238 Ca 0.29 -0.82 -0.00 0.00 0.36 0.00 0.00 54.97 54.80 3gyr s GLU 238 Cb 0.15 -2.68 0.04 0.00 0.26 0.00 0.00 34.13 31.90 3gyr s GLU 238 CO 0.23 -0.23 -0.06 0.42 -0.54 0.00 0.00 175.26 175.07 3gyr s ILE 239 N 1.32 1.21 0.24 -3.70 1.01 0.10 -4.77 121.20 116.61 3gyr s ILE 239 Ca 0.04 -0.68 -0.30 0.00 0.00 0.00 0.00 60.65 59.71 3gyr s ILE 239 Cb -0.14 -1.36 -0.09 0.00 0.01 0.00 0.00 42.46 40.89 3gyr s ILE 239 CO -0.11 0.15 1.22 -2.84 0.00 0.00 0.00 174.94 173.36 3gyr s PRO 240 N 1.59 4.48 -0.26 2.79 0.02 -1.26 -0.74 135.00 141.62 3gyr s PRO 240 Ca 0.01 1.96 0.02 0.00 0.02 0.00 0.00 61.00 63.00 3gyr s PRO 240 Cb -0.15 -3.19 0.05 0.00 0.02 0.00 0.00 34.50 31.23 3gyr s PRO 240 CO -0.08 -0.07 -0.10 -0.51 -0.33 0.00 0.00 177.00 175.91 3gyr s LEU 241 N -0.78 3.39 -0.46 -5.54 1.43 0.12 -4.82 118.68 112.02 3gyr s LEU 241 Ca 0.51 -1.30 -0.12 0.00 -1.03 0.00 0.00 54.13 52.19 3gyr s LEU 241 Cb -0.35 -1.57 0.09 0.00 0.03 0.00 0.00 46.19 44.39 3gyr s LEU 241 CO 0.41 -0.18 0.34 -0.76 0.23 0.00 0.00 176.35 176.39 3gyr s LEU 242 N 1.15 5.48 -0.03 1.79 1.02 -1.26 -0.83 118.68 126.00 3gyr s LEU 242 Ca -0.07 -1.50 -0.03 0.00 0.02 0.00 0.00 54.13 52.54 3gyr s LEU 242 Cb -0.19 -2.09 -0.04 0.00 0.02 0.00 0.00 46.19 43.89 3gyr s LEU 242 CO -0.05 -0.62 0.16 0.27 0.02 0.00 0.00 176.35 176.13 3gyr s ILE 243 N 1.52 5.37 -0.26 -0.59 -4.36 -0.84 -1.01 121.20 121.03 3gyr s ILE 243 Ca 0.04 -0.12 -0.16 0.00 -0.26 0.00 0.00 60.65 60.15 3gyr s ILE 243 Cb -0.24 -3.47 0.07 0.00 1.25 0.00 0.00 42.46 40.07 3gyr s ILE 243 CO 0.04 0.38 0.65 0.00 0.24 0.00 0.00 174.94 176.24 3gyr s ALA 244 N -1.25 -1.73 0.43 2.27 0.00 -0.55 0.91 121.76 121.85 3gyr s ALA 244 Ca 0.24 2.23 -0.21 0.00 0.00 0.00 0.00 51.96 54.22 3gyr s ALA 244 Cb -0.12 -1.31 -0.10 0.00 0.00 0.00 0.00 23.12 21.58 3gyr s ALA 244 CO 0.15 -0.35 0.97 0.16 0.00 0.00 0.00 175.76 176.69 3gyr s ASP 245 N 1.45 6.84 0.09 0.00 -4.77 -1.26 -0.54 116.67 118.49 3gyr s ASP 245 Ca -0.09 1.75 0.03 0.00 -3.30 0.00 0.00 52.55 50.94 3gyr s ASP 245 Cb -0.05 -2.55 -0.04 0.00 -1.09 0.00 0.00 42.92 39.19 3gyr s ASP 245 CO -0.16 -0.43 -0.08 -0.13 0.70 0.00 0.00 175.17 175.07 3gyr s ARG 246 N -3.10 0.82 0.28 2.11 1.81 0.10 -4.80 118.95 116.17 3gyr s ARG 246 Ca 0.62 -1.21 0.11 0.00 -1.72 0.00 0.00 55.73 53.53 3gyr s ARG 246 Cb -0.11 -0.36 -0.05 0.00 -0.45 0.00 0.00 34.95 33.97 3gyr s ARG 246 CO 0.15 0.03 -0.12 1.21 -0.68 0.00 0.00 175.30 175.89 3gyr s ASN 247 N -2.66 3.93 0.11 0.23 3.84 -1.25 -1.89 114.94 117.25 3gyr s ASN 247 Ca 0.07 -0.91 0.07 0.00 0.21 0.00 0.00 52.86 52.30 3gyr s ASN 247 Cb 0.00 -0.48 -0.04 0.00 -0.55 0.00 0.00 41.25 40.18 3gyr s ASN 247 CO -0.02 0.01 -0.17 -0.76 -2.79 0.00 0.00 177.10 173.37 3gyr s LEU 248 N -3.58 2.34 0.72 3.21 1.43 -1.26 -0.71 118.68 120.83 3gyr s LEU 248 Ca 0.31 -0.73 -0.06 0.00 -1.03 0.00 0.00 54.13 52.62 3gyr s LEU 248 Cb -0.05 -0.69 0.08 0.00 0.03 0.00 0.00 46.19 45.56 3gyr s LEU 248 CO 0.17 -0.04 1.02 -0.62 0.23 0.00 0.00 176.35 177.10 3gyr s ASP 249 N -2.11 4.62 0.02 2.29 -1.08 -0.13 -1.14 116.67 119.14 3gyr s ASP 249 Ca 0.06 0.27 0.00 0.00 -0.52 0.00 0.00 52.55 52.36 3gyr s ASP 249 Cb -0.08 -0.84 -0.02 0.00 -1.46 0.00 0.00 42.92 40.52 3gyr s ASP 249 CO 0.04 -1.70 -0.04 0.42 0.52 0.00 0.00 175.17 174.41 3gyr s THR 250 N -3.25 0.18 0.87 1.71 -4.23 -1.26 -1.38 115.64 108.28 3gyr s THR 250 Ca 0.62 -0.84 -0.11 0.00 -1.18 0.00 0.00 61.69 60.17 3gyr s THR 250 Cb -0.09 -0.30 0.11 0.00 1.34 0.00 0.00 72.50 73.56 3gyr s THR 250 CO 0.45 -0.42 1.09 -1.81 -0.54 0.00 0.00 174.62 173.39 3gyr s ASP 251 N -1.32 3.74 0.55 3.99 1.01 0.42 -4.85 116.67 120.22 3gyr s ASP 251 Ca -0.13 1.53 0.26 0.00 0.71 0.00 0.00 52.55 54.92 3gyr s ASP 251 Cb -0.09 -2.22 1.47 0.00 1.01 0.00 0.00 42.92 43.09 3gyr s ASP 251 CO -0.01 -2.48 2.01 1.05 0.21 0.00 0.00 175.17 175.96 3gyr h GLU 252 N -1.44 0.00 -0.13 8.23 4.11 -2.00 0.99 114.58 124.34 3gyr h GLU 252 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3gyr h GLU 252 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3gyr h GLU 252 CO 0.54 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.22 3gyr n ASP 253 N -4.13 0.78 0.00 3.06 5.75 -1.26 -4.90 116.55 115.85 3gyr n ASP 253 Ca 0.07 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.96 3gyr n ASP 253 Cb 0.53 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 3gyr n ASP 253 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3gyr n GLY 254 N 0.78 0.53 3.79 6.12 0.00 0.34 -5.04 105.19 111.71 3gyr n GLY 254 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3gyr n GLY 254 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 255 N -0.02 4.50 0.15 1.61 1.81 -1.24 -4.74 118.95 121.02 3gyr s ARG 255 Ca 0.00 1.33 -0.31 0.00 -1.72 0.00 0.00 55.73 55.04 3gyr s ARG 255 Cb 0.00 -2.70 -0.08 0.00 -0.45 0.00 0.00 34.95 31.72 3gyr s ARG 255 CO 0.00 0.20 1.31 -0.51 -0.68 0.00 0.00 175.30 175.62 3gyr s LEU 256 N -2.24 4.40 -0.05 2.53 1.43 -1.26 -0.44 118.68 123.05 3gyr s LEU 256 Ca 0.52 2.30 0.08 0.00 -1.03 0.00 0.00 54.13 56.01 3gyr s LEU 256 Cb -0.18 -3.60 0.16 0.00 0.03 0.00 0.00 46.19 42.60 3gyr s LEU 256 CO 0.23 -0.54 1.10 -0.46 0.23 0.00 0.00 176.35 176.91 3gyr n ASN 257 N 3.24 2.34 0.00 2.29 0.23 -0.48 -4.83 115.26 118.05 3gyr n ASN 257 Ca 0.08 -2.39 0.00 0.00 -0.53 0.00 0.00 54.58 51.74 3gyr n ASN 257 Cb 0.43 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 37.94 3gyr n ASN 257 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3gyr n GLY 258 N -0.66 0.80 3.73 4.83 0.00 -1.26 -4.75 105.19 107.88 3gyr n GLY 258 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 3gyr n GLY 258 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 259 N -0.26 4.42 0.12 1.61 0.52 -1.26 -4.51 118.95 119.59 3gyr s ARG 259 Ca 0.00 0.85 -0.31 0.00 -0.52 0.00 0.00 55.73 55.75 3gyr s ARG 259 Cb 0.00 -3.42 -0.10 0.00 0.52 0.00 0.00 34.95 31.94 3gyr s ARG 259 CO 0.00 0.14 1.87 -0.51 0.02 0.00 0.00 175.30 176.81 3gyr s LEU 260 N 0.56 4.41 -0.24 2.53 1.43 -1.26 -0.96 118.68 125.15 3gyr s LEU 260 Ca 0.36 2.77 0.02 0.00 -1.03 0.00 0.00 54.13 56.26 3gyr s LEU 260 Cb -0.18 -3.56 0.05 0.00 0.03 0.00 0.00 46.19 42.53 3gyr s LEU 260 CO 0.18 -1.02 -0.12 -0.22 0.23 0.00 0.00 176.35 175.39 3gyr s LEU 261 N 2.98 3.13 -0.75 1.79 2.96 0.11 -0.87 118.68 128.04 3gyr s LEU 261 Ca 0.83 -1.24 -0.23 0.00 -0.22 0.00 0.00 54.13 53.27 3gyr s LEU 261 Cb -0.46 -1.51 0.07 0.00 0.50 0.00 0.00 46.19 44.80 3gyr s LEU 261 CO 0.37 -0.16 1.08 -2.28 -1.32 0.00 0.00 176.35 174.04 3gyr s HIS 262 N 1.16 2.68 -0.25 5.38 5.65 0.38 -3.75 115.29 126.54 3gyr s HIS 262 Ca -0.06 -0.65 0.02 0.00 0.25 0.00 0.00 55.06 54.63 3gyr s HIS 262 Cb -0.19 -4.37 0.06 0.00 -1.18 0.00 0.00 32.58 26.90 3gyr s HIS 262 CO -0.07 -1.71 -0.10 0.21 -0.65 0.00 0.00 174.74 172.43 3gyr s LYS 263 N 4.15 2.09 0.35 2.88 2.20 -1.26 -1.66 119.74 128.48 3gyr s LYS 263 Ca 0.28 -1.23 0.08 0.00 -0.36 0.00 0.00 55.97 54.74 3gyr s LYS 263 Cb -0.12 -2.79 -0.04 0.00 -1.51 0.00 0.00 37.83 33.37 3gyr s LYS 263 CO 0.06 -0.56 0.17 0.95 -0.36 0.00 0.00 175.35 175.60 3gyr s THR 264 N 1.19 3.02 -0.16 3.43 -4.23 -0.90 -4.50 115.64 113.49 3gyr s THR 264 Ca -0.08 -1.64 -0.02 0.00 -1.18 0.00 0.00 61.69 58.77 3gyr s THR 264 Cb -0.19 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 3gyr s THR 264 CO -0.06 -0.16 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.10 3gyr s VAL 265 N -2.42 3.41 -0.26 2.29 1.01 -1.26 -1.03 120.40 122.14 3gyr s VAL 265 Ca 0.39 -0.52 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 3gyr s VAL 265 Cb -0.02 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 3gyr s VAL 265 CO 0.23 0.49 1.63 -0.63 0.00 0.00 0.00 175.10 176.82 3gyr s ILE 266 N 0.67 3.68 -1.09 2.22 1.01 0.15 -1.74 121.20 126.10 3gyr s ILE 266 Ca -0.04 0.75 0.22 0.00 0.00 0.00 0.00 60.65 61.57 3gyr s ILE 266 Cb -0.15 -3.74 -0.19 0.00 0.01 0.00 0.00 42.46 38.39 3gyr s ILE 266 CO 0.02 -0.35 0.97 1.33 0.00 0.00 0.00 174.94 176.91 3gyr n VAL 267 N 6.64 0.00 -3.48 2.92 0.24 0.62 -3.53 118.33 121.74 3gyr n VAL 267 Ca 0.19 -0.02 -0.17 0.00 -2.04 0.00 0.00 64.34 62.30 3gyr n VAL 267 Cb 0.46 0.95 -0.12 0.00 -1.47 0.00 0.00 33.84 33.65 3gyr n VAL 267 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3gyr s GLN 268 N -2.95 0.21 0.17 7.34 0.74 -0.79 -4.99 119.66 119.39 3gyr s GLN 268 Ca 0.09 0.28 -0.09 0.00 0.05 0.00 0.00 55.36 55.69 3gyr s GLN 268 Cb 0.16 -1.04 0.04 0.00 1.10 0.00 0.00 33.01 33.27 3gyr s GLN 268 CO 0.83 -0.63 1.57 0.37 -0.55 0.00 0.00 175.29 176.87 3gyr h GLN 269 N 8.29 0.97 -2.93 1.67 5.75 -1.88 0.31 115.11 127.30 3gyr h GLN 269 Ca -0.17 -0.41 -0.42 0.00 -0.15 0.00 0.00 58.65 57.50 3gyr h GLN 269 Cb 1.15 -0.04 -0.40 0.00 1.07 0.00 0.00 27.48 29.27 3gyr h GLN 269 CO 0.27 1.08 -0.72 0.45 -2.65 0.00 0.00 178.83 177.26 3gyr s SER 270 N -6.73 2.04 0.16 -0.69 0.15 -1.26 -3.27 113.70 104.11 3gyr s SER 270 Ca -0.11 -0.48 -0.30 0.00 0.70 0.00 0.00 55.95 55.76 3gyr s SER 270 Cb 0.12 -0.07 -0.08 0.00 -1.71 0.00 0.00 66.02 64.28 3gyr s SER 270 CO 0.87 -0.34 1.31 0.21 1.20 0.00 0.00 173.24 176.49 3gyr s ASN 271 N 2.19 6.91 0.20 5.45 2.47 -0.43 -4.91 114.94 126.82 3gyr s ASN 271 Ca 0.03 2.33 -0.21 0.00 0.42 0.00 0.00 52.86 55.44 3gyr s ASN 271 Cb -0.16 -2.60 0.14 0.00 -1.45 0.00 0.00 41.25 37.19 3gyr s ASN 271 CO -0.10 -0.54 1.57 -0.65 -3.72 0.00 0.00 177.10 173.67 3gyr h PRO 272 N 5.86 -0.12 -0.02 0.43 0.11 -1.94 -2.74 132.00 133.59 3gyr h PRO 272 Ca -0.44 0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.49 3gyr h PRO 272 Cb 1.21 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 3gyr h PRO 272 CO 0.80 -0.08 -0.82 0.93 -0.21 0.00 0.00 178.00 178.62 3gyr h GLU 273 N -0.12 0.24 -6.23 1.05 5.08 -1.94 -3.46 114.58 109.20 3gyr h GLU 273 Ca 0.26 -0.23 -0.59 0.00 -1.00 0.00 0.00 59.36 57.80 3gyr h GLU 273 Cb 0.56 0.06 -0.12 0.00 0.50 0.00 0.00 28.75 29.75 3gyr h GLU 273 CO -0.77 0.93 -0.71 0.95 -1.00 0.00 0.00 179.01 178.41 3gyr s THR 274 N -3.34 2.94 -1.25 1.13 -4.23 -1.03 -5.00 115.64 104.86 3gyr s THR 274 Ca -0.03 -2.14 0.05 0.00 -1.18 0.00 0.00 61.69 58.39 3gyr s THR 274 Cb 0.10 -2.55 0.07 0.00 1.34 0.00 0.00 72.50 71.46 3gyr s THR 274 CO 0.83 -0.37 1.08 0.61 -0.54 0.00 0.00 174.62 176.22 3gyr n GLY 275 N -0.68 -0.55 3.80 3.99 0.00 -1.26 -3.52 105.19 106.96 3gyr n GLY 275 Ca -0.06 -0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 3gyr n GLY 275 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gyr s LYS 276 N -2.75 2.92 0.43 1.61 1.02 -1.26 -4.45 119.74 117.26 3gyr s LYS 276 Ca 0.04 -0.80 -0.23 0.00 0.02 0.00 0.00 55.97 55.00 3gyr s LYS 276 Cb 0.03 -2.69 -0.08 0.00 -0.52 0.00 0.00 37.83 34.58 3gyr s LYS 276 CO 0.09 0.51 1.11 -1.25 -0.92 0.00 0.00 175.35 174.89 3gyr s PRO 277 N -2.87 3.94 -0.22 -1.68 0.04 -1.20 -1.32 135.00 131.70 3gyr s PRO 277 Ca 0.31 1.65 -0.01 0.00 0.04 0.00 0.00 61.00 62.99 3gyr s PRO 277 Cb -0.11 -2.46 0.02 0.00 0.04 0.00 0.00 34.50 31.99 3gyr s PRO 277 CO 0.23 -0.37 -0.11 0.08 0.04 0.00 0.00 177.00 176.87 3gyr s VAL 278 N -1.60 2.62 0.22 -0.36 1.01 0.10 -4.95 120.40 117.43 3gyr s VAL 278 Ca 0.61 -0.91 0.11 0.00 0.00 0.00 0.00 61.98 61.78 3gyr s VAL 278 Cb -0.26 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 3gyr s VAL 278 CO 0.31 0.37 -0.17 -0.94 0.00 0.00 0.00 175.10 174.67 3gyr s SER 279 N 1.33 3.77 0.89 3.32 1.04 -1.26 -0.28 113.70 122.51 3gyr s SER 279 Ca 0.03 -0.81 -0.14 0.00 0.48 0.00 0.00 55.95 55.51 3gyr s SER 279 Cb -0.15 -0.43 0.13 0.00 0.10 0.00 0.00 66.02 65.67 3gyr s SER 279 CO -0.08 0.09 1.23 0.27 0.98 0.00 0.00 173.24 175.73 3gyr s ILE 280 N -1.94 1.99 1.13 -1.02 -4.36 -0.71 -4.91 121.20 111.38 3gyr s ILE 280 Ca 0.25 0.00 -0.12 0.00 -0.26 0.00 0.00 60.65 60.52 3gyr s ILE 280 Cb -0.07 -2.96 0.27 0.00 1.25 0.00 0.00 42.46 40.94 3gyr s ILE 280 CO 0.13 0.00 1.04 -2.65 0.24 0.00 0.00 174.94 173.70 3gyr n PRO 281 N -3.57 -2.14 -2.58 0.37 -0.02 -1.26 -4.44 135.00 121.36 3gyr n PRO 281 Ca 0.11 -0.59 -0.41 0.00 -2.02 0.00 0.00 63.50 60.59 3gyr n PRO 281 Cb 0.60 -2.21 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 3gyr n PRO 281 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3gyr s PHE 282 N -2.45 3.64 -0.00 6.00 5.36 -1.26 -4.71 117.98 124.56 3gyr s PHE 282 Ca 0.68 1.63 -0.02 0.00 -0.96 0.00 0.00 56.93 58.26 3gyr s PHE 282 Cb -0.25 -3.22 -0.00 0.00 -0.34 0.00 0.00 43.02 39.21 3gyr s PHE 282 CO 0.64 -0.41 0.03 -0.06 -1.46 0.00 0.00 175.22 173.96 3gyr s PHE 283 N 0.09 0.06 0.12 10.12 0.08 -1.26 -4.15 117.98 123.03 3gyr s PHE 283 Ca 0.50 -0.12 -0.03 0.00 0.12 0.00 0.00 56.93 57.40 3gyr s PHE 283 Cb -0.27 -0.06 -0.03 0.00 -0.57 0.00 0.00 43.02 42.09 3gyr s PHE 283 CO 0.32 -0.11 0.09 0.20 -0.10 0.00 0.00 175.22 175.62 3gyr s GLY 284 N -0.62 0.75 0.14 4.36 0.00 -1.26 -4.80 107.32 105.88 3gyr s GLY 284 Ca -0.07 -1.26 0.25 0.00 0.00 0.00 0.00 44.72 43.63 3gyr s GLY 284 CO -0.00 -1.22 1.48 -1.55 0.00 0.00 0.00 173.10 171.81 3gyr n PRO 285 N -0.08 0.27 -4.39 2.90 -0.04 -1.12 -4.54 135.00 128.01 3gyr n PRO 285 Ca -0.08 0.12 -0.34 0.00 -0.04 0.00 0.00 63.50 63.16 3gyr n PRO 285 Cb 0.63 -1.71 -0.11 0.00 -0.04 0.00 0.00 33.50 32.27 3gyr n PRO 285 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3gyr