#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 0.25 -0.36 0.00 -0.02 -1.26 -1.15 135.00 132.45 3gyr n PRO 38 Ca 0.00 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 3gyr n PRO 38 Cb 0.00 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3gyr n PRO 38 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gyr n GLY 39 N 2.90 0.87 3.87 -1.23 0.00 -1.26 -5.06 105.19 105.28 3gyr n GLY 39 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.54 3.81 0.19 1.61 2.02 -0.30 -4.78 118.70 120.71 3gyr s GLU 40 Ca 0.00 0.25 -0.30 0.00 0.02 0.00 0.00 54.97 54.94 3gyr s GLU 40 Cb 0.00 -2.83 -0.08 0.00 0.10 0.00 0.00 34.13 31.32 3gyr s GLU 40 CO 0.00 0.44 1.09 -0.51 0.02 0.00 0.00 175.26 176.30 3gyr s LEU 41 N -2.36 4.50 -0.19 1.80 1.43 -1.26 -4.87 118.68 117.73 3gyr s LEU 41 Ca 0.41 2.11 -0.29 0.00 -1.03 0.00 0.00 54.13 55.32 3gyr s LEU 41 Cb -0.13 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.48 3gyr s LEU 41 CO 0.20 -0.19 1.17 -0.89 0.23 0.00 0.00 176.35 176.87 3gyr s THR 42 N -0.40 4.45 0.64 5.49 2.01 -1.26 -5.03 115.64 121.54 3gyr s THR 42 Ca 0.48 1.75 -0.17 0.00 0.31 0.00 0.00 61.69 64.06 3gyr s THR 42 Cb -0.30 -4.13 -0.01 0.00 0.01 0.00 0.00 72.50 68.08 3gyr s THR 42 CO 0.36 -0.15 1.17 -2.16 -0.69 0.00 0.00 174.62 173.14 3gyr s PRO 43 N 3.34 2.76 -1.09 4.92 0.04 -1.26 -3.73 135.00 139.98 3gyr s PRO 43 Ca 0.50 1.65 -0.05 0.00 0.04 0.00 0.00 61.00 63.14 3gyr s PRO 43 Cb -0.19 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.43 3gyr s PRO 43 CO 0.11 -1.33 0.94 1.19 0.04 0.00 0.00 177.00 177.96 3gyr n PHE 44 N -2.09 -2.24 0.23 0.56 0.99 0.76 -4.93 117.46 110.75 3gyr n PHE 44 Ca 0.12 0.83 0.11 0.00 -0.00 0.00 0.00 57.45 58.51 3gyr n PHE 44 Cb 0.51 -4.42 -0.08 0.00 -1.00 0.00 0.00 39.48 34.49 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 -4.30 3.02 -2.60 4.37 0.00 -1.24 -4.69 120.51 115.07 3gyr n ALA 45 Ca -0.07 -0.43 -0.17 0.00 0.00 0.00 0.00 53.44 52.78 3gyr n ALA 45 Cb 0.58 -0.89 -0.11 0.00 0.00 0.00 0.00 19.45 19.02 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 -3.37 1.23 0.39 0.00 0.00 -1.26 -4.93 121.76 113.82 3gyr s ALA 46 Ca -0.02 -1.12 -0.25 0.00 0.00 0.00 0.00 51.96 50.57 3gyr s ALA 46 Cb 0.13 -0.05 -0.09 0.00 0.00 0.00 0.00 23.12 23.11 3gyr s ALA 46 CO 0.85 0.09 1.08 -1.25 0.00 0.00 0.00 175.76 176.54 3gyr s PRO 47 N -2.25 4.17 0.21 0.00 0.04 -1.26 -1.36 135.00 134.54 3gyr s PRO 47 Ca 0.03 1.62 -0.32 0.00 0.04 0.00 0.00 61.00 62.37 3gyr s PRO 47 Cb -0.07 -2.63 -0.14 0.00 0.04 0.00 0.00 34.50 31.70 3gyr s PRO 47 CO 0.02 -0.16 1.31 -0.11 0.04 0.00 0.00 177.00 178.10 3gyr n LEU 48 N 0.06 2.45 -4.86 -3.56 7.94 0.70 -4.77 117.00 114.95 3gyr n LEU 48 Ca 0.04 1.14 -0.21 0.00 -1.11 0.00 0.00 56.01 55.87 3gyr n LEU 48 Cb 0.48 -1.34 -0.03 0.00 0.53 0.00 0.00 43.42 43.06 3gyr n LEU 48 CO 0.47 -0.82 -0.08 0.42 -1.11 0.00 0.00 177.39 176.28 3gyr s THR 49 N -0.08 3.71 0.05 1.96 -4.23 -1.26 -4.99 115.64 110.80 3gyr s THR 49 Ca 0.71 -1.33 0.07 0.00 -1.18 0.00 0.00 61.69 59.95 3gyr s THR 49 Cb -0.74 -3.24 -0.03 0.00 1.34 0.00 0.00 72.50 69.84 3gyr s THR 49 CO 0.50 -0.19 -0.20 0.68 -0.54 0.00 0.00 174.62 174.87 3gyr s VAL 50 N -2.27 1.63 0.71 2.29 -7.23 -1.26 -4.76 120.40 109.51 3gyr s VAL 50 Ca 0.40 -1.24 -0.16 0.00 -1.81 0.00 0.00 61.98 59.18 3gyr s VAL 50 Cb -0.06 -1.43 0.01 0.00 0.56 0.00 0.00 36.38 35.45 3gyr s VAL 50 CO 0.27 0.15 1.06 -2.65 -0.31 0.00 0.00 175.10 173.62 3gyr n PRO 51 N 1.74 0.60 -1.64 4.82 -0.02 -1.26 -4.99 135.00 134.24 3gyr n PRO 51 Ca -0.18 0.26 -0.36 0.00 -2.02 0.00 0.00 63.50 61.20 3gyr n PRO 51 Cb 0.53 -2.31 0.08 0.00 -0.02 0.00 0.00 33.50 31.78 3gyr n PRO 51 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3gyr s PRO 52 N -3.42 2.41 -0.14 0.52 0.04 -1.26 -4.55 135.00 128.60 3gyr s PRO 52 Ca 0.75 1.99 -0.12 0.00 0.04 0.00 0.00 61.00 63.66 3gyr s PRO 52 Cb -0.35 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 3gyr s PRO 52 CO 0.48 -1.69 0.25 0.08 0.04 0.00 0.00 177.00 176.16 3gyr s VAL 53 N -1.56 5.33 -0.16 -0.36 1.01 -1.26 -1.39 120.40 122.01 3gyr s VAL 53 Ca 0.80 0.46 -0.01 0.00 0.00 0.00 0.00 61.98 63.23 3gyr s VAL 53 Cb -0.35 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 3gyr s VAL 53 CO 0.41 0.47 -0.10 -0.22 0.00 0.00 0.00 175.10 175.66 3gyr s LEU 54 N -0.08 2.76 -0.42 3.92 2.96 0.12 -4.92 118.68 123.03 3gyr s LEU 54 Ca 0.16 -0.35 0.03 0.00 -0.22 0.00 0.00 54.13 53.74 3gyr s LEU 54 Cb -0.13 -1.65 0.11 0.00 0.50 0.00 0.00 46.19 45.02 3gyr s LEU 54 CO 0.04 0.10 0.15 -0.13 -1.32 0.00 0.00 176.35 175.19 3gyr s ARG 55 N 0.74 1.75 0.27 1.98 0.52 -1.26 -0.60 118.95 122.35 3gyr s ARG 55 Ca -0.05 -2.12 0.25 0.00 -0.52 0.00 0.00 55.73 53.30 3gyr s ARG 55 Cb -0.15 -3.32 0.70 0.00 0.52 0.00 0.00 34.95 32.70 3gyr s ARG 55 CO 0.02 -1.02 1.73 -1.00 0.02 0.00 0.00 175.30 175.05 3gyr h PRO 56 N 7.31 0.00 -6.51 3.54 0.13 -1.98 -3.47 132.00 131.02 3gyr h PRO 56 Ca -0.06 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.54 3gyr h PRO 56 Cb 0.98 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.14 3gyr h PRO 56 CO 0.60 0.00 0.96 0.00 -0.23 0.00 0.00 178.00 179.33 3gyr s ALA 57 N -3.14 3.72 0.35 -0.56 0.00 -1.26 -4.89 121.76 115.98 3gyr s ALA 57 Ca 0.09 1.28 0.03 0.00 0.00 0.00 0.00 51.96 53.37 3gyr s ALA 57 Cb 0.10 -3.67 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 3gyr s ALA 57 CO 0.61 -0.99 0.10 -1.54 0.00 0.00 0.00 175.76 173.93 3gyr s SER 58 N 1.97 2.33 0.00 0.00 1.04 -1.26 -5.04 113.70 112.75 3gyr s SER 58 Ca 0.73 -1.51 0.28 0.00 0.48 0.00 0.00 55.95 55.93 3gyr s SER 58 Cb -0.42 0.22 1.10 0.00 0.10 0.00 0.00 66.02 67.03 3gyr s SER 58 CO 0.32 -0.77 1.78 0.47 0.98 0.00 0.00 173.24 176.02 3gyr n ASP 59 N -0.92 0.69 -4.17 7.02 8.00 -1.26 -4.44 116.55 121.48 3gyr n ASP 59 Ca -0.03 -0.75 -0.39 0.00 0.71 0.00 0.00 54.79 54.32 3gyr n ASP 59 Cb 0.66 -0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.66 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 -2.43 2.50 0.50 -1.24 2.02 -1.26 -4.96 118.70 113.84 3gyr s GLU 60 Ca 0.29 -2.05 0.21 0.00 0.02 0.00 0.00 54.97 53.45 3gyr s GLU 60 Cb 0.20 -3.85 1.31 0.00 0.10 0.00 0.00 34.13 31.89 3gyr s GLU 60 CO 0.47 -1.17 2.08 -0.24 0.02 0.00 0.00 175.26 176.42 3gyr h VAL 61 N 5.83 0.84 0.00 2.63 3.04 -1.91 -1.36 116.25 125.32 3gyr h VAL 61 Ca -0.11 -0.43 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 3gyr h VAL 61 Cb 1.03 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 3gyr h VAL 61 CO 0.78 0.11 0.00 0.35 -1.01 0.00 0.00 177.57 177.80 3gyr n THR 62 N -4.04 0.06 -2.88 3.17 -2.24 -1.26 -4.47 114.28 102.61 3gyr n THR 62 Ca -0.02 0.02 -0.43 0.00 -2.27 0.00 0.00 64.05 61.34 3gyr n THR 62 Cb 0.20 -0.54 -0.04 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 -2.63 3.14 0.64 -0.78 3.52 -0.51 -5.04 118.95 117.29 3gyr s ARG 63 Ca 0.25 -0.76 -0.16 0.00 -0.13 0.00 0.00 55.73 54.93 3gyr s ARG 63 Cb 0.19 -4.19 -0.01 0.00 -1.56 0.00 0.00 34.95 29.38 3gyr s ARG 63 CO 0.45 -1.72 1.14 -1.21 -0.81 0.00 0.00 175.30 173.15 3gyr s GLU 64 N 3.91 2.81 -0.21 5.12 2.02 -1.26 -4.82 118.70 126.27 3gyr s GLU 64 Ca 0.23 1.56 -0.19 0.00 0.02 0.00 0.00 54.97 56.58 3gyr s GLU 64 Cb -0.17 -1.94 -0.03 0.00 0.10 0.00 0.00 34.13 32.10 3gyr s GLU 64 CO 0.12 -1.27 0.57 0.99 0.02 0.00 0.00 175.26 175.68 3gyr s THR 65 N -2.06 5.06 0.04 3.63 2.01 -0.28 -4.93 115.64 119.11 3gyr s THR 65 Ca 0.71 1.04 -0.30 0.00 0.31 0.00 0.00 61.69 63.45 3gyr s THR 65 Cb -0.24 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 3gyr s THR 65 CO 0.38 0.13 1.05 -0.70 -0.69 0.00 0.00 174.62 174.79 3gyr s GLU 66 N 1.92 4.54 -0.24 4.92 2.12 -1.26 -1.43 118.70 129.26 3gyr s GLU 66 Ca 0.25 1.55 0.02 0.00 0.36 0.00 0.00 54.97 57.15 3gyr s GLU 66 Cb -0.16 -3.41 0.06 0.00 0.26 0.00 0.00 34.13 30.89 3gyr s GLU 66 CO 0.10 -0.08 -0.09 0.42 -0.54 0.00 0.00 175.26 175.07 3gyr s ILE 67 N 0.85 1.85 -0.22 -3.70 1.01 -0.58 -4.94 121.20 115.47 3gyr s ILE 67 Ca 0.53 -1.38 -0.10 0.00 0.00 0.00 0.00 60.65 59.70 3gyr s ILE 67 Cb -0.24 -2.01 -0.05 0.00 0.01 0.00 0.00 42.46 40.17 3gyr s ILE 67 CO 0.29 -0.02 0.14 0.00 0.00 0.00 0.00 174.94 175.35 3gyr s ALA 68 N 1.26 3.63 -0.00 9.38 0.00 -1.26 -0.73 121.76 134.03 3gyr s ALA 68 Ca -0.06 -0.80 -0.30 0.00 0.00 0.00 0.00 51.96 50.80 3gyr s ALA 68 Cb -0.19 -2.23 -0.03 0.00 0.00 0.00 0.00 23.12 20.67 3gyr s ALA 68 CO -0.06 -0.02 0.99 -0.51 0.00 0.00 0.00 175.76 176.16 3gyr s LEU 69 N 0.72 4.36 -0.05 0.00 1.02 0.13 0.14 118.68 125.02 3gyr s LEU 69 Ca 0.07 1.67 -0.04 0.00 0.02 0.00 0.00 54.13 55.85 3gyr s LEU 69 Cb -0.12 -3.57 0.01 0.00 0.02 0.00 0.00 46.19 42.53 3gyr s LEU 69 CO 0.01 -0.28 0.12 -0.13 0.02 0.00 0.00 176.35 176.10 3gyr s ARG 70 N 1.05 0.14 0.32 1.70 0.52 -0.55 -1.08 118.95 121.05 3gyr s ARG 70 Ca 0.52 0.19 -0.27 0.00 -0.52 0.00 0.00 55.73 55.65 3gyr s ARG 70 Cb -0.21 0.05 -0.13 0.00 0.52 0.00 0.00 34.95 35.18 3gyr s ARG 70 CO 0.28 -0.03 1.03 -2.30 0.02 0.00 0.00 175.30 174.30 3gyr n PRO 71 N 3.11 1.42 -3.70 3.54 -0.02 -1.26 -1.10 135.00 137.00 3gyr n PRO 71 Ca -0.13 0.50 -0.13 0.00 -2.02 0.00 0.00 63.50 61.71 3gyr n PRO 71 Cb 0.59 -1.92 -0.07 0.00 -0.02 0.00 0.00 33.50 32.07 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 -1.11 0.06 -0.20 3.45 -1.32 0.17 -4.84 115.64 111.84 3gyr s THR 72 Ca 0.59 -0.46 -0.05 0.00 -1.21 0.00 0.00 61.69 60.56 3gyr s THR 72 Cb -0.66 -0.84 -0.02 0.00 -1.51 0.00 0.00 72.50 69.47 3gyr s THR 72 CO 0.60 -0.25 -0.01 0.26 -2.21 0.00 0.00 174.62 173.01 3gyr s TRP 73 N -1.99 3.03 -0.13 9.09 0.52 -1.26 -1.03 118.94 127.17 3gyr s TRP 73 Ca -0.08 -0.49 0.01 0.00 0.02 0.00 0.00 56.10 55.55 3gyr s TRP 73 Cb -0.02 -2.08 -0.01 0.00 -1.15 0.00 0.00 33.47 30.21 3gyr s TRP 73 CO 0.01 -0.26 -0.16 0.08 0.02 0.00 0.00 176.95 176.64 3gyr s VAL 74 N 1.02 2.75 -0.73 4.03 1.01 0.51 -4.87 120.40 124.12 3gyr s VAL 74 Ca 0.02 -0.77 -0.24 0.00 0.00 0.00 0.00 61.98 60.99 3gyr s VAL 74 Cb -0.14 -2.13 0.06 0.00 0.00 0.00 0.00 36.38 34.16 3gyr s VAL 74 CO 0.01 0.53 1.13 -0.60 0.00 0.00 0.00 175.10 176.18 3gyr s ARG 75 N 0.40 3.19 0.26 2.72 6.06 -1.26 -0.52 118.95 129.80 3gyr s ARG 75 Ca -0.12 -0.64 0.07 0.00 -2.50 0.00 0.00 55.73 52.53 3gyr s ARG 75 Cb -0.16 -4.31 0.32 0.00 0.06 0.00 0.00 34.95 30.86 3gyr s ARG 75 CO 0.06 -1.98 1.60 -0.07 -2.50 0.00 0.00 175.30 172.41 3gyr h LEU 76 N 12.10 0.17 -7.05 -0.88 3.38 -1.84 -3.45 115.31 117.75 3gyr h LEU 76 Ca -0.24 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.58 3gyr h LEU 76 Cb 1.06 -0.05 -0.20 0.00 0.09 0.00 0.00 40.66 41.56 3gyr h LEU 76 CO 1.23 0.71 0.12 -2.28 0.09 0.00 0.00 178.44 178.32 3gyr s HIS 77 N -3.76 -0.67 0.55 1.13 5.04 -1.26 -0.54 115.29 115.78 3gyr s HIS 77 Ca -0.03 1.37 0.30 0.00 -1.54 0.00 0.00 55.06 55.16 3gyr s HIS 77 Cb 0.12 0.33 1.76 0.00 0.04 0.00 0.00 32.58 34.84 3gyr s HIS 77 CO 0.78 -0.49 2.22 -1.35 -2.34 0.00 0.00 174.74 173.56 3gyr h PRO 78 N 3.91 0.00 -0.12 2.88 0.11 -1.92 0.12 132.00 136.98 3gyr h PRO 78 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3gyr h PRO 78 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3gyr h PRO 78 CO 0.26 0.03 0.00 1.04 -0.21 0.00 0.00 178.00 179.12 3gyr n GLN 79 N -3.78 1.62 -4.21 1.05 6.02 -1.26 -4.85 117.38 111.97 3gyr n GLN 79 Ca -0.03 -0.93 -0.29 0.00 -0.01 0.00 0.00 57.00 55.75 3gyr n GLN 79 Cb 0.12 -1.40 -0.09 0.00 1.02 0.00 0.00 30.24 29.89 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 -1.63 3.16 0.74 1.08 1.43 0.42 -5.06 118.68 118.81 3gyr s LEU 80 Ca 0.33 -0.39 -0.11 0.00 -1.03 0.00 0.00 54.13 52.93 3gyr s LEU 80 Cb 0.17 -1.89 0.04 0.00 0.03 0.00 0.00 46.19 44.54 3gyr s LEU 80 CO 0.27 0.14 1.08 -2.16 0.23 0.00 0.00 176.35 175.91 3gyr s PRO 81 N -2.50 2.54 0.66 1.29 0.04 -1.26 -4.74 135.00 131.04 3gyr s PRO 81 Ca 0.24 1.01 -0.18 0.00 0.04 0.00 0.00 61.00 62.12 3gyr s PRO 81 Cb -0.10 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 3gyr s PRO 81 CO 0.16 -1.40 1.23 -0.35 0.04 0.00 0.00 177.00 176.68 3gyr n PRO 82 N -3.34 0.98 -4.68 0.56 -0.04 -1.26 -4.67 135.00 122.55 3gyr n PRO 82 Ca 0.08 0.39 -0.33 0.00 -0.04 0.00 0.00 63.50 63.60 3gyr n PRO 82 Cb 0.54 -2.47 -0.13 0.00 -0.04 0.00 0.00 33.50 31.40 3gyr n PRO 82 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3gyr s THR 83 N -1.48 3.43 0.01 0.52 2.01 0.32 -4.87 115.64 115.58 3gyr s THR 83 Ca 0.81 -0.56 -0.30 0.00 0.31 0.00 0.00 61.69 61.95 3gyr s THR 83 Cb -0.37 -2.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 3gyr s THR 83 CO 0.42 0.56 1.13 -0.22 -0.69 0.00 0.00 174.62 175.82 3gyr s LEU 84 N -0.25 4.35 0.24 4.42 2.96 -1.26 -0.36 118.68 128.77 3gyr s LEU 84 Ca 0.03 1.85 -0.01 0.00 -0.22 0.00 0.00 54.13 55.77 3gyr s LEU 84 Cb -0.13 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 3gyr s LEU 84 CO 0.03 -0.43 0.23 -0.04 -1.32 0.00 0.00 176.35 174.82 3gyr s MET 85 N 1.33 1.40 -0.14 1.98 -1.94 -0.20 -4.79 119.30 116.94 3gyr s MET 85 Ca 0.56 -1.65 -0.00 0.00 -1.71 0.00 0.00 55.69 52.89 3gyr s MET 85 Cb -0.26 0.32 -0.01 0.00 2.01 0.00 0.00 34.83 36.90 3gyr s MET 85 CO 0.27 -0.50 -0.14 -1.58 -0.01 0.00 0.00 175.02 173.06 3gyr s TRP 86 N -3.93 2.80 0.00 -0.03 0.51 -0.04 -0.65 118.94 117.61 3gyr s TRP 86 Ca 0.36 -0.82 0.04 0.00 -2.12 0.00 0.00 56.10 53.56 3gyr s TRP 86 Cb 0.04 -1.87 -0.01 0.00 -0.81 0.00 0.00 33.47 30.82 3gyr s TRP 86 CO 0.15 -0.33 -0.12 0.20 -0.51 0.00 0.00 176.95 176.33 3gyr s GLY 87 N 0.59 0.64 0.18 0.98 0.00 -0.26 -3.32 107.32 106.14 3gyr s GLY 87 Ca -0.08 -0.60 -0.32 0.00 0.00 0.00 0.00 44.72 43.73 3gyr s GLY 87 CO 0.03 -0.53 1.61 -0.19 0.00 0.00 0.00 173.10 174.03 3gyr s TYR 88 N -0.44 3.01 -0.98 1.90 2.02 -1.19 -1.48 117.35 120.20 3gyr s TYR 88 Ca 0.04 0.55 -0.09 0.00 -0.37 0.00 0.00 57.07 57.20 3gyr s TYR 88 Cb -0.06 -3.99 0.08 0.00 -0.40 0.00 0.00 41.96 37.59 3gyr s TYR 88 CO -0.00 -3.67 0.31 -0.25 -1.57 0.00 0.00 175.55 170.37 3gyr n ASP 89 N 3.90 -2.39 -0.67 2.29 8.00 0.38 -1.38 116.55 126.67 3gyr n ASP 89 Ca 0.14 -0.24 -0.09 0.00 0.71 0.00 0.00 54.79 55.31 3gyr n ASP 89 Cb 0.37 -2.06 -0.04 0.00 -0.02 0.00 0.00 41.12 39.37 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 -0.89 0.99 3.51 0.44 0.00 -0.55 -4.98 105.19 103.71 3gyr n GLY 90 Ca 0.01 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.50 2.41 -0.12 1.61 -1.52 -0.48 -4.82 119.66 114.25 3gyr s GLN 91 Ca 0.00 -0.77 -0.01 0.00 -1.95 0.00 0.00 55.36 52.63 3gyr s GLN 91 Cb 0.00 -2.37 0.03 0.00 -0.22 0.00 0.00 33.01 30.46 3gyr s GLN 91 CO 0.00 0.60 -0.02 0.08 -0.25 0.00 0.00 175.29 175.69 3gyr s VAL 92 N -0.86 0.69 0.97 1.09 1.01 -1.26 -2.82 120.40 119.24 3gyr s VAL 92 Ca 0.14 -0.21 -0.12 0.00 0.00 0.00 0.00 61.98 61.79 3gyr s VAL 92 Cb -0.11 -0.87 0.17 0.00 0.00 0.00 0.00 36.38 35.58 3gyr s VAL 92 CO 0.04 0.20 1.08 -2.84 0.00 0.00 0.00 175.10 173.58 3gyr s PRO 93 N 1.83 0.62 1.18 2.72 0.02 -1.26 -4.33 135.00 135.77 3gyr s PRO 93 Ca 0.03 0.81 -0.15 0.00 0.02 0.00 0.00 61.00 61.72 3gyr s PRO 93 Cb -0.13 -1.74 0.25 0.00 0.02 0.00 0.00 34.50 32.90 3gyr s PRO 93 CO -0.07 -2.68 0.70 0.41 -0.33 0.00 0.00 177.00 175.03 3gyr n GLY 94 N -0.64 -2.28 3.74 0.52 0.00 0.23 -4.76 105.19 102.00 3gyr n GLY 94 Ca 0.06 -1.09 -0.39 0.00 0.00 0.00 0.00 46.02 44.60 3gyr n GLY 94 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3gyr n PRO 95 N -4.17 1.64 -2.38 1.61 -0.02 -1.26 -4.55 135.00 125.87 3gyr n PRO 95 Ca 0.02 0.61 -0.43 0.00 -2.02 0.00 0.00 63.50 61.67 3gyr n PRO 95 Cb 0.57 -2.55 -0.02 0.00 -0.02 0.00 0.00 33.50 31.47 3gyr n PRO 95 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3gyr s THR 96 N -1.30 3.91 0.08 3.45 2.01 -0.49 -4.27 115.64 119.04 3gyr s THR 96 Ca 0.72 0.90 -0.29 0.00 0.31 0.00 0.00 61.69 63.33 3gyr s THR 96 Cb -0.42 -4.29 -0.05 0.00 0.01 0.00 0.00 72.50 67.75 3gyr s THR 96 CO 0.49 -0.86 0.94 -0.63 -0.69 0.00 0.00 174.62 173.87 3gyr s ILE 97 N 5.48 4.59 -0.07 1.82 1.01 -0.89 0.15 121.20 133.29 3gyr s ILE 97 Ca 0.58 2.01 0.03 0.00 0.00 0.00 0.00 60.65 63.27 3gyr s ILE 97 Cb -0.12 -4.30 0.01 0.00 0.01 0.00 0.00 42.46 38.06 3gyr s ILE 97 CO 0.31 0.30 -0.14 -0.70 0.00 0.00 0.00 174.94 174.71 3gyr s GLU 98 N 0.16 1.94 0.16 2.79 2.12 0.23 -0.02 118.70 126.09 3gyr s GLU 98 Ca 0.47 -0.50 -0.02 0.00 0.36 0.00 0.00 54.97 55.27 3gyr s GLU 98 Cb -0.23 -1.57 -0.04 0.00 0.26 0.00 0.00 34.13 32.56 3gyr s GLU 98 CO 0.29 0.06 0.12 0.14 -0.54 0.00 0.00 175.26 175.32 3gyr s VAL 99 N 0.59 0.07 -0.03 3.70 -7.23 -0.77 -4.34 120.40 112.39 3gyr s VAL 99 Ca -0.15 -1.86 -0.00 0.00 -1.81 0.00 0.00 61.98 58.15 3gyr s VAL 99 Cb -0.16 -2.16 -0.04 0.00 0.56 0.00 0.00 36.38 34.58 3gyr s VAL 99 CO 0.05 -0.30 0.04 -0.13 -0.31 0.00 0.00 175.10 174.45 3gyr s ARG 100 N -4.07 2.96 -0.23 4.82 0.52 -1.26 -0.77 118.95 120.93 3gyr s ARG 100 Ca 0.28 -0.49 -0.37 0.00 -0.52 0.00 0.00 55.73 54.62 3gyr s ARG 100 Cb 0.07 -2.79 -0.17 0.00 0.52 0.00 0.00 34.95 32.57 3gyr s ARG 100 CO 0.05 0.66 1.14 -2.13 0.02 0.00 0.00 175.30 175.04 3gyr n ARG 101 N 1.53 0.00 0.00 3.54 0.63 0.86 -0.90 116.66 122.32 3gyr n ARG 101 Ca -0.15 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.78 3gyr n ARG 101 Cb 0.53 -1.27 0.00 0.00 0.45 0.00 0.00 32.46 32.17 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 2.40 1.39 3.56 5.14 0.00 0.24 -4.98 105.19 112.93 3gyr n GLY 102 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.57 3.16 0.11 1.61 -0.21 -0.08 -4.90 119.66 118.78 3gyr s GLN 103 Ca 0.00 0.11 -0.31 0.00 0.02 0.00 0.00 55.36 55.18 3gyr s GLN 103 Cb 0.00 -4.18 -0.08 0.00 1.00 0.00 0.00 33.01 29.75 3gyr s GLN 103 CO 0.00 -2.14 1.46 0.50 -2.12 0.00 0.00 175.29 172.99 3gyr s ARG 104 N 5.81 4.28 0.00 2.91 3.52 -1.24 -4.53 118.95 129.69 3gyr s ARG 104 Ca 0.45 2.16 0.03 0.00 -0.13 0.00 0.00 55.73 58.24 3gyr s ARG 104 Cb -0.09 -3.31 -0.01 0.00 -1.56 0.00 0.00 34.95 29.98 3gyr s ARG 104 CO 0.19 -0.53 -0.09 0.08 -0.81 0.00 0.00 175.30 174.14 3gyr s VAL 105 N 1.46 0.74 -0.07 7.11 1.01 -0.69 -4.79 120.40 125.17 3gyr s VAL 105 Ca 0.67 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 62.17 3gyr s VAL 105 Cb -0.38 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.36 3gyr s VAL 105 CO 0.30 0.13 -0.19 -0.13 0.00 0.00 0.00 175.10 175.21 3gyr s ARG 106 N -0.44 2.29 -0.08 2.72 0.52 -1.26 -1.03 118.95 121.66 3gyr s ARG 106 Ca 0.02 -0.69 0.02 0.00 -0.52 0.00 0.00 55.73 54.56 3gyr s ARG 106 Cb -0.05 -1.84 0.02 0.00 0.52 0.00 0.00 34.95 33.60 3gyr s ARG 106 CO -0.00 0.18 -0.11 0.42 0.02 0.00 0.00 175.30 175.81 3gyr s ILE 107 N 0.28 1.11 -0.80 1.52 1.01 -0.54 -1.12 121.20 122.66 3gyr s ILE 107 Ca -0.12 -0.44 -0.14 0.00 0.00 0.00 0.00 60.65 59.95 3gyr s ILE 107 Cb -0.15 -1.05 0.20 0.00 0.01 0.00 0.00 42.46 41.48 3gyr s ILE 107 CO 0.05 0.36 0.76 0.00 0.00 0.00 0.00 174.94 176.11 3gyr s ALA 108 N 0.92 4.00 -0.45 9.38 0.00 -0.51 -1.31 121.76 133.79 3gyr s ALA 108 Ca -0.10 -3.21 -0.27 0.00 0.00 0.00 0.00 51.96 48.39 3gyr s ALA 108 Cb -0.15 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.40 3gyr s ALA 108 CO 0.01 -2.29 2.20 -1.58 0.00 0.00 0.00 175.76 174.10 3gyr s TRP 109 N 0.46 1.28 -0.23 0.00 0.52 -0.33 -1.53 118.94 119.10 3gyr s TRP 109 Ca 0.17 1.13 -0.02 0.00 0.02 0.00 0.00 56.10 57.40 3gyr s TRP 109 Cb -0.12 -3.80 0.02 0.00 -1.15 0.00 0.00 33.47 28.41 3gyr s TRP 109 CO -0.08 -2.82 -0.07 0.99 0.02 0.00 0.00 176.95 175.00 3gyr s THR 110 N 10.34 2.95 -0.54 2.01 2.01 0.09 -0.59 115.64 131.90 3gyr s THR 110 Ca 0.90 -0.86 -0.28 0.00 0.31 0.00 0.00 61.69 61.76 3gyr s THR 110 Cb -0.20 -2.43 0.02 0.00 0.01 0.00 0.00 72.50 69.91 3gyr s THR 110 CO 0.27 0.30 1.33 0.21 -0.69 0.00 0.00 174.62 176.04 3gyr s ASN 111 N 1.37 6.29 -0.30 3.53 3.84 -0.44 -0.69 114.94 128.54 3gyr s ASN 111 Ca 0.02 0.32 0.08 0.00 0.21 0.00 0.00 52.86 53.49 3gyr s ASN 111 Cb -0.16 -2.55 0.47 0.00 -0.55 0.00 0.00 41.25 38.47 3gyr s ASN 111 CO -0.05 -1.57 1.38 0.54 -2.79 0.00 0.00 177.10 174.61 3gyr n ARG 112 N 8.46 2.35 -3.13 0.43 5.12 -0.24 0.45 116.66 130.09 3gyr n ARG 112 Ca 0.12 -3.51 -0.43 0.00 -1.93 0.00 0.00 57.85 52.10 3gyr n ARG 112 Cb 0.49 -1.94 -0.07 0.00 -1.16 0.00 0.00 32.46 29.78 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 -3.76 4.85 0.51 0.55 1.01 -1.19 -4.67 121.20 118.50 3gyr s ILE 113 Ca 0.47 0.01 -0.23 0.00 0.00 0.00 0.00 60.65 60.90 3gyr s ILE 113 Cb 0.41 -4.20 -0.07 0.00 0.01 0.00 0.00 42.46 38.61 3gyr s ILE 113 CO -0.01 -0.60 1.27 -2.65 0.00 0.00 0.00 174.94 172.95 3gyr n PRO 114 N 6.20 1.68 -1.60 2.79 -0.02 -1.26 -4.49 135.00 138.30 3gyr n PRO 114 Ca -0.03 0.61 -0.40 0.00 -2.02 0.00 0.00 63.50 61.67 3gyr n PRO 114 Cb 0.48 -2.44 0.03 0.00 -0.02 0.00 0.00 33.50 31.54 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 1.12 -0.96 -0.52 5.02 -1.26 -2.08 118.16 118.88 3gyr n LYS 115 Ca 0.09 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 3gyr n LYS 115 Cb 0.43 -2.