#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gyr n PRO 38 N 0.00 1.82 -0.48 0.00 -0.02 -1.26 -1.20 135.00 133.86 3gyr n PRO 38 Ca 0.00 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3gyr n PRO 38 Cb 0.00 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.03 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 4.16 0.76 3.91 -1.23 0.00 -1.26 -5.09 105.19 106.43 3gyr n GLY 39 Ca 0.23 0.00 -0.31 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 -0.52 3.52 0.27 1.61 2.02 -0.34 -4.76 118.70 120.51 3gyr s GLU 40 Ca 0.00 -0.27 -0.29 0.00 0.02 0.00 0.00 54.97 54.43 3gyr s GLU 40 Cb 0.00 -2.97 -0.09 0.00 0.10 0.00 0.00 34.13 31.17 3gyr s GLU 40 CO 0.00 0.56 1.05 -0.51 0.02 0.00 0.00 175.26 176.37 3gyr s LEU 41 N -2.51 4.57 -0.18 1.80 1.43 -1.26 -4.90 118.68 117.63 3gyr s LEU 41 Ca 0.37 2.16 -0.29 0.00 -1.03 0.00 0.00 54.13 55.34 3gyr s LEU 41 Cb -0.13 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.46 3gyr s LEU 41 CO 0.26 -0.06 1.01 -0.89 0.23 0.00 0.00 176.35 176.90 3gyr s THR 42 N -1.18 4.74 0.60 5.49 2.01 -1.26 -5.02 115.64 121.01 3gyr s THR 42 Ca 0.44 1.99 -0.16 0.00 0.31 0.00 0.00 61.69 64.26 3gyr s THR 42 Cb -0.30 -4.29 -0.03 0.00 0.01 0.00 0.00 72.50 67.89 3gyr s THR 42 CO 0.38 -0.10 1.08 -2.16 -0.69 0.00 0.00 174.62 173.13 3gyr s PRO 43 N 2.70 3.19 -1.19 4.92 0.04 -1.26 -3.93 135.00 139.48 3gyr s PRO 43 Ca 0.45 1.33 -0.04 0.00 0.04 0.00 0.00 61.00 62.77 3gyr s PRO 43 Cb -0.16 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.38 3gyr s PRO 43 CO 0.11 -0.93 1.02 1.19 0.04 0.00 0.00 177.00 178.42 3gyr n PHE 44 N -1.98 -2.37 0.15 0.56 0.99 0.80 -4.93 117.46 110.67 3gyr n PHE 44 Ca 0.10 0.91 0.11 0.00 -0.00 0.00 0.00 57.45 58.57 3gyr n PHE 44 Cb 0.52 -4.79 -0.10 0.00 -1.00 0.00 0.00 39.48 34.11 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 -4.39 2.91 -2.71 4.37 0.00 -1.25 -4.70 120.51 114.74 3gyr n ALA 45 Ca -0.12 -0.43 -0.18 0.00 0.00 0.00 0.00 53.44 52.71 3gyr n ALA 45 Cb 0.60 -0.87 -0.13 0.00 0.00 0.00 0.00 19.45 19.05 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 -3.41 0.98 0.57 0.00 0.00 -1.26 -4.93 121.76 113.71 3gyr s ALA 46 Ca -0.04 -0.80 -0.20 0.00 0.00 0.00 0.00 51.96 50.93 3gyr s ALA 46 Cb 0.13 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 3gyr s ALA 46 CO 0.86 0.15 1.23 -1.25 0.00 0.00 0.00 175.76 176.75 3gyr s PRO 47 N -1.28 3.07 0.35 0.00 0.04 -1.26 -1.91 135.00 134.01 3gyr s PRO 47 Ca -0.02 1.91 -0.29 0.00 0.04 0.00 0.00 61.00 62.64 3gyr s PRO 47 Cb -0.08 -2.04 -0.11 0.00 0.04 0.00 0.00 34.50 32.31 3gyr s PRO 47 CO 0.01 -1.15 1.52 -1.17 0.04 0.00 0.00 177.00 176.25 3gyr s LEU 48 N -3.86 4.33 0.25 -3.56 2.96 0.35 -4.75 118.68 114.39 3gyr s LEU 48 Ca 0.75 3.01 0.08 0.00 -0.22 0.00 0.00 54.13 57.75 3gyr s LEU 48 Cb -0.32 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 42.67 3gyr s LEU 48 CO 0.36 -0.88 0.09 0.42 -1.32 0.00 0.00 176.35 175.03 3gyr s THR 49 N -0.76 3.95 0.20 3.68 -4.23 -1.26 -5.00 115.64 112.22 3gyr s THR 49 Ca 0.56 -1.63 0.10 0.00 -1.18 0.00 0.00 61.69 59.55 3gyr s THR 49 Cb -0.47 -3.11 -0.04 0.00 1.34 0.00 0.00 72.50 70.22 3gyr s THR 49 CO 0.58 -0.34 -0.17 0.68 -0.54 0.00 0.00 174.62 174.83 3gyr s VAL 50 N -2.18 2.71 0.81 2.29 -7.23 -1.26 -4.73 120.40 110.81 3gyr s VAL 50 Ca 0.32 -1.94 -0.11 0.00 -1.81 0.00 0.00 61.98 58.44 3gyr s VAL 50 Cb -0.07 -2.34 0.08 0.00 0.56 0.00 0.00 36.38 34.61 3gyr s VAL 50 CO 0.22 -0.16 1.09 -2.84 -0.31 0.00 0.00 175.10 173.10 3gyr s PRO 51 N -2.87 1.94 0.69 4.82 0.02 -1.26 -4.99 135.00 133.35 3gyr s PRO 51 Ca 0.24 1.00 -0.15 0.00 0.02 0.00 0.00 61.00 62.11 3gyr s PRO 51 Cb -0.08 -1.87 0.02 0.00 0.02 0.00 0.00 34.50 32.59 3gyr s PRO 51 CO 0.13 -1.81 1.14 -1.25 -0.33 0.00 0.00 177.00 174.88 3gyr s PRO 52 N -4.94 2.52 -0.13 5.54 0.04 -1.26 -4.59 135.00 132.17 3gyr s PRO 52 Ca 0.62 1.51 -0.13 0.00 0.04 0.00 0.00 61.00 63.04 3gyr s PRO 52 Cb -0.17 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 3gyr s PRO 52 CO 0.56 -1.49 0.28 0.08 0.04 0.00 0.00 177.00 176.47 3gyr s VAL 53 N -2.24 5.30 -0.13 -0.36 1.01 -1.26 -0.95 120.40 121.77 3gyr s VAL 53 Ca 0.69 0.52 0.01 0.00 0.00 0.00 0.00 61.98 63.20 3gyr s VAL 53 Cb -0.23 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 3gyr s VAL 53 CO 0.43 0.45 -0.17 -0.22 0.00 0.00 0.00 175.10 175.60 3gyr s LEU 54 N 0.01 2.42 -0.41 3.92 2.96 0.49 -4.92 118.68 123.15 3gyr s LEU 54 Ca 0.17 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.62 3gyr s LEU 54 Cb -0.13 -1.53 0.11 0.00 0.50 0.00 0.00 46.19 45.14 3gyr s LEU 54 CO 0.05 0.12 0.17 -0.13 -1.32 0.00 0.00 176.35 175.25 3gyr s ARG 55 N 0.58 1.86 0.07 1.98 0.52 -1.26 -0.65 118.95 122.05 3gyr s ARG 55 Ca -0.10 -1.98 0.24 0.00 -0.52 0.00 0.00 55.73 53.37 3gyr s ARG 55 Cb -0.16 -3.44 0.35 0.00 0.52 0.00 0.00 34.95 32.22 3gyr s ARG 55 CO 0.04 -1.04 1.31 -0.35 0.02 0.00 0.00 175.30 175.27 3gyr n PRO 56 N 4.23 0.20 -1.68 3.54 -0.04 -1.26 -4.92 135.00 135.07 3gyr n PRO 56 Ca 0.02 0.05 -0.39 0.00 -0.04 0.00 0.00 63.50 63.13 3gyr n PRO 56 Cb 0.40 -1.61 0.04 0.00 -0.04 0.00 0.00 33.50 32.29 3gyr n PRO 56 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gyr n ALA 57 N -1.73 0.96 -3.45 0.55 0.00 -1.26 -4.90 120.51 110.68 3gyr n ALA 57 Ca 0.04 0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.45 3gyr n ALA 57 Cb 0.41 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.55 3gyr n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3gyr s SER 58 N -0.91 -0.54 0.00 0.00 0.15 -1.26 -5.01 113.70 106.13 3gyr s SER 58 Ca 0.70 0.64 0.13 0.00 0.70 0.00 0.00 55.95 58.11 3gyr s SER 58 Cb -0.45 0.58 0.57 0.00 -1.71 0.00 0.00 66.02 65.01 3gyr s SER 58 CO 0.51 -0.52 1.42 0.47 1.20 0.00 0.00 173.24 176.33 3gyr n ASP 59 N 1.25 0.00 -3.97 5.45 8.00 -1.26 -4.25 116.55 121.77 3gyr n ASP 59 Ca -0.19 0.50 -0.31 0.00 0.71 0.00 0.00 54.79 55.50 3gyr n ASP 59 Cb 0.57 -0.50 -0.13 0.00 -0.02 0.00 0.00 41.12 41.04 3gyr n ASP 59 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3gyr s GLU 60 N -2.99 2.10 0.50 -1.24 2.12 -1.26 -4.97 118.70 112.95 3gyr s GLU 60 Ca 0.06 -2.63 0.15 0.00 0.36 0.00 0.00 54.97 52.91 3gyr s GLU 60 Cb 0.09 -3.40 1.18 0.00 0.26 0.00 0.00 34.13 32.26 3gyr s GLU 60 CO 0.24 -1.13 2.10 -0.24 -0.54 0.00 0.00 175.26 175.70 3gyr h VAL 61 N 5.42 1.04 0.00 3.70 3.04 -1.92 -1.12 116.25 126.42 3gyr h VAL 61 Ca -0.06 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 3gyr h VAL 61 Cb 0.90 1.08 0.00 0.00 -2.01 0.00 0.00 31.29 31.25 3gyr h VAL 61 CO 0.69 0.05 0.00 0.35 -1.01 0.00 0.00 177.57 177.66 3gyr n THR 62 N -4.48 0.11 -3.17 3.17 -2.24 -1.26 -4.43 114.28 101.97 3gyr n THR 62 Ca -0.03 0.03 -0.45 0.00 -2.27 0.00 0.00 64.05 61.33 3gyr n THR 62 Cb 0.13 -0.62 -0.05 0.00 -2.10 0.00 0.00 70.33 67.70 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 -2.29 3.03 0.70 -0.78 3.52 -0.42 -5.04 118.95 117.66 3gyr s ARG 63 Ca 0.31 -1.40 -0.13 0.00 -0.13 0.00 0.00 55.73 54.38 3gyr s ARG 63 Cb 0.17 -4.26 0.02 0.00 -1.56 0.00 0.00 34.95 29.32 3gyr s ARG 63 CO 0.34 -1.46 1.10 -1.21 -0.81 0.00 0.00 175.30 173.25 3gyr s GLU 64 N 2.39 2.65 -0.26 5.12 2.02 -1.26 -4.83 118.70 124.53 3gyr s GLU 64 Ca 0.09 1.27 -0.16 0.00 0.02 0.00 0.00 54.97 56.19 3gyr s GLU 64 Cb -0.25 -1.94 -0.03 0.00 0.10 0.00 0.00 34.13 32.00 3gyr s GLU 64 CO 0.06 -1.35 0.45 0.99 0.02 0.00 0.00 175.26 175.42 3gyr s THR 65 N -2.60 5.13 0.02 3.63 2.01 -0.05 -4.93 115.64 118.85 3gyr s THR 65 Ca 0.64 0.74 -0.29 0.00 0.31 0.00 0.00 61.69 63.09 3gyr s THR 65 Cb -0.19 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.52 3gyr s THR 65 CO 0.47 0.14 0.92 -0.70 -0.69 0.00 0.00 174.62 174.76 3gyr s GLU 66 N 2.08 4.57 -0.32 4.92 2.12 -1.26 -1.03 118.70 129.78 3gyr s GLU 66 Ca 0.19 1.32 0.02 0.00 0.36 0.00 0.00 54.97 56.86 3gyr s GLU 66 Cb -0.16 -3.43 0.08 0.00 0.26 0.00 0.00 34.13 30.89 3gyr s GLU 66 CO 0.09 0.06 0.02 0.42 -0.54 0.00 0.00 175.26 175.32 3gyr s ILE 67 N 0.62 2.50 -0.26 -3.70 1.01 -0.27 -4.93 121.20 116.17 3gyr s ILE 67 Ca 0.48 -1.98 -0.21 0.00 0.00 0.00 0.00 60.65 58.94 3gyr s ILE 67 Cb -0.21 -2.66 -0.02 0.00 0.01 0.00 0.00 42.46 39.58 3gyr s ILE 67 CO 0.27 -0.39 0.65 0.00 0.00 0.00 0.00 174.94 175.47 3gyr s ALA 68 N 1.04 3.60 0.07 9.38 0.00 -1.26 -1.24 121.76 133.35 3gyr s ALA 68 Ca 0.03 -0.43 -0.31 0.00 0.00 0.00 0.00 51.96 51.25 3gyr s ALA 68 Cb -0.20 -3.07 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 3gyr s ALA 68 CO -0.06 -0.86 1.36 -0.51 0.00 0.00 0.00 175.76 175.69 3gyr s LEU 69 N 2.56 4.35 -0.01 0.00 1.02 -0.24 0.10 118.68 126.47 3gyr s LEU 69 Ca 0.27 2.19 -0.03 0.00 0.02 0.00 0.00 54.13 56.58 3gyr s LEU 69 Cb -0.15 -3.58 -0.00 0.00 0.02 0.00 0.00 46.19 42.48 3gyr s LEU 69 CO 0.09 -0.64 0.07 -0.13 0.02 0.00 0.00 176.35 175.76 3gyr s ARG 70 N 1.53 0.28 0.62 1.70 0.52 -0.72 -1.37 118.95 121.50 3gyr s ARG 70 Ca 0.63 -0.24 -0.18 0.00 -0.52 0.00 0.00 55.73 55.42 3gyr s ARG 70 Cb -0.34 