s TYR 286 N -3.14 3.09 -0.25 0.54 1.51 -0.79 -4.41 117.35 113.89 3gyr s TYR 286 Ca 0.08 -0.01 -0.09 0.00 -1.01 0.00 0.00 57.07 56.04 3gyr s TYR 286 Cb 0.13 -1.86 -0.04 0.00 -0.11 0.00 0.00 41.96 40.08 3gyr s TYR 286 CO 0.68 0.24 0.11 0.99 -1.11 0.00 0.00 175.55 176.46 3gyr s THR 287 N -0.32 4.70 -0.09 -0.71 2.01 -1.26 0.03 115.64 119.99 3gyr s THR 287 Ca 0.06 -0.04 -0.09 0.00 0.31 0.00 0.00 61.69 61.92 3gyr s THR 287 Cb -0.12 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 3gyr s THR 287 CO 0.02 0.33 0.21 0.42 -0.69 0.00 0.00 174.62 174.91 3gyr s THR 288 N 1.50 5.38 -0.19 -0.82 -4.23 0.30 -2.10 115.64 115.47 3gyr s THR 288 Ca 0.06 0.38 0.01 0.00 -1.18 0.00 0.00 61.69 60.97 3gyr s THR 288 Cb -0.15 -3.49 0.03 0.00 1.34 0.00 0.00 72.50 70.23 3gyr s THR 288 CO 0.06 0.59 -0.18 -0.69 -0.54 0.00 0.00 174.62 173.86 3gyr s VAL 289 N -0.92 2.04 -1.42 2.29 1.01 0.13 -1.48 120.40 122.04 3gyr s VAL 289 Ca 0.17 -1.06 -0.07 0.00 0.00 0.00 0.00 61.98 61.02 3gyr s VAL 289 Cb -0.13 -1.91 0.04 0.00 0.00 0.00 0.00 36.38 34.38 3gyr s VAL 289 CO 0.06 0.41 0.81 0.59 0.00 0.00 0.00 175.10 176.97 3gyr n ASN 290 N 4.59 -2.82 -0.11 3.32 4.13 -0.18 -2.09 115.26 122.10 3gyr n ASN 290 Ca -0.19 -0.82 -0.01 0.00 1.68 0.00 0.00 54.58 55.24 3gyr n ASN 290 Cb 0.48 -3.90 -0.01 0.00 -1.54 0.00 0.00 39.78 34.82 3gyr n ASN 290 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3gyr n GLY 291 N -1.66 0.47 3.17 7.41 0.00 -1.26 -4.51 105.19 108.81 3gyr n GLY 291 Ca -0.14 -0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.44 3gyr n GLY 291 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 292 N -1.06 1.72 0.05 1.61 0.52 -0.89 -4.47 118.95 116.43 3gyr s ARG 292 Ca 0.00 -0.66 -0.30 0.00 -0.52 0.00 0.00 55.73 54.25 3gyr s ARG 292 Cb 0.00 -1.56 -0.08 0.00 0.52 0.00 0.00 34.95 33.83 3gyr s ARG 292 CO 0.00 0.33 1.73 0.42 0.02 0.00 0.00 175.30 177.79 3gyr s ILE 293 N -0.19 3.04 -1.12 1.52 1.01 -0.42 0.20 121.20 125.23 3gyr s ILE 293 Ca 0.01 0.38 -0.26 0.00 0.00 0.00 0.00 60.65 60.78 3gyr s ILE 293 Cb -0.10 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.16 3gyr s ILE 293 CO 0.01 -0.01 0.67 0.79 0.00 0.00 0.00 174.94 176.40 3gyr n TRP 294 N 6.14 -1.57 -1.82 3.97 8.01 -0.89 -4.73 117.44 126.55 3gyr n TRP 294 Ca 0.17 0.26 -0.29 0.00 -1.31 0.00 0.00 57.50 56.33 3gyr n TRP 294 Cb 0.41 -2.80 0.13 0.00 -2.01 0.00 0.00 31.31 27.04 3gyr n TRP 294 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.69 175.43 3gyr s PRO 295 N -6.79 1.35 0.07 -0.99 0.04 -1.26 -0.53 135.00 126.89 3gyr s PRO 295 Ca 0.37 -0.01 0.08 0.00 0.04 0.00 0.00 61.00 61.49 3gyr s PRO 295 Cb -0.20 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 3gyr s PRO 295 CO 0.95 -2.00 -0.22 1.52 0.04 0.00 0.00 177.00 177.29 3gyr s TYR 296 N -3.60 1.92 -0.10 0.56 -0.85 -0.33 -2.23 117.35 112.72 3gyr s TYR 296 Ca 0.66 -0.39 0.03 0.00 -0.52 0.00 0.00 57.07 56.85 3gyr s TYR 296 Cb -0.10 -1.11 0.01 0.00 0.38 0.00 0.00 41.96 41.14 3gyr s TYR 296 CO 0.51 0.16 -0.20 0.00 -1.52 0.00 0.00 175.55 174.49 3gyr s ALA 297 N -0.93 1.95 -0.12 9.51 0.00 0.78 0.51 121.76 133.46 3gyr s ALA 297 Ca 0.08 -0.86 -0.28 0.00 0.00 0.00 0.00 51.96 50.90 3gyr s ALA 297 Cb -0.09 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 3gyr s ALA 297 CO 0.03 0.14 0.94 -0.51 0.00 0.00 0.00 175.76 176.36 3gyr s ASP 298 N 0.59 7.15 0.18 0.00 1.01 -1.26 -0.62 116.67 123.71 3gyr s ASP 298 Ca -0.14 1.41 0.04 0.00 0.71 0.00 0.00 52.55 54.57 3gyr s ASP 298 Cb -0.17 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.20 3gyr s ASP 298 CO 0.04 -0.41 -0.07 0.68 0.21 0.00 0.00 175.17 175.62 3gyr s VAL 299 N 1.97 1.11 0.51 -1.27 -7.23 -0.27 -4.92 120.40 110.31 3gyr s VAL 299 Ca 0.45 -2.05 -0.03 0.00 -1.81 0.00 0.00 61.98 58.54 3gyr s VAL 299 Cb -0.18 -2.02 -0.00 0.00 0.56 0.00 0.00 36.38 34.74 3gyr s VAL 299 CO 0.16 -0.60 0.78 -1.81 -0.31 0.00 0.00 175.10 173.33 3gyr s ASP 300 N -3.21 5.78 -1.26 4.85 1.01 -1.26 -0.37 116.67 122.20 3gyr s ASP 300 Ca 0.21 0.53 -0.08 0.00 0.71 0.00 0.00 52.55 53.92 3gyr s ASP 300 Cb 0.04 -1.68 -0.08 0.00 1.01 0.00 0.00 42.92 42.20 3gyr s ASP 300 CO 0.03 -0.84 2.61 -0.90 0.21 0.00 0.00 175.17 176.29 3gyr n ASP 301 N -2.31 6.97 -0.92 0.27 5.75 -0.79 -4.74 116.55 120.79 3gyr n ASP 301 Ca 0.03 -2.45 0.00 0.00 -0.01 0.00 0.00 54.79 52.35 3gyr n ASP 301 Cb 0.57 -1.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.32 3gyr n ASP 301 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3gyr n GLY 302 N 3.61 4.54 3.75 6.12 0.00 -1.26 -3.65 105.19 118.30 3gyr n GLY 302 Ca 0.63 -1.74 -0.38 0.00 0.00 0.00 0.00 46.02 44.52 3gyr n GLY 302 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3gyr s TRP 303 N -1.43 3.62 0.15 1.61 0.52 -1.26 -0.94 118.94 121.22 3gyr s TRP 303 Ca 0.00 1.07 0.10 0.00 0.02 0.00 0.00 56.10 57.29 3gyr s TRP 303 Cb 0.00 -2.57 -0.04 0.00 -1.15 0.00 0.00 33.47 29.71 3gyr s TRP 303 CO 0.00 0.30 -0.20 0.71 0.02 0.00 0.00 176.95 177.78 3gyr s TYR 304 N 0.06 2.43 -0.16 -1.98 1.51 -0.36 -4.81 117.35 114.03 3gyr s TYR 304 Ca 0.29 -0.31 -0.01 0.00 -1.01 0.00 0.00 57.07 56.03 3gyr s TYR 304 Cb -0.17 -1.25 -0.01 0.00 -0.11 0.00 0.00 41.96 40.42 3gyr s TYR 304 CO 0.14 0.43 -0.12 0.50 -1.11 0.00 0.00 175.55 175.40 3gyr s ARG 305 N -2.41 3.31 -0.18 -0.62 3.52 0.11 -1.08 118.95 121.60 3gyr s ARG 305 Ca 0.19 -0.70 -0.04 0.00 -0.13 0.00 0.00 55.73 55.06 3gyr s ARG 305 Cb -0.09 -2.71 -0.02 0.00 -1.56 0.00 0.00 34.95 30.56 3gyr s ARG 305 CO 0.10 0.03 -0.04 -0.51 -0.81 0.00 0.00 175.30 174.07 3gyr s LEU 306 N 0.81 3.09 -0.72 -0.88 1.43 0.91 -0.72 118.68 122.59 3gyr s LEU 306 Ca -0.04 -0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 52.69 3gyr s LEU 306 Cb -0.15 -1.76 0.19 0.00 0.03 0.00 0.00 46.19 44.50 3gyr s LEU 306 CO 0.01 0.10 0.66 -0.13 0.23 0.00 0.00 176.35 177.21 3gyr s ARG 307 N 0.78 3.32 -0.26 1.70 1.81 0.08 -0.77 118.95 125.61 3gyr s ARG 307 Ca -0.02 -2.24 -0.12 0.00 -1.72 0.00 0.00 55.73 51.63 3gyr s ARG 307 Cb -0.15 -4.32 -0.05 0.00 -0.45 0.00 0.00 34.95 29.99 3gyr s ARG 307 CO 0.02 -1.29 0.24 -1.17 -0.68 0.00 0.00 175.30 172.42 3gyr s LEU 308 N 0.57 4.07 -0.05 2.53 2.96 -0.16 0.15 118.68 128.74 3gyr s LEU 308 Ca 0.13 0.15 0.05 0.00 -0.22 0.00 0.00 54.13 54.25 3gyr s LEU 308 Cb -0.17 -2.22 -0.01 0.00 0.50 0.00 0.00 46.19 44.29 3gyr s LEU 308 CO -0.05 -0.04 -0.22 0.54 -1.32 0.00 0.00 176.35 175.25 3gyr s VAL 309 N 1.55 1.84 -0.58 1.68 0.11 -0.01 -0.41 120.40 124.58 3gyr s VAL 309 Ca 0.10 -0.95 -0.25 0.00 -2.93 0.00 0.00 61.98 57.95 3gyr s VAL 309 Cb -0.15 -1.57 0.04 0.00 -1.53 0.00 0.00 36.38 33.17 3gyr s VAL 309 CO 0.08 0.52 1.03 0.21 -3.33 0.00 0.00 175.10 173.61 3gyr s ASN 310 N -0.08 6.34 -0.07 3.54 3.84 -1.16 -1.99 114.94 125.37 3gyr s ASN 310 Ca -0.04 -0.30 0.14 0.00 0.21 0.00 0.00 52.86 52.88 3gyr s ASN 310 Cb -0.13 -2.47 0.53 0.00 -0.55 0.00 0.00 41.25 38.62 3gyr s ASN 310 CO 0.03 -1.36 1.41 0.00 -2.79 0.00 0.00 177.10 174.39 3gyr n ALA 311 N 7.88 2.83 -1.40 1.71 0.00 0.26 -0.64 120.51 131.15 3gyr n ALA 311 Ca 0.03 -1.12 -0.32 0.00 0.00 0.00 0.00 53.44 52.03 3gyr n ALA 311 Cb 0.48 -1.01 0.07 0.00 0.00 0.00 0.00 19.45 18.99 3gyr n ALA 311 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3gyr s SER 312 N -0.84 4.82 0.20 0.00 0.01 -1.19 -4.81 113.70 111.89 3gyr s SER 312 Ca 0.38 1.92 -0.10 0.00 1.31 0.00 0.00 55.95 59.46 3gyr s SER 312 Cb 0.23 -2.54 0.14 0.00 0.21 0.00 0.00 66.02 64.06 3gyr s SER 312 CO 0.20 -1.82 1.83 0.78 0.41 0.00 0.00 173.24 174.64 3gyr h ASN 313 N -0.49 0.88 0.00 2.44 4.21 -1.88 -3.43 115.58 117.32 3gyr h ASN 313 Ca -0.45 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 56.98 3gyr h ASN 313 Cb 1.24 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 38.22 3gyr h ASN 313 CO 0.53 0.70 0.00 0.00 -1.29 0.00 0.00 177.43 177.37 3gyr n ALA 314 N -2.34 0.09 -1.95 -0.83 0.00 -1.26 -0.77 120.51 113.45 3gyr n ALA 314 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.09 3gyr n ALA 314 Cb 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.49 3gyr n ALA 314 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3gyr s ARG 315 N -0.22 4.41 -0.35 0.00 3.52 -1.26 -4.71 118.95 120.33 3gyr s ARG 315 Ca 0.00 2.05 -0.13 0.00 -0.13 0.00 0.00 55.73 57.52 3gyr s ARG 315 Cb 0.00 -3.18 -0.01 0.00 -1.56 0.00 0.00 34.95 30.20 3gyr s ARG 315 CO 0.00 -0.20 0.24 0.42 -0.81 0.00 0.00 175.30 174.95 3gyr s ILE 316 N -0.18 5.23 -0.11 4.11 1.01 -1.26 -4.09 121.20 125.90 3gyr s ILE 316 Ca 0.54 -0.29 -0.29 0.00 0.00 0.00 0.00 60.65 60.61 3gyr s ILE 316 Cb -0.36 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.38 3gyr s ILE 316 CO 0.41 -0.04 0.98 -0.31 0.00 0.00 0.00 174.94 175.97 3gyr s TYR 317 N 1.71 3.50 -0.66 3.97 2.02 -1.01 -4.91 117.35 121.97 3gyr s TYR 317 Ca 0.06 1.55 -0.07 0.00 -0.37 0.00 0.00 57.07 58.23 3gyr s TYR 317 Cb -0.18 -3.16 0.17 0.00 -0.40 0.00 0.00 41.96 38.39 3gyr s TYR 317 CO 0.10 -0.23 0.52 -0.80 -1.57 0.00 0.00 175.55 173.57 3gyr s ASN 318 N 1.10 5.78 0.04 2.29 -0.87 -1.26 0.06 114.94 122.08 3gyr s ASN 318 Ca 0.47 -2.63 -0.23 0.00 -1.57 0.00 0.00 52.86 48.89 3gyr s ASN 318 Cb -0.18 -1.99 -0.06 0.00 -0.02 0.00 0.00 41.25 39.00 3gyr s ASN 318 CO 0.17 -0.49 0.71 -0.76 -2.57 0.00 0.00 177.10 174.16 3gyr s LEU 319 N 0.27 4.45 -0.04 0.60 1.43 -0.45 0.21 118.68 125.15 3gyr s LEU 319 Ca 0.15 1.37 0.03 0.00 -1.03 0.00 0.00 54.13 54.65 3gyr s LEU 319 Cb -0.18 -3.13 0.00 0.00 0.03 0.00 0.00 46.19 42.91 3gyr s LEU 319 CO -0.05 0.07 -0.12 -0.69 0.23 0.00 0.00 176.35 175.79 3gyr s VAL 320 N -0.21 1.06 -0.19 -1.59 1.01 -0.34 -1.20 120.40 118.94 3gyr s VAL 320 Ca 0.36 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.59 3gyr s VAL 320 Cb -0.20 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.23 3gyr s VAL 320 CO 0.21 0.32 0.81 -0.22 0.00 0.00 0.00 175.10 176.22 3gyr s LEU 321 N 0.21 4.15 0.22 3.92 2.96 -1.26 -0.92 118.68 127.95 3gyr s LEU 321 Ca -0.05 1.10 0.07 0.00 -0.22 0.00 0.00 54.13 55.03 3gyr s LEU 321 Cb -0.11 -3.19 -0.05 0.00 0.50 0.00 0.00 46.19 43.35 3gyr s LEU 321 CO 0.01 -0.42 -0.11 0.27 -1.32 0.00 0.00 176.35 174.79 3gyr s ILE 322 N 2.32 1.60 0.00 6.68 -4.36 0.14 -1.13 121.20 126.45 3gyr s ILE 322 Ca 0.36 -2.16 0.00 0.00 -0.26 0.00 0.00 60.65 58.59 3gyr s ILE 322 Cb -0.16 -2.15 0.00 0.00 1.25 0.00 0.00 42.46 41.40 3gyr s ILE 322 CO 0.11 -0.52 0.00 -0.90 0.24 0.00 0.00 174.94 173.87 3gyr n ASP 323 N -0.41 0.00 0.30 4.36 5.75 0.24 -0.71 116.55 126.07 3gyr n ASP 323 Ca -0.07 -0.89 0.17 0.00 -0.01 0.00 0.00 54.79 53.99 3gyr n ASP 323 Cb 0.61 0.00 0.97 0.00 -1.03 0.00 0.00 41.12 41.68 3gyr n ASP 323 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3gyr h GLU 324 N 0.00 0.00 -0.69 0.11 3.07 -1.89 -0.54 114.58 114.64 3gyr h GLU 324 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3gyr h GLU 324 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3gyr h GLU 324 CO 0.00 0.02 0.00 -0.25 -1.40 0.00 0.00 179.01 177.38 3gyr n ASP 325 N -3.58 4.31 -0.16 1.42 9.92 -1.26 -4.91 116.55 122.28 3gyr n ASP 325 Ca -0.03 -2.24 -0.02 0.00 -0.53 0.00 0.00 54.79 51.97 3gyr n ASP 325 Cb 0.11 -0.53 -0.01 0.00 -0.64 0.00 0.00 41.12 40.04 3gyr n ASP 325 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3gyr n ASP 326 N 1.34 -4.75 -4.71 -2.24 9.92 -0.21 -4.99 116.55 110.90 3gyr n ASP 326 Ca 0.25 0.05 -0.42 0.00 -0.53 0.00 0.00 54.79 54.14 3gyr n ASP 326 Cb 0.76 -2.44 -0.03 0.00 -0.64 0.00 0.00 41.12 38.76 3gyr n ASP 326 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 3gyr s ARG 327 N -1.51 4.57 0.36 -1.24 3.52 -1.26 -4.67 118.95 118.71 3gyr s ARG 327 Ca 0.00 1.36 -0.28 0.00 -0.13 0.00 0.00 55.73 56.68 3gyr s ARG 327 Cb 0.00 -3.44 -0.11 0.00 -1.56 0.00 0.00 34.95 29.84 3gyr s ARG 327 CO 0.00 0.01 1.48 -2.14 -0.81 0.00 0.00 175.30 173.84 3gyr s PRO 328 N 0.82 4.14 -0.44 5.12 0.02 -1.26 -0.59 135.00 142.81 3gyr s PRO 328 Ca 0.50 2.53 -0.15 0.00 0.02 0.00 0.00 61.00 63.90 3gyr s PRO 328 Cb -0.21 -2.99 0.05 0.00 0.02 0.00 0.00 34.50 31.37 3gyr s PRO 328 CO 0.27 -0.51 0.34 0.08 -0.33 0.00 0.00 177.00 176.84 3gyr s VAL 329 N -0.93 5.15 0.54 3.83 1.01 -0.28 -4.86 120.40 124.86 3gyr s VAL 329 Ca 0.54 -0.89 -0.06 0.00 0.00 0.00 0.00 61.98 61.57 3gyr s VAL 329 Cb -0.46 -3.98 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 3gyr s VAL 329 CO 0.60 -0.44 0.85 -2.16 0.00 0.00 0.00 175.10 173.95 3gyr s PRO 330 N 1.64 3.28 -0.20 2.72 0.04 -1.26 -4.38 135.00 136.83 3gyr s PRO 330 Ca 0.04 0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.23 3gyr s PRO 330 Cb -0.22 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 32.01 3gyr s PRO 330 CO 0.08 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.08 3gyr n GLY 331 N -2.44 0.53 0.02 0.56 0.00 -1.26 -4.86 105.19 97.74 3gyr n GLY 331 Ca 0.03 -0.34 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 3gyr n GLY 331 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gyr n VAL 332 N -2.81 0.20 -4.20 1.61 0.31 -1.26 -4.88 118.33 107.30 3gyr n VAL 332 Ca -0.02 -0.08 -0.34 0.00 -0.01 0.00 0.00 64.34 63.88 3gyr n VAL 332 Cb 0.13 -0.67 -0.10 0.00 -0.91 0.00 0.00 33.84 32.29 3gyr n VAL 332 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3gyr s VAL 