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.39 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 1.28 0.97 3.71 0.72 0.00 -1.26 -5.03 105.19 105.57 3gyr n GLY 116 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 2.68 -4.75 1.61 7.64 -0.88 -4.96 113.62 114.96 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 -1.51 -0.04 0.00 -1.01 0.00 0.00 64.21 61.65 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 -2.17 4.55 -0.03 1.43 2.12 -1.26 -4.94 118.70 118.40 3gyr s GLU 118 Ca 0.60 1.86 -0.30 0.00 0.36 0.00 0.00 54.97 57.49 3gyr s GLU 118 Cb -0.51 -3.21 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 3gyr s GLU 118 CO 0.59 0.05 1.41 -0.47 -0.54 0.00 0.00 175.26 176.29 3gyr s TYR 119 N -0.64 2.74 0.33 5.30 5.04 -1.26 -4.91 117.35 123.95 3gyr s TYR 119 Ca 0.49 0.77 0.37 0.00 -2.44 0.00 0.00 57.07 56.26 3gyr s TYR 119 Cb -0.33 -3.67 1.76 0.00 0.35 0.00 0.00 41.96 40.08 3gyr s TYR 119 CO 0.40 -2.49 2.13 -1.35 -1.34 0.00 0.00 175.55 172.90 3gyr h PRO 120 N 8.12 0.00 -5.04 4.97 0.11 -1.93 -3.43 132.00 134.80 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 -0.29 0.00 0.11 0.00 0.00 31.00 31.98 3gyr h PRO 120 CO 0.92 0.01 -0.76 0.08 -0.21 0.00 0.00 178.00 178.05 3gyr s VAL 121 N -3.88 3.06 0.11 3.15 1.01 -1.26 -4.10 120.40 118.49 3gyr s VAL 121 Ca -0.01 -0.60 -0.24 0.00 0.00 0.00 0.00 61.98 61.12 3gyr s VAL 121 Cb 0.11 -2.37 -0.07 0.00 0.00 0.00 0.00 36.38 34.05 3gyr s VAL 121 CO 0.50 0.46 0.73 -0.89 0.00 0.00 0.00 175.10 175.90 3gyr s THR 122 N 1.35 4.54 -0.07 3.92 2.01 0.78 -4.73 115.64 123.44 3gyr s THR 122 Ca 0.04 1.58 0.04 0.00 0.31 0.00 0.00 61.69 63.67 3gyr s THR 122 Cb -0.14 -4.08 -0.00 0.00 0.01 0.00 0.00 72.50 68.28 3gyr s THR 122 CO -0.05 0.48 -0.20 -0.55 -0.69 0.00 0.00 174.62 173.61 3gyr s SER 123 N -0.82 2.60 0.02 3.53 0.15 -1.26 0.10 113.70 118.02 3gyr s SER 123 Ca 0.35 -0.45 -0.02 0.00 0.70 0.00 0.00 55.95 56.53 3gyr s SER 123 Cb -0.22 -0.94 -0.01 0.00 -1.71 0.00 0.00 66.02 63.14 3gyr s SER 123 CO 0.24 0.16 0.02 0.68 1.20 0.00 0.00 173.24 175.54 3gyr s VAL 124 N 0.18 0.11 -0.16 4.45 -7.23 -0.30 -0.69 120.40 116.77 3gyr s VAL 124 Ca -0.10 -0.87 -0.01 0.00 -1.81 0.00 0.00 61.98 59.19 3gyr s VAL 124 Cb -0.15 -0.35 -0.01 0.00 0.56 0.00 0.00 36.38 36.43 3gyr s VAL 124 CO 0.05 -0.48 -0.13 -1.61 -0.31 0.00 0.00 175.10 172.62 3gyr s GLU 125 N -1.52 3.30 0.20 4.82 2.02 -1.26 -1.65 118.70 124.61 3gyr s GLU 125 Ca -0.15 -0.71 0.08 0.00 0.02 0.00 0.00 54.97 54.21 3gyr s GLU 125 Cb -0.09 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.41 3gyr s GLU 125 CO -0.01 0.06 0.00 0.14 0.02 0.00 0.00 175.26 175.47 3gyr s VAL 126 N 0.75 3.66 0.93 2.63 -7.23 0.16 -4.90 120.40 116.40 3gyr s VAL 126 Ca -0.05 -1.55 -0.11 0.00 -1.81 0.00 0.00 61.98 58.45 3gyr s VAL 126 Cb -0.15 -2.88 0.15 0.00 0.56 0.00 0.00 36.38 34.06 3gyr s VAL 126 CO 0.01 -0.19 1.09 -2.84 -0.31 0.00 0.00 175.10 172.87 3gyr s PRO 127 N -3.16 0.93 0.17 4.82 0.02 -1.26 -0.16 135.00 136.36 3gyr s PRO 127 Ca 0.28 1.01 -0.14 0.00 0.02 0.00 0.00 61.00 62.17 3gyr s PRO 127 Cb -0.08 -1.76 0.09 0.00 0.02 0.00 0.00 34.50 32.77 3gyr s PRO 127 CO 0.19 -2.52 1.79 -0.07 -0.33 0.00 0.00 177.00 176.07 3gyr h LEU 128 N -1.76 0.39 -0.27 -5.54 3.38 -1.95 -3.43 115.31 106.13 3gyr h LEU 128 Ca -0.50 0.01 0.38 0.00 0.09 0.00 0.00 57.88 57.87 3gyr h LEU 128 Cb 1.28 -0.06 -0.10 0.00 0.09 0.00 0.00 40.66 41.87 3gyr h LEU 128 CO 0.51 0.28 -0.54 0.61 0.09 0.00 0.00 178.44 179.39 3gyr n GLY 129 N -1.23 -1.88 3.74 0.83 0.00 -1.26 -4.62 105.19 100.77 3gyr n GLY 129 Ca 0.03 -1.10 -0.41 0.00 0.00 0.00 0.00 46.02 44.53 3gyr n GLY 129 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gyr s PRO 130 N -2.27 4.35 0.54 1.61 0.02 -1.26 -4.93 135.00 133.07 3gyr s PRO 130 Ca 0.00 2.14 -0.22 0.00 0.02 0.00 0.00 61.00 62.94 3gyr s PRO 130 Cb 0.00 -3.16 -0.05 0.00 0.02 0.00 0.00 34.50 31.31 3gyr s PRO 130 CO 0.00 -0.30 1.37 -0.35 -0.33 0.00 0.00 177.00 177.40 3gyr n PRO 131 N 2.40 1.75 -0.96 5.54 -0.05 -1.26 -2.11 135.00 140.31 3gyr n PRO 131 Ca 0.06 0.64 0.00 0.00 -0.05 0.00 0.00 63.50 64.15 3gyr n PRO 131 Cb 0.42 -2.59 0.00 0.00 -0.05 0.00 0.00 33.50 31.28 3gyr n PRO 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 3gyr n GLY 132 N 0.73 0.33 3.68 0.55 0.00 -1.26 -5.02 105.19 104.21 3gyr n GLY 132 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.76 3.85 0.45 2.61 -4.23 -0.90 -5.09 115.64 110.57 3gyr s THR 133 Ca 0.00 -1.36 -0.23 0.00 -1.18 0.00 0.00 61.69 58.92 3gyr s THR 133 Cb 0.00 -2.94 -0.10 0.00 1.34 0.00 0.00 72.50 70.81 3gyr s THR 133 CO 0.00 -0.10 0.99 -2.65 -0.54 0.00 0.00 174.62 172.31 3gyr n PRO 134 N -0.13 1.26 -1.63 3.99 -0.02 -1.26 -4.91 135.00 132.29 3gyr n PRO 134 Ca -0.09 0.46 -0.31 0.00 -2.02 0.00 0.00 63.50 61.53 3gyr n PRO 134 Cb 0.55 -2.05 0.05 0.00 -0.02 0.00 0.00 33.50 32.02 3gyr n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr s ALA 135 N -1.33 2.74 -0.03 3.55 0.00 -1.26 -4.93 121.76 120.50 3gyr s ALA 135 Ca 0.65 0.02 0.30 0.00 0.00 0.00 0.00 51.96 52.94 3gyr s ALA 135 Cb -0.53 -3.15 1.42 0.00 0.00 0.00 0.00 23.12 20.86 3gyr s ALA 135 CO 0.55 -1.15 1.91 -1.35 0.00 0.00 0.00 175.76 175.72 3gyr h PRO 136 N -0.67 0.00 0.00 0.00 0.11 -1.88 -1.12 132.00 128.43 3gyr h PRO 136 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3gyr h PRO 136 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3gyr h PRO 136 CO 0.58 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.64 3gyr n ASN 137 N -2.65 0.00 -0.68 -2.05 0.23 -1.26 -1.61 115.26 107.24 3gyr n ASN 137 Ca -0.00 -1.46 0.10 0.00 -0.53 0.00 0.00 54.58 52.69 3gyr n ASN 137 Cb 0.18 0.00 0.30 0.00 -2.08 0.00 0.00 39.78 38.18 3gyr n ASN 137 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3gyr n THR 138 N -0.74 0.33 -4.38 5.53 -2.24 -0.43 -4.06 114.28 108.30 3gyr n THR 138 Ca 0.11 -0.45 -0.19 0.00 -2.27 0.00 0.00 64.05 61.25 3gyr n THR 138 Cb 0.05 0.42 -0.15 0.00 -2.10 0.00 0.00 70.33 68.55 3gyr n THR 138 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3gyr s GLU 139 N -1.67 0.77 0.99 -0.78 2.02 -0.63 -4.78 118.70 114.62 3gyr s GLU 139 Ca 0.32 -0.37 -0.12 0.00 0.02 0.00 0.00 54.97 54.81 3gyr s GLU 139 Cb 0.17 -0.74 0.18 0.00 0.10 0.00 0.00 34.13 33.85 3gyr s GLU 139 CO 0.25 0.20 1.08 -1.25 0.02 0.00 0.00 175.26 175.56 3gyr s PRO 140 N -0.31 0.51 0.00 0.39 0.04 -1.26 -4.92 135.00 129.44 3gyr s PRO 140 Ca 0.03 0.86 0.00 0.00 0.04 0.00 0.00 61.00 61.93 3gyr s PRO 140 Cb -0.04 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.78 3gyr s PRO 140 CO -0.00 -2.76 0.00 0.41 0.04 0.00 0.00 177.00 174.68 3gyr n GLY 141 N -0.46 -1.31 0.00 0.56 0.00 0.42 -4.77 105.19 99.63 3gyr n GLY 141 Ca 0.06 -1.60 0.10 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.63 0.04 0.00 1.61 1.74 -1.26 -4.92 116.66 112.25 3gyr n ARG 142 Ca 0.00 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 3gyr n ARG 142 Cb 0.00 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 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 1.48 3.64 0.25 -0.13 0.00 -1.26 -1.72 105.19 107.46 3gyr n GLY 143 Ca 0.04 0.15 -0.04 0.00 0.00 0.00 0.00 46.02 46.17 3gyr n GLY 143 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3gyr h GLY 144 N 0.00 0.22 -4.66 -0.02 0.00 -2.01 -3.48 103.07 93.12 3gyr h GLY 144 Ca 0.00 0.25 -0.55 0.00 0.00 0.00 0.00 47.33 47.03 3gyr h GLY 144 CO 0.00 -0.21 0.10 0.14 0.00 0.00 0.00 176.54 176.57 3gyr s VAL 145 N -6.16 4.78 0.22 4.60 1.01 -0.70 -5.01 120.40 119.13 3gyr s VAL 145 Ca -0.14 1.50 -0.31 0.00 0.00 0.00 0.00 61.98 63.03 3gyr s VAL 145 Cb 0.16 -4.05 -0.10 0.00 0.00 0.00 0.00 36.38 32.39 3gyr s VAL 145 CO 0.71 0.39 1.53 -1.61 0.00 0.00 0.00 175.10 176.12 3gyr s GLU 146 N -0.13 4.21 0.39 2.72 0.41 -1.26 -4.87 118.70 120.18 3gyr s GLU 146 Ca 0.36 2.39 -0.25 0.00 -0.41 0.00 0.00 54.97 57.06 3gyr s GLU 146 Cb -0.20 -3.11 -0.11 0.00 -1.78 0.00 0.00 34.13 28.93 3gyr s GLU 146 CO 0.21 -0.55 1.09 -2.30 -0.49 0.00 0.00 175.26 173.22 3gyr n PRO 147 N 3.07 1.55 -1.63 0.39 -0.02 -1.26 -4.83 135.00 132.26 3gyr n PRO 147 Ca 0.10 0.55 -0.43 0.00 -2.02 0.00 0.00 63.50 61.71 3gyr n PRO 147 Cb 0.39 -2.11 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 3gyr n PRO 147 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3gyr s ASN 148 N -0.63 5.90 0.38 2.55 3.84 0.14 -4.88 114.94 122.24 3gyr s ASN 148 Ca 0.61 2.25 0.12 0.00 0.21 0.00 0.00 52.86 56.06 3gyr s ASN 148 Cb -0.57 -2.52 0.76 0.00 -0.55 0.00 0.00 41.25 38.37 3gyr s ASN 148 CO 0.58 -1.56 1.85 0.11 -2.79 0.00 0.00 177.10 175.30 3gyr h LYS 149 N 13.07 0.02 -0.24 0.43 1.79 -1.90 -2.13 116.57 127.61 3gyr h LYS 149 Ca -0.45 -0.01 -0.13 0.00 -2.18 0.00 0.00 60.65 57.88 3gyr h LYS 149 Cb 1.24 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.88 3gyr h LYS 149 CO 0.95 0.35 -0.38 -0.44 -1.08 0.00 0.00 179.45 178.85 3gyr h ASP 150 N 0.02 0.58 0.04 0.86 3.45 -1.98 -0.37 116.42 119.01 3gyr h ASP 150 Ca 0.00 -0.25 -0.00 0.00 0.43 0.00 0.00 57.03 57.21 3gyr h ASP 150 Cb 0.59 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.20 3gyr h ASP 150 CO 0.04 0.90 -0.02 0.58 -1.57 0.00 0.00 179.24 179.18 3gyr h VAL 151 N 0.46 1.24 -1.20 -1.35 2.07 -1.90 -3.10 116.25 112.46 3gyr h VAL 151 Ca 0.04 -0.92 0.36 0.00 0.82 0.00 0.00 66.70 67.00 3gyr h VAL 151 Cb 0.87 1.85 -0.11 0.00 -1.52 0.00 0.00 31.29 32.38 3gyr h VAL 151 CO 0.07 0.23 0.78 0.00 0.02 0.00 0.00 177.57 178.68 3gyr h ALA 152 N 0.47 2.57 -0.00 1.67 0.00 -1.13 -1.39 119.26 121.44 3gyr h ALA 152 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3gyr h ALA 152 Cb 0.42 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3gyr h ALA 152 CO 0.01 -1.08 -0.08 0.00 0.00 0.00 0.00 179.25 178.10 3gyr n ALA 153 N -2.52 2.73 -1.72 0.00 0.00 -0.17 -4.34 120.51 114.48 3gyr n ALA 153 Ca 0.31 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 53.06 3gyr n ALA 153 Cb 1.19 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 3gyr n ALA 153 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gyr n LEU 154 N -0.85 3.96 -4.92 0.00 4.77 -0.53 -5.02 117.00 114.42 3gyr n LEU 154 Ca 0.16 1.07 -0.28 0.00 -0.03 0.00 0.00 56.01 56.93 3gyr n LEU 154 Cb 0.26 -1.56 0.10 0.00 -2.33 0.00 0.00 43.42 39.89 3gyr n LEU 154 CO 0.22 0.14 0.73 -2.16 -1.33 0.00 0.00 177.39 175.00 3gyr s PRO 155 N 0.97 1.85 -0.25 3.23 0.04 -1.26 -4.61 135.00 134.96 3gyr s PRO 155 Ca 0.74 -0.13 -0.29 0.00 0.04 0.00 0.00 61.00 61.36 3gyr s PRO 155 Cb -0.52 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 31.98 3gyr s PRO 155 CO 0.34 -1.58 1.59 0.00 0.04 0.00 0.00 177.00 177.39 3gyr s ALA 156 N -3.49 3.23 -0.32 8.56 0.00 -1.26 -4.93 121.76 123.55 3gyr s ALA 156 Ca 0.63 0.37 0.01 0.00 0.00 0.00 0.00 51.96 52.97 3gyr s ALA 156 Cb -0.10 -3.86 0.15 0.00 0.00 0.00 0.00 23.12 19.30 3gyr s ALA 156 CO 0.48 -2.02 0.34 -0.46 0.00 0.00 0.00 175.76 174.10 3gyr s TRP 157 N 5.29 -0.50 0.03 0.00 -0.00 -1.26 -3.97 118.94 118.53 3gyr s TRP 157 Ca 0.70 -0.31 0.03 0.00 -0.00 0.00 0.00 56.10 56.52 3gyr s TRP 157 Cb -0.23 -0.39 -0.02 0.00 -0.00 0.00 0.00 33.47 32.83 3gyr s TRP 157 CO 0.29 -0.95 -0.10 0.45 -0.00 0.00 0.00 176.95 176.65 3gyr s SER 158 N 2.08 1.10 0.01 5.86 0.15 -1.04 -4.79 113.70 117.08 3gyr s SER 158 Ca 0.12 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.35 3gyr s SER 158 Cb -0.14 -0.04 -0.01 0.00 -1.71 0.00 0.00 66.02 64.12 3gyr s SER 158 CO -0.23 -0.06 -0.03 0.54 1.20 0.00 0.00 173.24 174.66 3gyr s VAL 159 N -0.92 0.16 -0.15 4.45 0.11 -1.26 -0.87 120.40 121.92 3gyr s VAL 159 Ca -0.03 -0.41 -0.03 0.00 -2.93 0.00 0.00 61.98 58.57 3gyr s VAL 159 Cb -0.07 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.55 3gyr s VAL 159 CO 0.01 -0.17 -0.05 -0.89 -3.33 0.00 0.00 175.10 170.67 3gyr s THR 160 N -0.59 3.80 -0.15 5.04 2.01 -1.26 -0.65 115.64 123.84 3gyr s THR 160 Ca -0.05 -0.39 -0.00 0.00 0.31 0.00 0.00 61.69 61.55 3gyr s THR 160 Cb -0.04 -2.65 -0.01 0.00 0.01 0.00 0.00 72.50 69.80 3gyr s THR 160 CO -0.00 0.50 -0.13 -2.28 -0.69 0.00 0.00 174.62 172.02 3gyr s HIS 161 N 0.30 2.81 -0.73 4.92 5.04 -0.19 -3.73 115.29 123.72 3gyr s HIS 161 Ca -0.04 -0.83 -0.20 0.00 -1.54 0.00 0.00 55.06 52.45 3gyr s HIS 161 Cb -0.14 -1.88 0.11 0.00 0.04 0.00 0.00 32.58 30.70 3gyr s HIS 161 CO 0.03 -0.35 0.91 -1.17 -2.34 0.00 0.00 174.74 171.83 3gyr s LEU 162 N 0.64 5.06 -0.23 8.88 2.96 -1.26 -2.03 118.68 132.70 3gyr s LEU 162 Ca -0.07 -1.55 -0.29 0.00 -0.22 0.00 0.00 54.13 52.00 3gyr s LEU 162 Cb -0.16 -2.36 -0.03 0.00 0.50 0.00 0.00 46.19 44.14 3gyr s LEU 162 CO 0.03 -1.17 1.85 -2.28 -1.32 0.00 0.00 176.35 173.45 3gyr s HIS 163 N 2.97 1.71 0.00 5.38 5.65 0.26 -1.59 115.29 129.67 3gyr s HIS 163 Ca 0.21 0.47 0.00 0.00 0.25 0.00 0.00 55.06 56.00 3gyr s HIS 163 Cb -0.15 -4.05 0.00 0.00 -1.18 0.00 0.00 32.58 27.20 3gyr s HIS 163 CO 0.02 -3.46 0.00 0.41 -0.65 0.00 0.00 174.74 171.06 3gyr n GLY 164 N 5.17 1.85 3.78 1.59 0.00 -1.26 -2.98 105.19 113.34 3gyr n GLY 164 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.93 3.57 -0.68 4.61 0.00 -0.62 -4.79 121.76 121.92 3gyr s ALA 165 Ca 0.00 1.56 -0.21 0.00 0.00 0.00 0.00 51.96 53.31 3gyr s ALA 165 Cb 0.00 -3.61 0.09 0.00 0.00 0.00 0.00 23.12 19.60 3gyr s ALA 165 CO 0.00 -1.04 0.92 -1.14 0.00 0.00 0.00 175.76 174.50 3gyr s GLN 166 N -2.08 3.16 0.18 0.00 0.74 -1.26 -4.26 119.66 116.14 3gyr s GLN 166 Ca 0.53 -1.10 -0.21 0.00 0.05 0.00 0.00 55.36 54.63 3gyr s GLN 166 Cb -0.46 -4.33 0.05 0.00 1.10 0.00 0.00 33.01 29.36 3gyr s GLN 166 CO 0.63 -1.74 0.57 -0.08 -0.55 0.00 0.00 175.29 174.12 3gyr s THR 167 N 3.49 0.02 0.73 -0.34 -1.32 -1.26 -4.54 115.64 112.43 3gyr s THR 167 Ca 0.21 -0.37 -0.12 0.00 -1.21 0.00 0.00 61.69 60.19 3gyr s THR 167 Cb -0.17 -1.27 0.04 0.00 -1.51 0.00 0.00 72.50 69.59 3gyr s THR 167 CO 0.06 -0.07 1.11 -0.83 -2.21 0.00 0.00 174.62 172.68 3gyr s GLY 168 N -2.81 1.89 0.58 6.08 0.00 -1.26 -4.76 107.32 107.04 3gyr s GLY 168 Ca 0.04 0.42 0.28 0.00 0.00 0.00 0.00 44.72 45.46 3gyr s GLY 168 CO -0.08 0.77 2.07 -1.33 0.00 0.00 0.00 173.10 174.53 3gyr h GLY 169 N -0.69 0.00 1.94 0.20 0.00 -1.43 0.95 103.07 104.04 3gyr h GLY 169 Ca -0.45 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.89 3gyr h GLY 169 CO 0.52 0.00 0.03 -1.33 0.00 0.00 0.00 176.54 175.75 3gyr h GLY 170 N 0.00 0.00 -0.51 4.60 0.00 -1.87 -2.55 103.07 102.74 3gyr h GLY 170 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3gyr h GLY 170 CO -0.00 0.00 -0.20 0.70 0.00 0.00 0.00 176.54 177.04 3gyr n ASN 171 N -3.76 1.30 -0.00 0.19 3.02 0.32 -4.66 115.26 111.66 3gyr n ASN 171 Ca -0.02 -1.15 0.13 0.00 -0.03 0.00 0.00 54.58 53.51 3gyr n ASN 171 Cb 0.11 0.43 0.45 0.00 -0.61 0.00 0.00 39.78 40.17 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 -0.18 0.24 -1.79 6.41 4.64 -0.96 -4.74 116.55 120.17 3gyr n ASP 172 Ca 0.04 0.14 -0.04 0.00 -1.38 0.00 0.00 54.79 53.55 3gyr n ASP 172 Cb 0.22 -0.15 0.02 0.00 -1.04 0.00 0.00 41.12 40.17 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 1.50 0.27 3.66 0.27 0.00 -1.24 -4.14 105.19 105.50 3gyr n GLY 173 Ca 0.06 -0.21 -0.56 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.90 1.78 -0.27 1.61 -0.00 -1.26 -4.66 117.44 112.74 3gyr n TRP 174 Ca -0.05 0.63 0.13 0.00 -0.00 0.00 0.00 57.50 58.21 3gyr n TRP 174 Cb 0.54 -2.38 0.39 0.00 -0.00 0.00 0.00 31.31 29.86 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 5.93 1.86 0.00 5.87 0.00 -1.95 -0.11 119.26 130.87 3gyr h ALA 175 Ca -0.47 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 3gyr h ALA 175 Cb 1.33 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 3gyr h ALA 175 CO 0.88 -0.11 -0.23 -0.44 0.00 0.00 0.00 179.25 179.35 3gyr h ASP 176 N 0.66 0.00 -0.74 0.00 3.32 -1.90 0.02 116.42 117.79 3gyr h ASP 176 Ca 0.45 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 57.08 3gyr h ASP 176 Cb 0.77 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.09 3gyr h ASP 176 CO -0.21 0.23 0.55 0.59 -1.72 0.00 0.00 179.24 178.67 3gyr n ASN 177 N -3.59 4.78 -4.75 6.45 5.03 -0.05 -4.89 115.26 118.24 3gyr n ASN 177 Ca -0.01 -3.28 -0.34 0.00 0.87 0.00 0.00 54.58 51.83 3gyr n ASN 177 Cb 0.37 -0.84 0.06 0.00 -1.02 0.00 0.00 39.78 38.35 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 -2.58 2.33 0.09 5.41 0.00 -1.25 -4.78 121.76 120.97 3gyr s ALA 178 Ca 0.44 0.73 0.10 0.00 0.00 0.00 0.00 51.96 53.23 3gyr s ALA 178 Cb 0.36 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 3gyr s ALA 178 CO 0.05 -1.51 -0.24 0.14 0.00 0.00 0.00 175.76 174.20 3gyr s VAL 179 N -2.11 2.40 0.88 0.00 -7.23 -0.05 -4.78 120.40 109.51 3gyr s VAL 179 Ca 0.71 -1.54 -0.11 0.00 -1.81 0.00 0.00 61.98 59.23 3gyr s VAL 179 Cb -0.25 -2.03 0.17 0.00 0.56 0.00 0.00 36.38 34.83 3gyr s VAL 179 CO 0.42 0.20 1.21 -0.83 -0.31 0.00 0.00 175.10 175.79 3gyr s GLY 180 N -1.76 1.77 -0.10 2.32 0.00 -1.26 -2.48 107.32 105.80 3gyr s GLY 180 Ca 0.14 -1.34 -0.41 0.00 0.00 0.00 0.00 44.72 43.11 3gyr s GLY 180 CO 0.06 -0.65 1.27 0.33 0.00 0.00 0.00 173.10 174.11 3gyr n PHE 181 N -3.46 1.11 0.00 1.90 7.35 -1.26 -1.52 117.46 121.59 3gyr n PHE 181 Ca 0.15 0.97 0.00 0.00 -0.76 0.00 0.00 57.45 57.81 3gyr n PHE 181 Cb 0.60 -2.18 0.00 0.00 0.35 0.00 0.00 39.48 38.24 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 2.35 1.71 3.90 7.13 0.00 0.17 -5.02 105.19 115.44 3gyr n GLY 182 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.14 6.00 0.19 1.61 1.01 -0.57 -4.90 116.67 117.87 3gyr s ASP 183 Ca 0.00 -0.01 0.11 0.00 0.71 0.00 0.00 52.55 53.36 3gyr s ASP 183 Cb 0.00 -1.70 -0.04 0.00 1.01 0.00 0.00 42.92 42.19 3gyr s ASP 183 CO 0.00 0.00 -0.21 0.00 0.21 0.00 0.00 175.17 175.17 3gyr s ALA 184 N -1.89 2.61 -0.22 5.23 0.00 -1.26 -1.32 121.76 124.90 3gyr s ALA 184 Ca 0.33 -1.60 -0.05 0.00 0.00 0.00 0.00 51.96 50.64 3gyr s ALA 184 Cb -0.10 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.59 3gyr s ALA 184 CO 0.27 0.45 0.01 -1.14 0.00 0.00 0.00 175.76 175.35 3gyr s GLN 185 N -2.66 3.58 -0.20 0.00 0.74 0.24 -4.97 119.66 116.38 3gyr s GLN 185 Ca 0.21 -0.53 -0.08 0.00 0.05 0.00 0.00 55.36 55.01 3gyr s GLN 