0.11 -0.03 0.00 0.52 0.00 0.00 34.95 35.21 3gyr s ARG 70 CO 0.29 -0.05 1.09 -2.30 0.02 0.00 0.00 175.30 174.35 3gyr n PRO 71 N 2.15 0.99 -3.56 3.54 -0.02 -1.26 -1.88 135.00 134.96 3gyr n PRO 71 Ca -0.19 0.38 -0.17 0.00 -2.02 0.00 0.00 63.50 61.51 3gyr n PRO 71 Cb 0.57 -2.31 -0.06 0.00 -0.02 0.00 0.00 33.50 31.67 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 -1.46 0.00 -0.22 3.45 -1.32 0.70 -4.85 115.64 111.95 3gyr s THR 72 Ca 0.78 -0.04 -0.07 0.00 -1.21 0.00 0.00 61.69 61.16 3gyr s THR 72 Cb -0.40 -0.96 -0.03 0.00 -1.51 0.00 0.00 72.50 69.59 3gyr s THR 72 CO 0.44 -0.02 0.07 0.26 -2.21 0.00 0.00 174.62 173.16 3gyr s TRP 73 N -0.95 3.14 -0.14 9.09 0.52 -1.26 -0.53 118.94 128.81 3gyr s TRP 73 Ca -0.09 -0.21 0.02 0.00 0.02 0.00 0.00 56.10 55.84 3gyr s TRP 73 Cb -0.01 -2.17 0.01 0.00 -1.15 0.00 0.00 33.47 30.15 3gyr s TRP 73 CO 0.08 -0.15 -0.20 0.08 0.02 0.00 0.00 176.95 176.78 3gyr s VAL 74 N 1.11 1.93 -0.89 4.03 1.01 -0.10 -4.86 120.40 122.62 3gyr s VAL 74 Ca 0.04 -0.89 -0.25 0.00 0.00 0.00 0.00 61.98 60.89 3gyr s VAL 74 Cb -0.14 -1.72 0.04 0.00 0.00 0.00 0.00 36.38 34.56 3gyr s VAL 74 CO 0.03 0.52 1.36 -0.60 0.00 0.00 0.00 175.10 176.41 3gyr s ARG 75 N 0.98 3.40 0.36 2.72 6.06 -1.26 -1.41 118.95 129.80 3gyr s ARG 75 Ca -0.04 -0.74 0.05 0.00 -2.50 0.00 0.00 55.73 52.50 3gyr s ARG 75 Cb -0.15 -4.80 0.67 0.00 0.06 0.00 0.00 34.95 30.74 3gyr s ARG 75 CO -0.04 -2.17 1.94 -0.07 -2.50 0.00 0.00 175.30 172.46 3gyr h LEU 76 N 12.82 0.52 -7.00 -0.88 3.38 -1.84 -3.45 115.31 118.86 3gyr h LEU 76 Ca -0.02 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3gyr h LEU 76 Cb 1.03 -0.13 -0.20 0.00 0.09 0.00 0.00 40.66 41.45 3gyr h LEU 76 CO 1.35 0.50 0.20 -2.28 0.09 0.00 0.00 178.44 178.30 3gyr s HIS 77 N -5.21 -0.68 0.55 1.13 5.04 -1.26 -0.93 115.29 113.93 3gyr s HIS 77 Ca -0.08 1.33 0.22 0.00 -1.54 0.00 0.00 55.06 54.99 3gyr s HIS 77 Cb 0.16 0.37 1.51 0.00 0.04 0.00 0.00 32.58 34.66 3gyr s HIS 77 CO 0.76 -0.52 2.19 -1.35 -2.34 0.00 0.00 174.74 173.47 3gyr h PRO 78 N 3.58 0.00 -0.12 2.88 0.11 -1.92 -0.95 132.00 135.59 3gyr h PRO 78 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3gyr h PRO 78 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3gyr h PRO 78 CO 0.28 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.11 3gyr n GLN 79 N -4.23 1.41 -4.19 1.05 6.02 -1.26 -4.87 117.38 111.32 3gyr n GLN 79 Ca -0.02 -0.63 -0.23 0.00 -0.01 0.00 0.00 57.00 56.11 3gyr n GLN 79 Cb 0.11 -1.30 -0.06 0.00 1.02 0.00 0.00 30.24 30.01 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 -1.42 3.30 0.78 1.08 1.43 -0.36 -5.06 118.68 118.42 3gyr s LEU 80 Ca 0.26 -0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 52.59 3gyr s LEU 80 Cb 0.13 -1.80 0.06 0.00 0.03 0.00 0.00 46.19 44.60 3gyr s LEU 80 CO 0.20 -0.13 1.13 -2.16 0.23 0.00 0.00 176.35 175.62 3gyr s PRO 81 N -3.77 2.26 0.61 1.29 0.04 -1.26 -4.81 135.00 129.36 3gyr s PRO 81 Ca 0.34 0.34 -0.18 0.00 0.04 0.00 0.00 61.00 61.54 3gyr s PRO 81 Cb -0.05 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 3gyr s PRO 81 CO 0.22 -1.44 1.21 -2.14 0.04 0.00 0.00 177.00 174.89 3gyr s PRO 82 N -5.41 2.86 -0.15 0.56 0.02 -1.26 -4.69 135.00 126.93 3gyr s PRO 82 Ca 0.60 1.83 -0.04 0.00 0.02 0.00 0.00 61.00 63.42 3gyr s PRO 82 Cb -0.12 -1.91 -0.03 0.00 0.02 0.00 0.00 34.50 32.46 3gyr s PRO 82 CO 0.51 -1.29 -0.04 0.99 -0.33 0.00 0.00 177.00 176.84 3gyr s THR 83 N -1.63 3.85 0.05 0.99 2.01 -0.50 -4.86 115.64 115.55 3gyr s THR 83 Ca 0.77 -0.37 -0.31 0.00 0.31 0.00 0.00 61.69 62.09 3gyr s THR 83 Cb -0.31 -2.68 -0.07 0.00 0.01 0.00 0.00 72.50 69.45 3gyr s THR 83 CO 0.35 0.49 1.46 -0.22 -0.69 0.00 0.00 174.62 176.01 3gyr s LEU 84 N 0.36 4.34 0.19 4.42 2.96 -1.26 -0.93 118.68 128.77 3gyr s LEU 84 Ca -0.04 2.27 -0.02 0.00 -0.22 0.00 0.00 54.13 56.11 3gyr s LEU 84 Cb -0.14 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 3gyr s LEU 84 CO 0.03 -0.74 0.15 -0.04 -1.32 0.00 0.00 176.35 174.43 3gyr s MET 85 N 2.05 1.19 -0.14 1.98 -1.94 0.31 -4.79 119.30 117.96 3gyr s MET 85 Ca 0.66 -1.56 -0.02 0.00 -1.71 0.00 0.00 55.69 53.06 3gyr s MET 85 Cb -0.35 0.28 -0.02 0.00 2.01 0.00 0.00 34.83 36.75 3gyr s MET 85 CO 0.29 -0.39 -0.06 -1.58 -0.01 0.00 0.00 175.02 173.26 3gyr s TRP 86 N -4.13 2.96 0.02 -0.03 0.51 0.61 -0.21 118.94 118.68 3gyr s TRP 86 Ca 0.35 -0.32 0.01 0.00 -2.12 0.00 0.00 56.10 54.01 3gyr s TRP 86 Cb 0.06 -1.89 -0.02 0.00 -0.81 0.00 0.00 33.47 30.81 3gyr s TRP 86 CO 0.10 -0.01 -0.04 0.20 -0.51 0.00 0.00 176.95 176.68 3gyr s GLY 87 N 0.16 0.31 0.08 0.98 0.00 -0.79 -3.28 107.32 104.78 3gyr s GLY 87 Ca -0.03 -0.59 -0.31 0.00 0.00 0.00 0.00 44.72 43.79 3gyr s GLY 87 CO 0.03 -0.64 1.42 -0.19 0.00 0.00 0.00 173.10 173.72 3gyr s TYR 88 N -1.27 3.05 -1.48 1.90 2.02 -1.17 -1.76 117.35 118.63 3gyr s TYR 88 Ca -0.12 0.85 -0.13 0.00 -0.37 0.00 0.00 57.07 57.30 3gyr s TYR 88 Cb -0.09 -3.70 0.09 0.00 -0.40 0.00 0.00 41.96 37.86 3gyr s TYR 88 CO -0.00 -2.55 0.74 -0.25 -1.57 0.00 0.00 175.55 171.92 3gyr n ASP 89 N 4.54 -4.22 -1.69 2.29 8.00 0.28 -1.23 116.55 124.53 3gyr n ASP 89 Ca 0.12 -0.65 -0.20 0.00 0.71 0.00 0.00 54.79 54.77 3gyr n ASP 89 Cb 0.43 -3.42 -0.08 0.00 -0.02 0.00 0.00 41.12 38.02 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 -1.43 1.63 3.37 0.44 0.00 -0.80 -4.98 105.19 103.42 3gyr n GLY 90 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.88 2.18 -0.17 1.61 -1.52 -0.37 -4.82 119.66 112.70 3gyr s GLN 91 Ca 0.00 -0.89 0.00 0.00 -1.95 0.00 0.00 55.36 52.52 3gyr s GLN 91 Cb 0.00 -2.13 0.03 0.00 -0.22 0.00 0.00 33.01 30.69 3gyr s GLN 91 CO 0.00 0.57 -0.12 0.08 -0.25 0.00 0.00 175.29 175.58 3gyr s VAL 92 N -0.68 1.53 1.04 1.09 1.01 -1.26 -2.45 120.40 120.68 3gyr s VAL 92 Ca 0.11 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.21 3gyr s VAL 92 Cb -0.10 -1.53 0.21 0.00 0.00 0.00 0.00 36.38 34.96 3gyr s VAL 92 CO 0.00 0.31 1.07 -2.84 0.00 0.00 0.00 175.10 173.64 3gyr s PRO 93 N 1.48 0.07 1.18 2.72 0.02 -1.26 -4.29 135.00 134.92 3gyr s PRO 93 Ca 0.02 0.91 -0.14 0.00 0.02 0.00 0.00 61.00 61.81 3gyr s PRO 93 Cb -0.14 -1.66 0.26 0.00 0.02 0.00 0.00 34.50 32.97 3gyr s PRO 93 CO -0.09 -3.07 0.82 0.41 -0.33 0.00 0.00 177.00 174.73 3gyr n GLY 94 N -0.01 -2.16 3.66 0.52 0.00 0.20 -4.80 105.19 102.60 3gyr n GLY 94 Ca 0.06 -1.12 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 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 -4.44 1.51 -2.37 1.61 -0.02 -1.26 -4.44 135.00 125.59 3gyr n PRO 95 Ca 0.02 0.55 -0.43 0.00 -2.02 0.00 0.00 63.50 61.62 3gyr n PRO 95 Cb 0.56 -2.24 -0.02 0.00 -0.02 0.00 0.00 33.50 31.77 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 -1.29 3.98 -0.01 3.45 2.01 -0.12 -4.22 115.64 119.43 3gyr s THR 96 Ca 0.65 1.04 -0.23 0.00 0.31 0.00 0.00 61.69 63.46 3gyr s THR 96 Cb -0.50 -4.19 -0.05 0.00 0.01 0.00 0.00 72.50 67.77 3gyr s THR 96 CO 0.55 -0.67 0.68 -0.63 -0.69 0.00 0.00 174.62 173.86 3gyr s ILE 97 N 5.08 4.90 -0.07 1.82 1.01 -0.43 -0.38 121.20 133.14 3gyr s ILE 97 Ca 0.60 1.43 0.03 0.00 0.00 0.00 0.00 60.65 62.70 3gyr s ILE 97 Cb -0.15 -4.03 0.01 0.00 0.01 0.00 0.00 42.46 38.31 3gyr s ILE 97 CO 0.30 0.34 -0.14 -0.70 0.00 0.00 0.00 174.94 174.74 3gyr s GLU 98 N 0.19 1.89 0.06 2.79 2.12 0.18 0.06 118.70 125.99 3gyr s GLU 98 Ca 0.35 -0.50 -0.05 0.00 0.36 0.00 0.00 54.97 55.14 3gyr s GLU 98 Cb -0.19 -1.54 -0.02 0.00 0.26 0.00 0.00 34.13 32.64 3gyr s GLU 98 CO 0.19 0.07 0.08 0.14 -0.54 0.00 0.00 175.26 175.21 3gyr s VAL 99 N 0.54 0.18 0.09 3.70 -7.23 -0.68 -4.31 120.40 112.69 3gyr s VAL 99 Ca -0.14 -1.44 -0.03 0.00 -1.81 0.00 0.00 61.98 58.55 3gyr s VAL 99 Cb -0.16 -1.36 -0.05 0.00 0.56 0.00 0.00 36.38 35.38 3gyr s VAL 99 CO 0.04 -0.80 0.30 -0.13 -0.31 0.00 0.00 175.10 174.21 3gyr s ARG 100 N -3.72 3.55 0.14 4.82 0.52 -1.26 -0.45 118.95 122.55 3gyr s ARG 100 Ca 0.04 -0.21 -0.33 0.00 -0.52 0.00 0.00 55.73 54.72 3gyr s ARG 100 Cb 0.05 -2.96 -0.17 0.00 0.52 0.00 0.00 34.95 32.40 3gyr s ARG 100 CO -0.10 0.55 0.92 -2.13 0.02 0.00 0.00 175.30 174.56 3gyr n ARG 101 N 0.34 0.50 0.00 3.54 0.63 0.13 -1.23 116.66 120.56 3gyr n ARG 101 Ca -0.05 0.18 0.00 0.00 -0.92 0.00 0.00 57.85 57.06 3gyr n ARG 101 Cb 0.52 -1.51 0.00 0.00 0.45 0.00 0.00 32.46 31.92 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 1.82 3.12 3.57 5.14 0.00 0.57 -4.98 105.19 114.44 3gyr n GLY 102 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.38 3.28 -0.02 1.61 -0.21 -0.36 -4.91 119.66 118.67 3gyr s GLN 103 Ca 0.00 0.44 -0.30 0.00 0.02 0.00 0.00 55.36 55.52 3gyr s GLN 103 Cb 0.00 -4.13 -0.06 0.00 1.00 0.00 0.00 33.01 29.82 3gyr s GLN 103 CO 0.00 -1.96 1.53 0.50 -2.12 0.00 0.00 175.29 173.24 3gyr s ARG 104 N 5.55 4.22 0.10 2.91 3.52 -1.26 -4.46 118.95 129.53 3gyr s ARG 104 Ca 0.52 2.08 0.06 0.00 -0.13 0.00 0.00 55.73 58.27 3gyr s ARG 104 Cb -0.11 -3.75 -0.03 0.00 -1.56 0.00 0.00 34.95 29.50 3gyr s ARG 104 CO 0.25 -0.72 -0.16 0.14 -0.81 0.00 0.00 175.30 174.00 3gyr s VAL 105 N 3.17 1.35 -0.16 7.11 -7.23 -0.66 -4.70 120.40 119.28 3gyr s VAL 105 Ca 0.68 -1.51 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 3gyr s VAL 105 Cb -0.33 -1.36 0.02 0.00 0.56 0.00 0.00 36.38 35.27 3gyr s VAL 105 CO 0.27 -0.25 -0.18 -0.13 -0.31 0.00 0.00 175.10 174.50 3gyr s ARG 106 N -2.12 2.68 -0.08 4.82 0.52 -1.26 -0.67 118.95 122.83 3gyr s ARG 106 Ca 0.04 -0.71 0.04 0.00 -0.52 0.00 0.00 55.73 54.58 3gyr s ARG 106 Cb -0.08 -2.32 -0.01 0.00 0.52 0.00 0.00 34.95 33.06 3gyr s ARG 106 CO 0.03 -0.17 -0.22 0.42 0.02 0.00 0.00 175.30 175.38 3gyr s ILE 107 N 1.25 2.27 -0.58 1.52 1.01 -0.71 -0.87 121.20 125.09 3gyr s ILE 107 Ca 0.02 -0.97 -0.15 0.00 0.00 0.00 0.00 60.65 59.55 3gyr s ILE 107 Cb -0.14 -1.86 0.14 0.00 0.01 0.00 0.00 42.46 40.61 3gyr s ILE 107 CO -0.09 0.56 0.53 0.00 0.00 0.00 0.00 174.94 175.94 3gyr s ALA 108 N 0.04 3.69 -0.47 9.38 0.00 -0.20 -1.40 121.76 132.81 3gyr s ALA 108 Ca -0.09 -2.66 -0.28 0.00 0.00 0.00 0.00 51.96 48.93 3gyr s ALA 108 Cb -0.15 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.69 3gyr s ALA 108 CO 0.06 -2.05 1.69 -1.58 0.00 0.00 0.00 175.76 173.88 3gyr s TRP 109 N 1.36 1.93 -0.17 0.00 0.52 -0.15 -1.12 118.94 121.32 3gyr s TRP 109 Ca 0.06 0.66 0.00 0.00 0.02 0.00 0.00 56.10 56.83 3gyr s TRP 109 Cb -0.27 -4.19 0.00 0.00 -1.15 0.00 0.00 33.47 27.87 3gyr s TRP 109 CO 0.01 -2.44 -0.15 0.99 0.02 0.00 0.00 176.95 175.38 3gyr s THR 110 N 7.21 2.58 -0.43 2.01 2.01 -0.38 0.32 115.64 128.96 3gyr s THR 110 Ca 0.68 -0.79 -0.27 0.00 0.31 0.00 0.00 61.69 61.62 3gyr s THR 110 Cb -0.16 -2.10 0.02 0.00 0.01 0.00 0.00 72.50 70.28 3gyr s THR 110 CO 0.28 0.51 1.03 0.21 -0.69 0.00 0.00 174.62 175.96 3gyr s ASN 111 N 0.99 6.65 -0.21 3.53 3.84 -0.20 -1.07 114.94 128.47 3gyr s ASN 111 Ca -0.02 0.49 0.12 0.00 0.21 0.00 0.00 52.86 53.66 3gyr s ASN 111 Cb -0.15 -2.50 0.43 0.00 -0.55 0.00 0.00 41.25 38.48 3gyr s ASN 111 CO -0.03 -1.06 1.21 0.54 -2.79 0.00 0.00 177.10 174.96 3gyr n ARG 112 N 7.29 1.91 -3.10 0.43 1.74 -0.47 -0.18 116.66 124.28 3gyr n ARG 112 Ca 0.09 -3.40 -0.42 0.00 -0.77 0.00 0.00 57.85 53.36 3gyr n ARG 112 Cb 0.48 -1.63 -0.07 0.00 -1.02 0.00 0.00 32.46 30.22 3gyr n ARG 112 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gyr s ILE 113 N -3.29 4.88 0.41 0.55 1.01 -1.18 -4.65 121.20 118.92 3gyr s ILE 113 Ca 0.40 0.57 -0.26 0.00 0.00 0.00 0.00 60.65 61.36 3gyr s ILE 113 Cb 0.38 -4.09 -0.09 0.00 0.01 0.00 0.00 42.46 38.66 3gyr s ILE 113 CO -0.05 -0.34 1.38 -2.84 0.00 0.00 0.00 174.94 173.08 3gyr s PRO 114 N 2.74 3.93 0.43 2.79 0.02 -1.26 -4.51 135.00 139.14 3gyr s PRO 114 Ca 0.25 2.33 -0.22 0.00 0.02 0.00 0.00 61.00 63.38 3gyr s PRO 114 Cb -0.14 -2.79 -0.12 0.00 0.02 0.00 0.00 34.50 31.47 3gyr s PRO 114 CO 0.15 -0.59 0.55 1.63 -0.33 0.00 0.00 177.00 178.41 3gyr n LYS 115 N 0.14 0.58 -0.25 5.54 4.76 -1.26 -1.73 118.16 125.94 3gyr n LYS 115 Ca 0.03 0.21 0.00 0.00 -2.87 0.00 0.00 58.31 55.69 3gyr n LYS 115 Cb 0.42 -1.53 0.00 0.00 -1.84 0.00 0.00 35.03 32.08 3gyr n LYS 115 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gyr n GLY 116 N 1.78 2.37 3.69 0.72 0.00 -1.26 -5.02 105.19 107.47 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 2.47 -4.77 1.61 7.64 -0.70 -4.94 113.62 114.93 3gyr n SER 117 Ca 0.00 1.11 -0.41 0.00 1.01 0.00 0.00 58.87 60.58 3gyr n SER 117 Cb 0.00 -1.49 -0.01 0.00 -1.01 0.00 0.00 64.21 61.71 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 -2.15 4.12 -0.01 1.43 2.12 -1.26 -4.96 118.70 118.00 3gyr s GLU 118 Ca 0.60 2.56 -0.30 0.00 0.36 0.00 0.00 54.97 58.19 3gyr s GLU 118 Cb -0.52 -2.99 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 3gyr s GLU 118 CO 0.58 -0.55 1.12 -0.47 -0.54 0.00 0.00 175.26 175.40 3gyr s TYR 119 N -0.76 3.44 -0.13 5.30 5.04 -1.26 -4.93 117.35 124.05 3gyr s TYR 119 Ca 0.56 1.42 0.29 0.00 -2.44 0.00 0.00 57.07 56.91 3gyr s TYR 119 Cb -0.47 -3.31 0.98 0.00 0.35 0.00 0.00 41.96 39.52 3gyr s TYR 119 CO 0.58 -0.81 1.84 -1.35 -1.34 0.00 0.00 175.55 174.47 3gyr h PRO 120 N 7.02 0.00 -5.28 4.97 0.11 -1.93 -3.43 132.00 133.46 3gyr h PRO 120 Ca -0.38 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.10 3gyr h PRO 120 Cb 1.19 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.12 3gyr h PRO 120 CO 0.82 0.00 -0.61 0.08 -0.21 0.00 0.00 178.00 178.08 3gyr s VAL 121 N -3.48 4.39 -0.09 3.15 1.01 -1.26 -4.10 120.40 120.02 3gyr s VAL 121 Ca 0.04 -0.18 -0.12 0.00 0.00 0.00 0.00 61.98 61.72 3gyr s VAL 121 Cb 0.08 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 3gyr s VAL 121 CO 0.58 0.47 0.28 -0.89 0.00 0.00 0.00 175.10 175.55 3gyr s THR 122 N 0.41 5.27 -0.09 3.92 2.01 0.00 -4.74 115.64 122.42 3gyr s THR 122 Ca 0.00 0.54 0.03 0.00 0.31 0.00 0.00 61.69 62.57 3gyr s THR 122 Cb -0.13 -3.59 0.01 0.00 0.01 0.00 0.00 72.50 68.80 3gyr s THR 122 CO 0.01 0.53 -0.18 -0.55 -0.69 0.00 0.00 174.62 173.75 3gyr s SER 123 N -0.56 2.47 0.03 3.53 0.15 -1.26 0.80 113.70 118.86 3gyr s SER 123 Ca 0.18 -0.44 0.02 0.00 0.70 0.00 0.00 55.95 56.42 3gyr s SER 123 Cb -0.14 -1.13 -0.02 0.00 -1.71 0.00 0.00 66.02 63.02 3gyr s SER 123 CO 0.07 0.08 -0.08 0.68 1.20 0.00 0.00 173.24 175.19 3gyr s VAL 124 N 0.64 0.57 -0.17 4.45 -7.23 -0.43 -0.80 120.40 117.43 3gyr s VAL 124 Ca -0.14 -0.90 -0.02 0.00 -1.81 0.00 0.00 61.98 59.11 3gyr s VAL 124 Cb -0.16 -0.59 -0.02 0.00 0.56 0.00 0.00 36.38 36.17 3gyr s VAL 124 CO 0.04 -0.25 -0.08 -1.61 -0.31 0.00 0.00 175.10 172.89 3gyr s GLU 125 N -1.26 3.44 0.13 4.82 2.02 -1.26 -1.65 118.70 124.95 3gyr s GLU 125 Ca -0.07 -0.63 0.08 0.00 0.02 0.00 0.00 54.97 54.38 3gyr s GLU 125 Cb -0.08 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 31.29 3gyr s GLU 125 CO 0.00 0.08 -0.13 0.14 0.02 0.00 0.00 175.26 175.38 3gyr s VAL 126 N 0.73 3.13 0.97 2.63 -7.23 0.69 -4.91 120.40 116.42 3gyr s VAL 126 Ca -0.04 -1.46 -0.11 0.00 -1.81 0.00 0.00 61.98 58.56 3gyr s VAL 126 Cb -0.15 -2.48 0.18 0.00 0.56 0.00 0.00 36.38 34.49 3gyr s VAL 126 CO 0.02 0.05 1.09 -2.84 -0.31 0.00 0.00 175.10 173.11 3gyr s PRO 127 N -2.35 0.61 0.16 4.82 0.02 -1.26 0.45 135.00 137.45 3gyr s PRO 127 Ca 0.21 1.04 -0.15 0.00 0.02 0.00 0.00 61.00 62.12 3gyr s PRO 127 Cb -0.10 -1.72 0.09 0.00 0.02 0.00 0.00 34.50 32.79 3gyr s PRO 127 CO 0.13 -2.75 1.76 -0.07 -0.33 0.00 0.00 177.00 175.73 3gyr h LEU 128 N -1.93 0.19 -0.31 -5.54 3.38 -1.94 -3.43 115.31 105.72 3gyr h LEU 128 Ca -0.51 0.04 0.34 0.00 0.09 0.00 0.00 57.88 57.84 3gyr h LEU 128 Cb 1.29 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.95 3gyr h LEU 128 CO 0.50 0.15 -0.63 0.61 0.09 0.00 0.00 178.44 179.15 3gyr n GLY 129 N -1.23 -1.97 3.75 0.83 0.00 -1.26 -4.58 105.19 100.73 3gyr n GLY 129 Ca 0.02 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.66 4.18 0.59 1.61 0.02 -1.26 -4.95 135.00 132.53 3gyr s PRO 130 Ca 0.00 2.47 -0.19 0.00 0.02 0.00 0.00 61.00 63.30 3gyr s PRO 130 Cb 0.00 -3.05 -0.03 0.00 0.02 0.00 0.00 34.50 31.43 3gyr s PRO 130 CO 0.00 -0.55 1.22 -1.25 -0.33 0.00 0.00 177.00 176.09 3gyr s PRO 131 N -0.52 2.96 -0.39 5.54 0.04 -1.26 -2.31 135.00 139.06 3gyr s PRO 131 Ca 0.61 1.86 0.00 0.00 0.04 0.00 0.00 61.00 63.51 3gyr s PRO 131 Cb -0.45 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.15 3gyr s PRO 131 CO 0.47 -1.23 0.00 0.41 0.04 0.00 0.00 177.00 176.69 3gyr n GLY 132 N 0.55 0.43 3.74 0.56 0.00 -1.26 -5.03 105.19 104.18 3gyr n GLY 132 Ca 0.14 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.49 3.51 0.37 2.61 -4.23 -0.98 -5.08 115.64 110.35 3gyr s THR 133 Ca 0.00 -1.66 -0.28 0.00 -1.18 0.00 0.00 61.69 58.57 3gyr s THR 133 Cb 0.00 -3.05 -0.10 0.00 1.34 0.00 0.00 72.50 70.68 3gyr s THR 133 CO 0.00 -0.27 1.41 -2.84 -0.54 0.00 0.00 174.62 172.37 3gyr s PRO 134 N -3.81 4.17 0.50 3.99 0.02 -1.26 -4.93 135.00 133.68 3gyr s PRO 134 Ca 0.35 2.41 -0.21 0.00 0.02 0.00 0.00 61.00 63.57 3gyr s PRO 134 Cb -0.05 -2.98 -0.08 0.00 0.02 0.00 0.00 34.50 31.40 3gyr s PRO 134 CO 0.23 -0.42 0.89 0.00 -0.33 0.00 0.00 177.00 177.37 3gyr n ALA 135 N 0.53 -0.12 0.33 -1.55 0.00 -1.26 -4.87 120.51 113.57 3gyr n ALA 135 Ca 0.01 0.11 0.19 0.00 0.00 0.00 0.00 53.44 53.75 3gyr n ALA 135 Cb 0.41 -2.03 1.02 0.00 0.00 0.00 0.00 19.45 18.84 3gyr n ALA 135 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3gyr h PRO 136 N 0.95 0.00 -0.00 0.00 0.11 -1.88 -0.83 132.00 130.34 3gyr h PRO 136 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3gyr h PRO 136 Cb 1.36 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.47 3gyr h PRO 136 CO 0.53 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.59 3gyr n ASN 137 N -3.04 0.14 -0.55 -2.05 6.94 -1.26 -1.70 115.26 113.74 3gyr n ASN 137 Ca -0.02 -1.15 0.12 0.00 -0.02 0.00 0.00 54.58 53.51 3gyr n ASN 137 Cb 0.23 -0.00 0.42 0.00 -2.36 0.00 0.00 39.78 38.06 3gyr n ASN 137 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 3gyr n THR 138 N -0.84 0.15 -4.44 