333 N -2.07 4.45 -0.06 2.52 1.01 -1.26 0.10 120.40 125.09 3gyr s VAL 333 Ca -0.04 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.78 3gyr s VAL 333 Cb 0.01 -2.96 0.02 0.00 0.00 0.00 0.00 36.38 33.46 3gyr s VAL 333 CO 0.09 0.51 -0.05 -1.00 0.00 0.00 0.00 175.10 174.65 3gyr s HIS 334 N 0.02 0.89 -0.01 5.22 0.09 0.79 -1.04 115.29 121.24 3gyr s HIS 334 Ca 0.04 -0.29 -0.25 0.00 -0.00 0.00 0.00 55.06 54.55 3gyr s HIS 334 Cb -0.13 -0.79 -0.04 0.00 -0.00 0.00 0.00 32.58 31.62 3gyr s HIS 334 CO 0.02 -0.25 0.78 -1.14 -0.00 0.00 0.00 174.74 174.14 3gyr s GLN 335 N 1.12 4.48 0.00 1.40 0.74 0.88 0.32 119.66 128.60 3gyr s GLN 335 Ca -0.08 1.05 0.01 0.00 0.05 0.00 0.00 55.36 56.40 3gyr s GLN 335 Cb -0.14 -3.42 -0.01 0.00 1.10 0.00 0.00 33.01 30.54 3gyr s GLN 335 CO -0.01 0.12 0.14 0.44 -0.55 0.00 0.00 175.29 175.43 3gyr n ILE 336 N 3.45 0.00 -3.76 -2.34 -5.35 0.12 -0.68 119.36 110.80 3gyr n ILE 336 Ca -0.00 -0.48 -0.09 0.00 -0.27 0.00 0.00 62.75 61.91 3gyr n ILE 336 Cb 0.51 1.01 -0.04 0.00 -1.74 0.00 0.00 39.64 39.38 3gyr n ILE 336 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3gyr s GLY 337 N -0.95 -0.06 0.00 3.28 0.00 -1.11 -0.15 107.32 108.34 3gyr s GLY 337 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 44.47 3gyr s GLY 337 CO 0.05 -0.26 0.00 -1.14 0.00 0.00 0.00 173.10 171.75 3gyr n SER 338 N -0.36 0.00 -0.31 1.64 3.41 -0.33 -1.60 113.62 116.07 3gyr n SER 338 Ca -0.09 -0.45 0.04 0.00 -0.26 0.00 0.00 58.87 58.10 3gyr n SER 338 Cb 0.62 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.68 3gyr n SER 338 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3gyr h ASP 339 N 0.00 -0.83 -0.02 4.04 3.32 -1.60 -2.36 116.42 118.98 3gyr h ASP 339 Ca 0.00 0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3gyr h ASP 339 Cb 0.00 0.55 0.00 0.00 0.22 0.00 0.00 39.33 40.10 3gyr h ASP 339 CO 0.00 -0.29 -0.15 0.61 -1.72 0.00 0.00 179.24 177.69 3gyr n GLY 340 N -1.56 0.41 0.00 2.75 0.00 -0.24 -4.48 105.19 102.06 3gyr n GLY 340 Ca 0.13 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.57 3gyr n GLY 340 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 341 N 1.21 0.75 3.59 -0.02 0.00 -0.89 -4.76 105.19 105.07 3gyr n GLY 341 Ca 0.11 -1.76 -0.50 0.00 0.00 0.00 0.00 46.02 43.87 3gyr n GLY 341 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gyr n LEU 342 N 0.00 1.68 -4.79 0.99 4.77 -1.26 -1.19 117.00 117.21 3gyr n LEU 342 Ca 0.00 1.13 -0.32 0.00 -0.03 0.00 0.00 56.01 56.79 3gyr n LEU 342 Cb 0.00 -1.22 0.05 0.00 -2.33 0.00 0.00 43.42 39.92 3gyr n LEU 342 CO 0.00 -1.14 0.72 -0.76 -1.33 0.00 0.00 177.39 174.88 3gyr s LEU 343 N 0.58 3.26 0.34 2.23 1.43 0.79 -4.72 118.68 122.57 3gyr s LEU 343 Ca 0.78 1.84 0.03 0.00 -1.03 0.00 0.00 54.13 55.75 3gyr s LEU 343 Cb -0.88 -4.53 0.60 0.00 0.03 0.00 0.00 46.19 41.41 3gyr s LEU 343 CO 0.49 -1.62 1.91 1.55 0.23 0.00 0.00 176.35 178.91 3gyr h PRO 344 N -0.37 0.64 -4.59 1.29 0.13 -1.89 -3.29 132.00 123.92 3gyr h PRO 344 Ca -0.45 -0.10 -0.26 0.00 -0.87 0.00 0.00 66.00 64.32 3gyr h PRO 344 Cb 1.23 -0.11 -0.19 0.00 0.13 0.00 0.00 31.00 32.05 3gyr h PRO 344 CO 0.54 0.57 -0.72 1.03 -0.23 0.00 0.00 178.00 179.19 3gyr s ARG 345 N -5.22 0.62 0.43 0.86 0.52 -1.26 -0.01 118.95 114.88 3gyr s ARG 345 Ca -0.09 -0.92 -0.25 0.00 -0.52 0.00 0.00 55.73 53.95 3gyr s ARG 345 Cb 0.16 -0.27 -0.08 0.00 0.52 0.00 0.00 34.95 35.28 3gyr s ARG 345 CO 0.77 0.03 1.37 -2.14 0.02 0.00 0.00 175.30 175.35 3gyr s PRO 346 N -2.22 3.80 -0.24 3.54 0.02 -1.26 -4.86 135.00 133.78 3gyr s PRO 346 Ca -0.04 2.29 -0.05 0.00 0.02 0.00 0.00 61.00 63.22 3gyr s PRO 346 Cb -0.06 -2.69 -0.00 0.00 0.02 0.00 0.00 34.50 31.77 3gyr s PRO 346 CO -0.01 -0.68 -0.00 0.08 -0.33 0.00 0.00 177.00 176.06 3gyr s VAL 347 N -1.24 3.56 0.20 3.83 1.01 0.15 -4.94 120.40 122.98 3gyr s VAL 347 Ca 0.59 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 3gyr s VAL 347 Cb -0.41 -2.70 -0.08 0.00 0.00 0.00 0.00 36.38 33.19 3gyr s VAL 347 CO 0.52 0.31 1.16 -2.16 0.00 0.00 0.00 175.10 174.93 3gyr s PRO 348 N 1.48 4.53 -0.45 2.72 0.04 -1.26 -0.09 135.00 141.98 3gyr s PRO 348 Ca 0.04 1.84 -0.07 0.00 0.04 0.00 0.00 61.00 62.85 3gyr s PRO 348 Cb -0.15 -3.24 0.11 0.00 0.04 0.00 0.00 34.50 31.26 3gyr s PRO 348 CO -0.01 -0.01 0.29 0.08 0.04 0.00 0.00 177.00 177.39 3gyr s VAL 349 N -0.30 3.92 -1.34 -0.36 1.01 -0.21 -4.90 120.40 118.23 3gyr s VAL 349 Ca 0.51 -1.82 0.13 0.00 0.00 0.00 0.00 61.98 60.79 3gyr s VAL 349 Cb -0.32 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.50 3gyr s VAL 349 CO 0.37 -0.72 0.80 0.47 0.00 0.00 0.00 175.10 176.02 3gyr n ASP 350 N 4.81 1.63 -2.51 3.32 8.00 -1.26 -4.22 116.55 126.31 3gyr n ASP 350 Ca -0.06 -1.31 -0.21 0.00 0.71 0.00 0.00 54.79 53.91 3gyr n ASP 350 Cb 0.41 0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.84 3gyr n ASP 350 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3gyr n PHE 351 N 0.10 -1.22 -0.27 1.24 3.01 -0.86 -4.16 117.46 115.30 3gyr n PHE 351 Ca 0.06 0.13 0.00 0.00 1.01 0.00 0.00 57.45 58.65 3gyr n PHE 351 Cb 0.29 -4.08 0.00 0.00 -0.01 0.00 0.00 39.48 35.68 3gyr n PHE 351 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 3gyr n ASP 352 N -2.08 0.00 0.04 4.37 3.85 -1.22 -4.72 116.55 116.79 3gyr n ASP 352 Ca -0.21 0.00 -0.22 0.00 -0.71 0.00 0.00 54.79 53.64 3gyr n ASP 352 Cb 0.67 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 40.30 3gyr n ASP 352 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 3gyr h ASP 353 N 0.00 0.52 -0.71 -1.12 5.19 -1.95 -0.23 116.42 118.12 3gyr h ASP 353 Ca 0.00 -0.92 0.15 0.00 -0.62 0.00 0.00 57.03 55.65 3gyr h ASP 353 Cb 0.00 -0.17 -0.04 0.00 0.18 0.00 0.00 39.33 39.30 3gyr h ASP 353 CO 0.00 1.75 0.48 0.74 -3.12 0.00 0.00 179.24 179.09 3gyr h THR 354 N -0.03 0.78 -1.30 0.35 2.02 -2.01 -3.34 112.91 109.38 3gyr h THR 354 Ca -0.34 -0.11 -0.22 0.00 0.77 0.00 0.00 66.41 66.50 3gyr h THR 354 Cb 1.99 0.43 -0.21 0.00 -1.74 0.00 0.00 68.15 68.61 3gyr h THR 354 CO 0.13 0.06 -0.58 -0.22 0.37 0.00 0.00 175.52 175.28 3gyr s LEU 355 N -9.22 -0.90 0.55 2.58 2.96 -1.25 -4.84 118.68 108.57 3gyr s LEU 355 Ca -0.07 -1.78 0.33 0.00 -0.22 0.00 0.00 54.13 52.39 3gyr s LEU 355 Cb 0.21 1.43 1.40 0.00 0.50 0.00 0.00 46.19 49.72 3gyr s LEU 355 CO 0.76 -0.11 2.00 1.55 -1.32 0.00 0.00 176.35 179.23 3gyr h PRO 356 N 5.61 0.00 -2.84 0.98 0.13 -1.17 -2.28 132.00 132.43 3gyr h PRO 356 Ca 0.09 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.09 3gyr h PRO 356 Cb 1.09 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.97 3gyr h PRO 356 CO 0.10 0.03 -0.29 0.08 -0.23 0.00 0.00 178.00 177.68 3gyr s VAL 357 N -3.71 -0.00 -0.59 1.56 1.01 -1.26 -4.56 120.40 112.84 3gyr s VAL 357 Ca 0.01 0.01 -0.21 0.00 0.00 0.00 0.00 61.98 61.78 3gyr s VAL 357 Cb 0.09 -0.52 0.07 0.00 0.00 0.00 0.00 36.38 36.03 3gyr s VAL 357 CO 0.55 0.00 0.84 -0.22 0.00 0.00 0.00 175.10 176.27 3gyr s LEU 358 N 0.27 4.65 -0.47 3.92 2.96 -0.34 -4.85 118.68 124.82 3gyr s LEU 358 Ca -0.01 -0.94 -0.25 0.00 -0.22 0.00 0.00 54.13 52.71 3gyr s LEU 358 Cb -0.03 -2.48 0.03 0.00 0.50 0.00 0.00 46.19 44.21 3gyr s LEU 358 CO -0.00 -1.23 0.92 -0.55 -1.32 0.00 0.00 176.35 174.17 3gyr s SER 359 N 3.32 6.47 -0.56 3.68 0.15 -1.26 -1.34 113.70 124.15 3gyr s SER 359 Ca 0.20 0.04 -0.02 0.00 0.70 0.00 0.00 55.95 56.87 3gyr s SER 359 Cb -0.18 -2.44 0.15 0.00 -1.71 0.00 0.00 66.02 61.83 3gyr s SER 359 CO 0.11 -1.07 0.36 0.00 1.20 0.00 0.00 173.24 173.85 3gyr s ALA 360 N 3.76 3.45 0.98 5.45 0.00 0.11 -4.99 121.76 130.52 3gyr s ALA 360 Ca 0.36 -3.11 -0.12 0.00 0.00 0.00 0.00 51.96 49.08 3gyr s ALA 360 Cb -0.10 -2.53 0.18 0.00 0.00 0.00 0.00 23.12 20.66 3gyr s ALA 360 CO 0.25 -2.03 1.09 0.00 0.00 0.00 0.00 175.76 175.07 3gyr s ALA 361 N 0.15 1.00 0.14 0.00 0.00 -1.26 -2.41 121.76 119.38 3gyr s ALA 361 Ca 0.15 -0.21 -0.33 0.00 0.00 0.00 0.00 51.96 51.57 3gyr s ALA 361 Cb -0.21 -3.17 -0.13 0.00 0.00 0.00 0.00 23.12 19.61 3gyr s ALA 361 CO -0.03 -2.79 1.65 -2.30 0.00 0.00 0.00 175.76 172.29 3gyr n PRO 362 N -4.17 2.31 -0.28 0.00 -0.02 -1.26 -2.48 135.00 129.10 3gyr n PRO 362 Ca 0.06 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 3gyr n PRO 362 Cb 0.56 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 3gyr n PRO 362 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr n ALA 363 N 3.98 0.00 -1.78 3.55 0.00 0.18 -4.92 120.51 121.52 3gyr n ALA 363 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.25 3gyr n ALA 363 Cb 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.74 3gyr n ALA 363 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3gyr s GLU 364 N -0.31 3.79 0.08 0.00 2.02 -1.04 -4.84 118.70 118.40 3gyr s GLU 364 Ca 0.00 1.62 0.07 0.00 0.02 0.00 0.00 54.97 56.68 3gyr s GLU 364 Cb 0.00 -2.32 -0.04 0.00 0.10 0.00 0.00 34.13 31.87 3gyr s GLU 364 CO 0.00 -0.49 -0.15 1.03 0.02 0.00 0.00 175.26 175.67 3gyr s ARG 365 N -2.83 2.04 -0.09 1.61 0.52 -1.26 -2.99 118.95 115.95 3gyr s ARG 365 Ca 0.64 -1.03 -0.02 0.00 -0.52 0.00 0.00 55.73 54.81 3gyr s ARG 365 Cb -0.24 -2.22 0.03 0.00 0.52 0.00 0.00 34.95 33.04 3gyr s ARG 365 CO 0.29 0.52 0.02 -0.06 0.02 0.00 0.00 175.30 176.09 3gyr s PHE 366 N -1.07 0.63 -0.48 -0.53 0.08 0.46 -3.83 117.98 113.22 3gyr s PHE 366 Ca 0.17 -0.22 -0.22 0.00 0.12 0.00 0.00 56.93 56.78 3gyr s PHE 366 Cb -0.11 -0.79 0.03 0.00 -0.57 0.00 0.00 43.02 41.59 3gyr s PHE 366 CO 0.09 -0.36 0.78 0.34 -0.10 0.00 0.00 175.22 175.97 3gyr s ASP 367 N 1.99 6.35 -0.06 1.36 -1.08 -0.63 -0.99 116.67 123.61 3gyr s ASP 367 Ca 0.04 -0.34 0.03 0.00 -0.52 0.00 0.00 52.55 51.77 3gyr s ASP 367 Cb -0.13 -2.37 -0.02 0.00 -1.46 0.00 0.00 42.92 38.93 3gyr s ASP 367 CO -0.06 -0.98 -0.16 -0.76 0.52 0.00 0.00 175.17 173.74 3gyr s LEU 368 N 3.30 2.61 -0.18 -1.34 1.43 0.05 0.14 118.68 124.68 3gyr s LEU 368 Ca 0.27 -0.27 -0.07 0.00 -1.03 0.00 0.00 54.13 53.02 3gyr s LEU 368 Cb -0.14 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 3gyr s LEU 368 CO 0.20 0.30 0.07 -0.76 0.23 0.00 0.00 176.35 176.38 3gyr s LEU 369 N -0.45 3.85 -0.08 1.79 1.43 0.15 -0.06 118.68 125.30 3gyr s LEU 369 Ca 0.05 0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.28 3gyr s LEU 369 Cb -0.12 -1.97 0.01 0.00 0.03 0.00 0.00 46.19 44.14 3gyr s LEU 369 CO 0.02 0.18 -0.16 0.68 0.23 0.00 0.00 176.35 177.30 3gyr s VAL 370 N 0.31 1.43 -0.50 -1.59 -7.23 -0.24 -0.15 120.40 112.44 3gyr s VAL 370 Ca 0.04 -0.65 -0.16 0.00 -1.81 0.00 0.00 61.98 59.40 3gyr s VAL 370 Cb -0.12 -1.28 0.10 0.00 0.56 0.00 0.00 36.38 35.63 3gyr s VAL 370 CO 0.00 0.42 0.44 -0.62 -0.31 0.00 0.00 175.10 175.03 3gyr s ASP 371 N 0.60 6.16 -0.07 4.85 2.15 0.12 -1.23 116.67 129.25 3gyr s ASP 371 Ca -0.15 -1.52 0.19 0.00 0.43 0.00 0.00 52.55 51.49 3gyr s ASP 371 Cb -0.16 -2.19 0.66 0.00 -0.30 0.00 0.00 42.92 40.93 3gyr s ASP 371 CO 0.05 -0.74 1.56 0.49 -0.17 0.00 0.00 175.17 176.36 3gyr n PHE 372 N 5.22 1.26 -0.25 -5.34 3.72 -0.12 -4.57 117.46 117.38 3gyr n PHE 372 Ca -0.13 -0.53 0.03 0.00 -0.05 0.00 0.00 57.45 56.76 3gyr n PHE 372 Cb 0.42 -0.16 0.15 0.00 -0.94 0.00 0.00 39.48 38.96 3gyr n PHE 372 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3gyr h ARG 373 N 3.95 0.55 -0.21 -1.08 3.08 -1.68 -1.96 114.38 117.03 3gyr h ARG 373 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3gyr h ARG 373 Cb 1.24 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3gyr h ARG 373 CO 0.15 0.36 0.00 0.00 -1.07 0.00 0.00 179.97 179.41 3gyr n ALA 374 N -2.44 2.50 -1.73 0.04 0.00 -1.26 -4.36 120.51 113.26 3gyr n ALA 374 Ca 0.12 -0.49 0.02 0.00 0.00 0.00 0.00 53.44 53.09 3gyr n ALA 374 Cb 0.32 -1.06 0.17 0.00 0.00 0.00 0.00 19.45 18.88 3gyr n ALA 374 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gyr n LEU 375 N 0.25 2.91 -4.76 0.00 4.77 -0.73 -5.04 117.00 114.41 3gyr n LEU 375 Ca 0.13 -3.91 -0.41 0.00 -0.03 0.00 0.00 56.01 51.79 3gyr n LEU 375 Cb 0.27 -0.46 -0.01 0.00 -2.33 0.00 0.00 43.42 40.89 3gyr n LEU 375 CO 0.10 1.45 1.24 -0.83 -1.33 0.00 0.00 177.39 178.02 3gyr s GLY 376 N -3.22 2.24 -1.06 -0.72 0.00 -1.26 -2.48 107.32 100.82 3gyr s GLY 376 Ca 0.40 1.60 0.00 0.00 0.00 0.00 0.00 44.72 46.71 3gyr s GLY 376 CO -0.06 2.53 0.00 0.61 0.00 0.00 0.00 173.10 176.18 3gyr n GLY 377 N 1.85 1.11 3.57 0.20 0.00 0.29 -4.74 105.19 107.48 3gyr n GLY 377 Ca 0.07 -0.57 -0.25 0.00 0.00 0.00 0.00 46.02 45.27 3gyr n GLY 377 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 378 N -2.91 2.07 -0.16 1.61 1.81 -1.03 -4.95 118.95 115.38 3gyr s ARG 378 Ca 0.00 -1.37 -0.01 0.00 -1.72 0.00 0.00 55.73 52.62 3gyr s ARG 378 Cb 0.00 -2.11 -0.01 0.00 -0.45 0.00 0.00 34.95 32.38 3gyr s ARG 378 CO 0.00 0.40 -0.11 1.03 -0.68 0.00 0.00 175.30 175.95 3gyr s ARG 379 N -3.13 3.36 0.06 3.54 0.52 -1.26 -1.51 118.95 120.53 3gyr s ARG 379 Ca 0.27 -0.67 0.10 0.00 -0.52 0.00 0.00 55.73 54.91 3gyr s ARG 379 Cb -0.08 -2.75 -0.03 0.00 0.52 0.00 0.00 34.95 32.61 3gyr s ARG 379 CO 0.16 0.06 -0.27 -0.51 0.02 0.00 0.00 175.30 174.76 3gyr s LEU 380 N 0.77 2.20 -0.06 2.53 1.43 0.34 -3.64 118.68 122.25 3gyr s LEU 380 Ca -0.04 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 52.49 3gyr s LEU 380 Cb -0.15 -1.