185 Cb -0.08 -3.14 -0.04 0.00 1.10 0.00 0.00 33.01 30.85 3gyr s GLN 185 CO 0.11 -0.09 0.08 -0.51 -0.55 0.00 0.00 175.29 174.32 3gyr s LEU 186 N 1.29 3.80 -0.09 3.68 1.43 -1.26 -1.18 118.68 126.35 3gyr s LEU 186 Ca 0.04 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 3gyr s LEU 186 Cb -0.15 -1.98 0.02 0.00 0.03 0.00 0.00 46.19 44.12 3gyr s LEU 186 CO 0.01 0.13 -0.08 -0.44 0.23 0.00 0.00 176.35 176.20 3gyr s SER 187 N 0.64 1.86 -0.18 2.29 0.01 -0.42 -4.73 113.70 113.16 3gyr s SER 187 Ca 0.04 -0.26 -0.09 0.00 1.31 0.00 0.00 55.95 56.95 3gyr s SER 187 Cb -0.13 -0.75 -0.05 0.00 0.21 0.00 0.00 66.02 65.30 3gyr s SER 187 CO 0.01 -0.08 0.13 -0.70 0.41 0.00 0.00 173.24 173.01 3gyr s GLU 188 N 1.35 4.03 -0.30 12.44 2.12 -1.26 -1.47 118.70 135.61 3gyr s GLU 188 Ca -0.02 -0.21 0.03 0.00 0.36 0.00 0.00 54.97 55.13 3gyr s GLU 188 Cb -0.14 -3.36 0.08 0.00 0.26 0.00 0.00 34.13 30.97 3gyr s GLU 188 CO -0.04 0.39 -0.02 0.71 -0.54 0.00 0.00 175.26 175.76 3gyr s TYR 189 N 0.11 3.52 0.55 5.30 2.02 -0.20 -4.74 117.35 123.90 3gyr s TYR 189 Ca 0.09 -2.68 0.30 0.00 -0.37 0.00 0.00 57.07 54.41 3gyr s TYR 189 Cb -0.11 -2.45 1.77 0.00 -0.40 0.00 0.00 41.96 40.76 3gyr s TYR 189 CO -0.01 -0.92 2.22 -1.35 -1.57 0.00 0.00 175.55 173.93 3gyr h PRO 190 N 7.69 0.00 -5.86 -1.71 0.11 -1.84 -1.83 132.00 128.56 3gyr h PRO 190 Ca -0.11 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.57 3gyr h PRO 190 Cb 1.03 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.18 3gyr h PRO 190 CO 0.49 0.03 -0.70 0.09 -0.21 0.00 0.00 178.00 177.70 3gyr n ASN 191 N -3.76 -5.57 -3.95 -2.05 5.03 -1.26 -3.73 115.26 99.97 3gyr n ASN 191 Ca -0.03 -0.60 -0.43 0.00 0.87 0.00 0.00 54.58 54.39 3gyr n ASN 191 Cb 0.12 -4.43 0.01 0.00 -1.02 0.00 0.00 39.78 34.45 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 -2.84 5.42 -3.61 6.41 4.64 -1.26 0.81 116.55 126.11 3gyr n ASP 192 Ca 0.01 -3.17 -0.16 0.00 -1.38 0.00 0.00 54.79 50.09 3gyr n ASP 192 Cb 0.55 -1.43 -0.07 0.00 -1.04 0.00 0.00 41.12 39.13 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 -0.32 -0.51 1.03 -0.67 2.46 -1.26 -4.98 115.29 111.05 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 0.07 0.29 0.21 0.00 -0.13 0.00 0.00 32.58 33.02 3gyr s HIS 193 CO 0.03 -0.51 1.07 1.14 -2.47 0.00 0.00 174.74 174.00 3gyr s GLN 194 N -1.09 0.13 0.31 2.88 -2.07 -1.26 -4.63 119.66 113.92 3gyr s GLN 194 Ca -0.11 0.83 -0.29 0.00 -1.82 0.00 0.00 55.36 53.97 3gyr s GLN 194 Cb -0.02 -1.68 -0.12 0.00 -1.09 0.00 0.00 33.01 30.10 3gyr s GLN 194 CO 0.07 -3.02 1.39 0.00 -1.32 0.00 0.00 175.29 172.42 3gyr n ALA 195 N -4.42 1.56 -3.84 2.60 0.00 -1.26 -4.90 120.51 110.24 3gyr n ALA 195 Ca 0.05 0.38 -0.00 0.00 0.00 0.00 0.00 53.44 53.87 3gyr n ALA 195 Cb 0.55 -2.31 0.01 0.00 0.00 0.00 0.00 19.45 17.70 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 -0.62 0.00 -0.32 0.00 -1.32 -0.72 -4.14 115.64 108.52 3gyr s THR 196 Ca 0.60 -0.39 -0.10 0.00 -1.21 0.00 0.00 61.69 60.60 3gyr s THR 196 Cb -0.57 -2.60 -0.00 0.00 -1.51 0.00 0.00 72.50 67.81 3gyr s THR 196 CO 0.56 0.00 0.16 -1.58 -2.21 0.00 0.00 174.62 171.55 3gyr s GLN 197 N -2.32 3.27 0.50 7.08 0.74 -1.26 -1.16 119.66 126.51 3gyr s GLN 197 Ca 0.21 -0.77 0.09 0.00 0.05 0.00 0.00 55.36 54.94 3gyr s GLN 197 Cb -0.00 -3.58 0.04 0.00 1.10 0.00 0.00 33.01 30.57 3gyr s GLN 197 CO 0.01 -0.45 0.64 -1.58 -0.55 0.00 0.00 175.29 173.36 3gyr s TRP 198 N 1.60 2.05 0.05 1.67 0.51 0.62 -4.86 118.94 120.58 3gyr s TRP 198 Ca 0.04 -0.60 -0.12 0.00 -2.12 0.00 0.00 56.10 53.30 3gyr s TRP 198 Cb -0.17 -2.24 0.01 0.00 -0.81 0.00 0.00 33.47 30.26 3gyr s TRP 198 CO 0.06 -0.74 0.27 1.67 -0.51 0.00 0.00 176.95 177.71 3gyr s TRP 199 N -2.54 -0.05 0.04 -1.98 1.48 -1.16 -1.31 118.94 113.42 3gyr s TRP 199 Ca 0.56 -0.13 0.07 0.00 -1.06 0.00 0.00 56.10 55.54 3gyr s TRP 199 Cb -0.07 0.06 -0.02 0.00 -1.16 0.00 0.00 33.47 32.28 3gyr s TRP 199 CO 0.34 -0.49 -0.21 1.52 -4.06 0.00 0.00 176.95 174.05 3gyr s TYR 200 N -2.68 1.82 0.21 1.66 -0.85 0.66 0.90 117.35 119.06 3gyr s TYR 200 Ca -0.04 -0.37 -0.22 0.00 -0.52 0.00 0.00 57.07 55.92 3gyr s TYR 200 Cb -0.00 -1.09 0.05 0.00 0.38 0.00 0.00 41.96 41.30 3gyr s TYR 200 CO -0.04 0.09 0.64 -3.38 -1.52 0.00 0.00 175.55 171.33 3gyr s HIS 201 N -0.79 -0.39 0.57 -3.49 -3.43 -0.86 -1.26 115.29 105.65 3gyr s HIS 201 Ca 0.07 0.08 -0.21 0.00 -0.80 0.00 0.00 55.06 54.20 3gyr s HIS 201 Cb -0.09 0.61 -0.04 0.00 -1.43 0.00 0.00 32.58 31.63 3gyr s HIS 201 CO 0.02 -1.00 1.34 0.34 -2.00 0.00 0.00 174.74 173.44 3gyr s ASP 202 N -2.82 5.09 0.00 7.38 -1.08 -1.04 -1.02 116.67 123.18 3gyr s ASP 202 Ca 0.05 2.73 0.01 0.00 -0.52 0.00 0.00 52.55 54.82 3gyr s ASP 202 Cb -0.03 -2.63 0.02 0.00 -1.46 0.00 0.00 42.92 38.82 3gyr s ASP 202 CO -0.05 -1.69 0.95 1.57 0.52 0.00 0.00 175.17 176.46 3gyr n HIS 203 N -1.27 0.00 -1.66 -5.34 -0.00 0.18 -4.76 115.22 102.38 3gyr n HIS 203 Ca 0.12 -0.02 -0.46 0.00 0.46 0.00 0.00 57.72 57.82 3gyr n HIS 203 Cb 0.46 -0.01 -0.03 0.00 -0.12 0.00 0.00 29.99 30.28 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 0.02 0.86 -1.69 1.57 0.00 -1.26 -4.22 120.51 115.78 3gyr n ALA 204 Ca 0.00 0.43 -0.44 0.00 0.00 0.00 0.00 53.44 53.43 3gyr n ALA 204 Cb 0.69 -2.25 -0.04 0.00 0.00 0.00 0.00 19.45 17.85 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 2.31 2.47 0.00 0.00 0.00 -0.00 -2.21 117.12 119.69 3gyr n MET 205 Ca 0.13 0.89 0.00 0.00 -0.00 0.00 0.00 57.70 58.73 3gyr n MET 205 Cb 0.30 -2.71 0.00 0.00 0.00 0.00 0.00 33.22 30.81 3gyr n MET 205 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3gyr n ASN 206 N 3.92 0.00 -0.06 6.12 3.02 -1.26 -4.69 115.26 122.31 3gyr n ASN 206 Ca 0.17 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.76 3gyr n ASN 206 Cb 0.32 -0.20 0.06 0.00 -0.61 0.00 0.00 39.78 39.35 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 -1.63 1.26 -0.33 2.41 -5.35 -1.02 -4.73 119.36 109.97 3gyr n ILE 207 Ca 0.00 -1.42 0.07 0.00 -0.27 0.00 0.00 62.75 61.13 3gyr n ILE 207 Cb 0.00 0.21 0.27 0.00 -1.74 0.00 0.00 39.64 38.38 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 0.58 0.94 0.00 7.28 2.02 -1.72 -0.50 112.91 121.50 3gyr h THR 208 Ca 0.00 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 3gyr h THR 208 Cb 0.79 -0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 3gyr h THR 208 CO 0.00 0.17 -0.01 0.08 0.37 0.00 0.00 175.52 176.14 3gyr h ARG 209 N 0.94 0.00 0.02 6.66 0.11 -1.85 -1.33 114.38 118.93 3gyr h ARG 209 Ca 0.46 0.00 -0.40 0.00 0.10 0.00 0.00 59.98 60.14 3gyr h ARG 209 Cb 0.47 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.49 3gyr h ARG 209 CO -0.22 0.01 -2.38 0.91 0.10 0.00 0.00 179.97 178.38 3gyr n TRP 210 N -3.61 0.21 -0.36 4.08 8.01 -0.33 -3.85 117.44 121.60 3gyr n TRP 210 Ca -0.03 0.06 -0.01 0.00 -1.31 0.00 0.00 57.50 56.21 3gyr n TRP 210 Cb 0.09 -1.03 0.13 0.00 -2.01 0.00 0.00 31.31 28.49 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 -0.29 1.06 -0.09 -0.99 4.21 -1.04 0.41 115.58 118.86 3gyr h ASN 211 Ca -0.58 -0.01 -0.03 0.00 1.21 0.00 0.00 56.30 56.89 3gyr h ASN 211 Cb 1.82 -0.24 -0.00 0.00 -1.12 0.00 0.00 38.32 38.77 3gyr h ASN 211 CO -0.16 0.73 -0.06 0.58 -1.29 0.00 0.00 177.43 177.23 3gyr h VAL 212 N 1.23 1.34 -0.79 2.81 2.07 -1.47 -3.01 116.25 118.44 3gyr h VAL 212 Ca 0.38 -1.14 0.06 0.00 0.82 0.00 0.00 66.70 66.81 3gyr h VAL 212 Cb -0.02 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.62 3gyr h VAL 212 CO -0.12 0.32 0.52 -0.03 0.02 0.00 0.00 177.57 178.28 3gyr h MET 213 N -0.20 0.85 -0.01 1.57 1.85 -1.60 -0.39 114.93 117.00 3gyr h MET 213 Ca 0.02 -0.05 0.00 0.00 -0.61 0.00 0.00 59.70 59.06 3gyr h MET 213 Cb 0.54 -0.19 -0.00 0.00 0.43 0.00 0.00 31.60 32.38 3gyr h MET 213 CO 0.02 0.56 0.23 0.00 -0.40 0.00 0.00 176.91 177.32 3gyr h ALA 214 N 1.57 1.25 0.00 0.39 0.00 -0.04 -3.45 119.26 118.98 3gyr h ALA 214 Ca 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3gyr h ALA 214 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3gyr h ALA 214 CO -0.11 -0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.32 3gyr n GLY 215 N -1.18 0.98 3.24 0.00 0.00 -0.17 -0.86 105.19 107.20 3gyr n GLY 215 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 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 5.78 -3.69 0.99 4.77 -1.13 -4.53 117.00 119.19 3gyr n LEU 216 Ca 0.00 -4.82 -0.14 0.00 -0.03 0.00 0.00 56.01 51.01 3gyr n LEU 216 Cb 0.00 -1.49 -0.08 0.00 -2.33 0.00 0.00 43.42 39.52 3gyr n LEU 216 CO 0.00 1.22 0.15 -0.72 -1.33 0.00 0.00 177.39 176.71 3gyr s TYR 217 N -0.39 -0.36 0.28 -1.77 -0.85 -1.26 -2.49 117.35 110.52 3gyr s TYR 217 Ca 0.36 0.65 -0.20 0.00 -0.52 0.00 0.00 57.07 57.36 3gyr s TYR 217 Cb -0.02 0.19 0.04 0.00 0.38 0.00 0.00 41.96 42.55 3gyr s TYR 217 CO -0.01 -0.42 0.81 0.20 -1.52 0.00 0.00 175.55 174.61 3gyr s GLY 218 N -1.02 0.02 0.39 5.49 0.00 -0.39 -0.60 107.32 111.21 3gyr s GLY 218 Ca -0.11 -0.35 0.06 0.00 0.00 0.00 0.00 44.72 44.33 3gyr s GLY 218 CO 0.05 0.05 0.01 -1.08 0.00 0.00 0.00 173.10 172.14 3gyr s THR 219 N -3.27 1.85 -0.27 0.90 -1.32 -1.26 -0.24 115.64 112.03 3gyr s THR 219 Ca 0.13 -2.01 -0.03 0.00 -1.21 0.00 0.00 61.69 58.57 3gyr s THR 219 Cb -0.05 -2.94 0.15 0.00 -1.51 0.00 0.00 72.50 68.15 3gyr s THR 219 CO 0.07 -0.01 0.49 -0.47 -2.21 0.00 0.00 174.62 172.49 3gyr s TYR 220 N -2.82 -1.19 -0.14 9.09 5.04 -0.43 -2.10 117.35 124.80 3gyr s TYR 220 Ca 0.35 1.37 -0.04 0.00 -2.44 0.00 0.00 57.07 56.31 3gyr s TYR 220 Cb 0.09 0.33 -0.03 0.00 0.35 0.00 0.00 41.96 42.70 3gyr s TYR 220 CO 0.17 -0.76 0.01 -0.51 -1.34 0.00 0.00 175.55 173.12 3gyr s LEU 221 N 2.71 3.53 -0.18 6.97 1.43 0.98 -0.28 118.68 133.83 3gyr s LEU 221 Ca 0.14 0.02 -0.08 0.00 -1.03 0.00 0.00 54.13 53.18 3gyr s LEU 221 Cb -0.15 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 3gyr s LEU 221 CO -0.18 0.24 0.07 -0.69 0.23 0.00 0.00 176.35 176.02 3gyr s VAL 222 N -0.03 4.90 0.10 -1.59 1.01 -0.31 -1.85 120.40 122.64 3gyr s VAL 222 Ca 0.03 0.01 0.04 0.00 0.00 0.00 0.00 61.98 62.06 3gyr s VAL 222 Cb -0.13 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 3gyr s VAL 222 CO 0.02 0.46 0.07 -0.13 0.00 0.00 0.00 175.10 175.52 3gyr s ARG 223 N 0.35 2.82 0.36 2.72 1.81 0.05 -1.75 118.95 125.31 3gyr s ARG 223 Ca 0.04 -0.75 -0.03 0.00 -1.72 0.00 0.00 55.73 53.26 3gyr s ARG 223 Cb -0.12 -2.68 0.01 0.00 -0.45 0.00 0.00 34.95 31.71 3gyr s ARG 223 CO -0.00 0.55 0.52 0.16 -0.68 0.00 0.00 175.30 175.84 3gyr s ASP 224 N -2.51 0.89 0.28 0.23 1.47 -1.26 -0.10 116.67 115.68 3gyr s ASP 224 Ca 0.29 -1.48 0.10 0.00 1.18 0.00 0.00 52.55 52.64 3gyr s ASP 224 Cb -0.12 0.70 0.40 0.00 -0.34 0.00 0.00 42.92 43.55 3gyr s ASP 224 CO 0.22 -1.36 1.64 0.44 0.68 0.00 0.00 175.17 176.78 3gyr h ASP 225 N 2.08 0.04 -0.10 2.11 3.45 -1.98 -1.92 116.42 120.10 3gyr h ASP 225 Ca -0.29 -0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.13 3gyr h ASP 225 Cb 1.24 -0.01 -0.00 0.00 -0.56 0.00 0.00 39.33 39.99 3gyr h ASP 225 CO 0.39 0.61 -0.02 -0.08 -1.57 0.00 0.00 179.24 178.57 3gyr h GLU 226 N 0.03 0.19 -0.46 3.56 4.81 -1.99 -0.78 114.58 119.94 3gyr h GLU 226 Ca -0.01 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.17 3gyr h GLU 226 Cb 1.03 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 3gyr h GLU 226 CO 0.08 0.49 0.27 1.49 -0.73 0.00 0.00 179.01 180.61 3gyr h GLU 227 N -0.13 0.53 -0.97 1.92 4.81 -1.97 -2.23 114.58 116.54 3gyr h GLU 227 Ca 0.03 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 3gyr h GLU 227 Cb 0.42 -0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 3gyr h GLU 227 CO 0.01 0.35 0.63 -0.44 -0.73 0.00 0.00 179.01 178.83 3gyr h ASP 228 N 0.55 1.02 0.06 1.04 3.32 -1.25 -0.86 116.42 120.29 3gyr h ASP 228 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3gyr h ASP 228 Cb 0.01 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.35 3gyr h ASP 228 CO -0.08 0.66 0.00 0.00 -1.72 0.00 0.00 179.24 178.10 3gyr n ALA 229 N -2.36 1.08 1.26 3.45 0.00 -0.31 -0.92 120.51 122.71 3gyr n ALA 229 Ca 0.14 0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.71 3gyr n ALA 229 Cb 0.15 -1.05 0.40 0.00 0.00 0.00 0.00 19.45 18.96 3gyr n ALA 229 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3gyr n LEU 230 N -1.54 1.86 -4.02 0.00 7.94 -0.33 -4.95 117.00 115.97 3gyr n LEU 230 Ca 0.00 -0.69 -0.26 0.00 -1.11 0.00 0.00 56.01 53.95 3gyr n LEU 230 Cb 0.02 -0.05 -0.08 0.00 0.53 0.00 0.00 43.42 43.84 3gyr n LEU 230 CO 0.02 0.35 -0.39 0.61 -1.11 0.00 0.00 177.39 176.87 3gyr n GLY 231 N 1.20 -0.11 3.75 -3.96 0.00 -0.10 -4.91 105.19 101.07 3gyr n GLY 231 Ca 0.17 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 46.03 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 -6.64 3.05 0.37 0.99 1.43 -1.26 -4.94 118.68 111.68 3gyr s LEU 232 Ca 0.02 1.94 -0.27 0.00 -1.03 0.00 0.00 54.13 54.80 3gyr s LEU 232 Cb -0.01 -4.54 -0.11 0.00 0.03 0.00 0.00 46.19 41.56 3gyr s LEU 232 CO 0.83 -2.21 1.30 -2.65 0.23 0.00 0.00 176.35 173.86 3gyr n PRO 233 N -3.49 2.12 -4.17 1.29 -0.02 -1.26 -4.98 135.00 124.49 3gyr n PRO 233 Ca 0.10 0.75 -0.18 0.00 -2.02 0.00 0.00 63.50 62.15 3gyr n PRO 233 Cb 0.53 -2.38 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 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 0.54 -1.08 0.00 2.55 3.41 -1.26 -4.46 113.62 113.31 3gyr n SER 234 Ca 0.05 -3.10 0.00 0.00 -0.26 0.00 0.00 58.87 55.56 3gyr n SER 234 Cb 0.38 2.19 0.00 0.00 -0.26 0.00 0.00 64.21 66.51 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 -0.62 3.43 0.42 5.00 0.00 -1.26 -1.47 105.19 110.68 3gyr n GLY 235 Ca 0.04 -0.11 0.22 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 0.32 -0.17 1.61 3.32 -2.03 -1.81 116.42 117.67 3gyr h ASP 236 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3gyr h ASP 236 Cb 0.00 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3gyr h ASP 236 CO 0.00 0.11 0.00 0.54 -1.72 0.00 0.00 179.24 178.17 3gyr n ARG 237 N -4.48 1.63 -4.39 3.56 5.12 -0.54 -4.70 116.66 112.85 3gyr n ARG 237 Ca 0.21 -0.95 -0.33 0.00 -1.93 0.00 0.00 57.85 54.84 3gyr n ARG 237 Cb 0.80 -1.35 -0.15 0.00 -1.16 0.00 0.00 32.46 30.60 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 -1.78 3.19 -0.16 5.56 2.12 -0.68 -1.41 118.70 125.54 3gyr s GLU 238 Ca 0.29 -0.75 -0.01 0.00 0.36 0.00 0.00 54.97 54.86 3gyr s GLU 238 Cb 0.15 -2.66 0.04 0.00 0.26 0.00 0.00 34.13 31.93 3gyr s GLU 238 CO 0.23 -0.05 -0.02 0.42 -0.54 0.00 0.00 175.26 175.30 3gyr s ILE 239 N 0.97 0.83 0.44 -3.70 1.01 0.44 -4.74 121.20 116.46 3gyr s ILE 239 Ca -0.02 -0.48 -0.22 0.00 0.00 0.00 0.00 60.65 59.93 3gyr s ILE 239 Cb -0.15 -1.09 -0.09 0.00 0.01 0.00 0.00 42.46 41.14 3gyr s ILE 239 CO -0.03 0.07 1.03 -2.84 0.00 0.00 0.00 174.94 173.17 3gyr s PRO 240 N 1.75 4.01 -0.24 2.79 0.02 -1.26 -1.22 135.00 140.85 3gyr s PRO 240 Ca 0.01 1.38 -0.03 0.00 0.02 0.00 0.00 61.00 62.38 3gyr s PRO 240 Cb -0.15 -2.29 0.08 0.00 0.02 0.00 0.00 34.50 32.16 3gyr s PRO 240 CO -0.07 -0.25 0.08 -0.51 -0.33 0.00 0.00 177.00 175.91 3gyr s LEU 241 N -3.10 1.24 -0.46 -5.54 1.43 0.29 -4.81 118.68 107.73 3gyr s LEU 241 Ca 0.63 -1.12 -0.13 0.00 -1.03 0.00 0.00 54.13 52.47 3gyr s LEU 241 Cb -0.17 -0.58 0.08 0.00 0.03 0.00 0.00 46.19 45.54 3gyr s LEU 241 CO 0.22 -0.37 0.35 -0.76 0.23 0.00 0.00 176.35 176.02 3gyr s LEU 242 N 1.87 5.49 0.05 1.79 1.02 -1.26 0.01 118.68 127.65 3gyr s LEU 242 Ca 0.04 -1.41 -0.02 0.00 0.02 0.00 0.00 54.13 52.76 3gyr s LEU 242 Cb -0.17 -2.12 -0.04 0.00 0.02 0.00 0.00 46.19 43.88 3gyr s LEU 242 CO -0.19 -0.62 0.24 0.27 0.02 0.00 0.00 176.35 176.07 3gyr s ILE 243 N 1.56 5.35 -0.28 -0.59 -4.36 -0.65 -1.29 121.20 120.94 3gyr s ILE 243 Ca 0.04 -0.20 -0.17 0.00 -0.26 0.00 0.00 60.65 60.06 3gyr s ILE 243 Cb -0.24 -3.60 0.10 0.00 1.25 0.00 0.00 42.46 39.97 3gyr s ILE 243 CO 0.05 0.19 0.80 0.00 0.24 0.00 0.00 174.94 176.22 3gyr s ALA 244 N -1.47 -2.00 0.42 2.27 0.00 -0.58 0.48 121.76 120.88 3gyr s ALA 244 Ca 0.34 2.29 -0.15 0.00 0.00 0.00 0.00 51.96 54.44 3gyr s ALA 244 Cb -0.13 -1.49 -0.08 0.00 0.00 0.00 0.00 23.12 21.41 3gyr s ALA 244 CO 0.24 -0.36 0.86 0.16 0.00 0.00 0.00 175.76 176.66 3gyr s ASP 245 N 1.36 6.70 0.04 0.00 -4.77 -1.26 -0.49 116.67 118.25 3gyr s ASP 245 Ca -0.08 1.40 -0.01 0.00 -3.30 0.00 0.00 52.55 50.57 3gyr s ASP 245 Cb -0.05 -2.43 -0.04 0.00 -1.09 0.00 0.00 42.92 39.32 3gyr s ASP 245 CO -0.16 -0.39 -0.03 -0.13 0.70 0.00 0.00 175.17 175.16 3gyr s ARG 246 N -3.55 0.54 0.24 2.11 1.81 0.54 -4.80 118.95 115.85 3gyr s ARG 246 Ca 0.56 -1.07 0.12 0.00 -1.72 0.00 0.00 55.73 53.62 3gyr s ARG 246 Cb -0.10 0.18 -0.05 0.00 -0.45 0.00 0.00 34.95 34.54 3gyr s ARG 246 CO 0.24 -0.09 -0.22 1.21 -0.68 0.00 0.00 175.30 175.76 3gyr s ASN 247 N -2.56 3.53 0.11 0.23 3.84 -1.25 -1.88 114.94 116.96 3gyr s ASN 247 Ca 0.01 -0.95 0.06 0.00 0.21 0.00 0.00 52.86 52.19 3gyr s ASN 247 Cb 0.04 -0.29 -0.03 0.00 -0.55 0.00 0.00 41.25 40.41 3gyr s ASN 247 CO -0.08 0.08 -0.15 -0.76 -2.79 0.00 0.00 177.10 173.39 3gyr s LEU 248 N -3.14 2.35 0.73 3.21 1.43 -1.26 -1.38 118.68 120.62 3gyr s LEU 248 Ca 0.26 -0.73 -0.09 0.00 -1.03 0.00 0.00 54.13 52.53 3gyr s LEU 248 Cb -0.06 -0.61 0.05 0.00 0.03 0.00 0.00 46.19 45.60 3gyr s LEU 248 CO 0.13 -0.08 1.08 -0.62 0.23 0.00 0.00 176.35 177.08 3gyr s ASP 249 N -2.16 4.89 0.12 2.29 -1.08 -0.08 -0.43 116.67 120.22 3gyr s ASP 249 Ca 0.06 0.72 0.06 0.00 -0.52 0.00 0.00 52.55 52.87 3gyr s ASP 249 Cb -0.07 -1.38 -0.04 0.00 -1.46 0.00 0.00 42.92 39.97 3gyr s ASP 249 CO 0.03 -1.61 -0.14 0.42 0.52 0.00 0.00 175.17 174.39 3gyr s THR 250 N -3.36 1.29 0.83 1.71 -4.23 -1.26 -1.17 115.64 109.45 3gyr s THR 250 Ca 0.60 -1.68 -0.12 0.00 -1.18 0.00 0.00 61.69 59.31 3gyr s THR 250 Cb -0.11 -1.48 0.09 0.00 1.34 0.00 0.00 72.50 72.34 3gyr s THR 250 CO 0.48 -0.41 1.18 -1.81 -0.54 0.00 0.00 174.62 173.52 3gyr s ASP 251 N -2.39 4.30 0.53 3.99 1.01 0.51 -4.87 116.67 119.76 3gyr s ASP 251 Ca 0.08 0.78 0.21 0.00 0.71 0.00 0.00 52.55 54.33 3gyr s ASP 251 Cb -0.05 -1.26 1.38 0.00 1.01 0.00 0.00 42.92 43.99 3gyr s ASP 251 CO 0.03 -2.04 2.09 -0.33 0.21 0.00 0.00 175.17 175.13 3gyr h GLU 252 N -1.15 0.00 0.00 8.23 5.08 -2.02 0.92 114.58 125.65 3gyr h GLU 252 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 3gyr h GLU 252 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 3gyr h GLU 252 CO 0.64 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.25 3gyr n ASP 253 N -4.38 0.00 0.00 1.42 5.75 -1.26 -4.85 116.55 113.23 3gyr n ASP 253 Ca 0.02 -0.96 0.00 0.00 -0.01 0.00 0.00 54.79 53.84 3gyr n ASP 253 Cb 0.30 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 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 0.60 0.73 3.76 6.12 0.00 0.32 -5.04 105.19 111.68 3gyr n GLY 254 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.53 4.60 0.15 1.61 0.52 -1.24 -4.73 118.95 119.33 3gyr s ARG 255 Ca 0.00 1.85 -0.31 0.00 -0.52 0.00 0.00 55.73 56.75 3gyr s ARG 255 Cb 0.00 -3.18 -0.10 0.00 0.52 0.00 0.00 34.95 32.19 3gyr s ARG 255 CO 0.00 0.15 1.58 -0.51 0.02 0.00 0.00 175.30 176.55 3gyr s LEU 256 N -1.41 4.37 0.00 2.53 1.43 -1.26 -0.36 118.68 123.98 3gyr s LEU 256 Ca 0.45 2.61 0.09 0.00 -1.03 0.00 0.00 54.13 56.25 3gyr s LEU 256 Cb -0.33 -3.59 0.19 0.00 0.03 0.00 0.00 46.19 42.49 3gyr s LEU 256 CO 0.42 -0.84 1.05 -0.46 0.23 0.00 0.00 176.35 176.76 3gyr n ASN 257 N 4.19 2.40 0.00 2.29 0.23 -0.32 -4.82 115.26 119.22 3gyr n ASN 257 Ca 0.14 -1.76 0.00 0.00 -0.53 0.00 0.00 54.58 52.43 3gyr n ASN 