5.53 -2.24 -0.32 -3.98 114.28 108.14 3gyr n THR 138 Ca 0.21 -0.33 -0.24 0.00 -2.27 0.00 0.00 64.05 61.42 3gyr n THR 138 Cb 0.12 0.43 -0.13 0.00 -2.10 0.00 0.00 70.33 68.65 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 -1.85 1.20 1.13 -0.78 2.02 -0.69 -4.75 118.70 114.98 3gyr s GLU 139 Ca 0.34 -1.01 -0.17 0.00 0.02 0.00 0.00 54.97 54.15 3gyr s GLU 139 Cb 0.19 -1.36 0.25 0.00 0.10 0.00 0.00 34.13 33.31 3gyr s GLU 139 CO 0.29 0.33 1.12 -1.25 0.02 0.00 0.00 175.26 175.77 3gyr s PRO 140 N -1.50 -0.62 0.00 0.39 0.04 -1.26 -4.92 135.00 127.13 3gyr s PRO 140 Ca 0.06 0.05 0.00 0.00 0.04 0.00 0.00 61.00 61.15 3gyr s PRO 140 Cb -0.09 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.79 3gyr s PRO 140 CO 0.03 -3.33 0.00 0.41 0.04 0.00 0.00 177.00 174.14 3gyr n GLY 141 N -1.25 -0.37 0.29 0.56 0.00 -0.32 -4.75 105.19 99.35 3gyr n GLY 141 Ca 0.11 -1.63 0.14 0.00 0.00 0.00 0.00 46.02 44.63 3gyr n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gyr n ARG 142 N -0.09 1.09 0.00 1.61 1.74 -1.26 -4.91 116.66 114.84 3gyr n ARG 142 Ca 0.00 -0.57 0.00 0.00 -0.77 0.00 0.00 57.85 56.51 3gyr n ARG 142 Cb 0.00 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 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 1.26 3.00 0.19 -0.13 0.00 -1.26 -2.00 105.19 106.24 3gyr n GLY 143 Ca 0.15 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 -4.05 -0.02 0.00 -2.01 -3.48 103.07 93.52 3gyr h GLY 144 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 3gyr h GLY 144 CO 0.00 0.00 0.36 0.14 0.00 0.00 0.00 176.54 177.04 3gyr s VAL 145 N -3.37 4.41 0.22 4.60 1.01 -0.85 -4.98 120.40 121.44 3gyr s VAL 145 Ca 0.05 2.06 -0.30 0.00 0.00 0.00 0.00 61.98 63.79 3gyr s VAL 145 Cb 0.09 -4.32 -0.09 0.00 0.00 0.00 0.00 36.38 32.07 3gyr s VAL 145 CO 0.53 0.35 1.17 -1.61 0.00 0.00 0.00 175.10 175.54 3gyr s GLU 146 N -0.21 4.53 0.36 2.72 0.41 -1.26 -4.83 118.70 120.42 3gyr s GLU 146 Ca 0.46 1.87 -0.26 0.00 -0.41 0.00 0.00 54.97 56.63 3gyr s GLU 146 Cb -0.24 -3.22 -0.13 0.00 -1.78 0.00 0.00 34.13 28.77 3gyr s GLU 146 CO 0.30 0.00 0.93 -2.30 -0.49 0.00 0.00 175.26 173.71 3gyr n PRO 147 N 1.98 1.21 -1.86 0.39 -0.02 -1.26 -4.83 135.00 130.61 3gyr n PRO 147 Ca 0.02 0.43 -0.43 0.00 -2.02 0.00 0.00 63.50 61.51 3gyr n PRO 147 Cb 0.45 -1.85 -0.03 0.00 -0.02 0.00 0.00 33.50 32.04 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 -0.69 6.25 0.51 2.55 3.84 0.02 -4.91 114.94 122.50 3gyr s ASN 148 Ca 0.61 2.07 0.30 0.00 0.21 0.00 0.00 52.86 56.05 3gyr s ASN 148 Cb -0.63 -2.53 1.14 0.00 -0.55 0.00 0.00 41.25 38.68 3gyr s ASN 148 CO 0.58 -1.30 1.90 0.11 -2.79 0.00 0.00 177.10 175.61 3gyr h LYS 149 N 11.43 0.00 -0.26 0.43 1.79 -1.90 -2.74 116.57 125.32 3gyr h LYS 149 Ca -0.41 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 57.91 3gyr h LYS 149 Cb 1.20 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.84 3gyr h LYS 149 CO 0.97 0.07 -0.45 -0.44 -1.08 0.00 0.00 179.45 178.51 3gyr h ASP 150 N 0.00 0.72 -0.12 0.86 3.45 -1.98 -2.35 116.42 117.01 3gyr h ASP 150 Ca -0.00 -0.35 -0.02 0.00 0.43 0.00 0.00 57.03 57.09 3gyr h ASP 150 Cb 0.62 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 39.19 3gyr h ASP 150 CO 0.01 1.07 -0.01 0.58 -1.57 0.00 0.00 179.24 179.31 3gyr h VAL 151 N 0.54 1.27 -0.07 -1.35 2.07 -1.92 -3.08 116.25 113.71 3gyr h VAL 151 Ca 0.03 -0.89 0.02 0.00 0.82 0.00 0.00 66.70 66.68 3gyr h VAL 151 Cb 1.00 1.63 -0.00 0.00 -1.52 0.00 0.00 31.29 32.39 3gyr h VAL 151 CO 0.09 0.26 0.16 0.00 0.02 0.00 0.00 177.57 178.10 3gyr h ALA 152 N 0.72 1.42 -0.00 1.67 0.00 -1.47 0.23 119.26 121.82 3gyr h ALA 152 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3gyr h ALA 152 Cb 0.40 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3gyr h ALA 152 CO 0.01 -0.20 -0.33 0.00 0.00 0.00 0.00 179.25 178.73 3gyr n ALA 153 N -2.14 3.22 -1.75 0.00 0.00 -0.89 -4.42 120.51 114.54 3gyr n ALA 153 Ca -0.01 -0.37 -0.42 0.00 0.00 0.00 0.00 53.44 52.64 3gyr n ALA 153 Cb 0.25 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 3gyr n ALA 153 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gyr s LEU 154 N -2.69 4.39 0.94 0.00 1.43 0.07 -5.01 118.68 117.81 3gyr s LEU 154 Ca 0.20 2.76 -0.13 0.00 -1.03 0.00 0.00 54.13 55.92 3gyr s LEU 154 Cb 0.19 -3.58 0.16 0.00 0.03 0.00 0.00 46.19 42.99 3gyr s LEU 154 CO 0.58 -0.98 1.16 -2.16 0.23 0.00 0.00 176.35 175.18 3gyr s PRO 155 N 2.21 0.88 -0.16 1.29 0.04 -1.26 -4.71 135.00 133.29 3gyr s PRO 155 Ca 0.78 0.17 -0.29 0.00 0.04 0.00 0.00 61.00 61.70 3gyr s PRO 155 Cb -0.46 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.23 3gyr s PRO 155 CO 0.35 -2.35 1.52 0.00 0.04 0.00 0.00 177.00 176.56 3gyr s ALA 156 N -3.33 3.48 -0.29 8.56 0.00 -1.26 -4.96 121.76 123.95 3gyr s ALA 156 Ca 0.66 0.58 0.01 0.00 0.00 0.00 0.00 51.96 53.21 3gyr s ALA 156 Cb -0.13 -3.76 0.15 0.00 0.00 0.00 0.00 23.12 19.39 3gyr s ALA 156 CO 0.53 -1.58 0.37 -0.46 0.00 0.00 0.00 175.76 174.63 3gyr s TRP 157 N 4.38 -0.84 0.00 0.00 -0.00 -1.26 -4.13 118.94 117.09 3gyr s TRP 157 Ca 0.67 0.16 0.02 0.00 -0.00 0.00 0.00 56.10 56.95 3gyr s TRP 157 Cb -0.26 -0.25 -0.01 0.00 -0.00 0.00 0.00 33.47 32.95 3gyr s TRP 157 CO 0.25 -0.97 -0.07 0.45 -0.00 0.00 0.00 176.95 176.61 3gyr s SER 158 N 2.48 0.85 0.05 5.86 0.15 -1.05 -4.76 113.70 117.27 3gyr s SER 158 Ca 0.10 -0.18 0.04 0.00 0.70 0.00 0.00 55.95 56.61 3gyr s SER 158 Cb -0.13 -0.08 -0.02 0.00 -1.71 0.00 0.00 66.02 64.08 3gyr s SER 158 CO -0.31 0.05 -0.12 0.54 1.20 0.00 0.00 173.24 174.60 3gyr s VAL 159 N -0.31 0.93 -0.17 4.45 0.11 -1.26 -0.99 120.40 123.16 3gyr s VAL 159 Ca 0.01 -1.06 -0.04 0.00 -2.93 0.00 0.00 61.98 57.96 3gyr s VAL 159 Cb -0.04 -0.89 -0.03 0.00 -1.53 0.00 0.00 36.38 33.89 3gyr s VAL 159 CO -0.00 -0.15 -0.02 -0.89 -3.33 0.00 0.00 175.10 170.71 3gyr s THR 160 N -1.06 3.99 -0.17 5.04 2.01 -1.26 -0.88 115.64 123.30 3gyr s THR 160 Ca -0.02 -0.32 -0.03 0.00 0.31 0.00 0.00 61.69 61.63 3gyr s THR 160 Cb -0.09 -2.76 -0.02 0.00 0.01 0.00 0.00 72.50 69.64 3gyr s THR 160 CO 0.01 0.48 -0.05 -2.28 -0.69 0.00 0.00 174.62 172.08 3gyr s HIS 161 N 0.50 2.96 -0.74 4.92 5.04 -0.12 -4.00 115.29 123.85 3gyr s HIS 161 Ca -0.02 -0.56 -0.20 0.00 -1.54 0.00 0.00 55.06 52.73 3gyr s HIS 161 Cb -0.14 -1.99 0.10 0.00 0.04 0.00 0.00 32.58 30.59 3gyr s HIS 161 CO 0.02 -0.24 0.96 -1.17 -2.34 0.00 0.00 174.74 171.98 3gyr s LEU 162 N 0.74 4.89 -0.03 8.88 2.96 -1.26 -2.12 118.68 132.74 3gyr s LEU 162 Ca -0.02 -1.49 -0.30 0.00 -0.22 0.00 0.00 54.13 52.10 3gyr s LEU 162 Cb -0.15 -2.38 -0.05 0.00 0.50 0.00 0.00 46.19 44.11 3gyr s LEU 162 CO 0.02 -1.22 1.37 -2.28 -1.32 0.00 0.00 176.35 172.92 3gyr s HIS 163 N 3.20 2.85 0.00 5.38 5.65 0.40 -1.72 115.29 131.04 3gyr s HIS 163 Ca 0.23 0.86 0.00 0.00 0.25 0.00 0.00 55.06 56.40 3gyr s HIS 163 Cb -0.14 -3.63 0.00 0.00 -1.18 0.00 0.00 32.58 27.63 3gyr s HIS 163 CO 0.02 -2.30 0.00 0.41 -0.65 0.00 0.00 174.74 172.22 3gyr n GLY 164 N 3.63 3.28 3.73 1.59 0.00 -1.26 -2.79 105.19 113.37 3gyr n GLY 164 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3gyr n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 165 N -2.97 3.89 -0.57 4.61 0.00 -0.70 -4.82 121.76 121.20 3gyr s ALA 165 Ca 0.00 1.56 -0.28 0.00 0.00 0.00 0.00 51.96 53.24 3gyr s ALA 165 Cb 0.00 -3.68 0.03 0.00 0.00 0.00 0.00 23.12 19.47 3gyr s ALA 165 CO 0.00 -0.92 1.22 -1.14 0.00 0.00 0.00 175.76 174.92 3gyr s GLN 166 N 0.84 3.51 0.11 0.00 0.74 -1.26 -4.26 119.66 119.34 3gyr s GLN 166 Ca 0.72 0.31 -0.26 0.00 0.05 0.00 0.00 55.36 56.19 3gyr s GLN 166 Cb -0.49 -4.02 0.07 0.00 1.10 0.00 0.00 33.01 29.68 3gyr s GLN 166 CO 0.35 -1.68 0.83 -0.08 -0.55 0.00 0.00 175.29 174.16 3gyr s THR 167 N 5.03 0.00 0.89 -0.34 -1.32 -1.26 -4.48 115.64 114.16 3gyr s THR 167 Ca 0.45 -0.32 -0.11 0.00 -1.21 0.00 0.00 61.69 60.50 3gyr s THR 167 Cb -0.08 -1.42 0.13 0.00 -1.51 0.00 0.00 72.50 69.62 3gyr s THR 167 CO 0.26 0.00 1.11 -0.83 -2.21 0.00 0.00 174.62 172.95 3gyr s GLY 168 N -2.73 1.66 0.54 6.08 0.00 -1.26 -4.75 107.32 106.87 3gyr s GLY 168 Ca 0.07 0.34 0.22 0.00 0.00 0.00 0.00 44.72 45.35 3gyr s GLY 168 CO -0.04 0.77 2.17 -1.33 0.00 0.00 0.00 173.10 174.67 3gyr h GLY 169 N -1.67 0.00 2.00 0.20 0.00 -1.50 -0.43 103.07 101.68 3gyr h GLY 169 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3gyr h GLY 169 CO 0.47 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.68 3gyr h GLY 170 N 0.13 0.00 0.00 4.60 0.00 -1.88 -2.82 103.07 103.10 3gyr h GLY 170 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3gyr h GLY 170 CO 0.00 0.00 -0.80 0.70 0.00 0.00 0.00 176.54 176.45 3gyr n ASN 171 N -2.86 0.84 0.21 0.19 3.02 -0.25 -4.65 115.26 111.75 3gyr n ASN 171 Ca 0.01 -0.67 0.14 0.00 -0.03 0.00 0.00 54.58 54.03 3gyr n ASN 171 Cb 0.31 1.11 0.48 0.00 -0.61 0.00 0.00 39.78 41.07 3gyr n ASN 171 CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 3gyr h ASP 172 N 0.00 0.00 -2.18 6.41 -0.00 -1.05 -3.45 116.42 116.16 3gyr h ASP 172 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3gyr h ASP 172 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.70 3gyr h ASP 172 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.85 3gyr n GLY 173 N 0.46 0.66 3.62 -0.78 0.00 -1.26 -4.21 105.19 103.69 3gyr n GLY 173 Ca 0.02 -0.39 -0.57 0.00 0.00 0.00 0.00 46.02 45.09 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 -1.09 1.48 -0.33 1.61 -0.00 -1.26 -4.66 117.44 113.19 3gyr n TRP 174 Ca 0.00 0.78 0.08 0.00 -0.00 0.00 0.00 57.50 58.36 3gyr n TRP 174 Cb 0.44 -2.29 0.28 0.00 -0.00 0.00 0.00 31.31 29.74 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 4.91 1.61 0.00 5.87 0.00 -1.95 -0.80 119.26 128.90 3gyr h ALA 175 Ca -0.48 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 3gyr h ALA 175 Cb 1.36 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 3gyr h ALA 175 CO 0.82 0.15 -0.07 -0.44 0.00 0.00 0.00 179.25 179.71 3gyr h ASP 176 N 0.91 0.00 -0.68 0.00 3.45 -1.90 -1.12 116.42 117.08 3gyr h ASP 176 Ca 0.48 0.00 -0.35 0.00 0.43 0.00 0.00 57.03 57.59 3gyr h ASP 176 Cb 0.54 0.00 -0.21 0.00 -0.56 0.00 0.00 39.33 39.10 3gyr h ASP 176 CO -0.25 0.07 0.45 0.59 -1.57 0.00 0.00 179.24 178.53 3gyr n ASN 177 N -3.54 3.51 -4.76 6.45 5.03 -0.30 -4.94 115.26 116.72 3gyr n ASN 177 Ca -0.02 -3.10 -0.33 0.00 0.87 0.00 0.00 54.58 52.00 3gyr n ASN 177 Cb 0.19 -0.73 0.06 0.00 -1.02 0.00 0.00 39.78 38.28 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 -2.25 2.38 0.10 5.41 0.00 -1.25 -4.78 121.76 121.37 3gyr s ALA 178 Ca 0.39 0.62 0.10 0.00 0.00 0.00 0.00 51.96 53.06 3gyr s ALA 178 Cb 0.33 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.06 3gyr s ALA 178 CO 0.07 -1.43 -0.24 0.14 0.00 0.00 0.00 175.76 174.30 3gyr s VAL 179 N -2.27 2.02 0.81 0.00 -7.23 -0.16 -4.78 120.40 108.79 3gyr s VAL 179 Ca 0.68 -1.59 -0.08 0.00 -1.81 0.00 0.00 61.98 59.18 3gyr s VAL 179 Cb -0.22 -1.79 0.14 0.00 0.56 0.00 0.00 36.38 35.06 3gyr s VAL 179 CO 0.43 0.09 1.12 -0.83 -0.31 0.00 0.00 175.10 175.60 3gyr s GLY 180 N -1.82 1.75 0.03 2.32 0.00 -1.26 -2.53 107.32 105.81 3gyr s GLY 180 Ca 0.11 -1.30 -0.37 0.00 0.00 0.00 0.00 44.72 43.16 3gyr s GLY 180 CO 0.05 -0.70 1.40 0.33 0.00 0.00 0.00 173.10 174.18 3gyr n PHE 181 N -3.21 1.59 0.00 1.90 7.35 -1.26 -2.22 117.46 121.61 3gyr n PHE 181 Ca 0.13 0.62 0.00 0.00 -0.76 0.00 0.00 57.45 57.44 3gyr n PHE 181 Cb 0.60 -2.35 0.00 0.00 0.35 0.00 0.00 39.48 38.08 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 2.77 3.37 3.93 7.13 0.00 0.74 -5.02 105.19 118.10 3gyr n GLY 182 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.07 6.15 0.17 1.61 1.01 -0.94 -4.86 116.67 118.74 3gyr s ASP 183 Ca 0.00 0.04 0.11 0.00 0.71 0.00 0.00 52.55 53.41 3gyr s ASP 183 Cb 0.00 -1.78 -0.04 0.00 1.01 0.00 0.00 42.92 42.11 3gyr s ASP 183 CO 0.00 -0.02 -0.25 0.00 0.21 0.00 0.00 175.17 175.11 3gyr s ALA 184 N -1.92 2.44 -0.16 5.23 0.00 -1.26 -1.03 121.76 125.06 3gyr s ALA 184 Ca 0.34 -1.56 -0.08 0.00 0.00 0.00 0.00 51.96 50.65 3gyr s ALA 184 Cb -0.09 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 3gyr s ALA 184 CO 0.28 0.46 0.11 -1.14 0.00 0.00 0.00 175.76 175.46 3gyr s GLN 185 N -2.44 3.81 -0.17 0.00 0.74 0.15 -4.98 119.66 116.78 3gyr s GLN 185 Ca 0.18 -0.23 -0.03 0.00 0.05 0.00 0.00 55.36 55.33 3gyr s GLN 185 Cb -0.09 -3.25 -0.02 0.00 1.10 0.00 0.00 33.01 30.75 3gyr s GLN 185 CO 0.08 0.48 -0.06 -0.51 -0.55 0.00 0.00 175.29 174.73 3gyr s LEU 186 N -0.18 3.03 -0.05 3.68 1.43 -1.26 -0.97 118.68 124.36 3gyr s LEU 186 Ca 0.10 -0.25 0.05 0.00 -1.03 0.00 0.00 54.13 52.99 3gyr s LEU 186 Cb -0.12 -1.73 -0.00 0.00 0.03 0.00 0.00 46.19 44.37 3gyr s LEU 186 CO 0.01 0.12 -0.19 -0.44 0.23 0.00 0.00 176.35 176.07 3gyr s SER 187 N 0.67 2.43 -0.19 2.29 0.01 -0.49 -4.72 113.70 113.69 3gyr s SER 187 Ca -0.03 -0.41 -0.10 0.00 1.31 0.00 0.00 55.95 56.73 3gyr s SER 187 Cb -0.15 -0.75 -0.05 0.00 0.21 0.00 0.00 66.02 65.28 3gyr s SER 187 CO 0.02 0.16 0.13 -0.70 0.41 0.00 0.00 173.24 173.26 3gyr s GLU 188 N 0.07 4.12 -0.31 12.44 2.12 -1.26 -1.74 118.70 134.15 3gyr s GLU 188 Ca -0.06 -0.22 -0.00 0.00 0.36 0.00 0.00 54.97 55.04 3gyr s GLU 188 Cb -0.13 -3.39 0.06 0.00 0.26 0.00 0.00 34.13 30.93 3gyr s GLU 188 CO 0.03 0.33 0.01 0.71 -0.54 0.00 0.00 175.26 175.80 3gyr s TYR 189 N 0.26 3.35 -0.50 5.30 2.02 0.15 -4.74 117.35 123.19 3gyr s TYR 189 Ca 0.08 -2.12 0.23 0.00 -0.37 0.00 0.00 57.07 54.89 3gyr s TYR 189 Cb -0.11 -2.27 0.97 0.00 -0.40 0.00 0.00 41.96 40.14 3gyr s TYR 189 CO -0.01 -0.85 1.70 -2.30 -1.57 0.00 0.00 175.55 172.51 3gyr n PRO 190 N 4.55 0.19 -3.77 -1.71 -0.02 -1.26 -1.65 135.00 131.32 3gyr n PRO 190 Ca -0.11 0.42 -0.28 0.00 -2.02 0.00 0.00 63.50 61.51 3gyr n PRO 190 Cb 0.43 -1.86 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 3gyr n PRO 190 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3gyr n ASN 191 N -2.20 -2.57 -4.09 2.55 5.03 -1.26 -4.09 115.26 108.62 3gyr n ASN 191 Ca 0.02 -0.64 -0.43 0.00 0.87 0.00 0.00 54.58 54.40 3gyr n ASN 191 Cb 0.22 -2.18 0.00 0.00 -1.02 0.00 0.00 39.78 36.80 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 -2.28 4.75 -3.63 6.41 4.64 -1.26 -0.32 116.55 124.86 3gyr n ASP 192 Ca 0.05 -2.97 -0.16 0.00 -1.38 0.00 0.00 54.79 50.33 3gyr n ASP 192 Cb 0.49 -1.60 -0.07 0.00 -1.04 0.00 0.00 41.12 38.90 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 2.14 -0.43 0.85 -0.67 2.46 -1.26 -4.97 115.29 113.41 3gyr s HIS 193 Ca 0.45 0.70 -0.11 0.00 0.47 0.00 0.00 55.06 56.56 3gyr s HIS 193 Cb 0.07 0.27 0.11 0.00 -0.13 0.00 0.00 32.58 32.90 3gyr s HIS 193 CO -0.01 -0.52 1.16 1.14 -2.47 0.00 0.00 174.74 174.05 3gyr s GLN 194 N -1.36 1.41 0.16 2.88 -2.07 -1.26 -4.60 119.66 114.82 3gyr s GLN 194 Ca -0.12 1.58 -0.34 0.00 -1.82 0.00 0.00 55.36 54.66 3gyr s GLN 194 Cb -0.02 -1.77 -0.14 0.00 -1.09 0.00 0.00 33.01 29.98 3gyr s GLN 194 CO 0.07 -2.35 1.48 0.00 -1.32 0.00 0.00 175.29 173.17 3gyr n ALA 195 N -3.78 0.74 -3.86 2.60 0.00 -1.26 -4.88 120.51 110.06 3gyr n ALA 195 Ca 0.12 0.46 -0.02 0.00 0.00 0.00 0.00 53.44 54.00 3gyr n ALA 195 Cb 0.52 -2.27 0.01 0.00 0.00 0.00 0.00 19.45 17.71 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 0.63 0.00 -0.32 0.00 -1.32 -0.96 -4.09 115.64 109.59 3gyr s THR 196 Ca 0.78 -0.49 -0.09 0.00 -1.21 0.00 0.00 61.69 60.69 3gyr s THR 196 Cb -0.74 -2.72 0.01 0.00 -1.51 0.00 0.00 72.50 67.54 3gyr s THR 196 CO 0.42 0.00 0.14 -1.58 -2.21 0.00 0.00 174.62 171.39 3gyr s GLN 197 N -2.30 3.12 0.55 7.08 0.74 -1.26 -1.21 119.66 126.38 3gyr s GLN 197 Ca 0.21 -0.86 0.06 0.00 0.05 0.00 0.00 55.36 54.83 3gyr s GLN 197 Cb -0.01 -3.53 0.06 0.00 1.10 0.00 0.00 33.01 30.63 3gyr s GLN 197 CO 0.03 -0.49 0.76 -1.58 -0.55 0.00 0.00 175.29 173.45 3gyr s TRP 198 N 1.55 2.08 0.03 1.67 0.51 0.61 -4.87 118.94 120.52 3gyr s TRP 198 Ca 0.03 -0.45 -0.13 0.00 -2.12 0.00 0.00 56.10 53.43 3gyr s TRP 198 Cb -0.18 -2.47 0.02 0.00 -0.81 0.00 0.00 33.47 30.03 3gyr s TRP 198 CO 0.05 -0.98 0.29 1.67 -0.51 0.00 0.00 176.95 177.46 3gyr s TRP 199 N -2.66 -0.10 0.06 -1.98 1.48 -1.12 -1.35 118.94 113.28 3gyr s TRP 199 Ca 0.60 -0.01 0.08 0.00 -1.06 0.00 0.00 56.10 55.71 3gyr s TRP 199 Cb -0.08 0.08 -0.03 0.00 -1.16 0.00 0.00 33.47 32.28 3gyr s TRP 199 CO 0.38 -0.47 -0.21 1.52 -4.06 0.00 0.00 176.95 174.12 3gyr s TYR 200 N -2.27 1.79 0.15 1.66 -0.85 -0.27 0.15 117.35 117.70 3gyr s TYR 200 Ca -0.07 -0.39 -0.24 0.00 -0.52 0.00 0.00 57.07 55.85 3gyr s TYR 200 Cb -0.02 -1.03 0.06 0.00 0.38 0.00 0.00 41.96 41.35 3gyr s TYR 200 CO -0.02 0.13 0.77 -3.38 -1.52 0.00 0.00 175.55 171.53 3gyr s HIS 201 N -0.93 -0.32 0.71 -3.49 -3.43 -0.90 -1.45 115.29 105.48 3gyr s HIS 201 Ca 0.07 0.05 -0.16 0.00 -0.80 0.00 0.00 55.06 54.21 3gyr s HIS 201 Cb -0.09 0.61 0.01 0.00 -1.43 0.00 0.00 32.58 31.68 3gyr s HIS 201 CO 0.03 -0.88 1.10 -3.47 -2.00 0.00 0.00 174.74 169.52 3gyr n ASP 202 N -0.39 1.04 -0.43 7.38 -0.08 -1.02 -0.94 116.55 122.11 3gyr n ASP 202 Ca -0.10 0.70 0.00 0.00 -1.51 0.00 0.00 54.79 53.89 3gyr n ASP 202 Cb 0.62 -1.47 0.00 0.00 2.34 0.00 0.00 41.12 42.61 3gyr n ASP 202 CO 0.00 0.00 0.00 1.57 0.12 0.00 0.00 177.20 178.89 3gyr n HIS 203 N -2.45 0.00 -1.66 -0.67 -0.00 -0.06 -4.77 115.22 105.61 3gyr n HIS 203 Ca 0.14 0.00 -0.45 0.00 0.46 0.00 0.00 57.72 57.87 3gyr n HIS 203 Cb 0.49 0.06 -0.02 0.00 -0.12 0.00 0.00 29.99 30.40 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 0.00 0.76 -1.98 1.57 0.00 -1.26 -4.29 120.51 115.31 3gyr n ALA 204 Ca 0.00 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 3gyr n ALA 204 Cb 0.61 -2.21 -0.03 0.00 0.00 0.00 0.00 19.45 17.83 3gyr n ALA 204 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3gyr s MET 205 N -0.94 4.23 0.00 0.00 1.75 -0.42 -2.43 119.30 121.48 3gyr s MET 205 Ca 0.64 2.29 0.00 0.00 -1.25 0.00 0.00 55.69 57.37 3gyr s MET 205 Cb -0.66 -3.32 0.00 0.00 2.84 0.00 0.00 34.83 33.69 3gyr s MET 205 CO 