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.78 3gyr s LEU 380 CO 0.01 0.24 -0.23 -0.13 0.23 0.00 0.00 176.35 176.48 3gyr s ARG 381 N -1.40 2.57 -0.05 1.70 0.52 0.11 0.89 118.95 123.29 3gyr s ARG 381 Ca 0.12 -0.87 -0.22 0.00 -0.52 0.00 0.00 55.73 54.24 3gyr s ARG 381 Cb -0.10 -2.21 -0.04 0.00 0.52 0.00 0.00 34.95 33.12 3gyr s ARG 381 CO 0.03 0.41 0.65 -1.17 0.02 0.00 0.00 175.30 175.24 3gyr s LEU 382 N -0.23 4.34 0.04 2.53 2.96 -0.39 0.25 118.68 128.18 3gyr s LEU 382 Ca -0.01 1.15 -0.00 0.00 -0.22 0.00 0.00 54.13 55.04 3gyr s LEU 382 Cb -0.13 -3.00 -0.03 0.00 0.50 0.00 0.00 46.19 43.52 3gyr s LEU 382 CO 0.03 -0.04 -0.04 0.68 -1.32 0.00 0.00 176.35 175.66 3gyr s VAL 383 N 0.48 0.25 -0.19 1.68 -7.23 -0.09 -1.21 120.40 114.09 3gyr s VAL 383 Ca 0.34 -1.46 -0.20 0.00 -1.81 0.00 0.00 61.98 58.86 3gyr s VAL 383 Cb -0.18 -1.03 -0.03 0.00 0.56 0.00 0.00 36.38 35.70 3gyr s VAL 383 CO 0.17 -0.77 0.58 -0.62 -0.31 0.00 0.00 175.10 174.15 3gyr s ASP 384 N -2.33 6.64 -0.33 4.85 2.15 0.38 -1.20 116.67 126.84 3gyr s ASP 384 Ca -0.02 0.78 -0.21 0.00 0.43 0.00 0.00 52.55 53.53 3gyr s ASP 384 Cb 0.00 -2.33 -0.00 0.00 -0.30 0.00 0.00 42.92 40.30 3gyr s ASP 384 CO -0.06 -0.22 0.69 -0.75 -0.17 0.00 0.00 175.17 174.66 3gyr s LYS 385 N 1.73 3.82 0.68 4.34 2.20 0.13 -4.59 119.74 128.04 3gyr s LYS 385 Ca 0.27 0.28 -0.14 0.00 -0.36 0.00 0.00 55.97 56.02 3gyr s LYS 385 Cb -0.16 -3.77 0.01 0.00 -1.51 0.00 0.00 37.83 32.40 3gyr s LYS 385 CO 0.10 -0.69 1.10 0.20 -0.36 0.00 0.00 175.35 175.70 3gyr s GLY 386 N 1.72 2.06 0.49 5.54 0.00 -1.26 -4.70 107.32 111.16 3gyr s GLY 386 Ca 0.27 0.48 0.28 0.00 0.00 0.00 0.00 44.72 45.75 3gyr s GLY 386 CO 0.14 0.83 1.85 -0.56 0.00 0.00 0.00 173.10 175.36 3gyr h PRO 387 N -0.18 0.00 -0.02 2.90 0.13 -1.92 -3.28 132.00 129.64 3gyr h PRO 387 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3gyr h PRO 387 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3gyr h PRO 387 CO 0.54 0.09 -0.25 0.41 -0.23 0.00 0.00 178.00 178.56 3gyr n GLY 388 N 0.30 0.14 3.15 1.56 0.00 -1.26 -4.98 105.19 104.10 3gyr n GLY 388 Ca 0.01 -0.58 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 3gyr n GLY 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 389 N -2.30 -0.21 0.69 4.61 0.00 -1.24 -5.08 121.76 118.24 3gyr s ALA 389 Ca 0.25 -0.44 -0.16 0.00 0.00 0.00 0.00 51.96 51.60 3gyr s ALA 389 Cb 0.19 0.29 -0.01 0.00 0.00 0.00 0.00 23.12 23.59 3gyr s ALA 389 CO 0.46 -0.36 0.98 -2.30 0.00 0.00 0.00 175.76 174.54 3gyr n PRO 390 N 0.64 0.62 -1.63 0.00 -0.02 -1.26 -4.46 135.00 128.89 3gyr n PRO 390 Ca -0.18 0.26 -0.46 0.00 -2.02 0.00 0.00 63.50 61.10 3gyr n PRO 390 Cb 0.59 -2.22 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 3gyr n PRO 390 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr n ALA 391 N -2.32 0.28 -0.03 3.55 0.00 -1.26 -1.12 120.51 119.60 3gyr n ALA 391 Ca 0.13 0.42 0.00 0.00 0.00 0.00 0.00 53.44 54.00 3gyr n ALA 391 Cb 0.49 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.79 3gyr n ALA 391 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gyr n GLY 392 N 1.86 1.89 3.66 0.00 0.00 -1.26 -4.90 105.19 106.43 3gyr n GLY 392 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3gyr n GLY 392 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gyr s THR 393 N -2.68 5.18 0.29 2.61 2.01 -0.28 -4.90 115.64 117.87 3gyr s THR 393 Ca 0.00 0.11 -0.28 0.00 0.31 0.00 0.00 61.69 61.83 3gyr s THR 393 Cb 0.00 -3.39 -0.14 0.00 0.01 0.00 0.00 72.50 68.98 3gyr s THR 393 CO 0.00 0.39 1.03 -2.65 -0.69 0.00 0.00 174.62 172.70 3gyr n PRO 394 N 4.00 1.39 -3.17 4.92 -0.02 -1.26 -4.75 135.00 136.12 3gyr n PRO 394 Ca -0.16 0.49 -0.19 0.00 -2.02 0.00 0.00 63.50 61.62 3gyr n PRO 394 Cb 0.52 -1.87 -0.03 0.00 -0.02 0.00 0.00 33.50 32.10 3gyr n PRO 394 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3gyr n ASP 395 N 1.22 1.19 -0.30 2.55 2.03 0.14 -4.83 116.55 118.55 3gyr n ASP 395 Ca 0.09 -3.07 0.21 0.00 0.52 0.00 0.00 54.79 52.55 3gyr n ASP 395 Cb 0.32 -0.62 0.50 0.00 -0.72 0.00 0.00 41.12 40.60 3gyr n ASP 395 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3gyr h PRO 396 N 3.05 0.41 0.00 -0.67 0.13 -1.83 0.65 132.00 133.74 3gyr h PRO 396 Ca 0.10 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 65.14 3gyr h PRO 396 Cb 0.92 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 3gyr h PRO 396 CO 0.53 0.27 -0.33 -0.07 -0.23 0.00 0.00 178.00 178.18 3gyr h LEU 397 N 0.42 0.00 -2.52 1.56 3.38 -1.92 -2.46 115.31 113.77 3gyr h LEU 397 Ca 0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.53 3gyr h LEU 397 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 3gyr h LEU 397 CO -0.26 0.33 0.00 0.61 0.09 0.00 0.00 178.44 179.20 3gyr n GLY 398 N -0.03 2.18 0.89 0.83 0.00 0.13 -4.86 105.19 104.33 3gyr n GLY 398 Ca -0.01 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.28 3gyr n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 399 N 1.50 0.77 2.77 -0.02 0.00 -0.93 -4.63 105.19 104.66 3gyr n GLY 399 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.96 3gyr n GLY 399 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gyr n VAL 400 N -2.26 1.99 -0.07 1.61 0.31 -0.63 -4.90 118.33 114.36 3gyr n VAL 400 Ca 0.00 -5.01 -0.02 0.00 -0.01 0.00 0.00 64.34 59.30 3gyr n VAL 400 Cb 0.00 -2.17 0.23 0.00 -0.91 0.00 0.00 33.84 30.99 3gyr n VAL 400 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3gyr h ARG 401 N 5.05 0.70 -4.15 5.55 2.43 -1.83 0.41 114.38 122.53 3gyr h ARG 401 Ca 0.17 -0.15 -0.63 0.00 -0.81 0.00 0.00 59.98 58.56 3gyr h ARG 401 Cb 0.73 -0.10 -0.40 0.00 -0.42 0.00 0.00 29.97 29.77 3gyr h ARG 401 CO 0.77 0.67 -0.73 0.71 -1.51 0.00 0.00 179.97 179.88 3gyr s TYR 402 N -5.08 2.92 0.36 2.20 4.12 -1.26 -4.39 117.35 116.22 3gyr s TYR 402 Ca -0.09 -2.53 0.09 0.00 0.02 0.00 0.00 57.07 54.56 3gyr s TYR 402 Cb 0.15 -2.44 0.81 0.00 -1.52 0.00 0.00 41.96 38.96 3gyr s TYR 402 CO 0.79 -0.91 1.88 -1.35 0.02 0.00 0.00 175.55 175.98 3gyr h PRO 403 N 7.69 0.68 -6.26 -1.71 0.11 -1.81 -3.45 132.00 127.25 3gyr h PRO 403 Ca -0.08 -0.04 -0.68 0.00 0.11 0.00 0.00 66.00 65.31 3gyr h PRO 403 Cb 1.01 -0.15 0.05 0.00 0.11 0.00 0.00 31.00 32.01 3gyr h PRO 403 CO 0.51 0.45 0.57 -0.85 -0.21 0.00 0.00 178.00 178.47 3gyr n GLU 404 N -4.55 1.22 -0.09 1.05 0.00 -1.26 -0.47 120.64 116.54 3gyr n GLU 404 Ca 0.17 0.44 -0.13 0.00 0.00 0.00 0.00 57.16 57.64 3gyr n GLU 404 Cb 0.44 -2.10 -0.04 0.00 0.00 0.00 0.00 31.44 29.73 3gyr n GLU 404 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3gyr n VAL 405 N 3.00 1.42 -3.59 3.84 0.31 -0.35 -4.57 118.33 118.39 3gyr n VAL 405 Ca 0.20 0.02 -0.05 0.00 -0.01 0.00 0.00 64.34 64.50 3gyr n VAL 405 Cb 0.19 -2.11 -0.02 0.00 -0.91 0.00 0.00 33.84 30.99 3gyr n VAL 405 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gyr s MET 406 N -2.67 0.61 -0.01 5.55 0.23 -1.16 -4.07 119.30 117.78 3gyr s MET 406 Ca -0.27 -0.27 0.07 0.00 -1.03 0.00 0.00 55.69 54.19 3gyr s MET 406 Cb 0.06 0.25 -0.02 0.00 -1.53 0.00 0.00 34.83 33.59 3gyr s MET 406 CO 0.38 -0.27 -0.23 -2.00 -2.03 0.00 0.00 175.02 170.87 3gyr s GLU 407 N -2.77 2.15 -0.17 3.16 2.12 -0.95 -1.27 118.70 120.98 3gyr s GLU 407 Ca 0.09 -0.91 -0.05 0.00 0.36 0.00 0.00 54.97 54.46 3gyr s GLU 407 Cb -0.00 -2.12 -0.03 0.00 0.26 0.00 0.00 34.13 32.24 3gyr s GLU 407 CO -0.05 0.57 0.00 -0.06 -0.54 0.00 0.00 175.26 175.18 3gyr s PHE 408 N -0.69 3.10 -0.36 5.30 0.40 0.26 -0.16 117.98 125.83 3gyr s PHE 408 Ca 0.11 -0.20 -0.05 0.00 -0.60 0.00 0.00 56.93 56.19 3gyr s PHE 408 Cb -0.10 -2.02 0.06 0.00 0.51 0.00 0.00 43.02 41.47 3gyr s PHE 408 CO 0.00 -0.01 0.13 1.03 0.70 0.00 0.00 175.22 177.07 3gyr s ARG 409 N 0.49 2.47 -0.40 0.44 0.52 0.20 -0.50 118.95 122.17 3gyr s ARG 409 Ca -0.01 -1.36 -0.21 0.00 -0.52 0.00 0.00 55.73 53.63 3gyr s ARG 409 Cb -0.14 -3.48 0.01 0.00 0.52 0.00 0.00 34.95 31.87 3gyr s ARG 409 CO 0.02 -0.78 0.67 0.08 0.02 0.00 0.00 175.30 175.31 3gyr s VAL 410 N 1.33 4.82 0.14 3.52 1.01 -0.57 -1.11 120.40 129.53 3gyr s VAL 410 Ca 0.00 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 62.11 3gyr s VAL 410 Cb -0.21 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 31.94 3gyr s VAL 410 CO 0.01 -0.49 0.94 -0.60 0.00 0.00 0.00 175.10 174.96 3gyr s ARG 411 N 2.87 4.72 0.02 2.72 3.52 0.50 0.10 118.95 133.40 3gyr s ARG 411 Ca 0.25 1.43 -0.30 0.00 -0.13 0.00 0.00 55.73 56.98 3gyr s ARG 411 Cb -0.14 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 3gyr s ARG 411 CO 0.18 0.30 1.14 -2.00 -0.81 0.00 0.00 175.30 174.11 3gyr s GLU 412 N -0.30 4.44 0.47 5.12 2.12 -1.26 -1.89 118.70 127.39 3gyr s GLU 412 Ca 0.45 1.66 0.03 0.00 0.36 0.00 0.00 54.97 57.47 3gyr s GLU 412 Cb -0.24 -3.43 0.03 0.00 0.26 0.00 0.00 34.13 30.76 3gyr s GLU 412 CO 0.30 -0.26 0.27 0.25 -0.54 0.00 0.00 175.26 175.28 3gyr n THR 413 N 4.10 0.00 -0.79 -1.70 -2.24 -1.26 -4.96 114.28 107.43 3gyr n THR 413 Ca 0.09 -1.93 0.08 0.00 -2.27 0.00 0.00 64.05 60.02 3gyr n THR 413 Cb 0.47 0.03 0.20 0.00 -2.10 0.00 0.00 70.33 68.93 3gyr n THR 413 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gyr s GLU 415 N -2.38 3.00 -0.25 0.00 2.02 -1.26 -5.06 118.70 114.77 3gyr s GLU 415 Ca 0.33 0.49 0.01 0.00 0.02 0.00 0.00 54.97 55.83 3gyr s GLU 415 Cb 0.26 -2.04 0.05 0.00 0.10 0.00 0.00 34.13 32.50 3gyr s GLU 415 CO 0.08 -0.93 -0.10 -1.21 0.02 0.00 0.00 175.26 173.12 3gyr s GLU 416 N -5.31 2.47 -0.47 1.61 0.41 -1.26 -5.06 118.70 111.10 3gyr s GLU 416 Ca 0.57 -1.20 -0.20 0.00 -0.41 0.00 0.00 54.97 53.74 3gyr s GLU 416 Cb -0.11 -2.89 0.04 0.00 -1.78 0.00 0.00 34.13 29.39 3gyr s GLU 416 CO 0.52 -0.49 0.61 0.34 -0.49 0.00 0.00 175.26 175.74 3gyr s ASP 417 N 1.18 6.26 0.00 -0.19 -1.08 -1.26 -4.91 116.67 116.68 3gyr s ASP 417 Ca -0.05 -0.63 0.20 0.00 -0.52 0.00 0.00 52.55 51.55 3gyr s ASP 417 Cb -0.18 -2.29 0.68 0.00 -1.46 0.00 0.00 42.92 39.66 3gyr s ASP 417 CO -0.06 -0.80 1.51 -1.54 0.52 0.00 0.00 175.17 174.80 3gyr n SER 418 N 6.14 1.88 -3.36 -0.34 3.41 -1.26 -4.98 113.62 115.11 3gyr n SER 418 Ca -0.05 -1.76 -0.46 0.00 -0.26 0.00 0.00 58.87 56.35 3gyr n SER 418 Cb 0.47 -0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 64.22 3gyr n SER 418 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3gyr n PHE 419 N 0.47 0.76 -4.33 7.33 7.35 -1.26 -4.94 117.46 122.84 3gyr n PHE 419 Ca 0.16 0.80 -0.35 0.00 -0.76 0.00 0.00 57.45 57.30 3gyr n PHE 419 Cb 0.36 -1.57 -0.09 0.00 0.35 0.00 0.00 39.48 38.53 3gyr n PHE 419 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3gyr s ALA 420 N 0.78 3.30 -0.28 3.13 0.00 -1.26 -5.10 121.76 122.33 3gyr s ALA 420 Ca 0.70 -0.79 -0.00 0.00 0.00 0.00 0.00 51.96 51.87 3gyr s ALA 420 Cb -0.99 -1.54 0.05 0.00 0.00 0.00 0.00 23.12 20.65 3gyr s ALA 420 CO 0.48 0.54 -0.04 -1.17 0.00 0.00 0.00 175.76 175.57 3gyr s LEU 421 N -0.73 3.67 0.58 0.00 2.96 -1.26 -5.06 118.68 118.84 3gyr s LEU 421 Ca 0.11 -1.27 -0.14 0.00 -0.22 0.00 0.00 54.13 52.61 3gyr s LEU 421 Cb -0.12 -1.65 -0.05 0.00 0.50 0.00 0.00 46.19 44.87 3gyr s LEU 421 CO 0.02 -0.22 1.02 -2.16 -1.32 0.00 0.00 176.35 173.69 3gyr s PRO 422 N 1.21 3.62 0.22 0.98 0.04 -1.26 -4.97 135.00 134.85 3gyr s PRO 422 Ca -0.06 0.96 -0.08 0.00 0.04 0.00 0.00 61.00 61.86 3gyr s PRO 422 Cb -0.20 -2.08 0.24 0.00 0.04 0.00 0.00 34.50 32.50 3gyr s PRO 422 CO -0.03 -0.55 1.87 0.93 0.04 0.00 0.00 177.00 179.26 3gyr h GLU 423 N 0.33 0.96 -5.45 4.56 4.39 -1.99 -3.40 114.58 113.99 3gyr h GLU 423 Ca -0.46 -0.06 -0.64 0.00 0.34 0.00 0.00 59.36 58.55 3gyr h GLU 423 Cb 1.20 -0.22 -0.16 0.00 -0.10 0.00 0.00 28.75 29.47 3gyr h GLU 423 CO 0.60 0.64 -0.58 0.08 -1.16 0.00 0.00 179.01 178.59 3gyr s VAL 424 N -6.10 4.64 -0.20 3.13 1.01 -1.26 -4.06 120.40 117.55 3gyr s VAL 424 Ca -0.13 -0.