257 Cb 0.39 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 37.97 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 0.43 2.40 3.67 4.83 0.00 -1.26 -4.71 105.19 110.54 3gyr n GLY 258 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.02 4.20 0.15 1.61 0.52 -1.26 -4.55 118.95 119.60 3gyr s ARG 259 Ca 0.00 2.11 -0.33 0.00 -0.52 0.00 0.00 55.73 56.98 3gyr s ARG 259 Cb 0.00 -3.86 -0.13 0.00 0.52 0.00 0.00 34.95 31.48 3gyr s ARG 259 CO 0.00 -0.78 1.65 1.28 0.02 0.00 0.00 175.30 177.48 3gyr n LEU 260 N 6.64 3.38 -3.90 2.53 4.77 -1.26 -0.90 117.00 128.26 3gyr n LEU 260 Ca 0.16 1.06 -0.28 0.00 -0.03 0.00 0.00 56.01 56.92 3gyr n LEU 260 Cb 0.43 -1.46 -0.16 0.00 -2.33 0.00 0.00 43.42 39.89 3gyr n LEU 260 CO 0.61 -0.14 -0.43 -0.22 -1.33 0.00 0.00 177.39 175.89 3gyr s LEU 261 N 1.38 1.68 -0.64 2.23 2.96 -0.48 -0.16 118.68 125.66 3gyr s LEU 261 Ca 0.80 -0.69 -0.18 0.00 -0.22 0.00 0.00 54.13 53.84 3gyr s LEU 261 Cb -0.63 -0.94 0.12 0.00 0.50 0.00 0.00 46.19 45.24 3gyr s LEU 261 CO 0.38 -0.18 0.72 -2.28 -1.32 0.00 0.00 176.35 173.67 3gyr s HIS 262 N 1.61 3.13 -0.26 5.38 5.65 0.29 -3.83 115.29 127.26 3gyr s HIS 262 Ca 0.00 -1.16 0.01 0.00 0.25 0.00 0.00 55.06 54.16 3gyr s HIS 262 Cb -0.15 -3.99 0.05 0.00 -1.18 0.00 0.00 32.58 27.30 3gyr s HIS 262 CO -0.08 -1.24 -0.09 0.21 -0.65 0.00 0.00 174.74 172.89 3gyr s LYS 263 N 2.26 2.48 0.24 2.88 2.20 -1.26 -1.15 119.74 127.40 3gyr s LYS 263 Ca 0.13 -1.20 0.09 0.00 -0.36 0.00 0.00 55.97 54.63 3gyr s LYS 263 Cb -0.22 -2.93 -0.04 0.00 -1.51 0.00 0.00 37.83 33.13 3gyr s LYS 263 CO 0.03 -0.51 -0.02 0.95 -0.36 0.00 0.00 175.35 175.44 3gyr s THR 264 N 1.20 3.42 -0.17 3.43 -4.23 -0.66 -4.54 115.64 114.08 3gyr s THR 264 Ca -0.05 -1.83 -0.08 0.00 -1.18 0.00 0.00 61.69 58.56 3gyr s THR 264 Cb -0.18 -2.79 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 3gyr s THR 264 CO -0.05 -0.30 0.08 -0.69 -0.54 0.00 0.00 174.62 173.12 3gyr s VAL 265 N -2.16 4.99 -0.16 2.29 1.01 -1.26 -0.67 120.40 124.44 3gyr s VAL 265 Ca 0.30 0.03 -0.29 0.00 0.00 0.00 0.00 61.98 62.02 3gyr s VAL 265 Cb -0.07 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 3gyr s VAL 265 CO 0.19 0.48 1.08 -0.63 0.00 0.00 0.00 175.10 176.22 3gyr s ILE 266 N 0.15 4.61 -0.72 2.22 1.01 0.77 -1.29 121.20 127.95 3gyr s ILE 266 Ca 0.06 1.91 0.16 0.00 0.00 0.00 0.00 60.65 62.78 3gyr s ILE 266 Cb -0.12 -4.23 -0.17 0.00 0.01 0.00 0.00 42.46 37.94 3gyr s ILE 266 CO 0.00 -0.09 0.66 1.33 0.00 0.00 0.00 174.94 176.84 3gyr n VAL 267 N 4.97 0.00 -3.60 2.92 0.24 0.60 -3.74 118.33 119.73 3gyr n VAL 267 Ca 0.11 -0.14 -0.11 0.00 -2.04 0.00 0.00 64.34 62.16 3gyr n VAL 267 Cb 0.47 0.97 -0.11 0.00 -1.47 0.00 0.00 33.84 33.70 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 -2.51 0.25 0.23 7.34 0.74 -0.97 -5.00 119.66 119.74 3gyr s GLN 268 Ca 0.06 0.80 0.08 0.00 0.05 0.00 0.00 55.36 56.34 3gyr s GLN 268 Cb 0.12 -0.03 0.19 0.00 1.10 0.00 0.00 33.01 34.38 3gyr s GLN 268 CO 0.65 -0.35 1.51 0.37 -0.55 0.00 0.00 175.29 176.92 3gyr h GLN 269 N 8.23 0.04 -2.16 1.67 5.75 -1.87 0.43 115.11 127.19 3gyr h GLN 269 Ca -0.16 -0.04 -0.15 0.00 -0.15 0.00 0.00 58.65 58.16 3gyr h GLN 269 Cb 1.12 0.01 -0.30 0.00 1.07 0.00 0.00 27.48 29.38 3gyr h GLN 269 CO 0.16 0.75 -0.46 0.45 -2.65 0.00 0.00 178.83 177.08 3gyr s SER 270 N -6.83 0.16 0.01 -0.69 0.15 -1.26 -3.43 113.70 101.82 3gyr s SER 270 Ca -0.01 0.44 -0.30 0.00 0.70 0.00 0.00 55.95 56.78 3gyr s SER 270 Cb 0.12 1.12 -0.04 0.00 -1.71 0.00 0.00 66.02 65.51 3gyr s SER 270 CO 0.78 -0.28 1.06 0.21 1.20 0.00 0.00 173.24 176.22 3gyr s ASN 271 N 2.54 7.26 0.40 5.45 2.47 0.21 -4.89 114.94 128.38 3gyr s ASN 271 Ca 0.08 1.77 0.25 0.00 0.42 0.00 0.00 52.86 55.38 3gyr s ASN 271 Cb -0.14 -2.57 1.37 0.00 -1.45 0.00 0.00 41.25 38.46 3gyr s ASN 271 CO -0.14 -0.35 1.59 -0.65 -3.72 0.00 0.00 177.10 173.84 3gyr h PRO 272 N 6.83 0.05 0.02 0.43 0.11 -1.94 -2.91 132.00 134.59 3gyr h PRO 272 Ca -0.41 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.53 3gyr h PRO 272 Cb 1.21 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3gyr h PRO 272 CO 0.78 0.03 -0.89 0.93 -0.21 0.00 0.00 178.00 178.63 3gyr h GLU 273 N 0.05 0.04 -6.16 1.05 5.08 -1.92 -3.47 114.58 109.25 3gyr h GLU 273 Ca 0.84 -0.08 -0.50 0.00 -1.00 0.00 0.00 59.36 58.63 3gyr h GLU 273 Cb 2.39 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 31.63 3gyr h GLU 273 CO -0.63 1.04 -0.40 0.95 -1.00 0.00 0.00 179.01 178.97 3gyr s THR 274 N -2.34 2.77 0.65 1.13 -4.23 -1.10 -4.99 115.64 107.53 3gyr s THR 274 Ca -0.24 -1.38 0.34 0.00 -1.18 0.00 0.00 61.69 59.24 3gyr s THR 274 Cb 0.03 -3.02 0.36 0.00 1.34 0.00 0.00 72.50 71.21 3gyr s THR 274 CO 0.65 -0.03 2.10 1.23 -0.54 0.00 0.00 174.62 178.04 3gyr h GLY 275 N 1.09 0.00 -3.56 3.99 0.00 -1.91 -3.29 103.07 99.39 3gyr h GLY 275 Ca -0.42 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.39 3gyr h GLY 275 CO 0.58 0.00 -0.50 0.54 0.00 0.00 0.00 176.54 177.16 3gyr s LYS 276 N -4.25 3.18 0.40 4.80 1.02 -1.26 -4.03 119.74 119.60 3gyr s LYS 276 Ca -0.04 -0.80 -0.25 0.00 0.02 0.00 0.00 55.97 54.90 3gyr s LYS 276 Cb 0.12 -2.78 -0.08 0.00 -0.52 0.00 0.00 37.83 34.57 3gyr s LYS 276 CO 0.39 0.47 1.14 -1.25 -0.92 0.00 0.00 175.35 175.18 3gyr s PRO 277 N -3.48 4.06 -0.18 -1.68 0.04 -1.22 -0.62 135.00 131.92 3gyr s PRO 277 Ca 0.33 1.77 -0.01 0.00 0.04 0.00 0.00 61.00 63.13 3gyr s PRO 277 Cb -0.10 -2.64 -0.00 0.00 0.04 0.00 0.00 34.50 31.81 3gyr s PRO 277 CO 0.26 -0.29 -0.12 0.08 0.04 0.00 0.00 177.00 176.97 3gyr s VAL 278 N -1.47 2.80 0.24 -0.36 1.01 0.15 -4.93 120.40 117.85 3gyr s VAL 278 Ca 0.57 -0.70 0.11 0.00 0.00 0.00 0.00 61.98 61.96 3gyr s VAL 278 Cb -0.29 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 3gyr s VAL 278 CO 0.36 0.49 -0.20 -0.94 0.00 0.00 0.00 175.10 174.81 3gyr s SER 279 N 1.11 3.36 0.84 3.32 1.04 -1.26 -0.29 113.70 121.83 3gyr s SER 279 Ca 0.00 -0.98 -0.13 0.00 0.48 0.00 0.00 55.95 55.33 3gyr s SER 279 Cb -0.14 -0.26 0.11 0.00 0.10 0.00 0.00 66.02 65.83 3gyr s SER 279 CO -0.04 0.03 1.21 0.27 0.98 0.00 0.00 173.24 175.69 3gyr s ILE 280 N -2.32 2.02 1.19 -1.02 -4.36 -0.41 -4.90 121.20 111.41 3gyr s ILE 280 Ca 0.26 -0.03 -0.16 0.00 -0.26 0.00 0.00 60.65 60.46 3gyr s ILE 280 Cb -0.05 -2.99 0.28 0.00 1.25 0.00 0.00 42.46 40.95 3gyr s ILE 280 CO 0.12 0.00 1.03 -2.84 0.24 0.00 0.00 174.94 173.49 3gyr s PRO 281 N -5.64 -1.13 -0.10 0.37 0.02 -1.26 -4.48 135.00 122.77 3gyr s PRO 281 Ca 0.65 0.45 -0.28 0.00 0.02 0.00 0.00 61.00 61.85 3gyr s PRO 281 Cb -0.09 -1.56 -0.02 0.00 0.02 0.00 0.00 34.50 32.85 3gyr s PRO 281 CO 0.50 -3.77 0.93 0.12 -0.33 0.00 0.00 177.00 174.45 3gyr s PHE 282 N -2.63 3.52 -0.03 6.54 5.36 -1.26 -4.72 117.98 124.77 3gyr s PHE 282 Ca 0.68 1.49 0.02 0.00 -0.96 0.00 0.00 56.93 58.16 3gyr s PHE 282 Cb -0.19 -3.09 0.01 0.00 -0.34 0.00 0.00 43.02 39.41 3gyr s PHE 282 CO 0.60 -0.16 -0.05 -0.06 -1.46 0.00 0.00 175.22 174.09 3gyr s PHE 283 N 1.76 0.66 0.24 10.12 0.08 -1.26 -4.04 117.98 125.54 3gyr s PHE 283 Ca 0.45 -0.15 0.05 0.00 0.12 0.00 0.00 56.93 57.40 3gyr s PHE 283 Cb -0.18 -0.53 -0.05 0.00 -0.57 0.00 0.00 43.02 41.69 3gyr s PHE 283 CO 0.18 -0.11 -0.05 0.20 -0.10 0.00 0.00 175.22 175.35 3gyr s GLY 284 N 0.44 1.59 0.23 4.36 0.00 -1.26 -4.77 107.32 107.91 3gyr s GLY 284 Ca -0.06 -1.78 0.24 0.00 0.00 0.00 0.00 44.72 43.13 3gyr s GLY 284 CO -0.00 -1.73 1.50 -0.56 0.00 0.00 0.00 173.10 172.31 3gyr h PRO 285 N 2.44 0.00 -5.44 2.90 0.13 -1.67 -3.41 132.00 126.95 3gyr h PRO 285 Ca -0.39 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.11 3gyr h PRO 285 Cb 1.22 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.18 3gyr h PRO 285 CO 0.65 0.00 -0.61 0.71 -0.23 0.00 0.00 178.00 178.52 3gyr s TYR 286 N -3.18 3.16 -0.25 1.56 1.51 -0.79 -4.40 117.35 114.96 3gyr s TYR 286 Ca 0.07 -0.03 -0.11 0.00 -1.01 0.00 0.00 57.07 55.99 3gyr s TYR 286 Cb 0.11 -1.97 -0.05 0.00 -0.11 0.00 0.00 41.96 39.94 3gyr s TYR 286 CO 0.68 0.16 0.19 0.99 -1.11 0.00 0.00 175.55 176.46 3gyr s THR 287 N 0.08 5.33 0.02 -0.71 2.01 -1.26 -0.34 115.64 120.77 3gyr s THR 287 Ca 0.03 0.23 -0.06 0.00 0.31 0.00 0.00 61.69 62.20 3gyr s THR 287 Cb -0.13 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.80 3gyr s THR 287 CO 0.02 0.31 0.27 0.42 -0.69 0.00 0.00 174.62 174.94 3gyr s THR 288 N 1.30 5.31 -0.15 -0.82 -4.23 0.35 -1.71 115.64 115.68 3gyr s THR 288 Ca 0.09 0.11 -0.02 0.00 -1.18 0.00 0.00 61.69 60.68 3gyr s THR 288 Cb -0.14 -3.57 0.05 0.00 1.34 0.00 0.00 72.50 70.17 3gyr s THR 288 CO 0.07 0.33 0.02 -0.69 -0.54 0.00 0.00 174.62 173.81 3gyr s VAL 289 N -1.34 0.47 -1.50 2.29 1.01 -0.11 -1.53 120.40 119.69 3gyr s VAL 289 Ca 0.29 -0.34 -0.12 0.00 0.00 0.00 0.00 61.98 61.81 3gyr s VAL 289 Cb -0.13 -0.87 0.07 0.00 0.00 0.00 0.00 36.38 35.45 3gyr s VAL 289 CO 0.17 -0.06 0.96 0.59 0.00 0.00 0.00 175.10 176.77 3gyr n ASN 290 N 5.08 -4.44 0.00 3.32 3.02 -0.41 -2.41 115.26 119.42 3gyr n ASN 290 Ca -0.08 -0.77 0.00 0.00 -0.03 0.00 0.00 54.58 53.69 3gyr n ASN 290 Cb 0.48 -3.96 0.00 0.00 -0.61 0.00 0.00 39.78 35.69 3gyr n ASN 290 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gyr n GLY 291 N -1.70 0.74 3.25 7.41 0.00 -1.26 -4.44 105.19 109.19 3gyr n GLY 291 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.24 2.57 0.12 1.61 0.52 -1.01 -4.50 118.95 118.02 3gyr s ARG 292 Ca 0.00 -0.88 -0.31 0.00 -0.52 0.00 0.00 55.73 54.02 3gyr s ARG 292 Cb 0.00 -2.13 -0.09 0.00 0.52 0.00 0.00 34.95 33.24 3gyr s ARG 292 CO 0.00 0.34 1.59 0.42 0.02 0.00 0.00 175.30 177.66 3gyr s ILE 293 N -0.06 2.86 -1.08 1.52 1.01 0.29 -0.94 121.20 124.80 3gyr s ILE 293 Ca -0.06 0.51 -0.22 0.00 0.00 0.00 0.00 60.65 60.88 3gyr s ILE 293 Cb -0.14 -3.32 0.02 0.00 0.01 0.00 0.00 42.46 39.02 3gyr s ILE 293 CO 0.04 0.02 0.69 0.79 0.00 0.00 0.00 174.94 176.48 3gyr n TRP 294 N 4.66 -1.73 -2.18 3.97 8.01 -0.69 -4.73 117.44 124.75 3gyr n TRP 294 Ca 0.14 0.38 -0.28 0.00 -1.31 0.00 0.00 57.50 56.44 3gyr n TRP 294 Cb 0.40 -2.97 0.04 0.00 -2.01 0.00 0.00 31.31 26.77 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 -6.32 2.83 0.15 -0.99 0.04 -1.26 -0.17 135.00 129.28 3gyr s PRO 295 Ca 0.35 0.16 0.07 0.00 0.04 0.00 0.00 61.00 61.62 3gyr s PRO 295 Cb -0.17 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 3gyr s PRO 295 CO 0.92 -0.88 -0.05 1.52 0.04 0.00 0.00 177.00 178.55 3gyr s TYR 296 N -3.16 2.78 -0.08 0.56 -0.85 -0.47 -2.01 117.35 114.12 3gyr s TYR 296 Ca 0.56 -0.15 0.02 0.00 -0.52 0.00 0.00 57.07 56.97 3gyr s TYR 296 Cb -0.11 -1.38 0.02 0.00 0.38 0.00 0.00 41.96 40.87 3gyr s TYR 296 CO 0.48 0.49 -0.12 0.00 -1.52 0.00 0.00 175.55 174.88 3gyr s ALA 297 N -1.57 1.38 -0.32 9.51 0.00 0.10 -0.22 121.76 130.64 3gyr s ALA 297 Ca 0.25 -0.52 -0.26 0.00 0.00 0.00 0.00 51.96 51.43 3gyr s ALA 297 Cb -0.10 -0.70 0.01 0.00 0.00 0.00 0.00 23.12 22.34 3gyr s ALA 297 CO 0.17 -0.03 0.94 -0.51 0.00 0.00 0.00 175.76 176.32 3gyr s ASP 298 N 0.94 6.79 0.26 0.00 1.01 -1.26 -0.74 116.67 123.67 3gyr s ASP 298 Ca -0.09 0.84 0.09 0.00 0.71 0.00 0.00 52.55 54.10 3gyr s ASP 298 Cb -0.15 -2.48 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 3gyr s ASP 298 CO 0.00 -0.76 -0.13 0.68 0.21 0.00 0.00 175.17 175.17 3gyr s VAL 299 N 3.33 1.97 0.56 -1.27 -7.23 -0.60 -4.94 120.40 112.23 3gyr s VAL 299 Ca 0.39 -2.24 -0.03 0.00 -1.81 0.00 0.00 61.98 58.29 3gyr s VAL 299 Cb -0.13 -2.28 0.02 0.00 0.56 0.00 0.00 36.38 34.55 3gyr s VAL 299 CO 0.14 -0.43 0.83 -1.81 -0.31 0.00 0.00 175.10 173.53 3gyr s ASP 300 N -3.43 5.51 -1.50 4.85 1.01 -1.26 -0.26 116.67 121.59 3gyr s ASP 300 Ca 0.27 0.46 -0.11 0.00 0.71 0.00 0.00 52.55 53.88 3gyr s ASP 300 Cb -0.00 -1.46 0.00 0.00 1.01 0.00 0.00 42.92 42.47 3gyr s ASP 300 CO 0.11 -1.04 2.55 -0.90 0.21 0.00 0.00 175.17 176.10 3gyr n ASP 301 N -2.45 6.68 -1.32 0.27 5.75 -0.78 -4.71 116.55 119.99 3gyr n ASP 301 Ca 0.05 -2.78 -0.03 0.00 -0.01 0.00 0.00 54.79 52.02 3gyr n ASP 301 Cb 0.58 -1.56 -0.01 0.00 -1.03 0.00 0.00 41.12 39.10 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 3.46 3.44 3.73 6.12 0.00 -1.26 -3.77 105.19 116.91 3gyr n GLY 302 Ca 0.64 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 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 -3.41 3.49 0.29 1.61 0.52 -1.26 -2.11 118.94 118.07 3gyr s TRP 303 Ca 0.05 1.44 0.10 0.00 0.02 0.00 0.00 56.10 57.71 3gyr s TRP 303 Cb 0.00 -3.37 -0.05 0.00 -1.15 0.00 0.00 33.47 28.90 3gyr s TRP 303 CO 0.04 -1.02 -0.14 0.71 0.02 0.00 0.00 176.95 176.55 3gyr s TYR 304 N 0.35 2.19 -0.11 -1.98 1.51 -0.56 -4.85 117.35 113.90 3gyr s TYR 304 Ca 0.54 -0.46 0.01 0.00 -1.01 0.00 0.00 57.07 56.15 3gyr s TYR 304 Cb -0.30 -1.08 0.02 0.00 -0.11 0.00 0.00 41.96 40.48 3gyr s TYR 304 CO 0.33 0.57 -0.13 0.50 -1.11 0.00 0.00 175.55 175.72 3gyr s ARG 305 N -3.59 1.98 -0.16 -0.62 3.52 -0.50 -0.35 118.95 119.24 3gyr s ARG 305 Ca 0.29 -0.46 -0.01 0.00 -0.13 0.00 0.00 55.73 55.42 3gyr s ARG 305 Cb -0.01 -1.77 -0.01 0.00 -1.56 0.00 0.00 34.95 31.60 3gyr s ARG 305 CO 0.14 -0.12 -0.11 -0.51 -0.81 0.00 0.00 175.30 173.88 3gyr s LEU 306 N 1.18 2.71 -0.94 -0.88 1.43 0.15 -0.42 118.68 121.91 3gyr s LEU 306 Ca -0.03 -0.38 -0.14 0.00 -1.03 0.00 0.00 54.13 52.55 3gyr s LEU 306 Cb -0.14 -1.63 0.22 0.00 0.03 0.00 0.00 46.19 44.66 3gyr s LEU 306 CO -0.04 0.10 0.95 -0.13 0.23 0.00 0.00 176.35 177.46 3gyr s ARG 307 N 0.75 3.78 -0.30 1.70 1.81 -0.36 -0.91 118.95 125.42 3gyr s ARG 307 Ca -0.05 -2.55 -0.21 0.00 -1.72 0.00 0.00 55.73 51.20 3gyr s ARG 307 Cb -0.15 -4.58 -0.01 0.00 -0.45 0.00 0.00 34.95 29.76 3gyr s ARG 307 CO 0.01 -1.38 0.65 -1.17 -0.68 0.00 0.00 175.30 172.73 3gyr s LEU 308 N 0.28 4.13 -0.10 2.53 1.98 -0.06 -0.55 118.68 126.90 3gyr s LEU 308 Ca 0.25 0.49 0.04 0.00 -2.89 0.00 0.00 54.13 52.02 3gyr s LEU 308 Cb -0.09 -2.86 -0.00 0.00 0.66 0.00 0.00 46.19 43.90 3gyr s LEU 308 CO -0.08 -0.49 -0.23 0.54 -1.89 0.00 0.00 176.35 174.20 3gyr s VAL 309 N 2.65 2.16 -0.51 1.68 0.11 0.10 -1.01 120.40 125.58 3gyr s VAL 309 Ca 0.26 -0.99 -0.28 0.00 -2.93 0.00 0.00 61.98 58.04 3gyr s VAL 309 Cb -0.15 -1.83 0.03 0.00 -1.53 0.00 0.00 36.38 32.90 3gyr s VAL 309 CO 0.11 0.56 1.13 0.21 -3.33 0.00 0.00 175.10 173.78 3gyr s ASN 310 N 0.29 6.56 -0.00 3.54 3.84 -1.20 -1.63 114.94 126.33 3gyr s ASN 310 Ca -0.17 0.31 0.16 0.00 0.21 0.00 0.00 52.86 53.38 3gyr s ASN 310 Cb -0.17 -2.54 0.48 0.00 -0.55 0.00 0.00 41.25 38.47 3gyr s ASN 310 CO 0.08 -1.29 1.40 0.00 -2.79 0.00 0.00 177.10 174.50 3gyr n ALA 311 N 7.92 2.44 -1.21 1.71 0.00 0.18 0.01 120.51 131.56 3gyr n ALA 311 Ca 0.10 -0.96 -0.32 0.00 0.00 0.00 0.00 53.44 52.26 3gyr n ALA 311 Cb 0.49 -0.96 0.10 0.00 0.00 0.00 0.00 19.45 19.08 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 -0.99 4.22 0.21 0.00 0.01 -1.22 -4.86 113.70 111.06 3gyr s SER 312 Ca 0.36 2.07 -0.10 0.00 1.31 0.00 0.00 55.95 59.59 3gyr s SER 312 Cb 0.19 -2.55 0.16 0.00 0.21 0.00 0.00 66.02 64.03 3gyr s SER 312 CO 0.24 -2.23 1.87 0.78 0.41 0.00 0.00 173.24 174.30 3gyr h ASN 313 N -0.83 0.79 0.00 2.44 4.21 -1.88 -3.44 115.58 116.87 3gyr h ASN 313 Ca -0.45 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.05 3gyr h ASN 313 Cb 1.26 -0.19 0.00 0.00 -1.12 0.00 0.00 38.32 38.27 3gyr h ASN 313 CO 0.49 0.56 0.00 0.00 -1.29 0.00 0.00 177.43 177.20 3gyr n ALA 314 N -2.30 0.23 -1.77 -0.83 0.00 -1.26 -0.85 120.51 113.73 3gyr n ALA 314 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.09 3gyr n ALA 314 Cb 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.46 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 -0.69 4.14 -0.34 0.00 3.52 -1.26 -4.70 118.95 119.63 3gyr s ARG 315 Ca 0.00 2.56 -0.21 0.00 -0.13 0.00 0.00 55.73 57.95 3gyr s ARG 315 Cb 0.00 -3.12 0.00 0.00 -1.56 0.00 0.00 34.95 30.27 3gyr s ARG 315 CO 0.00 -0.73 0.67 0.42 -0.81 0.00 0.00 175.30 174.85 3gyr s ILE 316 N 1.26 4.87 -0.16 4.11 1.01 -1.26 -4.11 121.20 126.92 3gyr s ILE 316 Ca 0.74 0.76 -0.26 0.00 0.00 0.00 0.00 60.65 61.89 3gyr s ILE 316 Cb -0.48 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 37.89 3gyr s ILE 316 CO 0.32 -0.28 0.87 -0.31 0.00 0.00 0.00 174.94 175.54 3gyr s TYR 317 N 2.76 3.44 -0.71 3.97 2.02 -0.54 -4.87 117.35 123.42 3gyr s TYR 317 Ca 0.26 1.33 -0.10 0.00 -0.37 0.00 0.00 57.07 58.19 3gyr s TYR 317 Cb -0.14 -3.05 0.18 0.00 -0.40 0.00 0.00 41.96 38.55 3gyr s TYR 317 CO 0.14 -0.24 0.61 -0.80 -1.57 0.00 0.00 175.55 173.69 3gyr s ASN 318 N 1.13 6.16 0.02 2.29 -0.87 -1.26 0.52 114.94 122.93 3gyr s ASN 318 Ca 0.40 -2.59 -0.20 0.00 -1.57 0.00 0.00 52.86 48.91 3gyr s ASN 318 Cb -0.17 -2.08 -0.06 0.00 -0.02 0.00 0.00 41.25 38.92 3gyr s ASN 318 CO 0.13 -0.55 0.58 -0.76 -2.57 0.00 0.00 177.10 173.93 3gyr s LEU 319 N 0.34 4.45 -0.03 0.60 1.43 0.19 -0.25 118.68 125.42 3gyr s LEU 319 Ca 0.15 1.18 0.03 0.00 -1.03 0.00 0.00 54.13 54.46 3gyr s LEU 319 Cb -0.16 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.16 3gyr s LEU 319 CO -0.05 0.16 -0.10 -0.69 0.23 0.00 0.00 176.35 175.90 3gyr s VAL 320 N -0.51 0.85 -0.35 -1.59 1.01 -0.73 -1.37 120.40 117.72 3gyr s VAL 320 Ca 0.30 -0.40 -0.20 0.00 0.00 0.00 0.00 61.98 61.67 3gyr s VAL 320 Cb -0.19 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.45 3gyr s VAL 320 CO 0.18 0.26 0.62 -0.22 0.00 0.00 0.00 175.10 175.94 3gyr s LEU 321 N 0.13 4.25 0.22 3.92 2.96 -1.26 -1.22 118.68 127.68 3gyr s LEU 321 Ca -0.02 0.17 0.10 0.00 -0.22 0.00 0.00 54.13 54.15 3gyr s LEU 321 Cb -0.08 -2.77 -0.04 0.00 0.50 0.00 0.00 46.19 43.79 3gyr s LEU 321 CO 0.01 -0.57 -0.09 0.27 -1.32 0.00 0.00 176.35 174.65 3gyr s ILE 322 N 2.66 3.11 0.20 6.68 -4.36 0.68 -0.25 121.20 129.91 3gyr s ILE 322 Ca 0.24 -1.88 -0.00 0.00 -0.26 0.00 0.00 60.65 58.74 3gyr s ILE 322 Cb -0.15 -2.59 0.04 0.00 1.25 0.00 0.00 42.46 41.01 3gyr s ILE 322 CO 0.14 -0.24 0.27 -0.90 0.24 0.00 0.00 174.94 174.45 3gyr n ASP 323 N -0.35 0.34 0.33 4.36 5.68 -0.22 -0.58 116.55 126.10 3gyr n ASP 323 Ca -0.09 -1.29 0.22 0.00 -0.50 0.00 0.00 54.79 53.13 3gyr n ASP 323 Cb 0.57 -0.18 1.12 0.00 -1.14 0.00 0.00 41.12 41.50 3gyr n ASP 323 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3gyr h GLU 324 N 0.00 0.00 -0.70 0.11 3.07 -1.90 0.14 114.58 115.30 3gyr h GLU 324 Ca -0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.77 3gyr h GLU 324 Cb 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 3gyr h GLU 324 CO 0.09 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.45 3gyr n ASP 325 N -3.08 4.37 0.00 1.42 9.92 -1.26 -4.92 116.55 123.00 3gyr n ASP 325 Ca -0.02 -2.22 0.00 0.00 -0.53 0.00 0.00 54.79 52.02 3gyr n ASP 325 Cb 0.12 -0.54 0.00 0.00 -0.64 0.00 0.00 41.12 40.06 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 1.41 -1.94 -4.70 -2.24 9.92 0.50 -4.99 116.55 114.51 3gyr n ASP 326 Ca 0.25 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.09 3gyr n ASP 326 Cb 0.76 -1.29 -0.03 0.00 -0.64 0.00 0.00 41.12 39.92 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 -0.57 4.46 0.43 -1.24 3.52 -1.26 -4.71 118.95 119.59 3gyr s ARG 327 Ca 0.00 1.59 -0.26 0.00 -0.13 0.00 0.00 55.73 56.93 3gyr s ARG 327 Cb 0.00 -3.45 -0.09 0.00 -1.56 0.00 0.00 34.95 29.85 3gyr s ARG 327 CO 0.00 -0.22 1.41 -2.30 -0.81 0.00 0.00 175.30 173.38 3gyr n PRO 328 N 4.26 2.26 -3.51 5.12 -0.02 -1.26 -1.06 135.00 140.78 3gyr n PRO 328 Ca 0.08 0.80 -0.42 0.00 -2.02 0.00 0.00 63.50 61.95 3gyr n PRO 328 Cb 0.48 -2.59 -0.08 0.00 -0.02 0.00 0.00 33.50 31.29 3gyr n PRO 328 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3gyr