0.55 -0.62 0.00 0.09 -0.65 0.00 0.00 175.02 174.39 3gyr n ASN 206 N 4.51 0.00 -0.17 1.11 3.02 -1.26 -4.74 115.26 117.73 3gyr n ASN 206 Ca 0.14 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.74 3gyr n ASN 206 Cb 0.40 -0.27 0.06 0.00 -0.61 0.00 0.00 39.78 39.36 3gyr n ASN 206 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3gyr n ILE 207 N -1.83 1.04 -0.23 2.41 -5.35 -1.10 -4.80 119.36 109.49 3gyr n ILE 207 Ca 0.00 -1.21 -0.08 0.00 -0.27 0.00 0.00 62.75 61.18 3gyr n ILE 207 Cb 0.00 0.21 0.03 0.00 -1.74 0.00 0.00 39.64 38.14 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 2.19 1.26 -0.34 7.28 2.02 -1.77 -1.88 112.91 121.68 3gyr h THR 208 Ca 0.00 -1.07 0.10 0.00 0.77 0.00 0.00 66.41 66.21 3gyr h THR 208 Cb 1.02 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 3gyr h THR 208 CO 0.00 0.40 0.39 0.08 0.37 0.00 0.00 175.52 176.75 3gyr h ARG 209 N 1.00 0.00 0.02 6.66 0.11 -1.87 -1.73 114.38 118.57 3gyr h ARG 209 Ca 0.19 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 59.91 3gyr h ARG 209 Cb 0.47 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.50 3gyr h ARG 209 CO 0.02 0.00 -2.04 0.91 0.10 0.00 0.00 179.97 178.96 3gyr n TRP 210 N -3.69 0.54 -0.28 4.08 8.01 -0.89 -3.89 117.44 121.32 3gyr n TRP 210 Ca 0.06 0.19 0.03 0.00 -1.31 0.00 0.00 57.50 56.46 3gyr n TRP 210 Cb 0.54 -1.06 0.24 0.00 -2.01 0.00 0.00 31.31 29.02 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 -0.65 0.90 -0.07 -0.99 2.35 -1.18 0.40 115.58 116.34 3gyr h ASN 211 Ca -0.52 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.18 3gyr h ASN 211 Cb 1.64 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.81 3gyr h ASN 211 CO -0.21 0.61 -0.12 0.58 -1.65 0.00 0.00 177.43 176.63 3gyr h VAL 212 N 1.04 1.41 -0.57 2.81 2.07 -1.55 -2.97 116.25 118.49 3gyr h VAL 212 Ca 0.36 -1.40 0.14 0.00 0.82 0.00 0.00 66.70 66.61 3gyr h VAL 212 Cb 0.09 2.17 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 3gyr h VAL 212 CO -0.12 0.39 0.40 -0.03 0.02 0.00 0.00 177.57 178.23 3gyr h MET 213 N -0.28 0.17 0.00 1.57 1.85 -1.56 -0.59 114.93 116.09 3gyr h MET 213 Ca 0.00 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.08 3gyr h MET 213 Cb 0.69 -0.04 0.00 0.00 0.43 0.00 0.00 31.60 32.68 3gyr h MET 213 CO 0.03 0.11 0.00 0.00 -0.40 0.00 0.00 176.91 176.65 3gyr h ALA 214 N 1.72 1.00 0.00 0.39 0.00 -0.06 -3.46 119.26 118.85 3gyr h ALA 214 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3gyr h ALA 214 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3gyr h ALA 214 CO -0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.62 3gyr n GLY 215 N -0.97 0.82 3.11 0.00 0.00 -0.24 -0.28 105.19 107.62 3gyr n GLY 215 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 3gyr n GLY 215 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gyr n LEU 216 N 0.00 6.04 -3.61 0.99 4.77 -1.11 -4.55 117.00 119.53 3gyr n LEU 216 Ca 0.00 -4.35 -0.16 0.00 -0.03 0.00 0.00 56.01 51.47 3gyr n LEU 216 Cb 0.00 -1.60 -0.07 0.00 -2.33 0.00 0.00 43.42 39.42 3gyr n LEU 216 CO 0.00 0.93 0.30 -0.72 -1.33 0.00 0.00 177.39 176.57 3gyr s TYR 217 N 2.03 -0.51 0.25 -1.77 -0.85 -1.26 -2.43 117.35 112.81 3gyr s TYR 217 Ca 0.45 0.89 -0.20 0.00 -0.52 0.00 0.00 57.07 57.69 3gyr s TYR 217 Cb 0.07 0.30 0.07 0.00 0.38 0.00 0.00 41.96 42.77 3gyr s TYR 217 CO -0.00 -0.52 0.94 0.20 -1.52 0.00 0.00 175.55 174.64 3gyr s GLY 218 N -1.12 0.16 0.39 5.49 0.00 -0.53 0.63 107.32 112.33 3gyr s GLY 218 Ca -0.11 -0.43 0.08 0.00 0.00 0.00 0.00 44.72 44.26 3gyr s GLY 218 CO 0.08 1.21 0.02 -1.08 0.00 0.00 0.00 173.10 173.32 3gyr s THR 219 N -2.38 2.21 -0.16 0.90 -1.32 -1.26 -1.12 115.64 112.52 3gyr s THR 219 Ca 0.18 -1.98 -0.05 0.00 -1.21 0.00 0.00 61.69 58.63 3gyr s THR 219 Cb -0.03 -2.89 0.08 0.00 -1.51 0.00 0.00 72.50 68.14 3gyr s THR 219 CO 0.07 -0.07 0.32 -0.47 -2.21 0.00 0.00 174.62 172.26 3gyr s TYR 220 N -2.64 -0.56 -0.11 9.09 6.14 -0.45 -1.31 117.35 127.50 3gyr s TYR 220 Ca 0.36 1.12 0.02 0.00 0.64 0.00 0.00 57.07 59.20 3gyr s TYR 220 Cb 0.06 0.07 -0.01 0.00 0.42 0.00 0.00 41.96 42.49 3gyr s TYR 220 CO 0.19 -0.43 -0.16 -0.51 0.64 0.00 0.00 175.55 175.28 3gyr s LEU 221 N 2.49 2.54 -0.16 6.97 1.43 0.11 -0.29 118.68 131.77 3gyr s LEU 221 Ca 0.01 -0.38 -0.05 0.00 -1.03 0.00 0.00 54.13 52.69 3gyr s LEU 221 Cb -0.12 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 3gyr s LEU 221 CO -0.10 0.19 0.00 -0.69 0.23 0.00 0.00 176.35 175.98 3gyr s VAL 222 N 0.21 4.28 0.14 -1.59 1.01 -0.35 -1.69 120.40 122.42 3gyr s VAL 222 Ca -0.10 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 61.71 3gyr s VAL 222 Cb -0.16 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 3gyr s VAL 222 CO 0.06 0.50 0.07 -0.13 0.00 0.00 0.00 175.10 175.60 3gyr s ARG 223 N 0.20 2.73 0.32 2.72 1.81 0.40 -2.26 118.95 124.87 3gyr s ARG 223 Ca 0.01 -0.88 -0.07 0.00 -1.72 0.00 0.00 55.73 53.07 3gyr s ARG 223 Cb -0.13 -2.58 0.03 0.00 -0.45 0.00 0.00 34.95 31.82 3gyr s ARG 223 CO 0.02 0.50 0.55 -0.40 -0.68 0.00 0.00 175.30 175.29 3gyr n ASP 224 N 0.01 -1.57 0.08 0.23 5.68 -1.26 0.18 116.55 119.90 3gyr n ASP 224 Ca -0.09 -2.52 -0.12 0.00 -0.50 0.00 0.00 54.79 51.57 3gyr n ASP 224 Cb 0.54 2.74 -0.05 0.00 -1.14 0.00 0.00 41.12 43.20 3gyr n ASP 224 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3gyr h ASP 225 N 1.71 0.36 -0.01 -1.12 3.45 -1.98 -1.64 116.42 117.19 3gyr h ASP 225 Ca -0.26 -0.32 -0.00 0.00 0.43 0.00 0.00 57.03 56.88 3gyr h ASP 225 Cb 1.05 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 39.71 3gyr h ASP 225 CO 0.34 1.15 0.00 -0.08 -1.57 0.00 0.00 179.24 179.08 3gyr h GLU 226 N 0.13 0.01 -0.13 3.56 4.81 -1.99 -1.51 114.58 119.46 3gyr h GLU 226 Ca -0.07 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3gyr h GLU 226 Cb 1.64 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.01 3gyr h GLU 226 CO 0.16 0.20 0.08 1.49 -0.73 0.00 0.00 179.01 180.21 3gyr h GLU 227 N -0.18 0.18 -0.89 1.92 4.81 -1.97 -2.02 114.58 116.43 3gyr h GLU 227 Ca 0.00 -0.01 0.20 0.00 -0.13 0.00 0.00 59.36 59.42 3gyr h GLU 227 Cb 0.20 -0.04 -0.12 0.00 0.63 0.00 0.00 28.75 29.42 3gyr h GLU 227 CO -0.00 0.15 0.42 -0.44 -0.73 0.00 0.00 179.01 178.41 3gyr h ASP 228 N 0.16 0.42 0.37 1.04 3.32 -1.25 -0.56 116.42 119.92 3gyr h ASP 228 Ca 0.05 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.23 3gyr h ASP 228 Cb 0.01 0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3gyr h ASP 228 CO -0.01 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 177.58 3gyr n ALA 229 N -2.46 1.78 0.80 3.45 0.00 -0.57 -1.81 120.51 121.69 3gyr n ALA 229 Ca 0.21 -0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.72 3gyr n ALA 229 Cb 0.60 -1.24 0.46 0.00 0.00 0.00 0.00 19.45 19.27 3gyr n ALA 229 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gyr n LEU 230 N -1.37 0.46 -3.53 0.00 4.77 -0.22 -4.96 117.00 112.16 3gyr n LEU 230 Ca 0.06 0.48 -0.21 0.00 -0.03 0.00 0.00 56.01 56.31 3gyr n LEU 230 Cb 0.14 -0.38 0.08 0.00 -2.33 0.00 0.00 43.42 40.94 3gyr n LEU 230 CO 0.12 -0.08 0.18 0.61 -1.33 0.00 0.00 177.39 176.89 3gyr n GLY 231 N 1.40 -0.46 3.78 -0.72 0.00 -0.75 -4.94 105.19 103.50 3gyr n GLY 231 Ca 0.06 0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 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 -6.86 4.02 0.18 0.99 1.43 -1.26 -4.94 118.68 112.25 3gyr s LEU 232 Ca 0.31 2.08 -0.31 0.00 -1.03 0.00 0.00 54.13 55.17 3gyr s LEU 232 Cb -0.14 -4.30 -0.17 0.00 0.03 0.00 0.00 46.19 41.62 3gyr s LEU 232 CO 0.73 -0.69 0.86 -2.65 0.23 0.00 0.00 176.35 174.83 3gyr n PRO 233 N -0.43 0.55 -2.81 1.29 -0.02 -1.26 -4.97 135.00 127.36 3gyr n PRO 233 Ca 0.07 0.19 -0.07 0.00 -2.02 0.00 0.00 63.50 61.67 3gyr n PRO 233 Cb 0.50 -1.47 -0.01 0.00 -0.02 0.00 0.00 33.50 32.50 3gyr n PRO 233 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3gyr n SER 234 N 1.78 -0.79 0.00 2.55 3.41 -1.26 -4.48 113.62 114.83 3gyr n SER 234 Ca 0.16 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.78 3gyr n SER 234 Cb 0.24 1.44 0.00 0.00 -0.26 0.00 0.00 64.21 65.63 3gyr n SER 234 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gyr n GLY 235 N -0.31 3.17 0.36 5.00 0.00 -1.26 -1.45 105.19 110.71 3gyr n GLY 235 Ca -0.00 -0.18 0.18 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -0.26 1.61 3.32 -2.02 -2.16 116.42 116.91 3gyr h ASP 236 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gyr h ASP 236 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3gyr h ASP 236 CO 0.00 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.06 3gyr n ARG 237 N -3.33 2.42 -3.90 3.56 5.12 -0.53 -4.77 116.66 115.23 3gyr n ARG 237 Ca 0.03 -2.15 -0.35 0.00 -1.93 0.00 0.00 57.85 53.45 3gyr n ARG 237 Cb 0.50 -1.49 -0.14 0.00 -1.16 0.00 0.00 32.46 30.17 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 -1.66 3.25 -0.20 5.56 2.12 -0.81 -0.47 118.70 126.48 3gyr s GLU 238 Ca 0.34 -0.71 0.01 0.00 0.36 0.00 0.00 54.97 54.98 3gyr