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 3gyr s VAL 424 Cb 0.17 -3.05 -0.11 0.00 0.00 0.00 0.00 36.38 33.39 3gyr s VAL 424 CO 0.78 0.51 -0.21 -0.11 0.00 0.00 0.00 175.10 176.07 3gyr n LEU 425 N 3.11 2.33 -4.26 3.92 7.94 0.98 -4.96 117.00 126.07 3gyr n LEU 425 Ca -0.17 0.05 -0.33 0.00 -1.11 0.00 0.00 56.01 54.44 3gyr n LEU 425 Cb 0.53 -0.65 -0.15 0.00 0.53 0.00 0.00 43.42 43.67 3gyr n LEU 425 CO 0.33 0.66 -0.47 -0.55 -1.11 0.00 0.00 177.39 176.25 3gyr s SER 426 N -6.31 3.70 0.28 1.96 0.15 -1.13 -4.98 113.70 107.37 3gyr s SER 426 Ca -0.27 -0.47 0.15 0.00 0.70 0.00 0.00 55.95 56.05 3gyr s SER 426 Cb 0.09 -1.58 0.14 0.00 -1.71 0.00 0.00 66.02 62.96 3gyr s SER 426 CO 0.41 0.07 1.48 1.23 1.20 0.00 0.00 173.24 177.63 3gyr h GLY 427 N 7.41 0.00 2.00 9.45 0.00 -1.93 -3.32 103.07 116.68 3gyr h GLY 427 Ca -0.34 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 3gyr h GLY 427 CO 0.58 0.00 -0.23 1.48 0.00 0.00 0.00 176.54 178.37 3gyr h SER 428 N 0.00 0.00 -2.73 0.19 4.64 -2.00 -3.45 113.55 110.19 3gyr h SER 428 Ca -0.01 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.78 3gyr h SER 428 Cb 1.34 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.46 3gyr h SER 428 CO 0.07 0.23 0.96 0.12 -0.87 0.00 0.00 176.83 177.34 3gyr s PHE 429 N -3.33 2.65 -0.17 4.77 5.36 -1.25 -4.99 117.98 121.02 3gyr s PHE 429 Ca 0.03 0.43 0.00 0.00 -0.96 0.00 0.00 56.93 56.43 3gyr s PHE 429 Cb 0.08 -3.95 0.00 0.00 -0.34 0.00 0.00 43.02 38.81 3gyr s PHE 429 CO 0.67 -3.71 -0.16 1.03 -1.46 0.00 0.00 175.22 171.59 3gyr s ARG 430 N 2.11 3.17 0.13 10.12 1.81 -1.26 -5.07 118.95 129.96 3gyr s ARG 430 Ca 0.73 -0.76 -0.31 0.00 -1.72 0.00 0.00 55.73 53.66 3gyr s ARG 430 Cb -0.41 -2.64 -0.10 0.00 -0.45 0.00 0.00 34.95 31.34 3gyr s ARG 430 CO 0.32 -0.05 1.84 0.50 -0.68 0.00 0.00 175.30 177.23 3gyr s ARG 431 N 0.98 4.13 0.06 3.54 6.06 -1.26 -4.96 118.95 127.51 3gyr s ARG 431 Ca -0.02 2.61 -0.33 0.00 -2.50 0.00 0.00 55.73 55.49 3gyr s ARG 431 Cb -0.15 -3.60 -0.12 0.00 0.06 0.00 0.00 34.95 31.14 3gyr s ARG 431 CO -0.03 -0.85 1.79 -1.33 -2.50 0.00 0.00 175.30 172.38 3gyr n MET 432 N 5.70 2.42 -3.73 5.12 2.81 -1.26 -5.01 117.12 123.17 3gyr n MET 432 Ca 0.18 0.88 -0.35 0.00 -1.81 0.00 0.00 57.70 56.59 3gyr n MET 432 Cb 0.38 -2.73 -0.09 0.00 -0.71 0.00 0.00 33.22 30.08 3gyr n MET 432 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3gyr s SER 433 N 2.77 6.11 0.63 7.83 0.15 -1.26 -4.96 113.70 124.98 3gyr s SER 433 Ca 0.85 0.17 0.28 0.00 0.70 0.00 0.00 55.95 57.95 3gyr s SER 433 Cb -0.60 -2.08 1.49 0.00 -1.71 0.00 0.00 66.02 63.12 3gyr s SER 433 CO 0.42 0.14 1.87 -0.74 1.20 0.00 0.00 173.24 176.13 3gyr h HIS 434 N 6.97 0.00 0.00 3.44 2.76 -2.01 -1.85 115.15 124.46 3gyr h HIS 434 Ca -0.40 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.77 3gyr h HIS 434 Cb 1.16 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.12 3gyr h HIS 434 CO 0.61 0.00 0.00 -0.25 -1.30 0.00 0.00 177.93 176.99 3gyr n ASP 435 N -3.20 0.58 -4.72 3.26 8.00 -1.26 -4.72 116.55 114.49 3gyr n ASP 435 Ca 0.02 0.66 -0.42 0.00 0.71 0.00 0.00 54.79 55.76 3gyr n ASP 435 Cb 0.53 -0.77 -0.03 0.00 -0.02 0.00 0.00 41.12 40.82 3gyr n ASP 435 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gyr s ILE 436 N -3.31 3.57 0.19 0.53 1.01 -0.70 -4.96 121.20 117.54 3gyr s ILE 436 Ca 0.04 1.17 -0.33 0.00 0.00 0.00 0.00 60.65 61.53 3gyr s ILE 436 Cb 0.09 -3.75 -0.15 0.00 0.01 0.00 0.00 42.46 38.66 3gyr s ILE 436 CO 0.35 0.11 1.30 -2.65 0.00 0.00 0.00 174.94 174.05 3gyr n PRO 437 N 3.59 1.56 -3.60 2.79 -0.02 -1.26 -4.97 135.00 133.10 3gyr n PRO 437 Ca 0.09 0.56 -0.13 0.00 -2.02 0.00 0.00 63.50 61.99 3gyr n PRO 437 Cb 0.44 -2.14 -0.05 0.00 -0.02 0.00 0.00 33.50 31.72 3gyr n PRO 437 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3gyr s HIS 438 N -0.02 -0.38 0.87 6.00 -3.43 -1.26 -4.31 115.29 112.77 3gyr s HIS 438 Ca 0.72 0.39 -0.10 0.00 -0.80 0.00 0.00 55.06 55.28 3gyr s HIS 438 Cb -0.77 0.31 0.17 0.00 -1.43 0.00 0.00 32.58 30.86 3gyr s HIS 438 CO 0.50 -0.63 1.20 0.20 -2.00 0.00 0.00 174.74 174.01 3gyr s GLY 439 N -2.01 1.77 0.00 -1.38 0.00 -0.39 -4.86 107.32 100.44 3gyr s GLY 439 Ca -0.05 -1.39 0.04 0.00 0.00 0.00 0.00 44.72 43.32 3gyr s GLY 439 CO -0.02 -0.70 -0.13 0.30 0.00 0.00 0.00 173.10 172.56 3gyr s HIS 440 N -3.61 1.12 0.06 1.90 3.76 -1.26 -0.46 115.29 116.80 3gyr s HIS 440 Ca 0.71 -0.24 0.07 0.00 -0.15 0.00 0.00 55.06 55.45 3gyr s HIS 440 Cb -0.05 -0.71 -0.03 0.00 1.11 0.00 0.00 32.58 32.91 3gyr s HIS 440 CO 0.50 -0.01 -0.19 1.03 -0.85 0.00 0.00 174.74 175.22 3gyr s ARG 441 N -0.46 1.22 -0.23 1.40 1.81 -0.44 -4.95 118.95 117.30 3gyr s ARG 441 Ca 0.04 -0.95 0.00 0.00 -1.72 0.00 0.00 55.73 53.10 3gyr s ARG 441 Cb -0.05 -1.34 0.03 0.00 -0.45 0.00 0.00 34.95 33.14 3gyr s ARG 441 CO -0.00 0.33 -0.12 -1.17 -0.68 0.00 0.00 175.30 173.66 3gyr s LEU 442 N -1.34 2.89 -0.24 2.53 2.96 -1.26 -0.89 118.68 123.33 3gyr s LEU 442 Ca 0.06 -0.90 -0.03 0.00 -0.22 0.00 0.00 54.13 53.04 3gyr s LEU 442 Cb -0.09 -1.58 0.01 0.00 0.50 0.00 0.00 46.19 45.03 3gyr s LEU 442 CO 0.02 -0.10 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.28 3gyr s ILE 443 N 1.27 3.15 -0.08 6.68 -1.09 0.24 -2.05 121.20 129.31 3gyr s ILE 443 Ca -0.00 -0.78 -0.14 0.00 -2.23 0.00 0.00 60.65 57.50 3gyr s ILE 443 Cb -0.16 -2.53 -0.05 0.00 -1.58 0.00 0.00 42.46 38.14 3gyr s ILE 443 CO -0.07 0.29 0.34 -0.69 -1.23 0.00 0.00 174.94 173.57 3gyr s VAL 444 N 1.40 5.21 -0.28 2.92 1.01 -0.13 -0.15 120.40 130.37 3gyr s VAL 444 Ca 0.03 0.66 -0.08 0.00 0.00 0.00 0.00 61.98 62.59 3gyr s VAL 444 Cb -0.16 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 3gyr s VAL 444 CO -0.04 0.50 0.10 -0.76 0.00 0.00 0.00 175.10 174.90 3gyr s LEU 445 N -0.39 3.78 0.17 3.92 1.43 0.10 -0.31 118.68 127.37 3gyr s LEU 445 Ca 0.20 -0.46 -0.00 0.00 -1.03 0.00 0.00 54.13 52.84 3gyr s LEU 445 Cb -0.15 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 3gyr s LEU 445 CO 0.09 -0.13 0.35 0.42 0.23 0.00 0.00 176.35 177.30 3gyr s THR 446 N 1.58 5.24 0.61 5.49 -4.23 -0.79 -1.38 115.64 122.16 3gyr s THR 446 Ca 0.05 -0.38 -0.18 0.00 -1.18 0.00 0.00 61.69 59.99 3gyr s THR 446 Cb -0.16 -3.71 -0.03 0.00 1.34 0.00 0.00 72.50 69.94 3gyr s THR 446 CO 0.04 -0.10 1.16 -2.16 -0.54 0.00 0.00 174.62 173.02 3gyr s PRO 447 N -3.14 2.96 0.28 3.99 0.04 -1.26 -3.71 135.00 134.16 3gyr s PRO 447 Ca 0.38 1.66 0.02 0.00 0.04 0.00 0.00 61.00 63.10 3gyr s PRO 447 Cb -0.11 -1.95 0.61 0.00 0.04 0.00 0.00 34.50 33.09 3gyr s PRO 447 CO 0.28 -1.17 1.78 -1.35 0.04 0.00 0.00 177.00 176.58 3gyr h PRO 448 N 0.68 0.70 -0.02 0.56 0.11 -1.84 -2.54 132.00 129.65 3gyr h PRO 448 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3gyr h PRO 448 Cb 1.28 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3gyr h PRO 448 CO 0.55 0.46 0.00 0.41 -0.21 0.00 0.00 178.00 179.21 3gyr n GLY 449 N -1.33 -0.46 3.76 -0.55 0.00 -1.26 -3.17 105.19 102.17 3gyr n GLY 449 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 3gyr n GLY 449 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gyr s THR 450 N -1.96 3.37 0.12 2.61 2.01 -0.96 -4.67 115.64 116.16 3gyr s THR 450 Ca 0.00 1.34 -0.35 0.00 0.31 0.00 0.00 61.69 62.99 3gyr s THR 450 Cb 0.00 -3.85 -0.17 0.00 0.01 0.00 0.00 72.50 68.49 3gyr s THR 450 CO 0.00 0.30 1.15 1.17 -0.69 0.00 0.00 174.62 176.55 3gyr n LYS 451 N 1.36 0.85 -0.60 4.92 4.81 -0.60 -1.80 118.16 127.10 3gyr n LYS 451 Ca 0.00 0.31 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 3gyr n LYS 451 Cb 0.44 -1.81 0.00 0.00 0.02 0.00 0.00 35.03 33.69 3gyr n LYS 451 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gyr n GLY 452 N 2.05 1.79 0.00 3.14 0.00 -1.26 -4.87 105.19 106.05 3gyr n GLY 452 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 3gyr n GLY 452 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gyr n SER 453 N 0.00 0.40 -1.52 1.61 3.41 -0.75 -4.95 113.62 111.83 3gyr n SER 453 Ca 0.00 -0.07 -0.17 0.00 -0.26 0.00 0.00 58.87 58.37 3gyr n SER 453 Cb 0.00 0.08 -0.05 0.00 -0.26 0.00 0.00 64.21 63.98 3gyr n SER 453 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gyr n GLY 454 N 1.49 1.01 1.65 5.00 0.00 -1.26 -2.93 105.19 110.14 3gyr n GLY 454 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3gyr n GLY 454 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 455 N -0.93 0.57 3.86 -0.02 0.00 -1.20 -4.89 105.19 102.58 3gyr n GLY 455 Ca -0.18 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 3gyr n GLY 455 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3gyr s HIS 456 N -2.00 3.49 0.57 1.61 3.76 -1.15 -4.60 115.29 116.97 3gyr s HIS 456 Ca 0.00 0.37 -0.19 0.00 -0.15 0.00 0.00 55.06 55.09 3gyr s HIS 456 Cb 0.00 -1.84 -0.05 0.00 1.11 0.00 0.00 32.58 31.80 3gyr s HIS 456 CO 0.00 0.65 1.17 -1.25 -0.85 0.00 0.00 174.74 174.46 3gyr s PRO 457 N -1.55 3.18 0.13 8.40 0.04 -1.26 -4.36 135.00 139.57 3gyr s PRO 457 Ca 0.22 1.72 0.03 0.00 0.04 0.00 0.00 61.00 63.01 3gyr s PRO 457 Cb -0.12 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 3gyr s PRO 457 CO 0.12 -1.01 -0.08 -1.21 0.04 0.00 0.00 177.00 174.86 3gyr s GLU 458 N -3.30 0.97 -0.19 4.56 2.02 -1.24 -4.77 118.70 116.74 3gyr s GLU 458 Ca 0.75 -1.41 -0.22 0.00 0.02 0.00 0.00 54.97 54.11 3gyr s GLU 458 Cb -0.27 -0.42 -0.02 0.00 0.10 0.00 0.00 34.13 33.52 3gyr s GLU 458 CO 0.30 0.02 0.69 0.42 0.02 0.00 0.00 175.26 176.71 3gyr s ILE 459 N -3.48 4.97 -0.23 -1.63 1.01 -1.26 -1.89 121.20 118.70 3gyr s ILE 459 Ca 0.15 1.32 -0.05 0.00 0.00 0.00 0.00 60.65 62.07 3gyr s ILE 459 Cb 0.04 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.49 3gyr s ILE 459 CO -0.01 0.08 -0.01 0.26 0.00 0.00 0.00 174.94 175.26 3gyr s TRP 460 N 2.04 3.00 -0.09 3.97 0.52 0.58 -3.92 118.94 125.04 3gyr s TRP 460 Ca 0.31 -0.75 -0.27 0.00 0.02 0.00 0.00 56.10 55.41 3gyr s TRP 460 Cb -0.16 -2.14 -0.02 0.00 -1.15 0.00 0.00 33.47 29.99 3gyr s TRP 460 CO 0.11 -0.47 0.88 -1.21 0.02 0.00 0.00 176.95 176.27 3gyr s GLU 461 N 1.49 4.43 0.05 4.98 2.02 -0.09 -0.96 118.70 130.61 3gyr s GLU 461 Ca 0.06 1.17 0.03 0.00 0.02 0.00 0.00 54.97 56.26 3gyr s GLU 461 Cb -0.15 -3.51 -0.04 0.00 0.10 0.00 0.00 34.13 30.54 3gyr s GLU 461 CO -0.01 -0.16 -0.00 -1.64 0.02 0.00 0.00 175.26 173.47 3gyr s MET 462 N 1.50 2.64 -0.06 1.61 -1.94 -0.87 0.96 119.30 123.14 3gyr s MET 462 Ca 0.44 -0.75 0.05 0.00 -1.71 0.00 0.00 55.69 53.73 3gyr s MET 462 Cb -0.18 -2.59 -0.01 0.00 2.01 0.00 0.00 34.83 34.06 3gyr s MET 462 CO 0.19 0.58 -0.23 0.00 -0.01 0.00 0.00 175.02 175.55 3gyr s ALA 463 N -1.21 2.00 0.29 3.03 0.00 0.82 -4.59 121.76 122.09 3gyr s ALA 463 Ca 0.23 -0.94 -0.30 0.00 0.00 0.00 0.00 51.96 50.95 3gyr s ALA 463 Cb -0.12 -0.65 -0.11 0.00 0.00 0.00 0.00 23.12 22.24 3gyr s ALA 463 CO 0.15 0.36 1.52 -2.00 0.00 0.00 0.00 175.76 175.78 3gyr s GLU 464 N -0.02 4.18 -0.12 0.00 2.12 -1.26 0.21 118.70 123.82 3gyr s GLU 464 Ca -0.06 2.47 -0.10 0.00 0.36 0.00 0.00 54.97 57.63 3gyr s GLU 464 Cb -0.14 -3.05 -0.05 0.00 0.26 0.00 0.00 34.13 31.16 3gyr s GLU 464 CO 0.04 -0.53 0.22 0.08 -0.54 0.00 0.00 175.26 174.53 3gyr s VAL 465 N -0.18 5.36 -0.48 3.70 1.01 0.81 -4.84 120.40 125.79 3gyr s VAL 465 Ca 0.60 0.39 0.08 0.00 0.00 0.00 0.00 61.98 63.05 3gyr s VAL 465 Cb -0.45 -3.51 0.33 0.00 0.00 0.00 0.00 36.38 32.75 3gyr s VAL 465 CO 0.48 0.54 0.81 -0.62 0.00 0.00 0.00 175.10 176.31 3gyr n GLU 466 N 2.46 2.01 0.00 2.72 1.02 -1.26 -4.66 120.64 122.93 3gyr n GLU 466 Ca -0.17 -4.08 0.00 0.00 -0.02 0.00 0.00 57.16 52.89 3gyr n GLU 466 Cb 0.53 -1.93 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 3gyr n GLU 466 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3gyr n GLN 472 N 0.19 0.00 -3.83 3.49 -0.06 -1.26 -5.20 117.38 110.71 3gyr n GLN 472 Ca 0.28 0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 55.21 3gyr n GLN 472 Cb 0.52 0.00 -0.01 0.00 -4.06 0.00 0.00 30.24 26.69 3gyr n GLN 472 CO 0.00 0.00 0.00 0.14 -0.20 0.00 0.00 177.06 177.00 3gyr s VAL 473 N 0.00 0.00 0.19 1.69 -7.23 -1.26 -4.68 120.40 109.11 3gyr s VAL 473 Ca 0.00 -0.93 -0.30 0.00 -1.81 0.00 0.00 61.98 58.94 3gyr s VAL 473 Cb 0.00 -2.28 -0.08 0.00 0.56 0.00 0.00 36.38 34.59 3gyr s VAL 473 CO 0.00 0.00 1.05 -2.16 -0.31 0.00 0.00 175.10 173.68 3gyr s PRO 474 N -3.32 4.66 0.01 4.82 0.04 -1.26 -5.16 135.00 134.77 3gyr s PRO 474 Ca 0.13 1.65 -0.04 0.00 0.04 0.00 0.00 61.00 62.78 3gyr s PRO 474 Cb -0.05 -3.28 -0.01 0.00 0.04 0.00 0.00 34.50 31.20 3gyr s PRO 474 CO 0.07 0.18 0.07 0.00 0.04 0.00 0.00 177.00 177.36 3gyr s ALA 475 N -0.46 -0.14 -0.26 8.56 0.00 -1.26 -5.07 121.76 123.13 3gyr s ALA 475 Ca 0.47 -0.27 -0.42 0.00 0.00 0.00 0.00 51.96 51.73 3gyr s ALA 475 Cb -0.28 0.10 -0.19 0.00 0.00 0.00 0.00 23.12 22.75 3gyr s ALA 475 CO 0.34 -0.17 1.48 -1.91 0.00 0.00 0.00 175.76 175.50 3gyr n GLU 476 N 1.68 0.43 -0.80 0.00 2.13 -1.24 -0.96 120.64 121.87 3gyr n GLU 476 Ca -0.22 0.16 0.00 0.00 0.66 0.00 0.00 57.16 57.76 3gyr n GLU 476 Cb 0.56 -1.72 0.00 0.00 0.27 0.00 0.00 31.44 30.55 3gyr n GLU 476 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3gyr n GLY 477 N 3.29 0.74 3.47 8.31 0.00 0.23 -4.93 105.19 116.30 3gyr n GLY 477 Ca 0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 3gyr n GLY 477 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gyr s VAL 478 N -2.74 3.89 -0.03 1.61 1.01 -0.13 0.98 120.40 124.98 3gyr s VAL 478 Ca 0.00 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.66 3gyr s VAL 478 Cb 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.65 3gyr s VAL 478 CO 0.00 0.46 -0.11 -0.63 0.00 0.00 0.00 175.10 174.82 3gyr s ILE 479 N 0.69 0.97 0.19 2.22 1.01 0.19 -1.77 121.20 124.69 3gyr s ILE 479 Ca -0.01 -0.47 0.11 0.00 0.00 0.00 0.00 60.65 60.27 3gyr s ILE 479 Cb -0.14 -0.85 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 3gyr s ILE 479 CO 0.02 0.29 -0.20 -1.10 0.00 0.00 0.00 174.94 173.95 3gyr s GLN 480 N 0.11 1.66 -0.17 2.79 -0.21 -1.26 -0.58 119.66 121.98 3gyr s GLN 480 Ca -0.02 -1.46 -0.06 0.00 0.02 0.00 0.00 55.36 53.84 3gyr s GLN 480 Cb -0.09 -1.93 0.08 0.00 1.00 0.00 0.00 33.01 32.07 3gyr s GLN 480 CO 0.01 0.41 0.37 0.08 -2.12 0.00 0.00 175.29 174.03 3gyr s VAL 481 N -1.67 -0.55 -0.29 1.09 1.01 -0.41 -0.30 120.40 119.28 3gyr s VAL 481 Ca 0.22 0.20 -0.18 0.00 0.00 0.00 0.00 61.98 62.21 3gyr s VAL 481 Cb -0.08 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 3gyr s VAL 481 CO 0.11 0.08 0.54 -0.89 0.00 0.00 0.00 175.10 174.94 3gyr s THR 482 N 2.49 5.03 0.26 3.92 2.01 -0.42 -0.16 115.64 128.78 3gyr s THR 482 Ca -0.01 0.74 -0.04 0.00 0.31 0.00 0.00 61.69 62.69 3gyr s THR 482 Cb -0.12 -3.89 0.06 0.00 0.01 0.00 0.00 72.50 68.56 3gyr s THR 482 CO -0.11 -0.03 0.32 0.61 -0.69 0.00 0.00 174.62 174.71 3gyr n GLY 483 N 4.50 -1.59 0.25 4.40 0.00 -0.13 -2.28 