s VAL 329 N -1.18 4.41 0.69 -1.45 1.01 0.65 -4.85 120.40 119.67 3gyr s VAL 329 Ca 0.60 -1.67 -0.11 0.00 0.00 0.00 0.00 61.98 60.80 3gyr s VAL 329 Cb -0.46 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.06 3gyr s VAL 329 CO 0.59 -0.75 1.06 -2.16 0.00 0.00 0.00 175.10 173.84 3gyr s PRO 330 N 1.42 3.03 -0.11 2.72 0.04 -1.26 -4.39 135.00 136.45 3gyr s PRO 330 Ca 0.05 0.71 0.00 0.00 0.04 0.00 0.00 61.00 61.80 3gyr s PRO 330 Cb -0.26 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.26 3gyr s PRO 330 CO 0.00 -0.97 0.00 0.41 0.04 0.00 0.00 177.00 176.48 3gyr n GLY 331 N -2.53 0.49 0.00 0.56 0.00 -1.26 -4.84 105.19 97.61 3gyr n GLY 331 Ca 0.07 -0.40 0.00 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 -2.90 0.00 -3.91 1.61 0.31 -1.26 -4.87 118.33 107.30 3gyr n VAL 332 Ca -0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.97 3gyr n VAL 332 Cb 0.07 -0.56 -0.09 0.00 -0.91 0.00 0.00 33.84 32.35 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 -1.94 5.05 -0.10 2.52 1.01 -1.26 0.19 120.40 125.87 3gyr s VAL 333 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.04 3gyr s VAL 333 Cb 0.00 -3.27 0.02 0.00 0.00 0.00 0.00 36.38 33.13 3gyr s VAL 333 CO 0.00 0.47 -0.08 -1.00 0.00 0.00 0.00 175.10 174.49 3gyr s HIS 334 N 0.20 1.39 0.11 5.22 3.76 0.43 -0.93 115.29 125.47 3gyr s HIS 334 Ca 0.06 -0.63 -0.29 0.00 -0.15 0.00 0.00 55.06 54.05 3gyr s HIS 334 Cb -0.12 -1.13 -0.06 0.00 1.11 0.00 0.00 32.58 32.38 3gyr s HIS 334 CO -0.00 -0.43 0.92 -1.14 -0.85 0.00 0.00 174.74 173.24 3gyr s GLN 335 N 1.43 4.68 0.00 1.40 0.74 0.18 -0.36 119.66 127.73 3gyr s GLN 335 Ca -0.01 1.38 0.00 0.00 0.05 0.00 0.00 55.36 56.79 3gyr s GLN 335 Cb -0.13 -3.36 0.00 0.00 1.10 0.00 0.00 33.01 30.61 3gyr s GLN 335 CO -0.05 0.26 0.18 0.44 -0.55 0.00 0.00 175.29 175.58 3gyr n ILE 336 N 2.64 0.00 -3.65 -2.34 -5.35 0.75 -1.03 119.36 110.38 3gyr n ILE 336 Ca 0.01 -0.34 -0.10 0.00 -0.27 0.00 0.00 62.75 62.05 3gyr n ILE 336 Cb 0.49 1.17 -0.03 0.00 -1.74 0.00 0.00 39.64 39.54 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 -0.32 -0.30 0.04 3.28 0.00 -1.11 -1.32 107.32 107.59 3gyr s GLY 337 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.76 3gyr s GLY 337 CO 0.00 -0.05 0.04 -1.14 0.00 0.00 0.00 173.10 171.95 3gyr n SER 338 N -0.39 -0.11 -0.27 1.64 3.41 0.51 -2.05 113.62 116.36 3gyr n SER 338 Ca -0.11 -1.25 0.10 0.00 -0.26 0.00 0.00 58.87 57.35 3gyr n SER 338 Cb 0.62 0.23 0.20 0.00 -0.26 0.00 0.00 64.21 65.00 3gyr n SER 338 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3gyr n ASP 339 N -2.62 -0.13 -0.94 4.04 8.00 -1.18 -0.46 116.55 123.26 3gyr n ASP 339 Ca 0.01 1.32 0.12 0.00 0.71 0.00 0.00 54.79 56.95 3gyr n ASP 339 Cb 0.07 -0.46 0.15 0.00 -0.02 0.00 0.00 41.12 40.86 3gyr n ASP 339 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gyr n GLY 340 N -1.41 0.98 0.00 0.44 0.00 0.09 -4.46 105.19 100.84 3gyr n GLY 340 Ca 0.17 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 1.35 0.78 3.52 -0.02 0.00 0.39 -4.76 105.19 106.46 3gyr n GLY 341 Ca 0.15 -2.03 -0.55 0.00 0.00 0.00 0.00 46.02 43.60 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 0.49 -4.79 0.99 4.77 -1.26 -0.36 117.00 116.85 3gyr n LEU 342 Ca 0.00 1.14 -0.30 0.00 -0.03 0.00 0.00 56.01 56.82 3gyr n LEU 342 Cb 0.00 -1.03 0.09 0.00 -2.33 0.00 0.00 43.42 40.15 3gyr n LEU 342 CO 0.00 -1.71 0.70 -0.76 -1.33 0.00 0.00 177.39 174.29 3gyr s LEU 343 N 0.49 2.79 0.15 2.23 1.43 -0.44 -4.68 118.68 120.66 3gyr s LEU 343 Ca 0.85 1.55 -0.11 0.00 -1.03 0.00 0.00 54.13 55.38 3gyr s LEU 343 Cb -1.10 -4.22 -0.00 0.00 0.03 0.00 0.00 46.19 40.89 3gyr s LEU 343 CO 0.54 -1.95 1.54 1.55 0.23 0.00 0.00 176.35 178.27 3gyr h PRO 344 N -1.07 0.95 -5.27 1.29 0.13 -1.90 -3.28 132.00 122.85 3gyr h PRO 344 Ca -0.46 -0.40 -0.40 0.00 -0.87 0.00 0.00 66.00 63.87 3gyr h PRO 344 Cb 1.25 -0.04 -0.22 0.00 0.13 0.00 0.00 31.00 32.12 3gyr h PRO 344 CO 0.56 1.06 -0.78 1.03 -0.23 0.00 0.00 178.00 179.65 3gyr s ARG 345 N -4.70 0.80 0.48 0.86 0.52 -1.26 -0.16 118.95 115.47 3gyr s ARG 345 Ca -0.12 -0.92 -0.24 0.00 -0.52 0.00 0.00 55.73 53.93 3gyr s ARG 345 Cb 0.12 -0.78 -0.07 0.00 0.52 0.00 0.00 34.95 34.74 3gyr s ARG 345 CO 0.86 0.17 1.36 -2.14 0.02 0.00 0.00 175.30 175.57 3gyr s PRO 346 N -1.68 3.56 -0.20 3.54 0.02 -1.26 -4.89 135.00 134.10 3gyr s PRO 346 Ca -0.03 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.26 3gyr s PRO 346 Cb -0.10 -2.52 0.02 0.00 0.02 0.00 0.00 34.50 31.92 3gyr s PRO 346 CO 0.02 -0.86 -0.16 0.08 -0.33 0.00 0.00 177.00 175.75 3gyr s VAL 347 N -1.27 2.32 0.29 3.83 1.01 -0.20 -4.95 120.40 121.43 3gyr s VAL 347 Ca 0.64 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 61.39 3gyr s VAL 347 Cb -0.40 -2.04 -0.11 0.00 0.00 0.00 0.00 36.38 33.83 3gyr s VAL 347 CO 0.50 0.45 1.52 -2.84 0.00 0.00 0.00 175.10 174.74 3gyr s PRO 348 N 1.31 4.18 -0.38 2.72 0.02 -1.26 -0.65 135.00 140.94 3gyr s PRO 348 Ca 0.04 2.47 0.04 0.00 0.02 0.00 0.00 61.00 63.57 3gyr s PRO 348 Cb -0.14 -3.05 0.11 0.00 0.02 0.00 0.00 34.50 31.44 3gyr s PRO 348 CO -0.10 -0.54 0.10 0.08 -0.33 0.00 0.00 177.00 176.21 3gyr s VAL 349 N -0.16 2.40 -1.00 3.83 1.01 -0.11 -4.87 120.40 121.49 3gyr s VAL 349 Ca 0.60 -2.52 0.08 0.00 0.00 0.00 0.00 61.98 60.15 3gyr s VAL 349 Cb -0.45 -2.74 0.06 0.00 0.00 0.00 0.00 36.38 33.25 3gyr s VAL 349 CO 0.48 -0.64 0.75 0.47 0.00 0.00 0.00 175.10 176.16 3gyr n ASP 350 N 4.05 1.66 -3.86 3.32 8.00 -1.26 -4.11 116.55 124.35 3gyr n ASP 350 Ca 0.04 -1.33 -0.29 0.00 0.71 0.00 0.00 54.79 53.92 3gyr n ASP 350 Cb 0.40 0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.54 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 0.44 -2.38 0.00 1.24 3.01 -0.84 -4.16 117.46 114.78 3gyr n PHE 351 Ca 0.05 0.92 0.00 0.00 1.01 0.00 0.00 57.45 59.43 3gyr n PHE 351 Cb 0.20 -4.15 0.00 0.00 -0.01 0.00 0.00 39.48 35.52 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 -2.87 0.00 0.00 4.37 3.85 -1.13 -4.70 116.55 116.07 3gyr n ASP 352 Ca 0.02 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.10 3gyr n ASP 352 Cb 0.54 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.31 3gyr n ASP 352 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 3gyr n ASP 353 N 0.00 1.25 0.31 -1.12 8.00 -1.26 -3.80 116.55 119.93 3gyr n ASP 353 Ca 0.00 0.00 0.18 0.00 0.71 0.00 0.00 54.79 55.68 3gyr n ASP 353 Cb 0.00 0.06 0.98 0.00 -0.02 0.00 0.00 41.12 42.14 3gyr n ASP 353 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gyr h THR 354 N 0.00 0.00 -0.40 -3.53 1.03 -2.00 -3.38 112.91 104.64 3gyr h THR 354 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 66.41 66.39 3gyr h THR 354 Cb 0.28 0.80 -0.16 0.00 -1.07 0.00 0.00 68.15 68.00 3gyr h THR 354 CO 0.00 0.00 -0.21 -0.22 -0.01 0.00 0.00 175.52 175.08 3gyr s LEU 355 N -5.73 -0.58 0.25 0.00 2.96 -1.26 -4.90 118.68 109.41 3gyr s LEU 355 Ca -0.04 -0.61 0.04 0.00 -0.22 0.00 0.00 54.13 53.30 3gyr s LEU 355 Cb 0.10 0.76 0.28 0.00 0.50 0.00 0.00 46.19 47.84 3gyr s LEU 355 CO 0.33 -0.03 1.59 1.55 -1.32 0.00 0.00 176.35 178.47 3gyr h PRO 356 N 4.68 0.27 -5.74 0.98 0.13 -1.76 -2.19 132.00 128.37 3gyr h PRO 356 Ca 0.01 -0.17 -0.48 0.00 -0.87 0.00 0.00 66.00 64.48 3gyr h PRO 356 Cb 1.17 0.02 -0.22 0.00 0.13 0.00 0.00 31.00 32.10 3gyr h PRO 356 CO -0.07 0.75 -0.80 0.14 -0.23 0.00 0.00 178.00 177.79 3gyr s VAL 357 N -3.87 1.41 -0.48 1.56 -7.23 -1.26 -4.48 120.40 106.04 3gyr s VAL 357 Ca -0.04 -1.43 -0.23 0.00 -1.81 0.00 0.00 61.98 58.47 3gyr s VAL 357 Cb 0.12 -1.31 0.03 0.00 0.56 0.00 0.00 36.38 35.78 3gyr s VAL 357 CO 0.80 -0.15 0.82 -0.22 -0.31 0.00 0.00 175.10 176.04 3gyr s LEU 358 N -1.83 4.26 -0.35 1.32 2.96 -0.47 -4.87 118.68 119.70 3gyr s LEU 358 Ca 0.02 -0.22 -0.18 0.00 -0.22 0.00 0.00 54.13 53.54 3gyr s LEU 358 Cb -0.10 -2.91 -0.01 0.00 0.50 0.00 0.00 46.19 43.68 3gyr s LEU 358 CO 0.03 -1.00 0.49 -0.55 -1.32 0.00 0.00 176.35 174.00 3gyr s SER 359 N 2.35 6.29 -0.33 3.68 0.15 -1.26 -0.64 113.70 123.94 3gyr s SER 359 Ca 0.29 -0.06 0.03 0.00 0.70 0.00 0.00 55.95 56.92 3gyr s SER 359 Cb -0.13 -2.26 0.09 0.00 -1.71 0.00 0.00 66.02 62.02 3gyr s SER 359 CO 0.21 -0.45 0.04 0.00 1.20 0.00 0.00 173.24 174.24 3gyr s ALA 360 N 2.32 2.87 0.61 5.45 0.00 0.18 -4.98 121.76 128.23 3gyr s ALA 360 Ca 0.17 -2.42 -0.08 0.00 0.00 0.00 0.00 51.96 49.63 3gyr s ALA 360 Cb -0.16 -1.95 -0.00 0.00 0.00 0.00 0.00 23.12 21.01 3gyr s ALA 360 CO 0.13 -1.62 0.96 0.00 0.00 0.00 0.00 175.76 175.23 3gyr s ALA 361 N 0.95 3.17 0.07 0.00 0.00 -1.26 -1.47 121.76 123.23 3gyr s ALA 361 Ca 0.08 -0.47 -0.37 0.00 0.00 0.00 0.00 51.96 51.20 3gyr s ALA 361 Cb -0.19 -2.80 -0.18 0.00 0.00 0.00 0.00 23.12 19.95 3gyr s ALA 361 CO -0.07 -0.81 1.14 -2.30 0.00 0.00 0.00 175.76 173.72 3gyr n PRO 362 N -2.68 0.60 -0.05 0.00 -0.02 -1.26 -2.40 135.00 129.19 3gyr n PRO 362 Ca 0.05 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3gyr n PRO 362 Cb 0.57 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 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 1.75 0.00 -1.78 3.55 0.00 0.10 -4.97 120.51 119.16 3gyr n ALA 363 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.26 3gyr n ALA 363 Cb 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.59 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 -0.04 3.80 0.01 0.00 2.02 -1.01 -4.87 118.70 118.61 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 -2.33 -0.03 0.00 0.10 0.00 0.00 34.13 31.87 3gyr s GLU 364 CO 0.00 -0.48 -0.21 1.03 0.02 0.00 0.00 175.26 175.62 3gyr s ARG 365 N -2.82 2.13 -0.15 1.61 0.52 -1.26 -3.27 118.95 115.71 3gyr s ARG 365 Ca 0.64 -0.93 -0.01 0.00 -0.52 0.00 0.00 55.73 54.92 3gyr s ARG 365 Cb -0.24 -2.16 0.04 0.00 0.52 0.00 0.00 34.95 33.11 3gyr s ARG 365 CO 0.29 0.56 -0.06 -0.06 0.02 0.00 0.00 175.30 176.06 3gyr s PHE 366 N -0.78 1.61 -0.45 -0.53 0.08 -0.18 -3.34 117.98 114.39 3gyr s PHE 366 Ca 0.12 -0.96 -0.23 0.00 0.12 0.00 0.00 56.93 55.99 3gyr s PHE 366 Cb -0.10 -1.28 0.03 0.00 -0.57 0.00 0.00 43.02 41.09 3gyr s PHE 366 CO 0.02 -0.58 0.76 0.34 -0.10 0.00 0.00 175.22 175.66 3gyr s ASP 367 N 1.66 6.39 -0.10 1.36 -1.08 -0.87 -0.88 116.67 123.16 3gyr s ASP 367 Ca 0.02 -0.17 0.03 0.00 -0.52 0.00 0.00 52.55 51.91 3gyr s ASP 367 Cb -0.14 -2.37 -0.01 0.00 -1.46 0.00 0.00 42.92 38.93 3gyr s ASP 367 CO -0.08 -0.90 -0.18 -0.76 0.52 0.00 0.00 175.17 173.77 3gyr s LEU 368 N 3.21 2.43 -0.14 -1.34 1.43 -0.09 -0.18 118.68 124.00 3gyr s LEU 368 Ca 0.28 -0.40 -0.09 0.00 -1.03 0.00 0.00 54.13 52.89 3gyr s LEU 368 Cb -0.13 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 3gyr s LEU 368 CO 0.22 0.21 0.16 -0.76 0.23 0.00 0.00 176.35 176.40 3gyr s LEU 369 N 0.08 4.32 -0.19 1.79 1.43 0.52 0.30 118.68 126.93 3gyr s LEU 369 Ca -0.08 0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 3gyr s LEU 369 Cb -0.15 -2.12 0.04 0.00 0.03 0.00 0.00 46.19 43.99 3gyr s LEU 369 CO 0.05 0.31 -0.08 0.68 0.23 0.00 0.00 176.35 177.54 3gyr s VAL 370 N -0.46 1.46 -0.66 -1.59 -7.23 0.53 -0.43 120.40 112.02 3gyr s VAL 370 Ca 0.13 -0.91 -0.25 0.00 -1.81 0.00 0.00 61.98 59.14 3gyr s VAL 370 Cb -0.12 -1.59 0.05 0.00 0.56 0.00 0.00 36.38 35.28 3gyr s VAL 370 CO 0.02 0.13 1.09 -0.62 -0.31 0.00 0.00 175.10 175.41 3gyr s ASP 371 N 1.47 6.22 0.00 4.85 2.15 0.13 -1.50 116.67 129.99 3gyr s ASP 371 Ca -0.01 -0.61 0.19 0.00 0.43 0.00 0.00 52.55 52.55 3gyr s ASP 371 Cb -0.16 -2.48 0.51 0.00 -0.30 0.00 0.00 42.92 40.49 3gyr s ASP 371 CO -0.08 -1.55 1.43 0.49 -0.17 0.00 0.00 175.17 175.29 3gyr n PHE 372 N 8.32 0.63 -0.29 -5.34 3.72 -0.90 -4.56 117.46 119.03 3gyr n PHE 372 Ca 0.00 -0.32 0.09 0.00 -0.05 0.00 0.00 57.45 57.18 3gyr n PHE 372 Cb 0.47 0.00 0.32 0.00 -0.94 0.00 0.00 39.48 39.34 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 3.30 0.79 -1.00 -1.08 3.08 -1.73 -1.72 114.38 116.01 3gyr h ARG 373 Ca 0.00 -0.05 -0.49 0.00 0.07 0.00 0.00 59.98 59.52 3gyr h ARG 373 Cb 0.75 -0.18 -0.29 0.00 0.08 0.00 0.00 29.97 30.33 3gyr h ARG 373 CO 0.00 0.52 0.62 0.00 -1.07 0.00 0.00 179.97 180.04 3gyr n ALA 374 N -2.41 5.40 -1.11 0.04 0.00 -1.26 -4.52 120.51 116.66 3gyr n ALA 374 Ca 0.17 -2.70 0.00 0.00 0.00 0.00 0.00 53.44 50.91 3gyr n ALA 374 Cb 0.39 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 -1.02 0.20 -4.67 0.00 4.77 -0.65 -5.08 117.00 110.55 3gyr n LEU 375 Ca 0.56 -0.41 -0.42 0.00 -0.03 0.00 0.00 56.01 55.71 3gyr n LEU 375 Cb 1.57 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.66 3gyr n LEU 375 CO 0.57 0.10 0.80 0.61 -1.33 0.00 0.00 177.39 178.14 3gyr n GLY 376 N -0.07 0.33 2.37 -0.72 0.00 -1.26 -1.81 105.19 104.04 3gyr n GLY 376 Ca 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 46.02 46.24 3gyr n GLY 376 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 377 N 0.91 0.50 3.63 -0.02 0.00 0.89 -4.73 105.19 106.37 3gyr n GLY 377 Ca 0.07 -0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.35 2.27 -0.11 1.61 1.81 -0.75 -4.95 118.95 117.49 3gyr s ARG 378 Ca 0.00 -1.34 0.02 0.00 -1.72 0.00 0.00 55.73 52.69 3gyr s ARG 378 Cb 0.00 -2.19 -0.01 0.00 -0.45 0.00 0.00 34.95 32.29 3gyr s ARG 378 CO 0.00 0.39 -0.17 1.03 -0.68 0.00 0.00 175.30 175.87 3gyr s ARG 379 N -3.39 3.17 0.03 3.54 0.52 -1.26 -0.62 118.95 120.93 3gyr s ARG 379 Ca 0.29 -0.76 0.05 0.00 -0.52 0.00 0.00 55.73 54.79 3gyr s ARG 379 Cb -0.07 -2.48 -0.02 0.00 0.52 0.00 0.00 34.95 32.89 3gyr s ARG 379 CO 0.19 0.25 -0.14 -0.51 0.02 0.00 0.00 175.30 175.11 3gyr s LEU 380 N 0.23 2.14 -0.07 2.53 1.43 -0.13 -3.63 118.68 121.19 3gyr s LEU 380 Ca -0.11 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.62 3gyr s LEU 380 Cb -0.16 -0.62 -0.02 0.00 0.03 0.00 0.00 46.19 45.42 3gyr s LEU 380 CO 0.06 0.06 -0.18 -0.13 0.23 0.00 0.00 176.35 176.39 3gyr s ARG 381 N -0.96 2.67 -0.18 1.70 0.52 0.25 0.75 118.95 123.71 3gyr s ARG 381 Ca 0.02 -0.78 -0.23 0.00 -0.52 0.00 0.00 55.73 54.22 3gyr s ARG 381 Cb -0.07 -2.34 -0.02 0.00 0.52 0.00 0.00 34.95 33.04 3gyr s ARG 381 CO 0.01 0.46 0.74 -1.17 0.02 0.00 0.00 175.30 175.36 3gyr s LEU 382 N -0.33 4.17 0.29 2.53 2.96 -0.60 -0.23 118.68 127.47 3gyr s LEU 382 Ca 0.02 1.03 0.09 0.00 -0.22 0.00 0.00 54.13 55.05 3gyr s LEU 382 Cb -0.13 -3.08 -0.06 0.00 0.50 0.00 0.00 46.19 43.42 3gyr s LEU 382 CO 0.02 -0.34 -0.12 0.68 -1.32 0.00 0.00 176.35 175.28 3gyr s VAL 383 N 2.01 2.04 -0.22 1.68 -7.23 -0.36 -1.34 120.40 116.98 3gyr s VAL 383 Ca 0.34 -2.23 -0.16 0.00 -1.81 0.00 0.00 61.98 58.12 3gyr s VAL 383 Cb -0.16 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 3gyr s VAL 383 CO 0.12 -0.34 0.41 -0.62 -0.31 0.00 0.00 175.10 174.36 3gyr s ASP 384 N -3.49 6.42 -0.21 4.85 2.15 0.36 -1.78 116.67 124.97 3gyr s ASP 384 Ca 0.29 0.49 -0.20 0.00 0.43 0.00 0.00 52.55 53.57 3gyr s ASP 384 Cb 0.01 -2.24 -0.03 0.00 -0.30 0.00 0.00 42.92 40.36 3gyr s ASP 384 CO 0.13 -0.12 0.59 -0.75 -0.17 0.00 0.00 175.17 174.86 3gyr s LYS 385 N 1.53 4.19 0.54 4.34 2.20 0.66 -4.60 119.74 128.60 3gyr s LYS 385 Ca 0.19 0.54 -0.17 0.00 -0.36 0.00 0.00 55.97 56.17 3gyr s LYS 385 Cb -0.15 -3.58 -0.07 0.00 -1.51 0.00 0.00 37.83 32.52 3gyr s LYS 385 CO 0.08 -0.23 1.02 0.20 -0.36 0.00 0.00 175.35 176.06 3gyr s GLY 386 N 1.23 2.15 0.62 5.54 0.00 -1.26 -4.70 107.32 110.90 3gyr s GLY 386 Ca 0.27 0.31 0.41 0.00 0.00 0.00 0.00 44.72 45.71 3gyr s GLY 386 CO 0.10 0.61 2.26 -0.56 0.00 0.00 0.00 173.10 175.50 3gyr h PRO 387 N 0.85 0.00 -0.04 2.90 0.13 -1.92 -3.18 132.00 130.75 3gyr h PRO 387 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3gyr h PRO 387 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3gyr h PRO 387 CO 0.60 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.78 3gyr n GLY 388 N -0.89 0.00 3.30 1.56 0.00 -1.26 -4.99 105.19 102.92 3gyr n GLY 388 Ca -0.02 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.06 -0.89 0.85 4.61 0.00 -1.20 -5.07 121.76 119.00 3gyr s ALA 389 Ca 0.16 0.19 -0.12 0.00 0.00 0.00 0.00 51.96 52.18 3gyr s ALA 389 Cb 0.11 0.35 0.09 0.00 0.00 0.00 0.00 23.12 23.67 3gyr s ALA 389 CO 0.16 -0.45 1.08 -2.30 0.00 0.00 0.00 175.76 174.25 3gyr n PRO 390 N 0.50 -0.06 -1.76 0.00 -0.02 -1.26 -4.32 135.00 128.07 3gyr n PRO 390 Ca -0.18 0.06 -0.42 0.00 -2.02 0.00 0.00 63.50 60.93 3gyr n PRO 390 Cb 0.60 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 3gyr n PRO 390 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr s ALA 391 N -2.30 3.87 0.00 3.55 0.00 -1.26 -1.37 121.76 124.25 3gyr s ALA 391 Ca 0.70 1.51 0.00 0.00 0.00 0.00 0.00 51.96 54.17 3gyr s ALA 391 Cb -0.27 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.15 3gyr s ALA 391 CO 0.55 -0.97 0.00 0.41 0.00 0.00 0.00 175.76 175.75 3gyr n GLY 392 N 4.00 2.16 3.70 0.00 0.00 -1.26 -4.85 105.19 108.94 3gyr n GLY 392 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.41 5.23 0.49 2.61 2.01 -0.47 -4.85 115.64 118.24 3gyr s THR 393 Ca 0.00 0.73 -0.24 0.00 0.31 0.00 0.00 61.69 62.49 3gyr s THR 393 Cb 0.00 -3.72 -0.07 0.00 0.01 0.00 0.00 72.50 68.71 3gyr s THR 393 CO 0.00 0.32 1.36 -2.65 -0.69 0.00 0.00 174.62 172.96 3gyr n PRO 394 N 3.94 1.95 -3.19 4.92 -0.02 -1.26 -4.69 135.00 136.65 3gyr n PRO 394 Ca -0.09 0.70 -0.23 0.00 -2.02 0.00 0.00 63.50 61.86 3gyr n PRO 394 Cb 0.51 -2.55 -0.06 0.00 -0.02 0.00 0.00 33.50 31.38 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 -0.44 0.22 -0.31 2.55 2.03 0.16 -4.88 116.55 115.89 3gyr n ASP 395 Ca 0.08 -2.74 0.03 0.00 0.52 0.00 0.00 54.79 52.68 3gyr n ASP 395 Cb 0.42 -0.61 0.18 0.00 -0.72 0.00 0.00 41.12 40.39 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 3.87 0.83 -0.27 -0.67 0.13 -1.80 -0.32 132.00 133.77 3gyr h PRO 396 Ca 0.07 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 65.20 3gyr h PRO 396 Cb 0.89 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 3gyr h PRO 396 CO 0.46 0.55 0.19 -0.07 -0.23 0.00 0.00 178.00 178.90 3gyr h LEU 397 N 0.86 0.12 -1.51 1.56 3.38 -1.92 -1.79 115.31 116.00 3gyr h LEU 397 Ca 0.41 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3gyr h LEU 397 Cb 0.