s GLU 238 Cb 0.22 -3.04 0.04 0.00 0.26 0.00 0.00 34.13 31.60 3gyr s GLU 238 CO 0.31 -0.26 -0.15 0.42 -0.54 0.00 0.00 175.26 175.03 3gyr s ILE 239 N 1.45 1.98 0.22 -3.70 1.01 0.12 -4.77 121.20 117.52 3gyr s ILE 239 Ca 0.04 -1.12 -0.30 0.00 0.00 0.00 0.00 60.65 59.27 3gyr s ILE 239 Cb -0.15 -1.92 -0.08 0.00 0.01 0.00 0.00 42.46 40.31 3gyr s ILE 239 CO -0.03 0.31 1.16 -2.84 0.00 0.00 0.00 174.94 173.54 3gyr s PRO 240 N 1.27 4.54 -0.26 2.79 0.02 -1.26 -1.32 135.00 140.78 3gyr s PRO 240 Ca 0.00 1.84 0.02 0.00 0.02 0.00 0.00 61.00 62.88 3gyr s PRO 240 Cb -0.15 -3.22 0.07 0.00 0.02 0.00 0.00 34.50 31.21 3gyr s PRO 240 CO -0.10 0.02 -0.05 -0.51 -0.33 0.00 0.00 177.00 176.03 3gyr s LEU 241 N -0.68 3.03 -0.41 -5.54 1.43 0.19 -4.87 118.68 111.85 3gyr s LEU 241 Ca 0.50 -1.37 -0.11 0.00 -1.03 0.00 0.00 54.13 52.12 3gyr s LEU 241 Cb -0.32 -1.31 0.06 0.00 0.03 0.00 0.00 46.19 44.64 3gyr s LEU 241 CO 0.38 -0.25 0.25 -0.76 0.23 0.00 0.00 176.35 176.21 3gyr s LEU 242 N 1.27 5.02 -0.00 1.79 1.02 -1.26 -1.14 118.68 125.37 3gyr s LEU 242 Ca -0.04 -1.28 0.02 0.00 0.02 0.00 0.00 54.13 52.85 3gyr s LEU 242 Cb -0.19 -2.02 -0.04 0.00 0.02 0.00 0.00 46.19 43.96 3gyr s LEU 242 CO -0.07 -0.49 -0.01 0.27 0.02 0.00 0.00 176.35 176.07 3gyr s ILE 243 N 1.50 4.08 -0.26 -0.59 -4.36 -0.64 -1.48 121.20 119.45 3gyr s ILE 243 Ca 0.02 -0.62 -0.13 0.00 -0.26 0.00 0.00 60.65 59.67 3gyr s ILE 243 Cb -0.22 -2.81 0.08 0.00 1.25 0.00 0.00 42.46 40.77 3gyr s ILE 243 CO 0.04 0.39 0.62 0.00 0.24 0.00 0.00 174.94 176.23 3gyr s ALA 244 N -1.06 -1.71 0.56 2.27 0.00 -0.34 -0.19 121.76 121.29 3gyr s ALA 244 Ca 0.19 2.19 -0.18 0.00 0.00 0.00 0.00 51.96 54.16 3gyr s ALA 244 Cb -0.11 -1.38 -0.05 0.00 0.00 0.00 0.00 23.12 21.57 3gyr s ALA 244 CO 0.09 -0.47 1.11 0.16 0.00 0.00 0.00 175.76 176.66 3gyr s ASP 245 N 1.85 5.70 0.04 0.00 -4.77 -1.26 -0.32 116.67 117.90 3gyr s ASP 245 Ca -0.09 2.08 -0.02 0.00 -3.30 0.00 0.00 52.55 51.22 3gyr s ASP 245 Cb -0.07 -2.57 -0.02 0.00 -1.09 0.00 0.00 42.92 39.16 3gyr s ASP 245 CO -0.18 -1.23 0.01 -0.13 0.70 0.00 0.00 175.17 174.33 3gyr s ARG 246 N -3.49 0.50 0.33 2.11 1.81 0.83 -4.80 118.95 116.24 3gyr s ARG 246 Ca 0.70 -0.87 0.09 0.00 -1.72 0.00 0.00 55.73 53.93 3gyr s ARG 246 Cb -0.22 0.18 -0.05 0.00 -0.45 0.00 0.00 34.95 34.42 3gyr s ARG 246 CO 0.29 -0.10 0.03 1.21 -0.68 0.00 0.00 175.30 176.05 3gyr s ASN 247 N -2.19 4.29 0.04 0.23 3.84 -1.25 -2.05 114.94 117.85 3gyr s ASN 247 Ca -0.04 -0.92 0.02 0.00 0.21 0.00 0.00 52.86 52.13 3gyr s ASN 247 Cb -0.01 -0.59 -0.02 0.00 -0.55 0.00 0.00 41.25 40.08 3gyr s ASN 247 CO -0.05 -0.22 -0.07 -0.76 -2.79 0.00 0.00 177.10 173.21 3gyr s LEU 248 N -3.73 2.23 0.75 3.21 1.43 -1.26 -1.25 118.68 120.06 3gyr s LEU 248 Ca 0.35 -0.50 -0.09 0.00 -1.03 0.00 0.00 54.13 52.85 3gyr s LEU 248 Cb -0.01 -0.13 0.07 0.00 0.03 0.00 0.00 46.19 46.14 3gyr s LEU 248 CO 0.20 -0.20 1.09 -0.62 0.23 0.00 0.00 176.35 177.05 3gyr s ASP 249 N -1.44 4.73 0.13 2.29 -1.08 -0.29 -1.18 116.67 119.83 3gyr s ASP 249 Ca -0.10 0.65 0.04 0.00 -0.52 0.00 0.00 52.55 52.62 3gyr s ASP 249 Cb -0.09 -1.25 -0.04 0.00 -1.46 0.00 0.00 42.92 40.08 3gyr s ASP 249 CO 0.00 -1.71 -0.10 0.42 0.52 0.00 0.00 175.17 174.31 3gyr s THR 250 N -3.40 1.04 0.76 1.71 -4.23 -1.26 -1.65 115.64 108.61 3gyr s THR 250 Ca 0.61 -1.95 -0.11 0.00 -1.18 0.00 0.00 61.69 59.06 3gyr s THR 250 Cb -0.11 -1.72 0.06 0.00 1.34 0.00 0.00 72.50 72.07 3gyr s THR 250 CO 0.47 -0.73 1.12 -1.81 -0.54 0.00 0.00 174.62 173.13 3gyr s ASP 251 N -3.00 4.80 0.63 3.99 1.01 -0.02 -4.86 116.67 119.23 3gyr s ASP 251 Ca 0.14 0.80 0.29 0.00 0.71 0.00 0.00 52.55 54.49 3gyr s ASP 251 Cb 0.02 -1.40 1.57 0.00 1.01 0.00 0.00 42.92 44.12 3gyr s ASP 251 CO -0.01 -1.70 1.92 -0.08 0.21 0.00 0.00 175.17 175.52 3gyr h GLU 252 N -0.86 0.00 -0.72 8.23 4.81 -2.02 0.65 114.58 124.67 3gyr h GLU 252 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3gyr h GLU 252 Cb 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 3gyr h GLU 252 CO 0.64 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.52 3gyr n ASP 253 N -3.25 4.02 0.00 1.04 5.75 -1.26 -4.92 116.55 117.93 3gyr n ASP 253 Ca 0.02 -2.07 0.00 0.00 -0.01 0.00 0.00 54.79 52.73 3gyr n ASP 253 Cb 0.48 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 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 1.58 1.07 3.74 6.12 0.00 0.23 -5.04 105.19 112.88 3gyr n GLY 254 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.64 4.39 0.12 1.61 1.81 -1.25 -4.71 118.95 120.26 3gyr s ARG 255 Ca 0.00 2.05 -0.32 0.00 -1.72 0.00 0.00 55.73 55.74 3gyr s ARG 255 Cb 0.00 -3.20 -0.11 0.00 -0.45 0.00 0.00 34.95 31.19 3gyr s ARG 255 CO 0.00 -0.26 1.79 1.28 -0.68 0.00 0.00 175.30 177.43 3gyr n LEU 256 N 2.71 3.83 -0.53 2.53 4.77 -1.26 -0.84 117.00 128.20 3gyr n LEU 256 Ca 0.06 1.01 0.05 0.00 -0.03 0.00 0.00 56.01 57.10 3gyr n LEU 256 Cb 0.43 -1.51 0.11 0.00 -2.33 0.00 0.00 43.42 40.12 3gyr n LEU 256 CO 0.58 0.08 0.55 -0.46 -1.33 0.00 0.00 177.39 176.81 3gyr n ASN 257 N 5.20 2.53 0.00 -1.43 0.23 -0.66 -4.82 115.26 116.31 3gyr n ASN 257 Ca 0.18 -1.81 0.00 0.00 -0.53 0.00 0.00 54.58 52.42 3gyr n ASN 257 Cb 0.35 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 37.90 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 0.49 1.06 3.71 4.83 0.00 -1.26 -4.70 105.19 109.31 3gyr n GLY 258 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.24 4.28 0.10 1.61 0.52 -1.26 -4.58 118.95 119.38 3gyr s ARG 259 Ca 0.00 2.14 -0.33 0.00 -0.52 0.00 0.00 55.73 57.02 3gyr s ARG 259 Cb 0.00 -3.35 -0.12 0.00 0.52 0.00 0.00 34.95 32.00 3gyr s ARG 259 CO 0.00 -0.53 1.74 1.28 0.02 0.00 0.00 175.30 177.81 3gyr n LEU 260 N 4.47 3.57 -4.05 2.53 4.77 -1.26 -1.14 117.00 125.89 3gyr n LEU 260 Ca 0.13 1.03 -0.31 0.00 -0.03 0.00 0.00 56.01 56.82 3gyr n LEU 260 Cb 0.42 -1.47 -0.16 0.00 -2.33 0.00 0.00 43.42 39.88 3gyr n LEU 260 CO 0.60 -0.04 -0.48 -0.22 -1.33 0.00 0.00 177.39 175.91 3gyr s LEU 261 N 2.22 2.34 -0.55 2.23 2.96 -0.38 -0.82 118.68 126.68 3gyr s LEU 261 Ca 0.82 -0.84 -0.20 0.00 -0.22 0.00 0.00 54.13 53.70 3gyr s LEU 261 Cb -0.60 -1.35 0.07 0.00 0.50 0.00 0.00 46.19 44.81 3gyr s LEU 261 CO 0.40 -0.10 0.71 -2.28 -1.32 0.00 0.00 176.35 173.77 3gyr s HIS 262 N 1.33 2.97 -0.24 5.38 5.65 0.24 -3.74 115.29 126.88 3gyr s HIS 262 Ca 0.00 -0.58 0.01 0.00 0.25 0.00 0.00 55.06 54.74 3gyr s HIS 262 Cb -0.15 -3.78 0.06 0.00 -1.18 0.00 0.00 32.58 27.52 3gyr s HIS 262 CO -0.09 -1.19 -0.07 0.21 -0.65 0.00 0.00 174.74 172.94 3gyr s LYS 263 N 2.92 1.82 0.30 2.88 2.20 -1.26 -1.31 119.74 127.29 3gyr s LYS 263 Ca 0.17 -1.10 0.08 0.00 -0.36 0.00 0.00 55.97 54.76 3gyr s LYS 263 Cb -0.19 -2.68 -0.04 0.00 -1.51 0.00 0.00 37.83 33.40 3gyr s LYS 263 CO 0.11 -0.59 0.12 0.95 -0.36 0.00 0.00 175.35 175.59 3gyr s THR 264 N 1.30 3.52 -0.18 3.43 -4.23 -0.66 -4.58 115.64 114.25 3gyr s THR 264 Ca -0.07 -1.67 -0.04 0.00 -1.18 0.00 0.00 61.69 58.73 3gyr s THR 264 Cb -0.19 -3.05 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 3gyr s THR 264 CO -0.06 -0.28 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.03 3gyr s VAL 265 N -2.32 3.84 -0.20 2.29 1.01 -1.26 -0.22 120.40 123.54 3gyr s VAL 265 Ca 0.35 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 3gyr s VAL 265 Cb -0.05 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 3gyr s VAL 265 CO 0.23 0.45 1.44 -0.63 0.00 0.00 0.00 175.10 176.58 3gyr s ILE 266 N 0.80 3.97 -0.05 2.22 1.01 0.17 -1.75 121.20 127.57 3gyr s ILE 266 Ca -0.01 1.13 0.22 0.00 0.00 0.00 0.00 60.65 61.99 3gyr s ILE 266 Cb -0.14 -3.88 -0.32 0.00 0.01 0.00 0.00 42.46 38.12 3gyr s ILE 266 CO 0.02 -0.27 0.51 1.33 0.00 0.00 0.00 174.94 176.53 3gyr n VAL 267 N 5.94 0.03 -3.69 2.92 0.24 0.85 -3.85 118.33 120.76 3gyr n VAL 267 Ca 0.16 -0.50 -0.25 0.00 -2.04 0.00 0.00 64.34 61.71 3gyr n VAL 267 Cb 0.45 -0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.65 3gyr n VAL 267 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3gyr s GLN 268 N -3.51 0.33 0.23 7.34 0.74 -0.96 -5.01 119.66 118.82 3gyr s GLN 268 Ca -0.07 -0.10 -0.06 0.00 0.05 0.00 0.00 55.36 55.18 3gyr s GLN 268 Cb 0.14 -1.60 0.22 0.00 1.10 0.00 0.00 33.01 32.87 3gyr s GLN 268 CO 0.90 -0.55 1.78 0.37 -0.55 0.00 0.00 175.29 177.24 3gyr h GLN 269 N 8.35 1.07 -2.42 1.67 5.75 -1.88 -0.02 115.11 127.62 3gyr h GLN 269 Ca -0.16 -0.22 -0.37 0.00 -0.15 0.00 0.00 58.65 57.76 3gyr h GLN 269 Cb 1.13 -0.16 -0.36 0.00 1.07 0.00 0.00 27.48 29.17 3gyr h GLN 269 CO 0.28 0.91 -0.66 0.45 -2.65 0.00 0.00 178.83 177.16 3gyr s SER 270 N -6.46 1.95 0.19 -0.69 0.15 -1.26 -3.20 113.70 104.38 3gyr s SER 270 Ca -0.11 -0.67 -0.31 0.00 0.70 0.00 0.00 55.95 55.56 3gyr s SER 270 Cb 0.15 0.28 -0.09 0.00 -1.71 0.00 0.00 66.02 64.65 3gyr s SER 270 CO 0.83 -0.38 1.45 0.21 1.20 0.00 0.00 173.24 176.55 3gyr s ASN 271 N 2.29 6.70 0.33 5.45 2.47 -0.47 -4.80 114.94 126.92 3gyr s ASN 271 Ca 0.08 2.55 0.10 0.00 