105.19 110.35 3gyr n GLY 483 Ca -0.04 -1.62 0.12 0.00 0.00 0.00 0.00 46.02 44.48 3gyr n GLY 483 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr h ALA 484 N -2.01 1.17 -0.11 4.61 0.00 -1.93 -2.21 119.26 118.78 3gyr h ALA 484 Ca -0.11 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3gyr h ALA 484 Cb 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3gyr h ALA 484 CO 0.07 0.20 0.00 -0.40 0.00 0.00 0.00 179.25 179.12 3gyr n ASP 485 N -3.53 1.14 0.00 0.00 5.75 -1.26 -4.90 116.55 113.75 3gyr n ASP 485 Ca -0.01 -2.07 0.00 0.00 -0.01 0.00 0.00 54.79 52.70 3gyr n ASP 485 Cb 0.31 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 3gyr n ASP 485 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3gyr n GLY 486 N 0.44 1.37 3.76 6.12 0.00 -0.83 -4.97 105.19 111.08 3gyr n GLY 486 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3gyr n GLY 486 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gyr s ARG 487 N 0.00 3.32 -0.17 1.61 3.52 -1.26 -4.79 118.95 121.17 3gyr s ARG 487 Ca 0.00 1.92 -0.04 0.00 -0.13 0.00 0.00 55.73 57.48 3gyr s ARG 487 Cb 0.00 -2.20 -0.02 0.00 -1.56 0.00 0.00 34.95 31.17 3gyr s ARG 487 CO 0.00 -0.95 -0.03 0.99 -0.81 0.00 0.00 175.30 174.49 3gyr s THR 488 N -1.50 3.83 0.31 4.11 2.01 -1.26 -0.95 115.64 122.18 3gyr s THR 488 Ca 0.71 -0.37 0.08 0.00 0.31 0.00 0.00 61.69 62.41 3gyr s THR 488 Cb -0.32 -2.69 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 3gyr s THR 488 CO 0.38 0.48 0.18 -0.54 -0.69 0.00 0.00 174.62 174.42 3gyr s LYS 489 N 0.56 2.60 -0.07 4.92 1.02 0.78 -4.94 119.74 124.61 3gyr s LYS 489 Ca -0.03 -1.33 0.03 0.00 0.02 0.00 0.00 55.97 54.66 3gyr s LYS 489 Cb -0.14 -2.36 0.01 0.00 -0.52 0.00 0.00 37.83 34.82 3gyr s LYS 489 CO 0.03 0.21 -0.14 0.99 -0.92 0.00 0.00 175.35 175.52 3gyr s THR 490 N -2.30 1.27 -0.02 2.17 2.01 -1.26 -1.29 115.64 116.21 3gyr s THR 490 Ca 0.37 -0.56 0.03 0.00 0.31 0.00 0.00 61.69 61.83 3gyr s THR 490 Cb -0.05 -1.15 -0.00 0.00 0.01 0.00 0.00 72.50 71.31 3gyr s THR 490 CO 0.24 0.39 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.14 3gyr s TYR 491 N 0.61 1.05 -0.11 4.92 1.51 0.25 -0.13 117.35 125.45 3gyr s TYR 491 Ca -0.15 -0.25 -0.02 0.00 -1.01 0.00 0.00 57.07 55.64 3gyr s TYR 491 Cb -0.16 -0.73 -0.03 0.00 -0.11 0.00 0.00 41.96 40.93 3gyr s TYR 491 CO 0.05 -0.09 -0.03 0.50 -1.11 0.00 0.00 175.55 174.86 3gyr s ARG 492 N 0.07 3.17 0.42 -0.62 3.52 0.13 -0.64 118.95 125.00 3gyr s ARG 492 Ca -0.01 -0.49 -0.25 0.00 -0.13 0.00 0.00 55.73 54.84 3gyr s ARG 492 Cb -0.08 -2.78 -0.08 0.00 -1.56 0.00 0.00 34.95 30.45 3gyr s ARG 492 CO 0.00 0.52 1.24 0.50 -0.81 0.00 0.00 175.30 176.75 3gyr s ARG 493 N -0.39 3.94 0.00 5.12 3.52 0.27 -0.13 118.95 131.29 3gyr s ARG 493 Ca 0.07 1.99 0.00 0.00 -0.13 0.00 0.00 55.73 57.66 3gyr s ARG 493 Cb -0.12 -2.67 0.00 0.00 -1.56 0.00 0.00 34.95 30.60 3gyr s ARG 493 CO 0.02 -0.46 0.00 -2.37 -0.81 0.00 0.00 175.30 171.68 3gyr n THR 494 N -0.01 0.00 -3.57 4.11 5.66 0.27 -4.85 114.28 115.89 3gyr n THR 494 Ca 0.05 -0.05 -0.17 0.00 -3.05 0.00 0.00 64.05 60.83 3gyr n THR 494 Cb 0.45 0.39 -0.07 0.00 -1.55 0.00 0.00 70.33 69.55 3gyr n THR 494 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3gyr s ALA 495 N -0.65 -1.62 0.00 1.79 0.00 -1.15 -4.90 121.76 115.23 3gyr s ALA 495 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.20 3gyr s ALA 495 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.01 3gyr s ALA 495 CO 0.00 -0.35 0.06 2.89 0.00 0.00 0.00 175.76 178.36 3gyr n ARG 496 N 1.17 0.89 -3.48 0.00 1.85 -1.25 -0.92 116.66 114.91 3gyr n ARG 496 Ca -0.19 -0.06 -0.11 0.00 -1.00 0.00 0.00 57.85 56.49 3gyr n ARG 496 Cb 0.57 -0.35 -0.02 0.00 -1.05 0.00 0.00 32.46 31.61 3gyr n ARG 496 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 3gyr s THR 497 N -0.14 0.00 0.22 8.89 -1.32 -1.26 -4.30 115.64 117.73 3gyr s THR 497 Ca 0.00 -0.15 -0.13 0.00 -1.21 0.00 0.00 61.69 60.21 3gyr s THR 497 Cb 0.00 -1.12 0.26 0.00 -1.51 0.00 0.00 72.50 70.12 3gyr s THR 497 CO 0.00 -0.02 1.62 0.15 -2.21 0.00 0.00 174.62 174.16 3gyr h PHE 498 N 2.02 -0.33 -0.28 9.09 3.04 -1.25 -1.67 116.94 127.57 3gyr h PHE 498 Ca -0.32 0.06 0.00 0.00 3.98 0.00 0.00 57.97 61.69 3gyr h PHE 498 Cb 1.30 0.25 0.00 0.00 2.56 0.00 0.00 35.95 40.06 3gyr h PHE 498 CO 0.26 -0.28 0.00 0.09 -2.02 0.00 0.00 178.31 176.36 3gyr n ASN 499 N -5.44 1.71 -4.67 0.41 5.03 -1.26 -4.54 115.26 106.49 3gyr n ASN 499 Ca 0.09 -1.91 -0.32 0.00 0.87 0.00 0.00 54.58 53.31 3gyr n ASN 499 Cb 0.35 -0.19 0.16 0.00 -1.02 0.00 0.00 39.78 39.08 3gyr n ASN 499 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 3gyr n ASP 500 N 0.40 0.56 -4.52 6.41 8.00 -0.63 -4.93 116.55 121.84 3gyr n ASP 500 Ca 0.13 0.48 -0.43 0.00 0.71 0.00 0.00 54.79 55.67 3gyr n ASP 500 Cb 0.29 -1.49 -0.00 0.00 -0.02 0.00 0.00 41.12 39.90 3gyr n ASP 500 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gyr n GLY 501 N 0.38 -0.92 3.60 0.44 0.00 -1.26 -4.86 105.19 102.57 3gyr n GLY 501 Ca 0.12 0.18 -0.50 0.00 0.00 0.00 0.00 46.02 45.82 3gyr n GLY 501 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3gyr n LEU 502 N 1.20 1.91 -0.07 0.99 7.94 -1.26 -4.92 117.00 122.79 3gyr n LEU 502 Ca 0.11 1.12 -0.06 0.00 -1.11 0.00 0.00 56.01 56.07 3gyr n LEU 502 Cb 0.36 -1.24 -0.02 0.00 0.53 0.00 0.00 43.42 43.04 3gyr n LEU 502 CO 0.57 -0.96 -0.48 0.61 -1.11 0.00 0.00 177.39 176.02 3gyr n GLY 503 N 2.51 -0.62 3.58 -3.96 0.00 -1.26 -4.99 105.19 100.45 3gyr n GLY 503 Ca 0.17 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 3gyr n GLY 503 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gyr s PHE 504 N -2.40 3.21 -0.13 1.61 0.08 -1.26 -5.04 117.98 114.05 3gyr s PHE 504 Ca -0.20 0.35 0.02 0.00 0.12 0.00 0.00 56.93 57.22 3gyr s PHE 504 Cb 0.03 -2.84 -0.00 0.00 -0.57 0.00 0.00 43.02 39.64 3gyr s PHE 504 CO 0.30 -0.43 -0.19 0.99 -0.10 0.00 0.00 175.22 175.79 3gyr s THR 505 N 2.35 2.44 -0.07 0.64 2.01 -1.26 -1.59 115.64 120.16 3gyr s THR 505 Ca 0.19 -0.87 0.01 0.00 0.31 0.00 0.00 61.69 61.34 3gyr s THR 505 Cb -0.15 -1.99 0.02 0.00 0.01 0.00 0.00 72.50 70.39 3gyr s THR 505 CO 0.12 0.54 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.87 3gyr s ILE 506 N 0.54 0.93 0.15 1.82 1.01 0.77 -4.98 121.20 121.44 3gyr s ILE 506 Ca -0.12 -0.33 -0.31 0.00 0.00 0.00 0.00 60.65 59.89 3gyr s ILE 506 Cb -0.16 -0.90 -0.09 0.00 0.01 0.00 0.00 42.46 41.32 3gyr s ILE 506 CO 0.04 0.32 1.43 -0.83 0.00 0.00 0.00 174.94 175.90 3gyr s GLY 507 N 0.95 1.95 0.36 6.18 0.00 -1.26 -1.18 107.32 114.32 3gyr s GLY 507 Ca -0.10 1.20 -0.28 0.00 0.00 0.00 0.00 44.72 45.54 3gyr s GLY 507 CO 0.00 2.38 1.51 1.85 0.00 0.00 0.00 173.10 178.85 3gyr s GLU 508 N 0.85 4.11 0.00 2.90 -6.30 0.13 -1.87 118.70 118.51 3gyr s GLU 508 Ca 0.65 2.58 0.00 0.00 -2.50 0.00 0.00 54.97 55.70 3gyr s GLU 508 Cb -0.39 -2.98 0.00 0.00 0.00 0.00 0.00 34.13 30.76 3gyr s GLU 508 CO 0.32 -0.56 0.00 0.41 0.02 0.00 0.00 175.26 175.45 3gyr n GLY 509 N 0.84 1.98 3.88 -1.50 0.00 0.92 -4.59 105.19 106.72 3gyr n GLY 509 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 3gyr n GLY 509 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gyr s THR 510 N -3.28 4.53 0.01 2.61 -4.23 -0.78 -4.73 115.64 109.78 3gyr s THR 510 Ca 0.00 0.63 -0.01 0.00 -1.18 0.00 0.00 61.69 61.14 3gyr s THR 510 Cb 0.00 -3.79 -0.04 0.00 1.34 0.00 0.00 72.50 70.01 3gyr s THR 510 CO 0.00 -0.98 0.13 -1.00 -0.54 0.00 0.00 174.62 172.23 3gyr s HIS 511 N -3.10 3.39 0.02 3.99 3.76 -1.26 -1.19 115.29 120.90 3gyr s HIS 511 Ca 0.54 0.24 0.01 0.00 -0.15 0.00 0.00 55.06 55.70 3gyr s HIS 511 Cb -0.11 -1.75 -0.02 0.00 1.11 0.00 0.00 32.58 31.81 3gyr s HIS 511 CO 0.51 0.58 -0.04 -1.21 -0.85 0.00 0.00 174.74 173.73 3gyr s GLU 512 N -2.00 0.36 -0.24 1.40 2.02 -0.77 -1.26 118.70 118.21 3gyr s GLU 512 Ca 0.27 -0.55 -0.09 0.00 0.02 0.00 0.00 54.97 54.62 3gyr s GLU 512 Cb -0.12 -0.08 -0.04 0.00 0.10 0.00 0.00 34.13 33.98 3gyr s GLU 512 CO 0.18 0.00 0.12 -1.14 0.02 0.00 0.00 175.26 174.44 3gyr s GLN 513 N -1.21 3.90 -0.13 1.61 0.74 0.40 -1.99 119.66 122.98 3gyr s GLN 513 Ca -0.11 -0.36 -0.06 0.00 0.05 0.00 0.00 55.36 54.88 3gyr s GLN 513 Cb -0.08 -3.42 -0.04 0.00 1.10 0.00 0.00 33.01 30.57 3gyr s GLN 513 CO -0.00 -0.01 0.10 -1.58 -0.55 0.00 0.00 175.29 173.25 3gyr s TRP 514 N 1.20 3.45 -0.23 1.67 0.52 0.11 -1.32 118.94 124.34 3gyr s TRP 514 Ca 0.06 0.39 -0.03 0.00 0.02 0.00 0.00 56.10 56.54 3gyr s TRP 514 Cb -0.14 -1.95 0.01 0.00 -1.15 0.00 0.00 33.47 30.23 3gyr s TRP 514 CO 0.05 0.56 -0.06 0.99 0.02 0.00 0.00 176.95 178.51 3gyr s THR 515 N -0.68 3.10 -0.42 2.01 2.01 -0.07 -0.78 115.64 120.81 3gyr s THR 515 Ca 0.12 -0.71 -0.19 0.00 0.31 0.00 0.00 61.69 61.22 3gyr s THR 515 Cb -0.12 -2.46 0.02 0.00 0.01 0.00 0.00 72.50 69.95 3gyr s THR 515 CO 0.02 0.35 0.55 -0.36 -0.69 0.00 0.00 174.62 174.49 3gyr s PHE 516 N 1.41 3.12 -0.44 4.92 0.40 0.08 -0.59 117.98 126.88 3gyr s PHE 516 Ca 0.04 -0.16 -0.12 0.00 -0.60 0.00 0.00 56.93 56.09 3gyr s PHE 516 Cb -0.15 -3.12 0.07 0.00 0.51 0.00 0.00 43.02 40.33 3gyr s PHE 516 CO -0.05 -0.77 0.31 -1.17 0.70 0.00 0.00 175.22 174.25 3gyr s LEU 517 N 2.50 5.31 -0.39 -0.37 2.96 0.78 -0.35 118.68 129.13 3gyr s LEU 517 Ca 0.18 -1.39 -0.18 0.00 -0.22 0.00 0.00 54.13 52.52 3gyr s LEU 517 Cb -0.15 -2.07 0.01 0.00 0.50 0.00 0.00 46.19 44.47 3gyr s LEU 517 CO 0.16 -0.57 0.48 0.21 -1.32 0.00 0.00 176.35 175.32 3gyr s ASN 518 N 2.27 6.25 0.00 3.68 3.84 0.10 -0.72 114.94 130.36 3gyr s ASN 518 Ca 0.03 -0.33 0.28 0.00 0.21 0.00 0.00 52.86 53.05 3gyr s ASN 518 Cb -0.23 -2.25 1.02 0.00 -0.55 0.00 0.00 41.25 39.24 3gyr s ASN 518 CO 0.04 -0.54 1.73 0.18 -2.79 0.00 0.00 177.10 175.72 3gyr n LEU 519 N 5.72 0.73 -4.74 3.21 4.77 -0.48 -0.65 117.00 125.56 3gyr n LEU 519 Ca -0.06 -0.12 -0.24 0.00 -0.03 0.00 0.00 56.01 55.57 3gyr n LEU 519 Cb 0.48 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 3gyr n LEU 519 CO 0.46 0.14 -0.16 -0.94 -1.33 0.00 0.00 177.39 175.55 3gyr s SER 520 N -2.48 4.51 0.00 -1.43 1.04 -1.25 -4.74 113.70 109.35 3gyr s SER 520 Ca 0.27 -0.98 0.20 0.00 0.48 0.00 0.00 55.95 55.92 3gyr s SER 520 Cb 0.20 -0.54 0.74 0.00 0.10 0.00 0.00 66.02 66.52 3gyr s SER 520 CO 0.49 -0.48 1.54 -0.81 0.98 0.00 0.00 173.24 174.96 3gyr n PRO 521 N -1.22 1.69 -3.17 4.02 -0.04 -1.26 -3.24 135.00 131.77 3gyr n PRO 521 Ca -0.01 -1.03 -0.39 0.00 -0.04 0.00 0.00 63.50 62.02 3gyr n PRO 521 Cb 0.63 -1.38 -0.05 0.00 -0.04 0.00 0.00 33.50 32.66 3gyr n PRO 521 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3gyr s ILE 522 N -1.79 5.10 -0.06 0.52 1.01 -1.26 -4.52 121.20 120.20 3gyr s ILE 522 Ca 0.31 1.20 -0.30 0.00 0.00 0.00 0.00 60.65 61.86 3gyr s ILE 522 Cb 0.17 -3.93 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 3gyr s ILE 522 CO 0.25 0.26 1.02 -0.22 0.00 0.00 0.00 174.94 176.24 3gyr s LEU 523 N 0.92 4.30 -0.21 2.97 0.20 -1.26 -4.52 118.68 121.08 3gyr s LEU 523 Ca 0.31 1.61 -0.02 0.00 0.69 0.00 0.00 54.13 56.73 3gyr s LEU 523 Cb -0.16 -3.56 0.01 0.00 -0.43 0.00 0.00 46.19 42.04 3gyr s LEU 523 CO 0.14 -0.39 -0.11 -1.00 -0.29 0.00 0.00 176.35 174.70 3gyr s HIS 524 N 1.63 2.89 -0.58 5.38 3.76 -0.79 -4.91 115.29 122.66 3gyr s HIS 524 Ca 0.50 -1.29 -0.28 0.00 -0.15 0.00 0.00 55.06 53.85 3gyr s HIS 524 Cb -0.20 -2.02 0.03 0.00 1.11 0.00 0.00 32.58 31.49 3gyr s HIS 524 CO 0.22 -0.67 1.25 -1.25 -0.85 0.00 0.00 174.74 173.44 3gyr s PRO 525 N 1.39 3.45 0.23 8.40 0.04 -1.26 -0.38 135.00 146.85 3gyr s PRO 525 Ca 0.05 0.28 -0.16 0.00 0.04 0.00 0.00 61.00 61.21 3gyr s PRO 525 Cb -0.14 -4.05 -0.08 0.00 0.04 0.00 0.00 34.50 30.27 3gyr s PRO 525 CO -0.08 -1.77 0.66 -1.64 0.04 0.00 0.00 177.00 174.22 3gyr s MET 526 N 5.13 4.08 -0.01 4.56 -1.94 0.21 -0.27 119.30 131.06 3gyr s MET 526 Ca 0.45 0.67 -0.01 0.00 -1.71 0.00 0.00 55.69 55.09 3gyr s MET 526 Cb -0.08 -2.77 0.01 0.00 2.01 0.00 0.00 34.83 34.00 3gyr s MET 526 CO 0.25 0.36 0.03 -1.58 -0.01 0.00 0.00 175.02 174.06 3gyr s HIS 527 N -1.64 -0.01 -0.16 -0.03 5.04 0.14 -1.21 115.29 117.41 3gyr s HIS 527 Ca 0.44 0.10 0.02 0.00 -1.54 0.00 0.00 55.06 54.08 3gyr s HIS 527 Cb -0.14 -0.07 0.01 0.00 0.04 0.00 0.00 32.58 32.42 3gyr s HIS 527 CO 0.20 -0.04 -0.21 0.42 -2.34 0.00 0.00 174.74 172.77 3gyr s ILE 528 N 0.39 2.09 1.20 0.89 1.01 -1.14 -1.07 121.20 124.58 3gyr s ILE 528 Ca -0.03 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.54 3gyr s ILE 528 Cb -0.05 -1.86 0.31 0.00 0.01 0.00 0.00 42.46 40.87 3gyr s ILE 528 CO -0.01 0.54 1.01 -1.00 0.00 0.00 0.00 174.94 175.48 3gyr s HIS 529 N 1.07 1.22 0.00 3.97 3.76 -0.61 -4.29 115.29 120.41 3gyr s HIS 529 Ca -0.01 1.14 0.00 0.00 -0.15 0.00 0.00 55.06 56.04 3gyr s HIS 529 Cb -0.14 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.48 3gyr s HIS 529 CO -0.08 -4.07 0.00 -0.11 -0.85 0.00 0.00 174.74 169.63 3gyr n LEU 530 N -5.06 0.00 -4.84 0.89 7.94 -1.26 -4.90 117.00 109.77 3gyr n LEU 530 Ca 0.02 0.00 -0.21 0.00 -1.11 0.00 0.00 56.01 54.71 3gyr n LEU 530 Cb 0.54 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.45 3gyr n LEU 530 CO 0.58 0.00 -0.07 0.00 -1.11 0.00 0.00 177.39 176.78 3gyr s ALA 531 N 0.00 3.86 -0.06 1.96 0.00 -1.26 -4.31 121.76 121.95 3gyr s ALA 531 Ca 0.00 -1.74 -0.02 0.00 0.00 0.00 