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3gyr h LEU 397 CO -0.24 0.08 0.00 0.61 0.09 0.00 0.00 178.44 178.98 3gyr n GLY 398 N -1.55 0.87 1.09 0.83 0.00 -0.70 -4.85 105.19 100.87 3gyr n GLY 398 Ca 0.03 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 1.20 0.72 2.54 -0.02 0.00 -0.67 -4.58 105.19 104.37 3gyr n GLY 399 Ca 0.15 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.55 0.31 -0.27 1.61 0.31 -0.21 -4.93 118.33 112.60 3gyr n VAL 400 Ca 0.00 -4.24 -0.03 0.00 -0.01 0.00 0.00 64.34 60.05 3gyr n VAL 400 Cb 0.00 -1.94 0.13 0.00 -0.91 0.00 0.00 33.84 31.12 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 5.10 1.13 -4.23 5.55 2.43 -1.83 0.45 114.38 122.99 3gyr h ARG 401 Ca 0.19 -0.15 -0.63 0.00 -0.81 0.00 0.00 59.98 58.59 3gyr h ARG 401 Cb 0.82 -0.21 -0.40 0.00 -0.42 0.00 0.00 29.97 29.76 3gyr h ARG 401 CO 0.56 0.86 -0.74 0.71 -1.51 0.00 0.00 179.97 179.85 3gyr s TYR 402 N -5.68 2.85 0.58 2.20 1.51 -1.26 -4.38 117.35 113.16 3gyr s TYR 402 Ca -0.12 -2.39 0.29 0.00 -1.01 0.00 0.00 57.07 53.84 3gyr s TYR 402 Cb 0.17 -2.32 1.79 0.00 -0.11 0.00 0.00 41.96 41.48 3gyr s TYR 402 CO 0.82 -0.90 2.25 -1.35 -1.11 0.00 0.00 175.55 175.25 3gyr h PRO 403 N 7.83 0.00 -6.86 -1.71 0.11 -1.81 -3.46 132.00 126.10 3gyr h PRO 403 Ca -0.09 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.49 3gyr h PRO 403 Cb 1.02 0.00 0.09 0.00 0.11 0.00 0.00 31.00 32.22 3gyr h PRO 403 CO 0.49 0.00 0.78 -1.83 -0.21 0.00 0.00 178.00 177.24 3gyr s GLU 404 N -4.64 4.18 0.01 1.05 1.03 -1.26 -0.48 118.70 118.58 3gyr s GLU 404 Ca -0.05 2.47 -0.04 0.00 0.03 0.00 0.00 54.97 57.39 3gyr s GLU 404 Cb 0.15 -3.02 -0.01 0.00 -0.80 0.00 0.00 34.13 30.45 3gyr s GLU 404 CO 0.55 -0.49 -0.07 0.28 -1.33 0.00 0.00 175.26 174.21 3gyr n VAL 405 N 1.29 0.88 -3.87 1.83 0.31 -0.45 -4.58 118.33 113.75 3gyr n VAL 405 Ca 0.04 0.27 -0.08 0.00 -0.01 0.00 0.00 64.34 64.56 3gyr n VAL 405 Cb 0.39 -1.60 -0.02 0.00 -0.91 0.00 0.00 33.84 31.71 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 -1.85 1.86 -0.06 5.55 0.23 -1.09 -4.02 119.30 119.92 3gyr s MET 406 Ca -0.06 -1.11 0.04 0.00 -1.03 0.00 0.00 55.69 53.53 3gyr s MET 406 Cb 0.01 0.60 -0.00 0.00 -1.53 0.00 0.00 34.83 33.90 3gyr s MET 406 CO 0.09 -0.85 -0.19 -2.00 -2.03 0.00 0.00 175.02 170.04 3gyr s GLU 407 N -3.61 2.08 -0.13 3.16 2.12 -0.85 -1.55 118.70 119.92 3gyr s GLU 407 Ca 0.13 -0.66 -0.11 0.00 0.36 0.00 0.00 54.97 54.69 3gyr s GLU 407 Cb -0.05 -1.73 -0.05 0.00 0.26 0.00 0.00 34.13 32.56 3gyr s GLU 407 CO 0.08 0.22 0.23 -0.06 -0.54 0.00 0.00 175.26 175.19 3gyr s PHE 408 N 0.16 3.54 -0.33 5.30 0.40 0.23 0.03 117.98 127.30 3gyr s PHE 408 Ca -0.08 0.58 0.01 0.00 -0.60 0.00 0.00 56.93 56.85 3gyr s PHE 408 Cb -0.14 -2.17 0.08 0.00 0.51 0.00 0.00 43.02 41.30 3gyr s PHE 408 CO 0.04 0.47 0.04 1.03 0.70 0.00 0.00 175.22 177.50 3gyr s ARG 409 N -0.26 1.96 -0.24 0.44 0.52 0.08 -0.95 118.95 120.50 3gyr s ARG 409 Ca 0.15 -1.63 -0.23 0.00 -0.52 0.00 0.00 55.73 53.51 3gyr s ARG 409 Cb -0.13 -3.23 -0.01 0.00 0.52 0.00 0.00 34.95 32.10 3gyr s ARG 409 CO 0.04 -0.83 0.76 0.08 0.02 0.00 0.00 175.30 175.38 3gyr s VAL 410 N 1.07 4.89 -0.03 3.52 1.01 0.21 -1.55 120.40 129.52 3gyr s VAL 410 Ca 0.03 1.43 -0.27 0.00 0.00 0.00 0.00 61.98 63.16 3gyr s VAL 410 Cb -0.20 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 3gyr s VAL 410 CO -0.05 -0.03 0.85 -0.60 0.00 0.00 0.00 175.10 175.26 3gyr s ARG 411 N 2.68 4.50 -0.18 2.72 3.52 0.64 -0.08 118.95 132.75 3gyr s ARG 411 Ca 0.32 1.16 -0.29 0.00 -0.13 0.00 0.00 55.73 56.79 3gyr s ARG 411 Cb -0.15 -3.45 -0.02 0.00 -1.56 0.00 0.00 34.95 29.76 3gyr s ARG 411 CO 0.08 0.01 1.42 -2.00 -0.81 0.00 0.00 175.30 174.00 3gyr s GLU 412 N 0.88 4.07 0.40 5.12 2.12 -1.26 -1.87 118.70 128.16 3gyr s GLU 412 Ca 0.45 1.69 0.08 0.00 0.36 0.00 0.00 54.97 57.55 3gyr s GLU 412 Cb -0.19 -3.89 -0.04 0.00 0.26 0.00 0.00 34.13 30.27 3gyr s GLU 412 CO 0.23 -0.93 0.24 0.99 -0.54 0.00 0.00 175.26 175.25 3gyr s THR 413 N 4.12 2.53 -1.95 -1.70 2.01 -1.26 -4.97 115.64 114.42 3gyr s THR 413 Ca 0.62 -1.59 0.17 0.00 0.31 0.00 0.00 61.69 61.21 3gyr s THR 413 Cb -0.24 -3.00 0.50 0.00 0.01 0.00 0.00 72.50 69.78 3gyr s THR 413 CO 0.22 -0.03 1.42 0.00 -0.69 0.00 0.00 174.62 175.54 3gyr s GLU 415 N -1.28 3.93 -0.29 0.00 2.02 -1.26 -5.05 118.70 116.77 3gyr s GLU 415 Ca 0.38 0.43 -0.10 0.00 0.02 0.00 0.00 54.97 55.70 3gyr s GLU 415 Cb 0.20 -2.88 -0.02 0.00 0.10 0.00 0.00 34.13 31.53 3gyr s GLU 415 CO 0.25 0.45 0.15 -1.21 0.02 0.00 0.00 175.26 174.92 3gyr s GLU 416 N -2.12 3.54 -0.35 1.61 0.41 -1.26 -5.01 118.70 115.52 3gyr s GLU 416 Ca 0.39 -0.58 -0.17 0.00 -0.41 0.00 0.00 54.97 54.20 3gyr s GLU 416 Cb -0.14 -3.54 -0.00 0.00 -1.78 0.00 0.00 34.13 28.66 3gyr s GLU 416 CO 0.19 -0.32 0.46 0.34 -0.49 0.00 0.00 175.26 175.45 3gyr s ASP 417 N 1.65 6.26 0.00 -0.19 -1.08 -1.26 -4.95 116.67 117.10 3gyr s ASP 417 Ca 0.06 -0.14 0.22 0.00 -0.52 0.00 0.00 52.55 52.16 3gyr s ASP 417 Cb -0.16 -2.24 0.44 0.00 -1.46 0.00 0.00 42.92 39.50 3gyr s ASP 417 CO 0.07 -0.45 1.39 -1.54 0.52 0.00 0.00 175.17 175.16 3gyr n SER 418 N 5.63 3.46 -4.15 -0.34 3.41 -1.26 -5.00 113.62 115.36 3gyr n SER 418 Ca -0.06 -1.97 -0.52 0.00 -0.26 0.00 0.00 58.87 56.06 3gyr n SER 418 Cb 0.49 -0.29 -0.06 0.00 -0.26 0.00 0.00 64.21 64.09 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 1.41 0.30 -4.56 7.33 7.35 -1.26 -4.94 117.46 123.09 3gyr n PHE 419 Ca 0.19 0.96 -0.33 0.00 -0.76 0.00 0.00 57.45 57.51 3gyr n PHE 419 Cb 0.58 -1.91 -0.13 0.00 0.35 0.00 0.00 39.48 38.38 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 -0.26 2.87 -0.33 3.13 0.00 -1.26 -5.11 121.76 120.80 3gyr s ALA 420 Ca 0.77 -0.85 -0.08 0.00 0.00 0.00 0.00 51.96 51.80 3gyr s ALA 420 Cb -1.09 -1.40 0.02 0.00 0.00 0.00 0.00 23.12 20.65 3gyr s ALA 420 CO 0.53 0.28 0.13 -1.17 0.00 0.00 0.00 175.76 175.52 3gyr s LEU 421 N 0.19 4.21 0.54 0.00 2.96 -1.26 -5.07 118.68 120.25 3gyr s LEU 421 Ca -0.04 -0.87 -0.07 0.00 -0.22 0.00 0.00 54.13 52.93 3gyr s LEU 421 Cb -0.14 -1.93 -0.03 0.00 0.50 0.00 0.00 46.19 44.59 3gyr s LEU 421 CO 0.04 -0.27 0.88 -2.16 -1.32 0.00 0.00 176.35 173.51 3gyr s PRO 422 N 1.50 3.46 0.24 0.98 0.04 -1.26 -4.95 135.00 135.01 3gyr s PRO 422 Ca 0.02 0.34 0.03 0.00 0.04 0.00 0.00 61.00 61.43 3gyr s PRO 422 Cb -0.18 -2.27 0.26 0.00 0.04 0.00 0.00 34.50 32.35 3gyr s PRO 422 CO 0.04 -0.40 1.58 0.93 0.04 0.00 0.00 177.00 179.19 3gyr h GLU 423 N -0.01 0.30 -5.13 4.56 4.39 -1.98 -3.38 114.58 113.32 3gyr h GLU 423 Ca -0.46 -0.19 -0.64 0.00 0.34 0.00 0.00 59.36 58.42 3gyr h GLU 423 Cb 1.21 0.02 -0.21 0.00 -0.10 0.00 0.00 28.75 29.67 3gyr h GLU 423 CO 0.62 0.78 -0.63 0.08 -1.16 0.00 0.00 179.01 178.69 3gyr s VAL 424 N -3.87 4.24 -0.19 3.13 1.01 -1.26 -4.13 120.40 119.32 3gyr s VAL 424 Ca -0.05 -0.22 -0.19 0.00 0.00 0.00 0.00 61.98 61.53 3gyr s VAL 424 Cb 0.12 -2.93 -0.15 0.00 0.00 0.00 0.00 36.38 33.42 3gyr s VAL 424 CO 0.80 0.42 0.14 -0.07 0.00 0.00 0.00 175.10 176.39 3gyr h LEU 425 N 7.41 0.00 -8.47 3.92 3.38 -0.73 -3.47 115.31 117.35 3gyr h LEU 425 Ca -0.36 -0.41 -0.66 0.00 0.09 0.00 0.00 57.88 56.54 3gyr h LEU 425 Cb 1.18 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.67 3gyr h LEU 425 CO 0.62 1.29 -0.66 -0.55 0.09 0.00 0.00 178.44 179.23 3gyr s SER 426 N -6.56 4.82 0.39 -0.43 0.15 -1.02 -4.96 113.70 106.10 3gyr s SER 426 Ca -0.25 -0.44 0.16 0.00 0.70 0.00 0.00 55.95 56.12 3gyr s SER 426 Cb 0.05 -1.84 0.81 0.00 -1.71 0.00 0.00 66.02 63.32 3gyr s SER 426 CO 0.50 -0.08 1.84 1.23 1.20 0.00 0.00 173.24 177.93 3gyr h GLY 427 N 8.19 0.00 1.56 9.45 0.00 -1.91 -3.28 103.07 117.08 3gyr h GLY 427 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 3gyr h GLY 427 CO 0.59 0.00 -0.38 1.48 0.00 0.00 0.00 176.54 178.23 3gyr h SER 428 N 0.00 0.00 -2.62 0.19 4.64 -1.99 -3.47 113.55 110.30 3gyr h SER 428 Ca -0.00 -0.05 -0.53 0.00 -0.47 0.00 0.00 61.79 60.73 3gyr h SER 428 Cb 0.68 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.79 3gyr h SER 428 CO 0.05 0.03 1.05 0.12 -0.87 0.00 0.00 176.83 177.20 3gyr s PHE 429 N -3.21 2.21 -0.17 4.77 5.36 -1.24 -4.97 117.98 120.72 3gyr s PHE 429 Ca 0.06 0.18 -0.00 0.00 -0.96 0.00 0.00 56.93 56.20 3gyr s PHE 429 Cb 0.10 -4.01 0.00 0.00 -0.34 0.00 0.00 43.02 38.76 3gyr s PHE 429 CO 0.69 -4.17 -0.14 1.03 -1.46 0.00 0.00 175.22 171.18 3gyr s ARG 430 N 3.03 3.21 0.04 10.12 1.81 -1.26 -5.07 118.95 130.84 3gyr s ARG 430 Ca 0.76 -0.74 -0.30 0.00 -1.72 0.00 0.00 55.73 53.73 3gyr s ARG 430 Cb -0.40 -2.69 -0.07 0.00 -0.45 0.00 0.00 34.95 31.33 3gyr s ARG 430 CO 0.33 -0.06 1.63 0.50 -0.68 0.00 0.00 175.30 177.02 3gyr s ARG 431 N 1.02 4.20 -0.09 3.54 6.06 -1.26 -4.96 118.95 127.47 3gyr s ARG 431 Ca -0.01 2.27 -0.35 0.00 -2.50 0.00 0.00 55.73 55.13 3gyr s ARG 431 Cb -0.15 -3.67 -0.13 0.00 0.06 0.00 0.00 34.95 31.06 3gyr s ARG 431 CO -0.03 -0.74 1.80 -1.33 -2.50 0.00 0.00 175.30 172.51 3gyr n MET 432 N 5.87 1.96 -3.58 5.12 2.81 -1.26 -5.00 117.12 123.04 3gyr n MET 432 Ca 0.16 0.72 -0.37 0.00 -1.81 0.00 0.00 57.70 56.40 3gyr n MET 432 Cb 0.41 -2.52 -0.07 0.00 -0.71 0.00 0.00 33.22 30.34 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 3.49 6.50 0.09 7.83 0.15 -1.26 -4.96 113.70 125.54 3gyr s SER 433 Ca 0.92 0.59 0.06 0.00 0.70 0.00 0.00 55.95 58.22 3gyr s SER 433 Cb -0.76 -2.18 0.31 0.00 -1.71 0.00 0.00 66.02 61.67 3gyr s SER 433 CO 0.52 0.19 1.13 1.57 1.20 0.00 0.00 173.24 177.85 3gyr n HIS 434 N 2.98 0.19 1.08 3.44 -0.00 -1.26 -2.08 115.22 119.58 3gyr n HIS 434 Ca -0.13 0.10 0.12 0.00 0.46 0.00 0.00 57.72 58.27 3gyr n HIS 434 Cb 0.52 -0.60 0.60 0.00 -0.12 0.00 0.00 29.99 30.39 3gyr n HIS 434 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 3gyr n ASP 435 N -1.67 0.00 -4.76 0.26 8.00 -1.26 -4.78 116.55 112.34 3gyr n ASP 435 Ca -0.00 0.13 -0.39 0.00 0.71 0.00 0.00 54.79 55.24 3gyr n ASP 435 Cb 0.07 -0.36 -0.05 0.00 -0.02 0.00 0.00 41.12 40.76 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 -2.73 3.75 0.12 0.53 1.01 -0.88 -4.99 121.20 118.01 3gyr s ILE 436 Ca 0.20 1.64 -0.31 0.00 0.00 0.00 0.00 60.65 62.18 3gyr s ILE 436 Cb 0.17 -4.00 -0.09 0.00 0.01 0.00 0.00 42.46 38.55 3gyr s ILE 436 CO 0.41 0.30 1.67 -2.84 0.00 0.00 0.00 174.94 174.49 3gyr s PRO 437 N -1.66 4.18 0.03 2.79 0.02 -1.26 -4.98 135.00 134.13 3gyr s PRO 437 Ca 0.47 2.42 -0.14 0.00 0.02 0.00 0.00 61.00 63.76 3gyr s PRO 437 Cb -0.27 -3.44 0.02 0.00 0.02 0.00 0.00 34.50 30.83 3gyr s PRO 437 CO 0.34 -0.73 0.32 -3.38 -0.33 0.00 0.00 177.00 173.23 3gyr s HIS 438 N 2.16 -0.14 0.70 6.54 -3.43 -1.26 -4.33 115.29 115.54 3gyr s HIS 438 Ca 0.74 0.05 -0.03 0.00 -0.80 0.00 0.00 55.06 55.02 3gyr s HIS 438 Cb -0.43 0.11 0.10 0.00 -1.43 0.00 0.00 32.58 30.93 3gyr s HIS 438 CO 0.33 -0.49 0.98 0.20 -2.00 0.00 0.00 174.74 173.76 3gyr s GLY 439 N -1.93 1.76 -0.05 -1.38 0.00 -0.61 -4.88 107.32 100.23 3gyr s GLY 439 Ca -0.06 -1.36 0.03 0.00 0.00 0.00 0.00 44.72 43.32 3gyr s GLY 439 CO -0.02 -0.88 -0.11 0.30 0.00 0.00 0.00 173.10 172.38 3gyr s HIS 440 N -3.16 1.29 0.03 1.90 3.76 -1.26 -0.59 115.29 117.26 3gyr s HIS 440 Ca 0.63 -0.41 0.06 0.00 -0.15 0.00 0.00 55.06 55.20 3gyr s HIS 440 Cb -0.08 -0.93 -0.03 0.00 1.11 0.00 0.00 32.58 32.65 3gyr s HIS 440 CO 0.44 -0.19 -0.16 1.03 -0.85 0.00 0.00 174.74 175.01 3gyr s ARG 441 N 0.42 2.16 -0.18 1.40 1.81 -0.25 -4.98 118.95 119.34 3gyr s ARG 441 Ca -0.09 -0.93 -0.01 0.00 -1.72 0.00 0.00 55.73 52.98 3gyr s ARG 441 Cb -0.13 -2.24 -0.00 0.00 -0.45 0.00 0.00 34.95 32.13 3gyr s ARG 441 CO 0.02 0.55 -0.11 -1.17 -0.68 0.00 0.00 175.30 173.91 3gyr s LEU 442 N -1.42 2.61 -0.23 2.53 2.96 -1.26 -1.12 118.68 122.75 3gyr s LEU 442 Ca 0.15 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.62 3gyr s LEU 442 Cb -0.11 -1.62 0.05 0.00 0.50 0.00 0.00 46.19 45.01 3gyr s LEU 442 CO 0.06 0.04 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.37 3gyr s ILE 443 N 1.12 1.98 -0.04 6.68 -1.09 0.14 -2.24 121.20 127.75 3gyr s ILE 443 Ca 0.01 -1.32 -0.18 0.00 -2.23 0.00 0.00 60.65 56.93 3gyr s ILE 443 Cb -0.14 -2.03 -0.05 0.00 -1.58 0.00 0.00 42.46 38.66 3gyr s ILE 443 CO -0.03 0.14 0.49 -0.69 -1.23 0.00 0.00 174.94 173.61 3gyr s VAL 444 N 1.23 5.03 -0.34 2.92 1.01 0.28 -0.22 120.40 130.31 3gyr s VAL 444 Ca -0.04 1.01 -0.10 0.00 0.00 0.00 0.00 61.98 62.85 3gyr s VAL 444 Cb -0.18 -3.82 0.02 0.00 0.00 0.00 0.00 36.38 32.40 3gyr s VAL 444 CO -0.08 0.44 0.17 -0.76 0.00 0.00 0.00 175.10 174.87 3gyr s LEU 445 N -0.22 4.40 0.23 3.92 1.43 0.01 0.22 118.68 128.67 3gyr s LEU 445 Ca 0.27 -0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 52.51 3gyr s LEU 445 Cb -0.17 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 3gyr s LEU 445 CO 0.14 -0.30 0.44 0.42 0.23 0.00 0.00 176.35 177.27 3gyr s THR 446 N 1.55 5.15 0.66 5.49 -4.23 -0.77 -0.43 115.64 123.07 3gyr s THR 446 Ca 0.02 -0.25 -0.13 0.00 -1.18 0.00 0.00 61.69 60.16 3gyr s THR 446 Cb -0.18 -3.73 -0.00 0.00 1.34 0.00 0.00 72.50 69.92 3gyr s THR 446 CO 0.06 -0.21 1.07 -2.16 -0.54 0.00 0.00 174.62 172.83 3gyr s PRO 447 N -3.38 2.97 0.23 3.99 0.04 -1.26 -3.47 135.00 134.11 3gyr s PRO 447 Ca 0.40 1.13 -0.07 0.00 0.04 0.00 0.00 61.00 62.50 3gyr s PRO 447 Cb -0.11 -1.99 0.32 0.00 0.04 0.00 0.00 34.50 32.76 3gyr s PRO 447 CO 0.29 -1.09 1.81 -1.35 0.04 0.00 0.00 177.00 176.70 3gyr h PRO 448 N -0.25 0.72 -1.00 0.56 0.11 -1.82 -2.86 132.00 127.46 3gyr h PRO 448 Ca -0.45 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3gyr h PRO 448 Cb 1.22 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 3gyr h PRO 448 CO 0.56 0.47 0.00 0.41 -0.21 0.00 0.00 178.00 179.24 3gyr n GLY 449 N -1.31 1.95 3.73 -0.55 0.00 -1.26 -3.13 105.19 104.63 3gyr n GLY 449 Ca 0.11 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.14 4.58 0.10 2.61 2.01 -1.08 -4.59 115.64 119.13 3gyr s THR 450 Ca 0.00 1.97 -0.35 0.00 0.31 0.00 0.00 61.69 63.62 3gyr s THR 450 Cb 0.00 -4.27 -0.18 0.00 0.01 0.00 0.00 72.50 68.06 3gyr s THR 450 CO 0.00 0.32 0.99 1.17 -0.69 0.00 0.00 174.62 176.40 3gyr n LYS 451 N 2.87 0.39 -0.42 4.92 4.81 0.19 -0.86 118.16 130.05 3gyr n LYS 451 Ca 0.01 0.14 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 3gyr n LYS 451 Cb 0.50 -1.53 0.00 0.00 0.02 0.00 0.00 35.03 34.01 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 1.83 1.96 0.12 3.14 0.00 -1.26 -4.83 105.19 106.15 3gyr n GLY 452 Ca 0.18 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 0.78 -1.54 1.61 3.41 -0.04 -4.92 113.62 112.93 3gyr n SER 453 Ca 0.00 -0.59 -0.18 0.00 -0.26 0.00 0.00 58.87 57.84 3gyr n SER 453 Cb 0.00 0.23 -0.07 0.00 -0.26 0.00 0.00 64.21 64.11 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 1.43 1.40 0.07 5.00 0.00 -1.26 -2.35 105.19 109.48 3gyr n GLY 454 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.77 0.40 3.87 -0.02 0.00 -1.24 -4.81 105.19 102.63 3gyr n GLY 455 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.04 3.48 0.72 1.61 3.76 -0.99 -4.48 115.29 117.36 3gyr s HIS 456 Ca 0.00 0.32 -0.14 0.00 -0.15 0.00 0.00 55.06 55.09 3gyr s HIS 456 Cb 0.00 -1.81 0.04 0.00 1.11 0.00 0.00 32.58 31.92 3gyr s HIS 456 CO 0.00 0.63 1.15 -1.25 -0.85 0.00 0.00 174.74 174.42 3gyr s PRO 457 N -1.84 2.29 0.09 8.40 0.04 -1.26 -4.44 135.00 138.28 3gyr s PRO 457 Ca 0.25 1.54 -0.03 0.00 0.04 0.00 0.00 61.00 62.81 3gyr s PRO 457 Cb -0.12 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 3gyr s PRO 457 CO 0.17 -1.67 0.04 -1.21 0.04 0.00 0.00 177.00 174.37 3gyr s GLU 458 N -4.14 0.77 -0.13 4.56 2.02 -1.23 -4.82 118.70 115.73 3gyr s GLU 458 Ca 0.70 -1.25 -0.19 0.00 0.02 0.00 0.00 54.97 54.25 3gyr s GLU 458 Cb -0.24 0.25 -0.04 0.00 0.10 0.00 0.00 34.13 34.20 3gyr s GLU 458 CO 0.46 -0.19 0.52 0.42 0.02 0.00 0.00 175.26 176.48 3gyr s ILE 459 N -3.95 5.15 -0.21 -1.63 1.01 -1.26 -1.85 121.20 118.46 3gyr s ILE 459 Ca 0.12 1.02 -0.02 0.00 0.00 0.00 0.00 60.65 61.78 3gyr s ILE 459 Cb 0.07 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.69 3gyr s ILE 459 CO -0.06 0.28 -0.10 0.26 0.00 0.00 0.00 174.94 175.32 3gyr s TRP 460 N 0.89 2.89 0.03 3.97 0.52 0.13 -4.07 118.94 123.31 3gyr s TRP 460 Ca 0.27 -1.22 -0.27 0.00 0.02 0.00 0.00 56.10 54.91 3gyr s TRP 460 Cb -0.15 -2.03 -0.05 0.00 -1.15 0.00 0.00 33.47 30.08 3gyr s TRP 460 CO 0.11 -0.65 0.83 -1.21 0.02 0.00 0.00 176.95 176.05 3gyr s GLU 461 N 1.40 4.54 0.12 4.98 2.02 -0.41 -0.55 118.70 130.80 3gyr s GLU 461 Ca 0.05 1.17 0.08 0.00 0.02 0.00 0.00 54.97 56.30 3gyr s GLU 461 Cb -0.14 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.66 3gyr s GLU 461 CO -0.07 0.17 -0.15 -1.64 0.02 0.00 0.00 175.26 173.59 3gyr s MET 462 N 0.29 1.90 -0.03 1.61 -1.94 -0.95 0.47 119.30 120.63 3gyr s MET 462 Ca 0.42 -1.14 0.03 0.00 -1.71 0.00 0.00 55.69 53.29 3gyr s MET 462 Cb -0.21 -2.17 0.00 0.00 2.01 0.00 0.00 34.83 34.47 3gyr s MET 462 CO 0.24 0.48 -0.12 0.00 -0.01 0.00 0.00 175.02 175.62 3gyr s ALA 463 N -1.20 1.12 0.28 3.03 0.00 0.16 -4.53 121.76 120.61 3gyr s ALA 463 Ca 0.19 -0.46 -0.30 0.00 0.00 0.00 0.00 51.96 51.40 3gyr s ALA 463 Cb -0.11 -0.40 -0.11 0.00 0.00 0.00 0.00 23.12 22.50 3gyr s ALA 463 CO 0.11 0.18 1.53 -2.00 0.00 0.00 0.00 175.76 175.59 3gyr s GLU 464 N 0.19 4.18 0.11 0.00 2.12 -1.26 -0.72 118.70 123.31 3gyr s GLU 464 Ca -0.04 2.47 -0.14 0.00 0.36 0.00 0.00 54.97 57.62 3gyr s GLU 464 Cb -0.10 -3.05 -0.07 0.00 0.26 0.00 0.00 34.13 31.17 3gyr s GLU 464 CO 0.01 -0.55 0.50 0.08 -0.54 0.00 0.00 175.26 174.77 3gyr s VAL 465 N -0.03 4.92 -0.43 3.70 1.01 0.14 -4.87 120.40 124.84 3gyr s VAL 465 Ca 0.61 0.77 0.09 0.00 0.00 0.00 0.00 61.98 63.46 3gyr s VAL 465 Cb -0.45 -3.72 0.40 0.00 0.00 0.00 0.00 36.38 32.60 3gyr s VAL 465 CO 0.46 0.31 0.96 -0.62 0.00 0.00 0.00 175.10 176.21 3gyr n GLU 466 N 0.98 2.36 -3.48 2.72 1.02 -1.26 -4.70 120.64 118.28 3gyr n GLU 466 Ca -0.07 -4.08 -0.27 0.00 -0.02 0.00 0.00 57.16 52.72 3gyr n GLU 466 Cb 0.52 -1.90 -0.13 0.00 -0.02 0.00 0.00 31.44 29.91 3gyr n GLU 466 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3gyr s GLN 472 N -3.21 0.38 0.58 3.49 -1.52 -1.26 -5.19 119.66 112.93 3gyr s GLN 472 Ca 0.42 -0.84 -0.16 0.00 -1.95 0.00 0.00 55.36 52.82 3gyr s GLN 472 Cb 0.37 -1.13 -0.04 0.00 -0.22 0.00 0.00 33.01 31.99 3gyr s GLN 472 CO -0.10 -1.11 1.05 0.08 -0.25 0.00 0.00 175.29 174.96 3gyr s VAL 473 N 1.65 3.86 0.10 1.09 1.01 -1.26 -4.33 120.40 122.53 3gyr s VAL 473 Ca 0.13 0.91 -0.13 0.00 0.00 0.00 0.00 61.98 62.90 3gyr s VAL 473 Cb -0.19 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.71 3gyr s VAL 473 CO -0.18 -0.49 0.48 -2.16 0.00 0.00 0.00 175.10 172.75 3gyr s PRO 474 N -3.99 3.90 -0.13 2.72 0.04 -1.26 -5.17 135.00 131.11 3gyr s PRO 474 Ca 0.64 0.38 -0.21 0.00 0.04 0.00 0.00 61.00 61.85 3gyr s PRO 474 Cb -0.16 -3.00 0.05 0.00 0.04 0.00 0.00 34.50 31.44 3gyr s PRO 474 CO 0.35 0.54 0.53 0.00 0.04 0.00 0.00 177.00 178.45 3gyr s ALA 475 N -1.39 -1.33 -0.16 8.56 0.00 -1.26 -5.08 121.76 121.11 3gyr s ALA 475 Ca 0.34 1.23 -0.40 0.00 0.00 0.00 0.00 51.96 53.14 3gyr s ALA 475 Cb -0.15 -0.48 -0.17 0.00 0.00 0.00 0.00 23.12 22.31 3gyr s ALA 475 CO 0.18 -0.28 1.51 -1.91 0.00 0.00 0.00 175.76 175.25 3gyr n GLU 476 N 2.04 0.84 -0.62 0.00 2.13 -1.24 -1.08 120.64 122.72 3gyr n GLU 476 Ca -0.16 0.31 0.00 0.00 0.66 0.00 0.00 57.16 57.96 3gyr n GLU 476 Cb 0.56 -1.93 0.00 0.00 0.27 0.00 0.00 31.44 30.35 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 3.28 1.03 3.55 8.31 0.00 0.34 -4.92 105.19 116.79 3gyr n GLY 477 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.33 4.74 -0.09 1.61 1.01 -0.24 -0.86 120.40 123.25 3gyr s VAL 478 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 61.98 3gyr s VAL 478 Cb 0.00 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.19 3gyr s VAL 478 CO 0.00 0.36 -0.19 -0.63 0.00 0.00 0.00 175.10 174.64 3gyr s ILE 479 N 1.19 1.69 -0.00 2.22 1.01 0.30 -1.06 121.20 126.53 3gyr s ILE 479 Ca 0.05 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.93 3gyr s ILE 479 Cb -0.14 -1.48 -0.03 0.00 0.01 0.00 0.00 42.46 40.81 3gyr s ILE 479 CO 0.04 0.48 -0.05 -1.10 0.00 0.00 0.00 174.94 174.31 3gyr s GLN 480 N 0.50 2.62 -0.05 2.79 -0.21 -1.26 -0.69 119.66 123.36 3gyr s GLN 480 Ca -0.17 -0.68 -0.00 0.00 0.02 0.00 0.00 55.36 54.53 3gyr s GLN 480 Cb -0.17 -2.55 0.03 0.00 1.00 0.00 0.00 33.01 31.32 3gyr s GLN 480 CO 0.06 0.61 -0.01 0.08 -2.12 0.00 0.00 175.29 173.92 3gyr s VAL 481 N -1.00 0.34 -0.45 1.09 1.01 -0.78 -0.12 120.40 120.49 3gyr s VAL 481 Ca 0.17 0.08 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 3gyr s VAL 481 Cb -0.11 -0.46 0.03 0.00 0.00 0.00 0.00 36.38 35.84 3gyr s VAL 481 CO 0.08 0.22 0.53 -0.89 0.00 0.00 0.00 175.10 175.03 3gyr s THR 482 N 1.52 4.98 1.27 3.92 2.01 0.47 -1.19 115.64 128.62 3gyr s THR 482 Ca -0.02 -0.29 -0.19 0.00 0.31 0.00 0.00 61.69 61.49 3gyr s THR 482 Cb -0.13 -4.14 0.31 0.00 0.01 0.00 0.00 72.50 68.55 3gyr s THR 482 CO -0.03 -0.55 1.03 -0.83 -0.69 0.00 0.00 174.62 173.54 3gyr s GLY 483 N 2.07 1.51 0.38 4.40 0.00 -0.57 -3.99 107.32 111.12 3gyr s GLY 483 Ca 0.15 -0.76 0.08 0.00 0.00 0.00 0.00 44.72 44.19 3gyr s GLY 483 CO 0.14 0.13 1.96 0.00 0.00 0.00 0.00 173.10 175.34 3gyr h ALA 484 N -2.87 1.77 0.00 3.20 0.00 -1.97 0.04 119.26 119.43 3gyr h ALA 484 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3gyr h ALA 484 Cb 1.32 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3gyr h ALA 484 CO 0.36 0.11 0.00 -0.40 0.00 0.00 0.00 179.25 179.32 3gyr n ASP 485 N -4.48 0.00 0.00 0.00 5.68 -1.26 -4.87 116.55 111.61 3gyr n ASP 485 Ca 0.11 -1.81 0.00 0.00 -0.50 0.00 0.00 54.79 52.58 3gyr n ASP 485 Cb 0.26 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.24 3gyr n ASP 485 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3gyr n GLY 486 N 0.52 1.56 3.79 6.12 0.00 -0.00 -5.00 105.19 112.17 3gyr n GLY 486 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.02 4.49 -0.24 1.61 3.52 -1.26 -4.85 118.95 122.20 3gyr s ARG 487 Ca 0.00 1.08 -0.07 0.00 -0.13 0.00 0.00 55.73 56.61 3gyr s ARG 487 Cb 0.00 -3.18 -0.03 0.00 -1.56 0.00 0.00 34.95 30.18 3gyr s ARG 487 CO 0.00 0.54 0.06 0.99 -0.81 0.00 0.00 175.30 176.08 3gyr s THR 488 N -1.23 4.29 0.28 4.11 2.01 -1.26 -1.51 115.64 122.34 3gyr s THR 488 Ca 0.37 -0.18 0.06 0.00 0.31 0.00 0.00 61.69 62.25 3gyr s THR 488 Cb -0.22 -2.99 -0.03 0.00 0.01 0.00 0.00 72.50 69.27 3gyr s THR 488 CO 0.25 0.36 0.32 -0.54 -0.69 0.00 0.00 174.62 174.31 3gyr s LYS 489 N 1.47 3.07 -0.10 4.92 1.02 -0.33 -4.93 119.74 124.85 3gyr s LYS 489 Ca 0.06 -1.01 0.03 0.00 0.02 0.00 0.00 55.97 55.07 3gyr s LYS 489 Cb -0.15 -2.69 0.01 0.00 -0.52 0.00 0.00 37.83 34.48 3gyr s LYS 489 CO 0.03 0.28 -0.20 0.99 -0.92 0.00 0.00 175.35 175.52 3gyr s THR 490 N -2.13 1.81 0.02 2.17 2.01 -1.26 -1.87 115.64 116.40 3gyr s THR 490 Ca 0.37 -0.87 0.07 0.00 0.31 0.00 0.00 61.69 61.58 3gyr s THR 490 Cb -0.08 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 70.82 3gyr s THR 490 CO 0.28 0.50 -0.22 -0.31 -0.69 0.00 0.00 174.62 174.18 3gyr s TYR 491 N 0.52 1.92 -0.06 4.92 1.51 0.14 0.28 117.35 126.58 3gyr s TYR 491 Ca -0.16 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 55.57 3gyr s TYR 491 Cb -0.17 -1.17 -0.02 0.00 -0.11 0.00 0.00 41.96 40.49 3gyr s TYR 491 CO 0.06 0.06 -0.19 0.50 -1.11 0.00 0.00 175.55 174.87 3gyr s ARG 492 N -0.97 2.56 -0.01 -0.62 3.52 0.10 -0.54 118.95 122.99 3gyr s ARG 492 Ca 0.08 -0.78 -0.30 0.00 -0.13 0.00 0.00 55.73 54.60 3gyr s ARG 492 Cb -0.09 -2.31 -0.06 0.00 -1.56 0.00 0.00 34.95 30.94 3gyr s ARG 492 CO 0.01 0.51 1.51 0.50 -0.81 0.00 0.00 175.30 177.01 3gyr s ARG 493 N -0.44 4.23 -0.03 5.12 3.52 -0.04 -0.67 118.95 130.64 3gyr s ARG 493 Ca 0.05 2.07 0.17 0.00 -0.13 0.00 0.00 55.73 57.90 3gyr s ARG 493 Cb -0.12 -3.70 -0.26 0.00 -1.56 0.00 0.00 34.95 29.30 3gyr s ARG 493 CO 0.02 -0.69 0.37 0.25 -0.81 0.00 0.00 175.30 174.43 3gyr n THR 494 N 4.95 0.03 -3.70 4.11 -2.24 0.18 -4.94 114.28 112.66 3gyr n THR 494 Ca 0.15 -0.40 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 3gyr n THR 494 Cb 0.43 0.09 -0.07 0.00 -2.10 0.00 0.00 70.33 68.67 3gyr n THR 494 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gyr s ALA 495 N -3.17 -0.99 0.00 6.98 0.00 -1.20 -4.90 121.76 118.48 3gyr s ALA 495 Ca -0.06 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.34 3gyr s ALA 495 Cb 0.11 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.40 3gyr s ALA 495 CO 0.71 -0.35 0.00 2.89 0.00 0.00 0.00 175.76 179.01 3gyr n ARG 496 N 0.92 2.65 -3.91 0.00 1.85 -1.26 -1.28 116.66 115.63 3gyr n ARG 496 Ca -0.20 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 56.56 3gyr n ARG 496 Cb 0.58 -0.24 -0.07 0.00 -1.05 0.00 0.00 32.46 31.68 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 -0.40 0.09 0.25 8.89 -1.32 -1.26 -4.20 115.64 117.70 3gyr s THR 497 Ca 0.00 -1.27 -0.05 0.00 -1.21 0.00 0.00 61.69 59.16 3gyr s THR 497 Cb 0.00 -1.63 0.28 0.00 -1.51 0.00 0.00 72.50 69.64 3gyr s THR 497 CO 0.00 -0.42 1.64 0.15 -2.21 0.00 0.00 174.62 173.78 3gyr h PHE 498 N 2.61 0.05 -0.50 9.09 3.04 -1.27 -2.15 116.94 127.82 3gyr h PHE 498 Ca -0.33 0.05 0.00 0.00 3.98 0.00 0.00 57.97 61.68 3gyr h PHE 498 Cb 1.22 0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.83 3gyr h PHE 498 CO 0.40 -0.22 0.00 0.09 -2.02 0.00 0.00 178.31 176.56 3gyr n ASN 499 N -5.31 3.08 -4.73 0.41 5.03 -1.26 -4.60 115.26 107.89 3gyr n ASN 499 Ca 0.15 -2.13 -0.31 0.00 0.87 0.00 0.00 54.58 53.16 3gyr n ASN 499 Cb 0.51 -0.40 0.12 0.00 -1.02 0.00 0.00 39.78 38.98 3gyr n ASN 499 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3gyr s ASP 500 N -0.91 3.94 0.20 6.41 1.01 -0.81 -4.96 116.67 121.56 3gyr s ASP 500 Ca 0.35 1.99 -0.29 0.00 0.71 0.00 0.00 52.55 55.31 3gyr s ASP 500 Cb 0.20 -2.54 -0.17 0.00 1.01 0.00 0.00 42.92 41.42 3gyr s ASP 500 CO 0.21 -2.42 0.69 0.61 0.21 0.00 0.00 175.17 174.47 3gyr n GLY 501 N -0.58 -1.26 3.52 0.21 0.00 -1.26 -4.88 105.19 100.94 3gyr n GLY 501 Ca 0.10 0.38 -0.46 0.00 0.00 0.00 0.00 46.02 46.04 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 1.81 0.73 -0.06 0.99 7.94 -1.26 -4.91 117.00 122.25 3gyr n LEU 502 Ca 0.16 1.16 -0.13 0.00 -1.11 0.00 0.00 56.01 56.09 3gyr n LEU 502 Cb 0.25 -1.16 -0.04 0.00 0.53 0.00 0.00 43.42 43.00 3gyr n LEU 502 CO 0.57 -1.92 -0.89 0.61 -1.11 0.00 0.00 177.39 174.65 3gyr n GLY 503 N 1.57 -0.21 3.44 -3.96 0.00 -1.26 -5.00 105.19 99.77 3gyr n GLY 503 Ca 0.13 -0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.24 3.16 -0.10 1.61 0.08 -1.26 -5.04 117.98 114.18 3gyr s PHE 504 Ca -0.17 -0.61 -0.03 0.00 0.12 0.00 0.00 56.93 56.23 3gyr s PHE 504 Cb 0.06 -3.16 -0.03 0.00 -0.57 0.00 0.00 43.02 39.32 3gyr s PHE 504 CO 0.22 -0.83 0.02 0.99 -0.10 0.00 0.00 175.22 175.52 3gyr s THR 505 N 2.10 4.44 -0.03 0.64 2.01 -1.26 -1.60 115.64 121.94 3gyr s THR 505 Ca 0.10 -0.19 -0.00 0.00 0.31 0.00 0.00 61.69 61.91 3gyr s THR 505 Cb -0.20 -2.89 0.03 0.00 0.01 0.00 0.00 72.50 69.45 3gyr s THR 505 CO 0.11 0.59 0.01 -0.63 -0.69 0.00 0.00 174.62 174.00 3gyr s ILE 506 N -0.69 0.16 0.03 1.82 1.01 0.50 -4.96 121.20 119.07 3gyr s ILE 506 Ca 0.11 0.13 -0.30 0.00 0.00 0.00 0.00 60.65 60.59 3gyr s ILE 506 Cb -0.12 -0.28 -0.06 0.00 0.01 0.00 0.00 42.46 42.02 3gyr s ILE 506 CO 0.02 0.16 1.38 -0.83 0.00 0.00 0.00 174.94 175.67 3gyr s GLY 507 N 1.23 1.93 0.39 6.18 0.00 -1.26 -1.56 107.32 114.23 3gyr s GLY 507 Ca -0.07 0.93 -0.27 0.00 0.00 0.00 0.00 44.72 45.32 3gyr s GLY 507 CO -0.02 2.44 1.32 -2.21 0.00 0.00 0.00 173.10 174.63 3gyr n GLU 508 N 4.93 2.15 -0.02 2.90 0.00 0.18 -1.76 120.64 129.01 3gyr n GLU 508 Ca 0.12 0.76 0.00 0.00 0.00 0.00 0.00 57.16 58.04 3gyr n GLU 508 Cb 0.44 -2.43 0.00 0.00 0.00 0.00 0.00 31.44 29.45 3gyr n GLU 508 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3gyr n GLY 509 N 0.72 1.96 3.91 8.31 0.00 0.18 -4.42 105.19 115.84 3gyr n GLY 509 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.69 3.56 0.00 2.61 -4.23 -0.72 -4.80 115.64 109.36 3gyr s THR 510 Ca 0.00 0.17 0.02 0.00 -1.18 0.00 0.00 61.69 60.70 3gyr s THR 510 Cb 0.00 -3.45 -0.03 0.00 1.34 0.00 0.00 72.50 70.36 3gyr s THR 510 CO 0.00 -0.51 -0.03 -1.00 -0.54 0.00 0.00 174.62 172.53 3gyr s HIS 511 N -3.13 2.98 0.00 3.99 3.76 -1.26 -1.62 115.29 120.00 3gyr s HIS 511 Ca 0.56 0.02 0.02 0.00 -0.15 0.00 0.00 55.06 55.51 3gyr s HIS 511 Cb -0.11 -1.64 -0.01 0.00 1.11 0.00 0.00 32.58 31.94 3gyr s HIS 511 CO 0.48 0.42 -0.08 -1.21 -0.85 0.00 0.00 174.74 173.50 3gyr s GLU 512 N -1.48 0.58 -0.18 1.40 2.02 -0.23 -1.58 118.70 119.23 3gyr s GLU 512 Ca 0.18 -0.34 -0.17 0.00 0.02 0.00 0.00 54.97 54.66 3gyr s GLU 512 Cb -0.11 -0.54 -0.04 0.00 0.10 0.00 0.00 34.13 33.54 3gyr s GLU 512 CO 0.09 0.14 0.45 -1.14 0.02 0.00 0.00 175.26 174.82 3gyr s GLN 513 N -0.40 4.22 -0.13 1.61 0.74 0.24 -0.53 119.66 125.41 3gyr s GLN 513 Ca 0.01 0.31 -0.02 0.00 0.05 0.00 0.00 55.36 55.72 3gyr s GLN 513 Cb -0.04 -3.52 -0.03 0.00 1.10 0.00 0.00 33.01 30.53 3gyr s GLN 513 CO -0.00 -0.02 -0.05 -1.58 -0.55 0.00 0.00 175.29 173.08 3gyr s TRP 514 N 1.24 2.98 -0.19 1.67 0.52 0.59 -1.09 118.94 124.67 3gyr s TRP 514 Ca 0.22 -0.23 -0.06 0.00 0.02 0.00 0.00 56.10 56.05 3gyr s TRP 514 Cb -0.15 -1.87 -0.03 0.00 -1.15 0.00 0.00 33.47 30.27 3gyr s TRP 514 CO 0.09 0.07 0.02 0.99 0.02 0.00 0.00 176.95 178.13 3gyr s THR 515 N -0.01 4.26 -0.35 2.01 2.01 -0.27 -1.00 115.64 122.28 3gyr s THR 515 Ca 0.00 -0.22 -0.11 0.00 0.31 0.00 0.00 61.69 61.67 3gyr s THR 515 Cb -0.13 -2.92 0.01 0.00 0.01 0.00 0.00 72.50 69.47 3gyr s THR 515 CO 0.03 0.44 0.21 -0.36 -0.69 0.00 0.00 174.62 174.25 3gyr s PHE 516 N 0.70 3.22 -0.38 4.92 0.40 0.85 -0.69 117.98 127.00 3gyr s PHE 516 Ca 0.01 -0.69 -0.04 0.00 -0.60 0.00 0.00 56.93 55.61 3gyr s PHE 516 Cb -0.14 -2.44 0.08 0.00 0.51 0.00 0.00 43.02 41.04 3gyr s PHE 516 CO 0.02 -0.54 0.16 -1.17 0.70 0.00 0.00 175.22 174.39 3gyr s LEU 517 N 1.61 4.84 -0.35 -0.37 2.96 0.70 -0.21 118.68 127.86 3gyr s LEU 517 Ca 0.04 -1.65 -0.20 0.00 -0.22 0.00 0.00 54.13 52.10 3gyr s LEU 517 Cb -0.18 -1.84 0.00 0.00 0.50 0.00 0.00 46.19 44.66 3gyr s LEU 517 CO 0.07 -0.46 0.61 0.21 -1.32 0.00 0.00 176.35 175.47 3gyr s ASN 518 N 1.74 6.42 0.00 3.68 3.84 0.65 -0.81 114.94 130.46 3gyr s ASN 518 Ca 0.03 0.15 0.19 0.00 0.21 0.00 0.00 52.86 53.44 3gyr s ASN 518 Cb -0.22 -2.32 0.53 0.00 -0.55 0.00 0.00 41.25 38.69 3gyr s ASN 518 CO -0.01 -0.56 1.43 0.18 -2.79 0.00 0.00 177.10 175.35 3gyr n LEU 519 N 5.98 2.66 -4.63 3.21 4.77 0.42 -1.24 117.00 128.17 3gyr n LEU 519 Ca -0.02 -1.23 -0.29 0.00 -0.03 0.00 0.00 56.01 54.44 3gyr n LEU 519 Cb 0.49 -0.26 -0.09 0.00 -2.33 0.00 0.00 43.42 41.23 3gyr n LEU 519 CO 0.48 0.62 -0.24 -0.94 -1.33 0.00 0.00 177.39 175.97 3gyr s SER 520 N -1.28 3.49 -0.02 -1.43 1.04 -1.26 -4.68 113.70 109.56 3gyr s SER 520 Ca 0.35 -1.60 0.20 0.00 0.48 0.00 0.00 55.95 55.39 3gyr s SER 520 Cb 0.19 0.33 0.62 0.00 0.10 0.00 0.00 66.02 67.26 3gyr s SER 520 CO 0.26 -0.80 1.52 -0.81 0.98 0.00 0.00 173.24 174.39 3gyr n PRO 521 N -1.05 2.80 -3.27 4.02 -0.04 -1.26 -1.85 135.00 134.35 3gyr n PRO 521 Ca -0.11 -2.49 -0.39 0.00 -0.04 0.00 0.00 63.50 60.46 3gyr n PRO 521 Cb 0.66 -1.60 -0.07 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.26 5.12 -0.15 0.52 1.01 -1.26 -4.52 121.20 120.66 3gyr s ILE 522 Ca 0.46 0.92 -0.29 0.00 0.00 0.00 0.00 60.65 61.74 3gyr s ILE 522 Cb 0.25 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 38.86 3gyr s ILE 522 CO 0.29 0.20 1.51 -0.22 0.00 0.00 0.00 174.94 176.71 3gyr s LEU 523 N 1.52 4.14 -0.23 2.97 0.20 -1.26 -3.99 118.68 122.03 3gyr s LEU 523 Ca 0.24 1.85 -0.05 0.00 0.69 0.00 0.00 54.13 56.85 3gyr s LEU 523 Cb -0.15 -3.53 -0.02 0.00 -0.43 0.00 0.00 46.19 42.06 3gyr s LEU 523 CO 0.09 -0.97 -0.01 -1.00 -0.29 0.00 0.00 176.35 174.18 3gyr s HIS 524 N 4.20 3.00 -0.45 5.38 3.76 -0.78 -4.92 115.29 125.49 3gyr s HIS 524 Ca 0.66 -0.75 -0.28 0.00 -0.15 0.00 0.00 55.06 54.54 3gyr s HIS 524 Cb -0.27 -2.14 0.03 0.00 1.11 0.00 0.00 32.58 31.31 3gyr s HIS 524 CO 0.24 -0.47 1.08 -1.25 -0.85 0.00 0.00 174.74 173.50 3gyr s PRO 525 N 1.49 3.75 -0.10 8.40 0.04 -1.26 -1.52 135.00 145.80 3gyr s PRO 525 Ca 0.06 0.57 -0.14 0.00 0.04 0.00 0.00 61.00 61.53 3gyr s PRO 525 Cb -0.15 -3.88 -0.05 0.00 0.04 0.00 0.00 34.50 30.47 3gyr s PRO 525 CO -0.01 -1.27 0.35 -1.64 0.04 0.00 0.00 177.00 174.47 3gyr s MET 526 N 4.18 4.08 -0.05 4.56 -1.94 0.46 -0.10 119.30 130.49 3gyr s MET 526 Ca 0.45 0.23 0.03 0.00 -1.71 0.00 0.00 55.69 54.70 3gyr s MET 526 Cb -0.09 -3.34 0.00 0.00 2.01 0.00 0.00 34.83 33.42 3gyr s MET 526 CO 0.28 0.42 -0.16 -1.58 -0.01 0.00 0.00 175.02 173.98 3gyr s HIS 527 N -0.15 1.66 -0.21 -0.03 5.04 -0.14 -0.41 115.29 121.06 3gyr s HIS 527 Ca 0.20 -0.54 -0.02 0.00 -1.54 0.00 0.00 55.06 53.16 3gyr s HIS 527 Cb -0.14 -1.15 0.00 0.00 0.04 0.00 0.00 32.58 31.33 3gyr s HIS 527 CO 0.08 -0.22 -0.09 0.42 -2.34 0.00 0.00 174.74 172.58 3gyr s ILE 528 N 0.28 2.91 0.98 0.89 1.01 -1.09 -1.15 121.20 125.02 3gyr s ILE 528 Ca -0.09 -0.68 -0.11 0.00 0.00 0.00 0.00 60.65 59.78 3gyr s ILE 528 Cb -0.13 -2.31 0.18 0.00 0.01 0.00 0.00 42.46 40.21 3gyr s ILE 528 CO 0.03 0.44 1.12 -1.00 0.00 0.00 0.00 174.94 175.53 3gyr s HIS 529 N 1.41 1.54 0.00 3.97 3.76 -0.70 -4.22 115.29 121.04 3gyr s HIS 529 Ca 0.05 1.66 0.00 0.00 -0.15 0.00 0.00 55.06 56.62 3gyr s HIS 529 Cb -0.14 -3.29 0.00 0.00 1.11 0.00 0.00 32.58 30.26 3gyr s HIS 529 CO -0.07 -3.09 0.00 -0.11 -0.85 0.00 0.00 174.74 170.63 3gyr n LEU 530 N -4.42 0.00 -4.92 0.89 7.94 -1.26 -4.93 117.00 110.31 3gyr n LEU 530 Ca 0.10 0.00 -0.27 0.00 -1.11 0.00 0.00 56.01 54.73 3gyr n LEU 530 Cb 0.53 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.45 3gyr n LEU 530 CO 0.51 0.00 0.18 0.00 -1.11 0.00 0.00 177.39 176.97 3gyr s ALA 531 N 0.00 3.66 -0.02 1.96 0.00 -1.26 -4.46 121.76 121.65 3gyr s ALA 531 Ca 0.00 -0.72 -0.15 0.00 0.00 0.00 0.00 51.96 51.10 3gyr s ALA 531 Cb 0.00 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 3gyr s ALA 531 CO 0.00 0.14 0.40 -0.51 0.00 0.00 0.00 175.76 175.79 3gyr s ASP 532 N -3.53 6.78 0.19 0.00 1.01 -1.26 -4.80 116.67 115.06 3gyr s ASP 532 Ca 0.42 0.92 0.06 0.00 0.71 0.00 0.00 52.55 54.66 3gyr s ASP 532 Cb -0.10 -2.24 -0.05 0.00 1.01 0.00 0.00 42.92 41.54 3gyr s ASP 532 CO 0.33 0.30 -0.11 -0.36 0.21 0.00 0.00 175.17 175.54 3gyr s PHE 533 N -0.93 1.55 0.03 4.23 0.40 -0.60 -3.59 117.98 119.07 3gyr s PHE 533 Ca 0.23 -0.68 0.08 0.00 -0.60 0.00 0.00 56.93 55.96 3gyr s PHE 533 Cb -0.16 -0.77 -0.02 0.00 0.51 0.00 0.00 43.02 42.57 3gyr s PHE 533 CO 0.13 0.22 -0.23 -0.65 0.70 0.00 0.00 175.22 175.38 3gyr s GLN 534 N -3.71 1.68 -0.01 0.44 -0.21 -0.20 -1.47 119.66 116.19 3gyr s GLN 534 Ca 0.21 -0.97 -0.30 0.00 0.02 0.00 0.00 55.36 54.33 3gyr s GLN 534 Cb 0.01 -1.77 -0.04 0.00 1.00 0.00 0.00 33.01 32.21 3gyr s GLN 534 CO 0.05 0.46 1.24 0.08 -2.12 0.00 0.00 175.29 175.01 3gyr s VAL 535 N -0.72 4.07 -0.09 1.09 1.01 -1.26 -0.65 120.40 123.84 3gyr s VAL 535 Ca 0.09 1.44 0.14 0.00 0.00 0.00 0.00 61.98 63.65 3gyr s VAL 535 Cb -0.09 -3.92 -0.21 0.00 0.00 0.00 0.00 36.38 32.16 3gyr s VAL 535 CO 0.01 0.03 0.18 0.18 0.00 0.00 0.00 175.10 175.50 3gyr n LEU 536 N 4.85 0.00 0.00 3.92 4.77 -0.54 -4.94 117.00 125.06 3gyr n LEU 536 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 3gyr n LEU 536 Cb 0.46 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 3gyr n LEU 536 CO 0.56 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 3gyr n GLY 537 N 1.88 1.10 3.38 -0.72 0.00 -1.12 -5.00 105.19 104.71 3gyr n GLY 537 Ca -0.15 -0.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 3gyr n GLY 537 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 538 N -1.86 1.37 -0.09 1.61 0.52 -1.26 -0.35 118.95 118.89 3gyr s ARG 538 Ca 0.00 -1.33 -0.08 0.00 -0.52 0.00 0.00 55.73 53.79 3gyr s ARG 538 Cb 0.00 -1.82 0.02 0.00 0.52 0.00 0.00 34.95 33.67 3gyr s ARG 538 CO 0.00 0.43 0.24 -0.51 0.02 0.00 0.00 175.30 175.47 3gyr s ASP 539 N -2.08 -0.24 0.29 0.23 1.11 -0.40 -4.85 116.67 110.73 3gyr s ASP 539 Ca 0.13 0.46 -0.29 0.00 0.18 0.00 0.00 52.55 53.03 3gyr s ASP 539 Cb -0.10 0.48 -0.10 0.00 1.07 0.00 0.00 42.92 44.27 3gyr s ASP 539 CO 0.06 -0.09 1.11 0.00 1.18 0.00 0.00 175.17 177.43 3gyr s ALA 540 N 0.08 3.39 0.14 5.23 0.00 -1.26 -0.49 121.76 128.86 3gyr s ALA 540 Ca -0.00 0.91 0.11 0.00 0.00 0.00 0.00 51.96 52.98 3gyr s ALA 540 Cb -0.02 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 3gyr s ALA 540 CO 0.00 -0.20 -0.24 0.71 0.00 0.00 0.00 175.76 176.03 3gyr s TYR 541 N -1.19 2.36 -0.42 0.00 2.02 -0.82 -0.60 117.35 118.68 3gyr s TYR 541 Ca 0.46 -0.35 -0.21 0.00 -0.37 0.00 0.00 57.07 56.60 3gyr s TYR 541 Cb -0.32 -1.24 0.02 0.00 -0.40 0.00 0.00 41.96 40.02 3gyr s TYR 541 CO 0.41 0.39 0.67 0.34 -1.57 0.00 0.00 175.55 175.79 3gyr s ASP 542 N -2.24 6.36 -0.16 2.29 -1.08 0.82 -4.66 116.67 118.01 3gyr s ASP 542 Ca 0.17 -0.19 0.16 0.00 -0.52 0.00 0.00 52.55 52.17 3gyr s ASP 542 Cb -0.10 -2.34 0.72 0.00 -1.46 0.00 0.00 42.92 39.75 3gyr s ASP 542 CO 0.08 -0.77 1.64 0.00 0.52 0.00 0.00 175.17 176.64 3gyr n ALA 543 N 6.32 3.35 0.26 3.66 0.00 -1.26 -2.66 120.51 130.18 3gyr n ALA 543 Ca -0.01 -1.80 0.14 0.00 0.00 0.00 0.00 53.44 51.78 3gyr n ALA 543 Cb 0.48 -0.99 0.67 0.00 0.00 0.00 0.00 19.45 19.61 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 3.70 0.00 0.13 0.00 4.64 -1.92 -1.87 113.55 118.23 3gyr h SER 544 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gyr h SER 544 Cb 1.63 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.72 3gyr h SER 544 CO 0.32 0.11 -0.01 1.23 -0.87 0.00 0.00 176.83 177.61 3gyr h GLY 545 N 1.54 0.00 -4.29 -0.77 0.00 -1.80 -3.43 103.07 94.32 3gyr h GLY 545 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 3gyr h GLY 545 CO 0.01 0.00 0.37 -0.12 0.00 0.00 0.00 176.54 176.80 3gyr s PHE 546 N -4.18 3.72 -0.33 5.60 2.19 -0.71 0.19 117.98 124.46 3gyr s PHE 546 Ca -0.04 1.73 0.01 0.00 0.33 0.00 0.00 56.93 58.97 3gyr s PHE 546 Cb 0.13 -3.10 0.08 0.00 -1.31 0.00 0.00 43.02 38.82 3gyr s PHE 546 CO 0.46 0.06 0.03 0.34 1.83 0.00 0.00 175.22 177.94 3gyr s ASP 547 N 0.61 4.81 0.32 6.13 -1.08 0.81 -4.93 116.67 123.34 3gyr s ASP 547 Ca 0.50 -1.79 0.06 0.00 -0.52 0.00 0.00 52.55 50.80 3gyr s ASP 547 Cb -0.22 -1.66 0.71 0.00 -1.46 0.00 0.00 42.92 40.29 3gyr s ASP 547 CO 0.29 -0.34 1.85 -0.07 0.52 0.00 0.00 175.17 177.41 3gyr h LEU 548 N 7.80 0.77 -0.51 -1.34 3.38 -1.87 0.21 115.31 123.76 3gyr h LEU 548 Ca -0.12 0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.73 3gyr h LEU 548 Cb 1.04 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 3gyr h LEU 548 CO 0.54 0.39 -0.73 0.00 0.09 0.00 0.00 178.44 178.73 3gyr h ALA 549 N 1.58 0.74 0.00 1.53 0.00 -1.94 0.54 119.26 121.71 3gyr h ALA 549 Ca 0.48 -0.65 -0.19 0.00 0.00 0.00 0.00 54.91 54.55 3gyr h ALA 549 Cb 0.65 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3gyr h ALA 549 CO -0.24 0.86 -0.87 1.25 0.00 0.00 0.00 179.25 180.25 3gyr h LEU 550 N 0.07 0.21 1.07 0.00 5.85 -1.71 -3.42 115.31 117.39 3gyr h LEU 550 Ca -0.02 -0.17 -0.21 0.00 0.84 0.00 0.00 57.88 58.32 3gyr h LEU 550 Cb 1.29 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.26 3gyr h LEU 550 CO 0.10 0.98 -0.28 0.61 -0.34 0.00 0.00 178.44 179.51 3gyr n GLY 551 N 0.86 -0.01 3.49 3.75 0.00 0.66 -3.62 105.19 110.31 3gyr n GLY 551 Ca -0.03 -0.41 -0.07 0.00 0.00 0.00 0.00 46.02 45.51 3gyr n GLY 551 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 552 N -1.05 1.00 3.86 -0.02 0.00 -1.21 0.13 105.19 107.89 3gyr n GLY 552 Ca -0.10 -1.22 -0.37 0.00 0.00 0.00 0.00 46.02 44.32 3gyr n GLY 552 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3gyr s THR 553 N -2.16 5.26 -0.23 2.61 -1.32 -0.23 -0.13 115.64 119.44 3gyr s THR 553 Ca 0.16 0.50 -0.10 0.00 -1.21 0.00 0.00 61.69 61.04 3gyr s THR 553 Cb -0.04 -3.57 -0.18 0.00 -1.51 0.00 0.00 72.50 67.20 3gyr s THR 553 CO 0.10 0.57 -0.05 0.54 -2.21 0.00 0.00 174.62 173.56 3gyr n ARG 554 N 1.78 0.64 -4.42 7.08 1.74 0.13 -4.51 116.66 119.09 3gyr n ARG 554 Ca -0.16 0.30 -0.24 0.00 -0.77 0.00 0.00 57.85 56.98 3gyr n ARG 554 Cb 0.53 -1.60 -0.09 0.00 -1.02 0.00 0.00 32.46 30.28 3gyr n ARG 554 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3gyr s THR 555 N -2.49 2.72 0.55 0.55 -4.23 -1.23 -4.90 115.64 106.61 3gyr s THR 555 Ca -0.32 -2.26 -0.21 0.00 -1.18 0.00 0.00 61.69 57.72 3gyr s THR 555 