0.00 51.96 50.20 3gyr s ALA 531 Cb 0.00 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 3gyr s ALA 531 CO 0.00 -0.05 0.07 -0.51 0.00 0.00 0.00 175.76 175.27 3gyr s ASP 532 N -4.01 5.70 0.12 0.00 1.01 -1.26 -4.79 116.67 113.43 3gyr s ASP 532 Ca 0.42 0.22 0.04 0.00 0.71 0.00 0.00 52.55 53.94 3gyr s ASP 532 Cb -0.05 -1.68 -0.04 0.00 1.01 0.00 0.00 42.92 42.17 3gyr s ASP 532 CO 0.26 0.34 -0.09 -0.36 0.21 0.00 0.00 175.17 175.53 3gyr s PHE 533 N -1.06 1.11 0.03 4.23 0.40 -0.65 -3.76 117.98 118.28 3gyr s PHE 533 Ca 0.18 -0.76 0.07 0.00 -0.60 0.00 0.00 56.93 55.82 3gyr s PHE 533 Cb -0.12 -0.59 -0.02 0.00 0.51 0.00 0.00 43.02 42.80 3gyr s PHE 533 CO 0.08 0.00 -0.21 -0.65 0.70 0.00 0.00 175.22 175.14 3gyr s GLN 534 N -3.45 1.45 -0.01 0.44 -0.21 -0.20 -1.09 119.66 116.60 3gyr s GLN 534 Ca 0.12 -0.92 -0.30 0.00 0.02 0.00 0.00 55.36 54.28 3gyr s GLN 534 Cb 0.01 -1.54 -0.05 0.00 1.00 0.00 0.00 33.01 32.43 3gyr s GLN 534 CO -0.01 0.40 1.28 0.08 -2.12 0.00 0.00 175.29 174.92 3gyr s VAL 535 N -0.75 3.98 -0.18 1.09 1.01 -1.26 -1.41 120.40 122.87 3gyr s VAL 535 Ca 0.08 1.36 0.13 0.00 0.00 0.00 0.00 61.98 63.55 3gyr s VAL 535 Cb -0.09 -3.87 -0.23 0.00 0.00 0.00 0.00 36.38 32.18 3gyr s VAL 535 CO 0.01 0.02 0.13 0.18 0.00 0.00 0.00 175.10 175.45 3gyr n LEU 536 N 4.96 0.73 -3.62 3.92 4.77 0.44 -4.97 117.00 123.23 3gyr n LEU 536 Ca 0.11 0.06 -0.02 0.00 -0.03 0.00 0.00 56.01 56.13 3gyr n LEU 536 Cb 0.45 0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.68 3gyr n LEU 536 CO 0.57 0.57 1.13 -0.83 -1.33 0.00 0.00 177.39 177.49 3gyr s GLY 537 N -5.59 -0.28 -0.03 -0.72 0.00 -1.17 -5.00 107.32 94.53 3gyr s GLY 537 Ca -0.14 1.63 0.04 0.00 0.00 0.00 0.00 44.72 46.26 3gyr s GLY 537 CO 0.79 0.52 -0.16 0.50 0.00 0.00 0.00 173.10 174.75 3gyr s ARG 538 N -2.17 1.44 0.02 2.90 0.52 -1.26 -1.31 118.95 119.08 3gyr s ARG 538 Ca 0.12 -0.55 0.04 0.00 -0.52 0.00 0.00 55.73 54.81 3gyr s ARG 538 Cb 0.00 -1.32 -0.02 0.00 0.52 0.00 0.00 34.95 34.14 3gyr s ARG 538 CO -0.04 0.28 -0.13 -0.51 0.02 0.00 0.00 175.30 174.93 3gyr s ASP 539 N -0.15 1.47 0.19 0.23 1.11 -0.63 -4.21 116.67 114.68 3gyr s ASP 539 Ca 0.01 -0.34 -0.16 0.00 0.18 0.00 0.00 52.55 52.24 3gyr s ASP 539 Cb -0.08 -0.12 -0.08 0.00 1.07 0.00 0.00 42.92 43.71 3gyr s ASP 539 CO 0.01 0.07 0.63 0.00 1.18 0.00 0.00 175.17 177.06 3gyr s ALA 540 N -0.60 3.49 0.04 5.23 0.00 -1.26 -0.71 121.76 127.96 3gyr s ALA 540 Ca 0.02 -0.01 0.05 0.00 0.00 0.00 0.00 51.96 52.02 3gyr s ALA 540 Cb -0.06 -2.65 -0.02 0.00 0.00 0.00 0.00 23.12 20.39 3gyr s ALA 540 CO 0.00 0.40 -0.15 0.71 0.00 0.00 0.00 175.76 176.72 3gyr s TYR 541 N -1.54 1.31 -0.44 0.00 2.02 -1.09 -0.36 117.35 117.25 3gyr s TYR 541 Ca 0.41 -0.35 -0.23 0.00 -0.37 0.00 0.00 57.07 56.54 3gyr s TYR 541 Cb -0.15 -0.78 0.02 0.00 -0.40 0.00 0.00 41.96 40.65 3gyr s TYR 541 CO 0.20 0.04 0.77 0.34 -1.57 0.00 0.00 175.55 175.33 3gyr s ASP 542 N -1.08 6.42 -0.06 2.29 2.15 0.19 -4.71 116.67 121.86 3gyr s ASP 542 Ca 0.03 -0.09 0.15 0.00 0.43 0.00 0.00 52.55 53.07 3gyr s ASP 542 Cb -0.08 -2.38 0.49 0.00 -0.30 0.00 0.00 42.92 40.65 3gyr s ASP 542 CO 0.01 -0.88 1.41 0.00 -0.17 0.00 0.00 175.17 175.54 3gyr n ALA 543 N 6.64 2.58 -0.11 3.66 0.00 -1.26 -0.66 120.51 131.36 3gyr n ALA 543 Ca 0.02 -1.51 0.19 0.00 0.00 0.00 0.00 53.44 52.14 3gyr n ALA 543 Cb 0.48 -0.68 0.59 0.00 0.00 0.00 0.00 19.45 19.84 3gyr n ALA 543 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3gyr h SER 544 N 2.73 0.22 -0.14 0.00 4.64 -1.91 0.63 113.55 119.71 3gyr h SER 544 Ca 0.00 0.01 0.04 0.00 -0.47 0.00 0.00 61.79 61.38 3gyr h SER 544 Cb 1.08 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 3gyr h SER 544 CO 0.10 0.11 0.20 1.23 -0.87 0.00 0.00 176.83 177.60 3gyr h GLY 545 N 0.23 0.00 -5.43 -0.77 0.00 -1.79 -3.41 103.07 91.89 3gyr h GLY 545 Ca 0.34 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.11 3gyr h GLY 545 CO -0.07 0.00 1.03 -0.12 0.00 0.00 0.00 176.54 177.38 3gyr s PHE 546 N -4.52 2.32 -0.40 5.60 2.19 0.21 -1.33 117.98 122.05 3gyr s PHE 546 Ca -0.05 0.57 -0.16 0.00 0.33 0.00 0.00 56.93 57.62 3gyr s PHE 546 Cb 0.14 -3.80 0.01 0.00 -1.31 0.00 0.00 43.02 38.07 3gyr s PHE 546 CO 0.50 -2.85 0.36 0.34 1.83 0.00 0.00 175.22 175.41 3gyr s ASP 547 N 3.07 6.15 0.22 6.13 -1.08 0.72 -4.93 116.67 126.94 3gyr s ASP 547 Ca 0.66 -0.68 -0.08 0.00 -0.52 0.00 0.00 52.55 51.93 3gyr s ASP 547 Cb -0.27 -2.19 0.17 0.00 -1.46 0.00 0.00 42.92 39.17 3gyr s ASP 547 CO 0.24 -0.48 1.81 -0.07 0.52 0.00 0.00 175.17 177.19 3gyr h LEU 548 N 8.82 1.07 -1.25 -1.34 4.07 -1.90 -1.29 115.31 123.50 3gyr h LEU 548 Ca -0.27 -0.13 -0.08 0.00 0.08 0.00 0.00 57.88 57.47 3gyr h LEU 548 Cb 1.12 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.58 3gyr h LEU 548 CO 0.75 0.90 -0.37 0.00 -1.08 0.00 0.00 178.44 178.64 3gyr h ALA 549 N 1.21 1.35 0.12 1.53 0.00 -1.93 -1.58 119.26 119.96 3gyr h ALA 549 Ca 0.28 -0.34 -0.31 0.00 0.00 0.00 0.00 54.91 54.54 3gyr h ALA 549 Cb 0.12 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3gyr h ALA 549 CO -0.04 0.47 -1.53 1.25 0.00 0.00 0.00 179.25 179.40 3gyr h LEU 550 N 0.00 0.40 0.00 0.00 5.85 -1.90 -3.43 115.31 116.24 3gyr h LEU 550 Ca -0.00 -0.56 0.00 0.00 0.84 0.00 0.00 57.88 58.16 3gyr h LEU 550 Cb 0.67 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.57 3gyr h LEU 550 CO 0.05 1.46 0.00 0.61 -0.34 0.00 0.00 178.44 180.22 3gyr n GLY 551 N 1.67 0.44 3.49 3.75 0.00 -0.52 -3.71 105.19 110.32 3gyr n GLY 551 Ca -0.17 -0.90 -0.14 0.00 0.00 0.00 0.00 46.02 44.82 3gyr n GLY 551 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gyr s GLY 552 N -2.95 1.31 -0.31 -0.02 0.00 -1.20 0.77 107.32 104.92 3gyr s GLY 552 Ca 0.00 -1.41 -0.19 0.00 0.00 0.00 0.00 44.72 43.12 3gyr s GLY 552 CO 0.00 -0.95 0.55 -0.51 0.00 0.00 0.00 173.10 172.19 3gyr s THR 553 N -3.26 5.00 0.02 0.90 -4.23 -0.73 -0.20 115.64 113.15 3gyr s THR 553 Ca 0.29 0.65 -0.24 0.00 -1.18 0.00 0.00 61.69 61.21 3gyr s THR 553 Cb -0.00 -3.94 -0.17 0.00 1.34 0.00 0.00 72.50 69.73 3gyr s THR 553 CO 0.18 -0.11 1.42 -0.09 -0.54 0.00 0.00 174.62 175.47 3gyr h ARG 554 N 8.26 0.08 -6.63 3.99 2.43 -1.55 -3.44 114.38 117.53 3gyr h ARG 554 Ca -0.28 -0.03 -0.69 0.00 -0.81 0.00 0.00 59.98 58.17 3gyr h ARG 554 Cb 1.13 -0.01 -0.25 0.00 -0.42 0.00 0.00 29.97 30.42 3gyr h ARG 554 CO 0.77 0.41 -0.84 -0.08 -1.51 0.00 0.00 179.97 178.71 3gyr s THR 555 N -4.81 2.45 0.23 0.20 -1.32 -1.22 -4.86 115.64 106.31 3gyr s THR 555 Ca -0.15 -1.22 -0.28 0.00 -1.21 0.00 0.00 61.69 58.83 3gyr s THR 555 Cb 0.04 -1.97 -0.16 0.00 -1.51 0.00 0.00 72.50 68.89 3gyr s THR 555 CO 0.69 0.40 0.68 -2.65 -2.21 0.00 0.00 174.62 171.53 3gyr n PRO 556 N 1.83 0.42 -2.03 7.08 -0.02 -1.26 -4.03 135.00 136.99 3gyr n PRO 556 Ca -0.17 0.15 -0.42 0.00 -2.02 0.00 0.00 63.50 61.05 3gyr n PRO 556 Cb 0.52 -1.27 -0.03 0.00 -0.02 0.00 0.00 33.50 32.70 3gyr n PRO 556 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3gyr s VAL 557 N -1.00 2.80 -0.11 -1.45 1.01 0.59 -4.51 120.40 117.74 3gyr s VAL 557 Ca 0.63 0.62 0.02 0.00 0.00 0.00 0.00 61.98 63.24 3gyr s VAL 557 Cb -0.86 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.14 3gyr s VAL 557 CO 0.57 0.07 -0.16 -0.60 0.00 0.00 0.00 175.10 174.98 3gyr s ARG 558 N 0.46 2.27 0.31 2.72 3.52 0.17 -1.30 118.95 127.10 3gyr s ARG 558 Ca 0.64 -0.58 -0.29 0.00 -0.13 0.00 0.00 55.73 55.36 3gyr s ARG 558 Cb -0.41 -1.90 -0.12 0.00 -1.56 0.00 0.00 34.95 30.96 3gyr s ARG 558 CO 0.36 -0.04 1.42 -0.11 -0.81 0.00 0.00 175.30 176.12 3gyr n LEU 559 N 4.11 3.83 -4.14 -0.88 0.00 -0.97 0.54 117.00 119.49 3gyr n LEU 559 Ca -0.19 1.18 -0.38 0.00 0.00 0.00 0.00 56.01 56.62 3gyr n LEU 559 Cb 0.51 -1.52 -0.10 0.00 0.00 0.00 0.00 43.42 42.31 3gyr n LEU 559 CO 0.24 -0.24 -0.09 -0.62 0.00 0.00 0.00 177.39 176.68 3gyr s ASP 560 N 0.04 5.40 0.01 1.96 2.15 0.52 -4.75 116.67 121.98 3gyr s ASP 560 Ca 0.60 -2.13 0.21 0.00 0.43 0.00 0.00 52.55 51.66 3gyr s ASP 560 Cb -0.56 -1.89 0.88 0.00 -0.30 0.00 0.00 42.92 41.06 3gyr s ASP 560 CO 0.57 -0.56 1.66 -0.81 -0.17 0.00 0.00 175.17 175.86 3gyr n PRO 561 N 4.51 0.01 -0.00 4.34 -0.05 -1.26 -2.39 135.00 140.15 3gyr n PRO 561 Ca -0.02 0.15 0.13 0.00 -0.05 0.00 0.00 63.50 63.71 3gyr n PRO 561 Cb 0.41 -1.51 0.33 0.00 -0.05 0.00 0.00 33.50 32.68 3gyr n PRO 561 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 3gyr n ASP 562 N -1.52 2.19 -3.84 3.54 8.00 -1.26 -4.42 116.55 119.23 3gyr n ASP 562 Ca 0.05 -1.73 -0.30 0.00 0.71 0.00 0.00 54.79 53.52 3gyr n ASP 562 Cb 0.24 -0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.25 3gyr n ASP 562 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3gyr n THR 563 N 0.72 2.32 -1.88 -3.53 -1.04 -1.01 -5.08 114.28 104.77 3gyr n THR 563 Ca 0.17 -5.07 -0.41 0.00 -2.04 0.00 0.00 64.05 56.70 3gyr n THR 563 Cb 0.47 -2.21 -0.01 0.00 -1.82 0.00 0.00 70.33 66.76 3gyr n THR 563 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3gyr s PRO 564 N -1.76 4.18 -0.40 -2.82 0.02 -1.26 -4.12 135.00 128.84 3gyr s PRO 564 Ca 0.29 2.47 -0.04 0.00 0.02 0.00 0.00 61.00 63.74 3gyr s PRO 564 Cb 0.00 -3.03 0.10 0.00 0.02 0.00 0.00 34.50 31.59 3gyr s PRO 564 CO -0.11 -0.49 0.20 0.08 -0.33 0.00 0.00 177.00 176.34 3gyr s VAL 565 N -0.50 3.42 0.58 3.83 1.01 -1.26 -4.97 120.40 122.51 3gyr s VAL 565 Ca 0.57 -1.88 -0.16 0.00 0.00 0.00 0.00 61.98 60.51 3gyr s VAL 565 Cb -0.45 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3gyr s VAL 565 CO 0.52 -0.60 1.06 -2.16 0.00 0.00 0.00 175.10 173.92 3gyr s PRO 566 N 1.20 3.34 0.36 2.72 0.04 -1.26 -4.31 135.00 137.09 3gyr s PRO 566 Ca 0.06 1.26 -0.25 0.00 0.04 0.00 0.00 61.00 62.10 3gyr s PRO 566 Cb -0.23 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 3gyr s PRO 566 CO -0.03 -0.80 1.01 -0.51 0.04 0.00 0.00 177.00 176.71 3gyr s LEU 567 N -4.36 4.25 0.36 -3.56 1.43 -1.26 -4.94 118.68 110.60 3gyr s LEU 567 Ca 0.65 1.96 -0.28 0.00 -1.03 0.00 0.00 54.13 55.43 3gyr s LEU 567 Cb -0.17 -4.08 -0.11 0.00 0.03 0.00 0.00 46.19 41.87 3gyr s LEU 567 CO 0.35 -0.28 1.44 0.00 0.23 0.00 0.00 176.35 178.08 3gyr s ALA 568 N -1.61 3.56 0.62 4.21 0.00 -1.26 -4.87 121.76 122.40 3gyr s ALA 568 Ca 0.54 1.49 0.31 0.00 0.00 0.00 0.00 51.96 54.29 3gyr s ALA 568 Cb -0.21 -3.57 1.72 0.00 0.00 0.00 0.00 23.12 21.06 3gyr s ALA 568 CO 0.27 -0.94 2.06 -1.35 0.00 0.00 0.00 175.76 175.80 3gyr h PRO 569 N 3.16 0.00 -0.63 0.00 0.11 -1.95 -1.65 132.00 131.04 3gyr h PRO 569 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3gyr h PRO 569 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3gyr h PRO 569 CO 0.65 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.71 3gyr n ASN 570 N -3.47 3.67 -1.42 -2.05 6.94 -1.26 -4.35 115.26 113.32 3gyr n ASN 570 Ca 0.01 -1.99 -0.08 0.00 -0.02 0.00 0.00 54.58 52.50 3gyr n ASN 570 Cb 0.36 -0.42 0.20 0.00 -2.36 0.00 0.00 39.78 37.56 3gyr n ASN 570 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 3gyr n GLU 571 N 1.53 2.05 -0.13 -3.83 0.28 -0.62 -4.50 120.64 115.42 3gyr n GLU 571 Ca 0.23 -3.13 0.11 0.00 -0.16 0.00 0.00 57.16 54.21 3gyr n GLU 571 Cb 0.59 -1.92 0.17 0.00 1.43 0.00 0.00 31.44 31.72 3gyr n GLU 571 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3gyr n LEU 572 N -1.06 3.23 0.00 -1.84 4.77 -1.26 -4.32 117.00 116.51 3gyr n LEU 572 Ca 0.39 -1.