Cb 0.10 -2.47 -0.05 0.00 1.34 0.00 0.00 72.50 71.42 3gyr s THR 555 CO 0.60 -0.38 1.25 -2.84 -0.54 0.00 0.00 174.62 172.72 3gyr s PRO 556 N -3.56 3.18 0.34 3.99 0.02 -1.26 -4.35 135.00 133.34 3gyr s PRO 556 Ca 0.31 1.97 -0.29 0.00 0.02 0.00 0.00 61.00 63.01 3gyr s PRO 556 Cb -0.05 -2.14 -0.11 0.00 0.02 0.00 0.00 34.50 32.22 3gyr s PRO 556 CO 0.16 -1.08 1.43 0.08 -0.33 0.00 0.00 177.00 177.26 3gyr s VAL 557 N -1.47 2.36 0.10 3.83 1.01 0.83 -4.53 120.40 122.53 3gyr s VAL 557 Ca 0.73 0.34 0.04 0.00 0.00 0.00 0.00 61.98 63.09 3gyr s VAL 557 Cb -0.34 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 3gyr s VAL 557 CO 0.39 0.08 -0.11 -0.13 0.00 0.00 0.00 175.10 175.32 3gyr s ARG 558 N -1.64 0.87 0.23 2.72 0.52 -1.09 -0.40 118.95 120.16 3gyr s ARG 558 Ca 0.53 -1.13 -0.30 0.00 -0.52 0.00 0.00 55.73 54.31 3gyr s ARG 558 Cb -0.44 -0.64 -0.09 0.00 0.52 0.00 0.00 34.95 34.30 3gyr s ARG 558 CO 0.56 0.11 1.21 -0.51 0.02 0.00 0.00 175.30 176.69 3gyr s LEU 559 N -2.31 4.47 -0.45 2.53 1.43 -1.26 -0.13 118.68 122.96 3gyr s LEU 559 Ca 0.04 2.33 -0.23 0.00 -1.03 0.00 0.00 54.13 55.25 3gyr s LEU 559 Cb -0.05 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.58 3gyr s LEU 559 CO 0.01 -0.36 0.76 -0.62 0.23 0.00 0.00 176.35 176.36 3gyr s ASP 560 N -0.15 6.39 0.09 2.29 -1.08 0.23 -4.64 116.67 119.78 3gyr s ASP 560 Ca 0.51 -0.18 0.19 0.00 -0.52 0.00 0.00 52.55 52.56 3gyr s ASP 560 Cb -0.34 -2.37 0.81 0.00 -1.46 0.00 0.00 42.92 39.56 3gyr s ASP 560 CO 0.40 -0.90 1.61 -0.81 0.52 0.00 0.00 175.17 175.99 3gyr n PRO 561 N 6.63 0.07 0.00 4.34 -0.04 -1.26 -3.52 135.00 141.22 3gyr n PRO 561 Ca 0.01 0.27 0.09 0.00 -0.04 0.00 0.00 63.50 63.83 3gyr n PRO 561 Cb 0.48 -1.62 0.04 0.00 -0.04 0.00 0.00 33.50 32.36 3gyr n PRO 561 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3gyr n ASP 562 N -1.76 2.21 -4.01 3.54 8.00 -1.26 -4.88 116.55 118.39 3gyr n ASP 562 Ca 0.04 -1.60 -0.31 0.00 0.71 0.00 0.00 54.79 53.62 3gyr n ASP 562 Cb 0.22 0.19 -0.15 0.00 -0.02 0.00 0.00 41.12 41.36 3gyr n ASP 562 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3gyr s THR 563 N -1.73 2.10 0.22 -3.53 2.01 -1.23 -5.10 115.64 108.37 3gyr s THR 563 Ca 0.19 -1.96 -0.30 0.00 0.31 0.00 0.00 61.69 59.93 3gyr s THR 563 Cb 0.15 -2.41 -0.09 0.00 0.01 0.00 0.00 72.50 70.15 3gyr s THR 563 CO 0.31 -0.37 1.39 -2.16 -0.69 0.00 0.00 174.62 173.10 3gyr s PRO 564 N 1.05 4.32 -0.50 4.92 0.04 -1.26 -4.33 135.00 139.24 3gyr s PRO 564 Ca 0.03 2.19 0.05 0.00 0.04 0.00 0.00 61.00 63.31 3gyr s PRO 564 Cb -0.19 -3.16 0.19 0.00 0.04 0.00 0.00 34.50 31.39 3gyr s PRO 564 CO -0.08 -0.36 0.46 0.28 0.04 0.00 0.00 177.00 177.34 3gyr n VAL 565 N 2.63 -0.07 -1.35 -0.36 0.31 -1.26 -4.95 118.33 113.28 3gyr n VAL 565 Ca 0.07 -4.07 -0.32 0.00 -0.01 0.00 0.00 64.34 60.01 3gyr n VAL 565 Cb 0.41 -1.89 0.09 0.00 -0.91 0.00 0.00 33.84 31.55 3gyr n VAL 565 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3gyr s PRO 566 N -0.82 2.22 0.38 5.55 0.04 -1.26 -4.59 135.00 136.52 3gyr s PRO 566 Ca 0.32 1.37 -0.26 0.00 0.04 0.00 0.00 61.00 62.47 3gyr s PRO 566 Cb 0.06 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.63 3gyr s PRO 566 CO -0.16 -1.70 1.23 -0.51 0.04 0.00 0.00 177.00 175.90 3gyr s LEU 567 N -5.61 4.26 0.29 -3.56 1.43 -1.26 -4.98 118.68 109.26 3gyr s LEU 567 Ca 0.65 2.49 -0.29 0.00 -1.03 0.00 0.00 54.13 55.95 3gyr s LEU 567 Cb -0.21 -3.90 -0.11 0.00 0.03 0.00 0.00 46.19 42.01 3gyr s LEU 567 CO 0.50 -0.68 1.46 0.00 0.23 0.00 0.00 176.35 177.86 3gyr s ALA 568 N -1.30 3.62 -0.17 4.21 0.00 -1.26 -4.91 121.76 121.95 3gyr s ALA 568 Ca 0.55 1.41 0.26 0.00 0.00 0.00 0.00 51.96 54.18 3gyr s ALA 568 Cb -0.35 -3.57 1.27 0.00 0.00 0.00 0.00 23.12 20.48 3gyr s ALA 568 CO 0.44 -0.83 1.80 -1.35 0.00 0.00 0.00 175.76 175.83 3gyr h PRO 569 N 4.37 0.00 -0.59 0.00 0.11 -1.94 -2.35 132.00 131.60 3gyr h PRO 569 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3gyr h PRO 569 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3gyr h PRO 569 CO 0.74 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.80 3gyr n ASN 570 N -2.44 4.10 -0.92 -2.05 6.94 -1.26 -4.39 115.26 115.24 3gyr n ASN 570 Ca -0.00 -2.27 0.05 0.00 -0.02 0.00 0.00 54.58 52.34 3gyr n ASN 570 Cb 0.14 -0.48 0.23 0.00 -2.36 0.00 0.00 39.78 37.31 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 1.05 2.50 -0.42 -3.83 0.28 -0.88 -4.60 120.64 114.73 3gyr n GLU 571 Ca 0.22 -2.92 0.11 0.00 -0.16 0.00 0.00 57.16 54.41 3gyr n GLU 571 Cb 0.72 -1.82 0.32 0.00 1.43 0.00 0.00 31.44 32.09 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 -0.76 3.97 0.00 -1.84 4.77 -1.26 -4.37 117.00 117.52 3gyr n LEU 572 Ca 0.25 -1.99 0.00 0.00 -0.03 0.00 0.00 56.01 54.23 3gyr n LEU 572 Cb 0.92 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 3gyr n LEU 572 CO 0.16 0.89 0.00 0.61 -1.33 0.00 0.00 177.39 177.72 3gyr n GLY 573 N 1.48 2.59 3.65 -0.72 0.00 -1.26 -4.80 105.19 106.12 3gyr n GLY 573 Ca 0.24 -1.78 -0.39 0.00 0.00 0.00 0.00 46.02 44.09 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 4.08 3.34 0.17 1.61 3.76 -1.26 -4.55 115.29 122.44 3gyr s HIS 574 Ca 0.00 0.65 0.06 0.00 -0.15 0.00 0.00 55.06 55.62 3gyr s HIS 574 Cb 0.00 -2.62 -0.04 0.00 1.11 0.00 0.00 32.58 31.02 3gyr s HIS 574 CO 0.00 -0.12 -0.13 0.15 -0.85 0.00 0.00 174.74 173.78 3gyr s LYS 575 N 1.72 1.19 0.00 1.40 -0.14 -0.54 -0.73 119.74 122.64 3gyr s LYS 575 Ca 0.21 -1.47 0.00 0.00 -1.36 0.00 0.00 55.97 53.34 3gyr s LYS 575 Cb -0.15 -0.95 0.00 0.00 -1.68 0.00 0.00 37.83 35.05 3gyr s LYS 575 CO 0.09 0.16 0.09 -0.40 -0.76 0.00 0.00 175.35 174.52 3gyr n ASP 576 N -0.12 0.17 -3.98 2.83 5.68 -1.26 -1.56 116.55 118.31 3gyr n ASP 576 Ca -0.10 -0.67 -0.27 0.00 -0.50 0.00 0.00 54.79 53.26 3gyr n ASP 576 Cb 0.60 0.11 -0.17 0.00 -1.14 0.00 0.00 41.12 40.52 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 -0.11 1.19 -0.08 2.12 1.01 -1.26 -2.68 120.40 120.59 3gyr s VAL 577 Ca 0.00 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.56 3gyr s VAL 577 Cb 0.00 -1.13 0.01 0.00 0.00 0.00 0.00 36.38 35.25 3gyr s VAL 577 CO 0.00 0.38 -0.18 -0.36 0.00 0.00 0.00 175.10 174.95 3gyr s PHE 578 N 1.19 1.97 0.25 5.22 0.40 0.45 -4.89 117.98 122.57 3gyr s PHE 578 Ca -0.04 -0.78 -0.30 0.00 -0.60 0.00 0.00 56.93 55.21 3gyr s PHE 578 Cb -0.14 -1.37 -0.10 0.00 0.51 0.00 0.00 43.02 41.92 3gyr s PHE 578 CO -0.03 -0.35 1.37 -0.65 0.70 0.00 0.00 175.22 176.26 3gyr s GLN 579 N 0.52 4.33 -0.48 0.44 -0.21 -1.26 -0.40 119.66 122.60 3gyr s GLN 579 Ca -0.16 2.20 0.03 0.00 0.02 0.00 0.00 55.36 57.45 3gyr s GLN 579 Cb -0.17 -3.13 0.15 0.00 1.00 0.00 0.00 33.01 30.86 3gyr s GLN 579 CO 0.06 -0.32 0.31 0.08 -2.12 0.00 0.00 175.29 173.30 3gyr s VAL 580 N -0.21 1.41 0.04 1.09 1.01 -0.58 -4.90 120.40 118.25 3gyr s VAL 580 Ca 0.56 -2.87 -0.30 0.00 0.00 0.00 0.00 61.98 59.37 3gyr s VAL 580 Cb -0.40 -1.97 -0.06 0.00 0.00 0.00 0.00 36.38 33.95 3gyr s VAL 580 CO 0.44 -0.99 1.33 -2.16 0.00 0.00 0.00 175.10 173.72 3gyr s PRO 581 N -0.02 4.33 0.39 2.72 0.04 -1.26 -1.87 135.00 139.33 3gyr s PRO 581 Ca 0.22 1.92 0.08 0.00 0.04 0.00 0.00 61.00 63.26 3gyr s PRO 581 Cb -0.15 -3.44 -0.00 0.00 0.04 0.00 0.00 34.50 30.95 3gyr s PRO 581 CO -0.07 -0.46 0.51 0.20 0.04 0.00 0.00 177.00 177.22 3gyr s GLY 582 N 1.47 1.87 -0.69 0.56 0.00 -1.24 -3.57 107.32 105.72 3gyr s GLY 582 Ca 0.62 -1.64 -0.24 0.00 0.00 0.00 0.00 44.72 43.46 3gyr s GLY 582 CO 0.28 -1.49 1.09 2.56 0.00 0.00 0.00 173.10 175.54 3gyr s PRO 583 N -4.26 3.15 0.15 2.90 0.04 -0.77 -4.22 135.00 131.98 3gyr s PRO 583 Ca 0.51 -0.57 -0.11 0.00 0.04 0.00 0.00 61.00 60.87 3gyr s PRO 583 Cb -0.09 -4.20 0.01 0.00 0.04 0.00 0.00 34.50 30.25 3gyr s PRO 583 CO 0.32 -1.94 0.32 -1.14 0.04 0.00 0.00 177.00 174.59 3gyr s GLN 584 N 4.75 1.11 -0.10 4.56 0.74 -0.37 -1.95 119.66 128.41 3gyr s GLN 584 Ca 0.28 -1.01 0.02 0.00 0.05 0.00 0.00 55.36 54.70 3gyr s GLN 584 Cb -0.13 0.41 -0.02 0.00 1.10 0.00 0.00 33.01 34.37 3gyr s GLN 584 CO 0.13 -0.42 -0.16 0.20 -0.55 0.00 0.00 175.29 174.49 3gyr s GLY 585 N -2.90 1.49 -0.14 2.59 0.00 0.36 -0.25 107.32 108.47 3gyr s GLY 585 Ca 0.11 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 43.90 3gyr s GLY 585 CO -0.05 -0.42 -0.17 -2.27 0.00 0.00 0.00 173.10 170.19 3gyr s LEU 586 N -0.01 2.40 -0.23 0.66 2.96 0.70 -1.28 118.68 123.88 3gyr s LEU 586 Ca -0.05 -0.48 -0.07 0.00 -0.22 0.00 0.00 54.13 53.31 3gyr s LEU 586 Cb -0.14 -1.53 -0.03 0.00 0.50 0.00 0.00 46.19 44.99 3gyr s LEU 586 CO 0.04 0.11 0.07 -0.13 -1.32 0.00 0.00 176.35 175.12 3gyr s ARG 587 N 0.66 3.73 0.17 1.98 0.52 0.53 -0.11 118.95 126.43 3gyr s ARG 587 Ca -0.09 -0.45 0.11 0.00 -0.52 0.00 0.00 55.73 54.78 3gyr s ARG 587 Cb -0.16 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 31.98 3gyr s ARG 587 CO 0.02 -0.07 -0.23 0.14 0.02 0.00 0.00 175.30 175.18 3gyr s VAL 588 N 1.30 2.21 0.01 3.52 -7.23 -0.17 -1.46 120.40 118.57 3gyr s VAL 588 Ca 0.05 -1.95 0.07 0.00 -1.81 0.00 0.00 61.98 58.34 3gyr s VAL 588 Cb -0.15 -2.02 -0.02 0.00 0.56 0.00 0.00 36.38 34.75 3gyr s VAL 588 CO 0.03 -0.12 -0.21 -0.32 -0.31 0.00 0.00 175.10 174.18 3gyr s MET 589 N -2.57 1.56 0.08 4.82 1.75 0.17 -0.30 119.30 124.82 3gyr s MET 589 Ca 0.18 -0.81 -0.10 0.00 -1.25 0.00 0.00 55.69 53.71 3gyr s MET 589 Cb -0.08 -1.57 0.00 0.00 2.84 0.00 0.00 34.83 36.02 3gyr s MET 589 CO 0.08 0.42 0.21 0.20 -0.65 0.00 0.00 175.02 175.28 3gyr s GLY 590 N -0.75 0.05 -0.23 2.11 0.00 0.31 -1.03 107.32 107.78 3gyr s GLY 590 Ca 0.08 -0.49 -0.08 0.00 0.00 0.00 0.00 44.72 44.23 3gyr s GLY 590 CO 0.00 -0.68 0.08 1.25 0.00 0.00 0.00 173.10 173.75 3gyr s LYS 591 N -3.56 3.79 -0.88 2.90 2.20 -1.24 -1.06 119.74 121.89 3gyr s LYS 591 Ca 0.02 -0.42 -0.18 0.00 -0.36 0.00 0.00 55.97 55.04 3gyr s LYS 591 Cb 0.03 -3.31 0.15 0.00 -1.51 0.00 0.00 37.83 33.19 3gyr s LYS 591 CO -0.09 -0.03 1.01 -0.06 -0.36 0.00 0.00 175.35 175.82 3gyr s PHE 592 N 1.20 3.27 -0.02 4.03 0.08 -0.64 -4.28 117.98 121.63 3gyr s PHE 592 Ca 0.05 -1.51 0.01 0.00 0.12 0.00 0.00 56.93 55.59 3gyr s PHE 592 Cb -0.14 -4.15 0.01 0.00 -0.57 0.00 0.00 43.02 38.17 3gyr s PHE 592 CO 0.04 -1.35 -0.02 0.34 -0.10 0.00 0.00 175.22 174.13 3gyr s ASP 593 N 3.25 0.40 0.00 1.36 2.15 -1.26 0.48 116.67 123.05 3gyr s ASP 593 Ca 0.28 -0.04 0.00 0.00 0.43 0.00 0.00 52.55 53.21 3gyr s ASP 593 Cb -0.07 -0.14 0.00 0.00 -0.30 0.00 0.00 42.92 42.41 3gyr s ASP 593 CO -0.08 -0.03 0.00 0.61 -0.17 0.00 0.00 175.17 175.50 3gyr n GLY 594 N 3.57 0.74 3.67 2.66 0.00 -1.26 -4.94 105.19 109.63 3gyr n GLY 594 Ca -0.20 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.62 -2.13 0.09 4.61 0.00 -1.26 -4.78 121.76 115.67 3gyr s ALA 595 Ca 0.00 0.53 0.02 0.00 0.00 0.00 0.00 51.96 52.51 3gyr s ALA 595 Cb 0.00 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.53 3gyr s ALA 595 CO 0.00 -1.06 -0.08 0.71 0.00 0.00 0.00 175.76 175.33 3gyr s TYR 596 N -2.55 0.89 -3.39 0.00 2.02 -1.26 -4.72 117.35 108.34 3gyr s TYR 596 Ca 0.15 -0.75 0.00 0.00 -0.37 0.00 0.00 57.07 56.09 3gyr s TYR 596 Cb 0.03 -0.51 0.00 0.00 -0.40 0.00 0.00 41.96 41.08 3gyr s TYR 596 CO -0.02 -0.09 0.00 0.41 -1.57 0.00 0.00 175.55 174.28 3gyr n GLY 597 N 0.43 0.83 3.69 0.71 0.00 0.26 -1.32 105.19 109.80 3gyr n GLY 597 Ca -0.15 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.50 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 -1.36 3.84 0.32 1.61 3.52 -1.26 -0.70 118.95 124.92 3gyr s ARG 598 Ca 0.00 -0.29 0.03 0.00 -0.13 0.00 0.00 55.73 55.34 3gyr s ARG 598 Cb 0.00 -3.21 -0.04 0.00 -1.56 0.00 0.00 34.95 30.15 3gyr s ARG 598 CO 0.00 0.40 0.15 -0.06 -0.81 0.00 0.00 175.30 174.98 3gyr s PHE 599 N 0.02 1.65 0.15 5.12 0.08 0.57 -4.52 117.98 121.06 3gyr s PHE 599 Ca 0.07 -1.33 0.07 0.00 0.12 0.00 0.00 56.93 55.86 3gyr s PHE 599 Cb -0.12 -0.92 -0.04 0.00 -0.57 0.00 0.00 43.02 41.37 3gyr s PHE 599 CO 0.00 -0.46 -0.05 -1.64 -0.10 0.00 0.00 175.22 172.98 3gyr s MET 600 N -3.81 2.26 0.13 0.44 -1.94 -1.26 -1.47 119.30 113.65 3gyr s MET 600 Ca 0.34 -1.10 0.06 0.00 -1.71 0.00 0.00 55.69 53.28 3gyr s MET 600 Cb 0.05 -2.31 -0.04 0.00 2.01 0.00 0.00 34.83 34.54 3gyr s MET 600 CO 0.17 0.47 -0.14 1.52 -0.01 0.00 0.00 175.02 177.03 3gyr s TYR 601 N -1.56 1.40 -0.10 -0.03 -0.85 0.67 -1.72 117.35 115.15 3gyr s TYR 601 Ca 0.25 -0.57 -0.33 0.00 -0.52 0.00 0.00 57.07 55.90 3gyr s TYR 601 Cb -0.10 -0.73 0.13 0.00 0.38 0.00 0.00 41.96 41.64 3gyr s TYR 601 CO 0.17 0.15 1.20 -3.38 -1.52 0.00 0.00 175.55 172.16 3gyr s HIS 602 N -2.26 -0.12 0.44 -3.49 -3.43 -0.30 -0.18 115.29 105.94 3gyr s HIS 602 Ca 0.10 0.03 -0.24 0.00 -0.80 0.00 0.00 55.06 54.15 3gyr s HIS 602 Cb -0.04 0.53 -0.08 0.00 -1.43 0.00 0.00 32.58 31.56 3gyr s HIS 602 CO 0.03 -0.28 1.21 0.00 -2.00 0.00 0.00 174.74 173.69 3gyr n HIS 604 N -0.22 1.99 -2.84 0.00 -0.00 0.86 -4.37 115.22 110.65 3gyr n HIS 604 Ca 0.06 -1.09 -0.43 0.00 0.46 0.00 0.00 57.72 56.72 3gyr n HIS 604 Cb 0.46 -0.57 -0.04 0.00 -0.12 0.00 0.00 29.99 29.72 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 -2.95 4.06 0.30 0.27 1.43 -1.26 -4.69 118.68 115.85 3gyr s LEU 605 Ca 0.52 -0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.53 3gyr s LEU 605 Cb 0.42 -3.00 0.67 0.00 0.03 0.00 0.00 46.19 44.31 3gyr s LEU 605 CO 0.12 -1.13 1.81 -0.07 0.23 0.00 0.00 176.35 177.31 3gyr h LEU 606 N 10.75 0.84 -1.06 1.79 3.38 -1.29 0.14 115.31 129.86 3gyr h LEU 606 Ca -0.25 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3gyr h LEU 606 Cb 1.07 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 3gyr h LEU 606 CO 1.05 0.37 0.64 -0.33 0.09 0.00 0.00 178.44 180.27 3gyr h GLU 607 N 0.86 1.25 -0.29 1.13 3.07 -1.92 -0.18 114.58 118.50 3gyr h GLU 607 Ca 0.54 -0.08 -0.09 0.00 -0.50 0.00 0.00 59.36 59.23 3gyr h GLU 607 Cb 0.71 -0.28 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 3gyr h GLU 607 CO -0.32 0.83 -0.17 0.45 -1.40 0.00 0.00 179.01 178.40 3gyr h HIS 608 N 1.29 0.73 -0.88 4.33 3.86 -1.20 -3.09 115.15 120.18 3gyr h HIS 608 Ca 0.36 -0.19 0.04 0.00 -1.16 0.00 0.00 60.37 59.42 3gyr h HIS 608 Cb -0.12 -0.16 -0.05 0.00 1.06 0.00 0.00 27.41 28.13 3gyr h HIS 608 CO -0.00 0.88 0.56 1.49 0.86 0.00 0.00 177.93 181.72 3gyr h GLU 609 N 0.37 1.04 0.00 2.45 4.81 -0.66 -0.97 114.58 121.63 3gyr h GLU 609 Ca 0.06 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3gyr h GLU 609 Cb 0.70 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.85 3gyr h GLU 609 CO 0.05 0.69 0.00 -0.25 -0.73 0.00 0.00 179.01 178.77 3gyr n ASP 610 N -4.55 0.58 -2.16 1.04 8.00 -0.11 -3.00 116.55 116.36 3gyr n ASP 610 Ca 0.11 0.63 -0.29 0.00 0.71 0.00 0.00 54.79 55.96 3gyr n ASP 610 Cb 0.11 -0.76 0.04 0.00 -0.02 0.00 0.00 41.12 40.49 3gyr n ASP 610 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3gyr n MET 611 N -2.13 3.24 0.00 -1.24 2.81 -0.44 -4.59 117.12 114.77 3gyr n MET 611 Ca 0.03 -3.82 0.00 0.00 -1.81 0.00 0.00 57.70 52.10 3gyr n MET 611 Cb 0.24 -2.28 0.00 0.00 -0.71 0.00 0.00 33.22 30.47 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 -0.79 1.24 2.78 3.03 0.00 -1.16 -4.96 105.19 105.33 3gyr n GLY 612 Ca 0.52 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.17 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 2.22 -3.60 1.61 0.00 -0.78 -2.54 117.12 112.03 3gyr n MET 613 Ca 0.00 -1.93 -0.11 0.00 -0.00 0.00 0.00 57.70 55.66 3gyr n MET 613 Cb 0.00 -2.84 -0.06 0.00 0.00 0.00 0.00 33.22 30.31 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 3.82 0.63 0.00 2.12 0.00 -1.26 -1.79 119.30 122.82 3gyr s MET 614 Ca 0.52 0.43 -0.09 0.00 0.00 0.00 0.00 55.69 56.54 3gyr s MET 614 Cb 0.14 0.30 0.01 0.00 0.00 0.00 0.00 34.83 35.28 3gyr s MET 614 CO 0.01 -0.14 0.18 1.03 0.00 0.00 0.00 175.02 176.10 3gyr s ARG 615 N -0.43 0.54 0.40 4.11 1.81 0.74 -2.68 118.95 123.44 3gyr s ARG 615 Ca -0.01 -0.36 -0.14 0.00 -1.72 0.00 0.00 55.73 53.51 3gyr s ARG 615 Cb -0.03 0.23 -0.08 0.00 -0.45 0.00 0.00 34.95 34.62 3gyr s ARG 615 CO -0.01 -0.14 0.80 -1.25 -0.68 0.00 0.00 175.30 174.03 3gyr s PRO 616 N -1.41 3.91 0.13 3.54 0.04 -1.26 -0.24 135.00 139.71 3gyr s PRO 616 Ca -0.14 0.65 -0.03 0.00 0.04 0.00 0.00 61.00 61.52 3gyr s PRO 616 Cb -0.07 -2.35 -0.03 0.00 0.04 0.00 0.00 34.50 32.09 3gyr s PRO 616 CO 0.02 -0.01 0.11 -0.59 0.04 0.00 0.00 177.00 176.57 3gyr s PHE 617 N -2.27 0.66 -0.07 0.56 -0.71 -0.54 -4.49 117.98 111.11 3gyr s PHE 617 Ca 0.54 -1.05 0.03 0.00 -1.04 0.00 0.00 56.93 55.41 3gyr s PHE 617 Cb -0.10 -0.34 0.01 0.00 -1.21 0.00 0.00 43.02 41.38 3gyr s PHE 617 CO 0.25 -0.56 -0.16 0.08 -1.34 0.00 0.00 175.22 173.50 3gyr s VAL 618 N -4.00 1.45 -0.03 -2.49 1.01 -0.62 -0.31 120.40 115.40 3gyr s VAL 618 Ca 0.19 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.55 3gyr s VAL 618 Cb 0.06 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 3gyr s VAL 618 CO -0.01 0.42 -0.16 -0.69 0.00 0.00 0.00 175.10 174.67 3gyr s VAL 619 N 0.50 2.95 -0.18 2.92 1.01 0.12 -0.37 120.40 127.35 3gyr s VAL 619 Ca -0.15 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 60.79 3gyr s VAL 619 Cb -0.16 -2.16 0.06 0.00 0.00 0.00 0.00 36.38 34.11 3gyr s VAL 619 CO 0.05 0.54 0.58 -0.32 0.00 0.00 0.00 175.10 175.95 3gyr s MET 620 N -0.86 0.73 0.24 2.72 0.00 -0.60 -0.57 119.30 120.96 3gyr s MET 620 Ca 0.12 0.66 -0.31 0.00 0.00 0.00 0.00 55.69 56.16 3gyr s MET 620 Cb -0.11 0.35 -0.14 0.00 0.00 0.00 0.00 34.83 34.94 3gyr s MET 620 CO 0.01 -0.12 1.26 -2.30 0.00 0.00 0.00 175.02 173.88 3gyr n PRO 621 N 2.40 1.70 -0.34 4.11 -0.02 -1.26 0.48 135.00 142.07 3gyr n PRO 621 Ca -0.15 0.60 0.31 0.00 -2.02 0.00 0.00 63.50 62.24 3gyr n PRO 621 Cb 0.56 -2.16 0.65 0.00 -0.02 0.00 0.00 33.50 32.52 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 3.43 0.16 0.00 0.52 0.11 -1.89 0.15 132.00 134.48 3gyr h PRO 622 Ca -0.44 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.58 3gyr h PRO 622 Cb 1.30 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 3gyr h PRO 622 CO 0.70 0.11 -0.41 0.93 -0.21 0.00 0.00 178.00 179.12 3gyr h GLU 623 N 0.17 0.00 0.00 1.05 3.07 -1.97 -2.76 114.58 114.14 3gyr h GLU 623 Ca 0.61 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 59.32 3gyr h GLU 623 Cb 2.03 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.92 3gyr h GLU 623 CO -0.17 0.41 -0.73 0.00 -1.40 0.00 0.00 179.01 177.12 3gyr h ALA 624 N 1.59 0.53 -0.02 3.43 0.00 -1.32 -3.17 119.26 120.30 3gyr h ALA 624 Ca -0.00 -0.67 0.01 0.00 0.00 0.00 0.00 54.91 54.25 3gyr h ALA 624 Cb 0.78 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3gyr h ALA 624 CO 0.05 0.91 0.02 1.25 0.00 0.00 0.00 179.25 181.48 3gyr h LEU 625 N 0.00 0.00 -2.43 0.00 5.85 -1.16 -0.76 115.31 116.81 3gyr h LEU 625 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3gyr h LEU 625 Cb 1.56 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.59 3gyr h LEU 625 CO 0.09 0.00 0.19 0.11 -0.34 0.00 0.00 178.44 178.49 3gyr h LYS 626 N 0.00 0.00 -0.41 1.25 1.79 -1.57 -0.90 116.57 116.72 3gyr h LYS 626 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 3gyr h LYS 626 Cb 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 3gyr h LYS 626 CO -0.00 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 179.56 3gyr n PHE 627 N -3.03 0.54 0.00 -1.35 3.72 -0.29 -5.18 117.46 111.86 3gyr n PHE 627 Ca -0.02 -0.35 0.00 0.00 -0.05 0.00 0.00 57.45 57.03 3gyr n PHE 627 Cb 0.25 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.78 3gyr n PHE 627 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46