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.00 3gyr n LEU 572 Cb 1.19 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 42.11 3gyr n LEU 572 CO 0.29 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 3gyr n GLY 573 N 1.35 2.38 3.68 -0.72 0.00 -1.26 -4.85 105.19 105.77 3gyr n GLY 573 Ca 0.17 -1.78 -0.39 0.00 0.00 0.00 0.00 46.02 44.02 3gyr n GLY 573 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3gyr s HIS 574 N 4.20 3.42 0.05 1.61 3.76 -1.26 -4.54 115.29 122.52 3gyr s HIS 574 Ca 0.00 0.79 0.04 0.00 -0.15 0.00 0.00 55.06 55.73 3gyr s HIS 574 Cb 0.00 -2.61 -0.02 0.00 1.11 0.00 0.00 32.58 31.06 3gyr s HIS 574 CO 0.00 -0.00 -0.11 0.15 -0.85 0.00 0.00 174.74 173.93 3gyr s LYS 575 N 1.26 0.68 0.00 1.40 -0.14 -0.25 -1.08 119.74 121.61 3gyr s LYS 575 Ca 0.24 -0.79 0.00 0.00 -1.36 0.00 0.00 55.97 54.06 3gyr s LYS 575 Cb -0.15 -0.57 0.00 0.00 -1.68 0.00 0.00 37.83 35.42 3gyr s LYS 575 CO 0.09 0.13 0.04 -0.40 -0.76 0.00 0.00 175.35 174.45 3gyr n ASP 576 N 1.56 0.09 -3.74 2.83 5.68 -1.26 -1.64 116.55 120.07 3gyr n ASP 576 Ca -0.21 -0.84 -0.28 0.00 -0.50 0.00 0.00 54.79 52.96 3gyr n ASP 576 Cb 0.55 0.02 -0.16 0.00 -1.14 0.00 0.00 41.12 40.38 3gyr n ASP 576 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3gyr s VAL 577 N -0.02 0.61 -0.03 2.12 1.01 -1.26 -2.88 120.40 119.95 3gyr s VAL 577 Ca 0.00 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.30 3gyr s VAL 577 Cb 0.00 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 3gyr s VAL 577 CO 0.00 -0.30 -0.20 -0.36 0.00 0.00 0.00 175.10 174.24 3gyr s PHE 578 N 1.80 2.52 0.18 5.22 0.08 -0.35 -4.78 117.98 122.66 3gyr s PHE 578 Ca 0.01 -0.29 -0.30 0.00 0.12 0.00 0.00 56.93 56.47 3gyr s PHE 578 Cb -0.17 -1.56 -0.08 0.00 -0.57 0.00 0.00 43.02 40.65 3gyr s PHE 578 CO -0.12 0.10 1.02 -0.65 -0.10 0.00 0.00 175.22 175.46 3gyr s GLN 579 N -0.75 4.70 -0.52 0.44 -0.21 -1.26 -0.62 119.66 121.44 3gyr s GLN 579 Ca 0.11 1.59 0.03 0.00 0.02 0.00 0.00 55.36 57.11 3gyr s GLN 579 Cb -0.10 -3.30 0.15 0.00 1.00 0.00 0.00 33.01 30.75 3gyr s GLN 579 CO 0.00 0.25 0.32 0.08 -2.12 0.00 0.00 175.29 173.82 3gyr s VAL 580 N -0.50 1.93 1.30 1.09 1.01 0.48 -4.90 120.40 120.80 3gyr s VAL 580 Ca 0.46 -3.18 -0.21 0.00 0.00 0.00 0.00 61.98 59.05 3gyr s VAL 580 Cb -0.27 -2.32 0.32 0.00 0.00 0.00 0.00 36.38 34.11 3gyr s VAL 580 CO 0.33 -0.94 1.05 -2.84 0.00 0.00 0.00 175.10 172.70 3gyr s PRO 581 N -0.29 -1.97 0.19 2.72 0.02 -1.26 -1.89 135.00 132.52 3gyr s PRO 581 Ca 0.21 -0.04 -0.17 0.00 0.02 0.00 0.00 61.00 61.02 3gyr s PRO 581 Cb -0.16 -1.51 0.03 0.00 0.02 0.00 0.00 34.50 32.88 3gyr s PRO 581 CO -0.06 -4.21 0.51 0.20 -0.33 0.00 0.00 177.00 173.11 3gyr s GLY 582 N -3.66 -0.09 -0.18 0.52 0.00 -1.25 -3.97 107.32 98.69 3gyr s GLY 582 Ca 0.70 -0.23 -0.29 0.00 0.00 0.00 0.00 44.72 44.91 3gyr s GLY 582 CO 0.57 -0.27 1.16 2.56 0.00 0.00 0.00 173.10 177.11 3gyr s PRO 583 N -3.87 4.26 0.02 2.90 0.04 -1.20 -4.34 135.00 132.80 3gyr s PRO 583 Ca 0.09 1.53 -0.28 0.00 0.04 0.00 0.00 61.00 62.38 3gyr s PRO 583 Cb -0.01 -3.69 0.08 0.00 0.04 0.00 0.00 34.50 30.92 3gyr s PRO 583 CO -0.03 -0.64 0.73 -1.14 0.04 0.00 0.00 177.00 175.95 3gyr s GLN 584 N 3.23 1.04 0.01 4.56 0.74 0.18 -2.68 119.66 126.74 3gyr s GLN 584 Ca 0.50 -0.10 0.05 0.00 0.05 0.00 0.00 55.36 55.86 3gyr s GLN 584 Cb -0.19 0.48 -0.03 0.00 1.10 0.00 0.00 33.01 34.37 3gyr s GLN 584 CO 0.12 -0.39 -0.12 0.20 -0.55 0.00 0.00 175.29 174.55 3gyr s GLY 585 N -1.92 1.66 -0.03 2.59 0.00 0.11 0.02 107.32 109.75 3gyr s GLY 585 Ca -0.03 -1.07 0.03 0.00 0.00 0.00 0.00 44.72 43.65 3gyr s GLY 585 CO -0.02 -0.93 -0.12 -2.27 0.00 0.00 0.00 173.10 169.76 3gyr s LEU 586 N -1.32 1.82 -0.21 0.66 2.96 0.53 -1.60 118.68 121.52 3gyr s LEU 586 Ca 0.15 -0.24 -0.04 0.00 -0.22 0.00 0.00 54.13 53.78 3gyr s LEU 586 Cb -0.11 -0.70 -0.02 0.00 0.50 0.00 0.00 46.19 45.87 3gyr s LEU 586 CO 0.06 0.09 -0.02 -0.13 -1.32 0.00 0.00 176.35 175.03 3gyr s ARG 587 N 0.16 3.49 0.17 1.98 0.52 -0.43 -0.74 118.95 124.11 3gyr s ARG 587 Ca -0.04 -0.58 0.09 0.00 -0.52 0.00 0.00 55.73 54.68 3gyr s ARG 587 Cb -0.10 -3.04 -0.04 0.00 0.52 0.00 0.00 34.95 32.29 3gyr s ARG 587 CO 0.01 -0.09 -0.18 0.14 0.02 0.00 0.00 175.30 175.20 3gyr s VAL 588 N 1.23 1.84 -0.01 3.52 -7.23 0.04 -0.42 120.40 119.36 3gyr s VAL 588 Ca 0.03 -1.97 -0.01 0.00 -1.81 0.00 0.00 61.98 58.23 3gyr s VAL 588 Cb -0.14 -1.88 0.01 0.00 0.56 0.00 0.00 36.38 34.92 3gyr s VAL 588 CO -0.00 -0.35 0.03 -0.32 -0.31 0.00 0.00 175.10 174.15 3gyr s MET 589 N -2.91 0.02 0.31 4.82 1.75 -0.50 0.09 119.30 122.87 3gyr s MET 589 Ca 0.17 0.07 -0.17 0.00 -1.25 0.00 0.00 55.69 54.50 3gyr s MET 589 Cb -0.05 -0.03 0.02 0.00 2.84 0.00 0.00 34.83 37.61 3gyr s MET 589 CO 0.07 -0.03 0.69 0.20 -0.65 0.00 0.00 175.02 175.29 3gyr s GLY 590 N 0.20 0.21 -0.15 2.11 0.00 -0.84 -1.04 107.32 107.82 3gyr s GLY 590 Ca -0.02 -0.58 0.02 0.00 0.00 0.00 0.00 44.72 44.14 3gyr s GLY 590 CO -0.01 -0.28 -0.21 1.25 0.00 0.00 0.00 173.10 173.86 3gyr s LYS 591 N -3.46 2.96 -0.77 2.90 2.20 -1.25 -1.85 119.74 120.48 3gyr s LYS 591 Ca 0.15 -0.83 -0.22 0.00 -0.36 0.00 0.00 55.97 54.72 3gyr s LYS 591 Cb -0.05 -2.46 0.08 0.00 -1.51 0.00 0.00 37.83 33.90 3gyr s LYS 591 CO 0.09 -0.10 1.07 -0.06 -0.36 0.00 0.00 175.35 175.99 3gyr s PHE 592 N 1.02 2.75 -0.04 4.03 0.08 -0.33 -4.50 117.98 121.00 3gyr s PHE 592 Ca -0.02 -0.76 0.03 0.00 0.12 0.00 0.00 56.93 56.30 3gyr s PHE 592 Cb -0.14 -4.35 0.00 0.00 -0.57 0.00 0.00 43.02 37.96 3gyr s PHE 592 CO -0.06 -1.66 -0.13 0.34 -0.10 0.00 0.00 175.22 173.61 3gyr s ASP 593 N 3.78 1.68 -0.54 1.36 3.68 -1.26 0.31 116.67 125.67 3gyr s ASP 593 Ca 0.28 -0.27 0.00 0.00 2.13 0.00 0.00 52.55 54.69 3gyr s ASP 593 Cb -0.12 -0.50 0.00 0.00 -1.45 0.00 0.00 42.92 40.86 3gyr s ASP 593 CO 0.04 0.10 0.00 0.61 0.13 0.00 0.00 175.17 176.04 3gyr n GLY 594 N 3.29 0.73 3.60 2.66 0.00 -1.26 -4.91 105.19 109.30 3gyr n GLY 594 Ca -0.19 -0.33 -0.06 0.00 0.00 0.00 0.00 46.02 45.44 3gyr n GLY 594 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 595 N -1.99 -1.80 0.10 4.61 0.00 -1.26 -4.73 121.76 116.70 3gyr s ALA 595 Ca 0.00 0.73 0.03 0.00 0.00 0.00 0.00 51.96 52.71 3gyr s ALA 595 Cb 0.00 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.54 3gyr s ALA 595 CO 0.00 -0.82 -0.08 0.71 0.00 0.00 0.00 175.76 175.57 3gyr s TYR 596 N -3.11 1.00 -3.03 0.00 2.02 -1.26 -4.80 117.35 108.17 3gyr s TYR 596 Ca 0.08 -0.79 0.00 0.00 -0.37 0.00 0.00 57.07 55.99 3gyr s TYR 596 Cb -0.01 -0.55 0.00 0.00 -0.40 0.00 0.00 41.96 41.00 3gyr s TYR 596 CO -0.05 -0.06 0.00 0.41 -1.57 0.00 0.00 175.55 174.28 3gyr n GLY 597 N 0.18 0.72 3.76 0.71 0.00 -0.09 -0.53 105.19 109.95 3gyr n GLY 597 Ca -0.13 -1.96 -0.36 0.00 0.00 0.00 0.00 46.02 43.57 3gyr n GLY 597 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gyr s ARG 598 N -1.21 3.76 0.39 1.61 3.52 -1.26 -0.72 118.95 125.03 3gyr s ARG 598 Ca 0.00 -0.23 0.05 0.00 -0.13 0.00 0.00 55.73 55.42 3gyr s ARG 598 Cb 0.00 -3.23 -0.02 0.00 -1.56 0.00 0.00 34.95 30.13 3gyr s ARG 598 CO 0.00 0.51 0.18 -0.06 -0.81 0.00 0.00 175.30 175.12 3gyr s PHE 599 N -0.27 1.77 0.12 5.12 0.08 0.22 -4.46 117.98 120.55 3gyr s PHE 599 Ca 0.10 -1.43 0.10 0.00 0.12 0.00 0.00 56.93 55.82 3gyr s PHE 599 Cb -0.12 -1.00 -0.04 0.00 -0.57 0.00 0.00 43.02 41.29 3gyr s PHE 599 CO 0.01 -0.50 -0.23 -1.64 -0.10 0.00 0.00 175.22 172.75 3gyr s MET 600 N -3.62 1.57 0.05 0.44 -1.94 -1.26 -1.75 119.30 112.80 3gyr s MET 600 Ca 0.29 -1.27 0.04 0.00 -1.71 0.00 0.00 55.69 53.04 3gyr s MET 600 Cb 0.02 -1.99 -0.03 0.00 2.01 0.00 0.00 34.83 34.85 3gyr s MET 600 CO 0.19 0.47 -0.11 1.52 -0.01 0.00 0.00 175.02 177.07 3gyr s TYR 601 N -1.08 0.97 0.10 -0.03 -0.85 -0.06 -1.57 117.35 114.83 3gyr s TYR 601 Ca 0.15 -0.46 -0.27 0.00 -0.52 0.00 0.00 57.07 55.98 3gyr s TYR 601 Cb -0.10 -0.56 0.08 0.00 0.38 0.00 0.00 41.96 41.76 3gyr s TYR 601 CO 0.07 -0.01 1.02 -3.38 -1.52 0.00 0.00 175.55 171.74 3gyr s HIS 602 N -1.25 -0.13 0.23 -3.49 -3.43 -0.23 -0.48 115.29 106.52 3gyr s HIS 602 Ca -0.05 -0.12 -0.30 0.00 -0.80 0.00 0.00 55.06 53.80 3gyr s HIS 602 Cb -0.10 0.61 -0.09 0.00 -1.43 0.00 0.00 32.58 31.58 3gyr s HIS 602 CO 0.01 -0.69 1.08 0.00 -2.00 0.00 0.00 174.74 173.15 3gyr n HIS 604 N 1.71 1.52 -3.11 0.00 -0.00 0.63 -4.17 115.22 111.80 3gyr n HIS 604 Ca 0.00 -0.74 -0.43 0.00 0.46 0.00 0.00 57.72 57.01 3gyr n HIS 604 Cb 0.46 -0.47 -0.06 0.00 -0.12 0.00 0.00 29.99 29.80 3gyr n HIS 604 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 3gyr s LEU 605 N -1.86 4.77 0.35 0.27 1.43 -1.26 -4.69 118.68 117.68 3gyr s LEU 605 Ca 0.35 -0.75 0.09 0.00 -1.03 0.00 0.00 54.13 52.79 3gyr s LEU 605 Cb 0.28 -2.54 0.82 0.00 0.03 0.00 0.00 46.19 44.78 3gyr s LEU 605 CO 0.09 -0.92 1.84 -0.07 0.23 0.00 0.00 176.35 177.52 3gyr h LEU 606 N 9.88 0.67 -1.43 1.79 3.38 -1.23 0.58 115.31 128.95 3gyr h LEU 606 Ca -0.27 0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.70 3gyr h LEU 606 Cb 1.09 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 3gyr h LEU 606 CO 0.97 0.30 -0.29 -0.33 0.09 0.00 0.00 178.44 179.18 3gyr h GLU 607 N 0.69 0.00 0.19 1.13 3.07 -1.92 -0.70 114.58 117.04 3gyr h GLU 607 Ca 0.50 0.00 -0.27 0.00 -0.50 0.00 0.00 59.36 59.09 3gyr h GLU 607 Cb 0.84 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.78 3gyr h GLU 607 CO -0.26 0.29 -1.16 0.45 -1.40 0.00 0.00 179.01 176.93 3gyr h HIS 608 N 0.00 0.81 -0.97 4.33 3.86 -0.32 -3.07 115.15 119.79 3gyr h HIS 608 Ca -0.00 -0.57 0.14 0.00 -1.16 0.00 0.00 60.37 58.77 3gyr h HIS 608 Cb 0.54 -0.04 -0.08 0.00 1.06 0.00 0.00 27.41 28.89 3gyr h HIS 608 CO 0.00 1.44 0.61 1.49 0.86 0.00 0.00 177.93 182.33 3gyr h GLU 609 N -0.06 0.85 0.00 2.45 4.81 -0.63 -0.67 114.58 121.32 3gyr h GLU 609 Ca -0.20 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 3gyr h GLU 609 Cb 1.91 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 31.10 3gyr h GLU 609 CO 0.22 0.56 0.00 -0.44 -0.73 0.00 0.00 179.01 178.62 3gyr h ASP 610 N 0.87 0.00 -2.11 1.04 3.32 -1.16 -3.22 116.42 115.16 3gyr h ASP 610 Ca 0.49 0.00 -0.69 0.00 0.02 0.00 0.00 57.03 56.85 3gyr h ASP 610 Cb 0.61 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 39.81 3gyr h ASP 610 CO -0.26 0.00 0.16 0.23 -1.72 0.00 0.00 179.24 177.65 3gyr n MET 611 N -2.77 3.94 -0.21 3.56 2.81 -0.31 -4.60 117.12 119.54 3gyr n MET 611 Ca 0.03 -4.55 0.00 0.00 -1.81 0.00 0.00 57.70 51.38 3gyr n MET 611 Cb 0.41 -2.32 0.00 0.00 -0.71 0.00 0.00 33.22 30.60 3gyr n MET 611 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gyr n GLY 612 N -0.27 2.16 2.38 3.03 0.00 -1.22 -4.90 105.19 106.37 3gyr n GLY 612 Ca 0.41 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.12 3gyr n GLY 612 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3gyr n MET 613 N -2.00 3.03 -3.61 1.61 0.00 -0.91 -2.59 117.12 112.66 3gyr n MET 613 Ca 0.00 -1.85 -0.16 0.00 -0.00 0.00 0.00 57.70 55.69 3gyr n MET 613 Cb 0.00 -2.61 -0.07 0.00 0.00 0.00 0.00 33.22 30.54 3gyr n MET 613 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 175.97 177.38 3gyr s MET 614 N 2.46 0.92 -0.02 2.12 0.00 -1.26 -2.20 119.30 121.31 3gyr s MET 614 Ca 0.60 0.11 -0.07 0.00 0.00 0.00 0.00 55.69 56.33 3gyr s MET 614 Cb 0.17 0.43 0.01 0.00 0.00 0.00 0.00 34.83 35.43 3gyr s MET 614 CO -0.05 -0.28 0.15 1.03 0.00 0.00 0.00 175.02 175.87 3gyr s ARG 615 N -1.23 0.38 0.40 4.11 1.81 0.37 -2.62 118.95 122.19 3gyr s ARG 615 Ca -0.12 -0.18 -0.14 0.00 -1.72 0.00 0.00 55.73 53.57 3gyr s ARG 615 Cb -0.02 0.16 -0.08 0.00 -0.45 0.00 0.00 34.95 34.57 3gyr s ARG 615 CO 0.08 -0.08 0.82 -1.25 -0.68 0.00 0.00 175.30 174.18 3gyr s PRO 616 N -0.88 3.92 0.14 3.54 0.04 -1.26 -0.88 135.00 139.61 3gyr s PRO 616 Ca -0.10 0.68 0.03 0.00 0.04 0.00 0.00 61.00 61.66 3gyr s PRO 616 Cb -0.05 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 3gyr s PRO 616 CO 0.01 -0.02 -0.06 -0.59 0.04 0.00 0.00 177.00 176.38 3gyr s PHE 617 N -2.29 1.12 -0.10 0.56 -0.71 -0.72 -4.47 117.98 111.37 3gyr s PHE 617 Ca 0.55 -0.89 0.04 0.00 -1.04 0.00 0.00 56.93 55.59 3gyr s PHE 617 Cb -0.10 -0.61 -0.00 0.00 -1.21 0.00 0.00 43.02 41.09 3gyr s PHE 617 CO 0.25 -0.08 -0.24 0.08 -1.34 0.00 0.00 175.22 173.90 3gyr s VAL 618 N -3.52 2.10 -0.14 -2.49 1.01 -0.62 -0.61 120.40 116.12 3gyr s VAL 618 Ca 0.17 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 3gyr s VAL 618 Cb 0.05 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 3gyr s VAL 618 CO -0.00 0.56 -0.09 -0.69 0.00 0.00 0.00 175.10 174.87 3gyr s VAL 619 N 0.30 3.37 0.10 2.92 1.01 0.10 -0.16 120.40 128.04 3gyr s VAL 619 Ca -0.18 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 3gyr s VAL 619 Cb -0.18 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 3gyr s VAL 619 CO 0.09 0.51 0.05 0.00 0.00 0.00 0.00 175.10 175.75 3gyr s MET 620 N 0.37 0.82 0.36 2.72 0.23 -0.33 -0.91 119.30 122.57 3gyr s MET 620 Ca -0.08 -1.30 -0.28 0.00 -1.03 0.00 0.00 55.69 52.99 3gyr s MET 620 Cb -0.15 0.25 -0.11 0.00 -1.53 0.00 0.00 34.83 33.28 3gyr s MET 620 CO 0.05 -0.22 1.46 -2.30 -2.03 0.00 0.00 175.02 171.98 3gyr n PRO 621 N -0.02 2.57 -0.29 3.16 -0.02 -1.26 0.18 135.00 139.32 3gyr n PRO 621 Ca -0.10 0.90 0.11 0.00 -2.02 0.00 0.00 63.50 62.40 3gyr n PRO 621 Cb 0.63 -2.61 0.26 0.00 -0.02 0.00 0.00 33.50 31.76 3gyr n PRO 621 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3gyr h PRO 622 N 3.05 0.24 -0.57 0.52 0.11 -1.90 0.15 132.00 133.60 3gyr h PRO 622 Ca -0.49 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.71 3gyr h PRO 622 Cb 1.25 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 3gyr h PRO 622 CO 0.65 0.16 0.39 0.93 -0.21 0.00 0.00 178.00 179.92 3gyr h GLU 623 N 0.25 0.31 0.00 1.05 3.07 -1.98 -1.41 114.58 115.88 3gyr h GLU 623 Ca 0.52 -0.02 -0.10 0.00 -0.50 0.00 0.00 59.36 59.26 3gyr h GLU 623 Cb 1.00 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.83 3gyr h GLU 623 CO -0.60 0.21 -0.46 0.00 -1.40 0.00 0.00 179.01 176.75 3gyr h ALA 624 N 1.71 0.77 -0.34 3.43 0.00 -1.32 -3.16 119.26 120.36 3gyr h ALA 624 Ca 0.27 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3gyr h ALA 624 Cb 0.63 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3gyr h ALA 624 CO -0.06 0.58 0.20 1.25 0.00 0.00 0.00 179.25 181.21 3gyr h LEU 625 N 0.00 0.40 -2.16 0.00 5.85 -0.96 -0.96 115.31 117.48 3gyr h LEU 625 Ca -0.00 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.73 3gyr h LEU 625 Cb 1.22 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 3gyr h LEU 625 CO 0.06 0.31 0.29 0.11 -0.34 0.00 0.00 178.44 178.87 3gyr h LYS 626 N 0.46 0.00 -0.35 1.25 1.79 -1.55 0.22 116.57 118.39 3gyr h LYS 626 Ca 0.12 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 3gyr h LYS 626 Cb -0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 3gyr h LYS 626 CO -0.02 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 179.54 3gyr n PHE 627 N -3.18 0.99 0.00 -1.35 3.72 -0.36 -5.19 117.46 112.09 3gyr n PHE 627 Ca -0.00 -0.75 0.00 0.00 -0.05 0.00 0.00 57.45 56.65 3gyr n PHE 627 Cb 0.37 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 3gyr n PHE 627 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46