0.42 0.00 0.00 52.86 56.01 3gyr s ASN 271 Cb -0.15 -2.61 0.87 0.00 -1.45 0.00 0.00 41.25 37.91 3gyr s ASN 271 CO -0.26 -0.70 1.77 -0.65 -3.72 0.00 0.00 177.10 173.54 3gyr h PRO 272 N 5.94 0.61 0.11 0.43 0.11 -1.94 0.83 132.00 138.09 3gyr h PRO 272 Ca -0.44 -0.04 -0.27 0.00 0.11 0.00 0.00 66.00 65.36 3gyr h PRO 272 Cb 1.21 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3gyr h PRO 272 CO 0.83 0.40 -1.28 0.93 -0.21 0.00 0.00 178.00 178.68 3gyr h GLU 273 N 0.63 0.23 0.00 1.05 5.08 -1.93 -3.39 114.58 116.25 3gyr h GLU 273 Ca 0.59 -0.40 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3gyr h GLU 273 Cb 1.10 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 3gyr h GLU 273 CO -0.37 1.17 -1.10 0.25 -1.00 0.00 0.00 179.01 177.96 3gyr n THR 274 N -3.49 0.02 -1.07 1.13 -2.24 -1.05 -5.02 114.28 102.55 3gyr n THR 274 Ca -0.09 -0.05 -0.03 0.00 -2.27 0.00 0.00 64.05 61.61 3gyr n THR 274 Cb 1.02 0.26 -0.01 0.00 -2.10 0.00 0.00 70.33 69.49 3gyr n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gyr n GLY 275 N 2.45 0.45 3.76 3.38 0.00 0.29 -4.95 105.19 110.58 3gyr n GLY 275 Ca -0.01 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 3gyr n GLY 275 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gyr s LYS 276 N -1.52 2.60 0.68 1.61 -2.85 -1.26 -4.53 119.74 114.47 3gyr s LYS 276 Ca 0.00 -1.30 -0.12 0.00 -1.00 0.00 0.00 55.97 53.55 3gyr s LYS 276 Cb 0.00 -2.36 0.00 0.00 -2.06 0.00 0.00 37.83 33.42 3gyr s LYS 276 CO 0.00 0.28 1.07 -1.25 0.10 0.00 0.00 175.35 175.54 3gyr s PRO 277 N -3.82 2.92 -0.11 1.78 0.04 -1.19 -1.36 135.00 133.25 3gyr s PRO 277 Ca 0.35 1.10 0.01 0.00 0.04 0.00 0.00 61.00 62.50 3gyr s PRO 277 Cb -0.06 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.51 3gyr s PRO 277 CO 0.23 -1.12 -0.14 0.08 0.04 0.00 0.00 177.00 176.09 3gyr s VAL 278 N -2.79 1.43 0.29 -0.36 1.01 -0.02 -4.89 120.40 115.06 3gyr s VAL 278 Ca 0.61 -0.59 0.11 0.00 0.00 0.00 0.00 61.98 62.11 3gyr s VAL 278 Cb -0.16 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.85 3gyr s VAL 278 CO 0.49 0.43 -0.16 -0.94 0.00 0.00 0.00 175.10 174.92 3gyr s SER 279 N 1.08 3.73 0.86 3.32 1.04 -1.26 -0.11 113.70 122.36 3gyr s SER 279 Ca -0.05 -1.01 -0.12 0.00 0.48 0.00 0.00 55.95 55.25 3gyr s SER 279 Cb -0.15 -0.37 0.11 0.00 0.10 0.00 0.00 66.02 65.71 3gyr s SER 279 CO -0.03 -0.00 1.17 0.27 0.98 0.00 0.00 173.24 175.63 3gyr s ILE 280 N -2.50 2.00 1.15 -1.02 -4.36 -0.71 -4.88 121.20 110.88 3gyr s ILE 280 Ca 0.31 0.00 -0.13 0.00 -0.26 0.00 0.00 60.65 60.56 3gyr s ILE 280 Cb -0.04 -2.89 0.28 0.00 1.25 0.00 0.00 42.46 41.05 3gyr s ILE 280 CO 0.16 0.00 1.03 -2.84 0.24 0.00 0.00 174.94 173.53 3gyr s PRO 281 N -5.46 -0.83 0.02 0.37 0.02 -1.26 -4.55 135.00 123.31 3gyr s PRO 281 Ca 0.63 0.69 -0.30 0.00 0.02 0.00 0.00 61.00 62.04 3gyr s PRO 281 Cb -0.12 -1.58 -0.04 0.00 0.02 0.00 0.00 34.50 32.78 3gyr s PRO 281 CO 0.51 -3.63 1.02 0.12 -0.33 0.00 0.00 177.00 174.70 3gyr s PHE 282 N -2.57 3.63 -0.01 6.54 5.36 -1.26 -4.78 117.98 124.89 3gyr s PHE 282 Ca 0.68 1.63 0.00 0.00 -0.96 0.00 0.00 56.93 58.28 3gyr s PHE 282 Cb -0.23 -3.18 0.01 0.00 -0.34 0.00 0.00 43.02 39.28 3gyr s PHE 282 CO 0.63 -0.26 -0.00 -0.06 -1.46 0.00 0.00 175.22 174.07 3gyr s PHE 283 N 0.92 0.10 0.15 10.12 0.08 -1.26 -3.89 117.98 124.20 3gyr s PHE 283 Ca 0.53 0.01 0.03 0.00 0.12 0.00 0.00 56.93 57.62 3gyr s PHE 283 Cb -0.23 -0.12 -0.04 0.00 -0.57 0.00 0.00 43.02 42.06 3gyr s PHE 283 CO 0.29 -0.03 -0.06 0.20 -0.10 0.00 0.00 175.22 175.52 3gyr s GLY 284 N 0.25 1.08 0.21 4.36 0.00 -1.26 -4.79 107.32 107.16 3gyr s GLY 284 Ca -0.02 -1.51 0.03 0.00 0.00 0.00 0.00 44.72 43.23 3gyr s GLY 284 CO -0.01 -1.56 1.51 -2.55 0.00 0.00 0.00 173.10 170.49 3gyr h PRO 285 N 2.77 0.25 -5.50 2.90 0.11 -1.68 -3.41 132.00 127.44 3gyr h PRO 285 Ca -0.36 -0.19 -0.59 0.00 0.11 0.00 0.00 66.00 64.96 3gyr h PRO 285 Cb 1.19 0.04 -0.10 0.00 0.11 0.00 0.00 31.00 32.23 3gyr h PRO 285 CO 0.64 0.83 -0.23 0.71 -0.21 0.00 0.00 178.00 179.74 3gyr s TYR 286 N -3.63 3.43 -0.27 0.65 1.51 -0.87 -4.42 117.35 113.75 3gyr s TYR 286 Ca -0.04 0.66 -0.19 0.00 -1.01 0.00 0.00 57.07 56.49 3gyr s TYR 286 Cb 0.11 -2.47 -0.02 0.00 -0.11 0.00 0.00 41.96 39.47 3gyr s TYR 286 CO 0.81 0.10 0.59 0.99 -1.11 0.00 0.00 175.55 176.93 3gyr s THR 287 N 0.92 5.01 -0.04 -0.71 2.01 -1.26 -0.12 115.64 121.45 3gyr s THR 287 Ca 0.20 0.98 -0.12 0.00 0.31 0.00 0.00 61.69 63.06 3gyr s THR 287 Cb -0.14 -3.91 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 3gyr s THR 287 CO 0.07 0.02 0.32 0.42 -0.69 0.00 0.00 174.62 174.75 3gyr s THR 288 N 2.45 5.19 -0.15 -0.82 -4.23 0.56 -1.73 115.64 116.92 3gyr s THR 288 Ca 0.24 0.62 0.00 0.00 -1.18 0.00 0.00 61.69 61.38 3gyr s THR 288 Cb -0.15 -3.61 0.02 0.00 1.34 0.00 0.00 72.50 70.10 3gyr s THR 288 CO 0.09 0.59 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.93 3gyr s VAL 289 N -1.06 1.61 -1.55 2.29 1.01 0.14 -1.20 120.40 121.63 3gyr s VAL 289 Ca 0.21 -0.67 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 3gyr s VAL 289 Cb -0.15 -1.51 0.08 0.00 0.00 0.00 0.00 36.38 34.80 3gyr s VAL 289 CO 0.10 0.45 0.72 0.59 0.00 0.00 0.00 175.10 176.97 3gyr n ASN 290 N 4.76 -2.65 0.00 3.32 3.02 -0.55 -2.07 115.26 121.09 3gyr n ASN 290 Ca -0.17 -0.94 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 3gyr n ASN 290 Cb 0.50 -3.20 0.00 0.00 -0.61 0.00 0.00 39.78 36.47 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 -1.66 0.66 3.22 7.41 0.00 -1.26 -4.53 105.19 109.03 3gyr n GLY 291 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.08 1.90 -0.06 1.61 0.52 -0.88 -4.53 118.95 117.43 3gyr s ARG 292 Ca 0.00 -0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 54.16 3gyr s ARG 292 Cb 0.00 -1.74 -0.05 0.00 0.52 0.00 0.00 34.95 33.68 3gyr s ARG 292 CO 0.00 0.40 1.63 0.42 0.02 0.00 0.00 175.30 177.77 3gyr s ILE 293 N -0.32 3.61 -1.14 1.52 1.01 -0.11 0.25 121.20 126.03 3gyr s ILE 293 Ca 0.03 0.75 -0.17 0.00 0.00 0.00 0.00 60.65 61.27 3gyr s ILE 293 Cb -0.10 -3.49 -0.02 0.00 0.01 0.00 0.00 42.46 38.87 3gyr s ILE 293 CO 0.01 -0.06 0.80 0.79 0.00 0.00 0.00 174.94 176.48 3gyr n TRP 294 N 7.04 -1.99 -2.34 3.97 8.01 -0.70 -4.74 117.44 126.69 3gyr n TRP 294 Ca 0.17 0.54 -0.28 0.00 -1.31 0.00 0.00 57.50 56.62 3gyr n TRP 294 Cb 0.43 -3.59 0.02 0.00 -2.01 0.00 0.00 31.31 26.16 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 -5.73 3.10 0.13 -0.99 0.04 -1.26 -0.14 135.00 130.14 3gyr s PRO 295 Ca 0.45 0.15 0.06 0.00 0.04 0.00 0.00 61.00 61.70 3gyr s PRO 295 Cb -0.14 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 3gyr s PRO 295 CO 0.84 -0.63 0.01 1.52 0.04 0.00 0.00 177.00 178.78 3gyr s TYR 296 N -3.00 2.94 -0.14 0.56 -0.85 -0.80 -2.01 117.35 114.04 3gyr s TYR 296 Ca 0.53 -0.07 -0.00 0.00 -0.52 0.00 0.00 57.07 57.01 3gyr s TYR 296 Cb -0.11 -1.48 0.03 0.00 0.38 0.00 0.00 41.96 40.79 3gyr s TYR 296 CO 0.47 0.49 -0.10 0.00 -1.52 0.00 0.00 175.55 174.89 3gyr s ALA 297 N -1.48 1.60 -0.10 9.51 0.00 0.88 -0.50 121.76 131.68 3gyr s ALA 297 Ca 0.26 -0.78 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 3gyr s ALA 297 Cb -0.11 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.94 3gyr s ALA 297 CO 0.19 -0.51 1.43 -0.51 0.00 0.00 0.00 175.76 176.36 3gyr s ASP 298 N 1.59 6.83 0.24 0.00 1.01 -1.26 -0.62 116.67 124.45 3gyr s ASP 298 Ca 0.04 1.95 0.05 0.00 0.71 0.00 0.00 52.55 55.30 3gyr s ASP 298 Cb -0.13 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.20 3gyr s ASP 298 CO -0.09 -0.82 -0.05 0.68 0.21 0.00 0.00 175.17 175.10 3gyr s VAL 299 N 3.57 1.33 0.41 -1.27 -7.23 -0.02 -4.91 120.40 112.28 3gyr s VAL 299 Ca 0.63 -2.09 -0.01 0.00 -1.81 0.00 0.00 61.98 58.71 3gyr s VAL 299 Cb -0.27 -2.29 -0.02 0.00 0.56 0.00 0.00 36.38 34.35 3gyr s VAL 299 CO 0.22 -0.39 0.64 -1.81 -0.31 0.00 0.00 175.10 173.44 3gyr s ASP 300 N -3.34 6.12 -1.04 4.85 1.01 -1.26 0.81 116.67 123.81 3gyr s ASP 300 Ca 0.27 0.49 -0.08 0.00 0.71 0.00 0.00 52.55 53.94 3gyr s ASP 300 Cb 0.04 -1.90 -0.11 0.00 1.01 0.00 0.00 42.92 41.96 3gyr s ASP 300 CO 0.09 -0.50 2.75 -0.90 0.21 0.00 0.00 175.17 176.82 3gyr n ASP 301 N -1.99 6.64 -1.19 0.27 5.75 -0.79 -4.71 116.55 120.53 3gyr n ASP 301 Ca -0.02 -2.44 0.00 0.00 -0.01 0.00 0.00 54.79 52.33 3gyr n ASP 301 Cb 0.56 -1.34 0.00 0.00 -1.03 0.00 0.00 41.12 39.32 3gyr n ASP 301 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3gyr n GLY 302 N 3.40 4.25 3.72 6.12 0.00 -1.26 -3.54 105.19 117.88 3gyr n GLY 302 Ca 0.59 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 3gyr n GLY 302 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3gyr s TRP 303 N -1.58 3.60 0.28 1.61 0.52 -1.26 -1.78 118.94 120.33 3gyr s TRP 303 Ca 0.00 1.58 0.12 0.00 0.02 0.00 0.00 56.10 57.81 3gyr s TRP 303 Cb 0.00 -3.22 -0.05 0.00 -1.15 0.00 0.00 33.47 29.05 3gyr s TRP 303 CO 0.00 -0.45 -0.17 0.71 0.02 0.00 0.00 176.95 177.06 3gyr s TYR 304 N 0.72 2.35 -0.16 -1.98 1.51 -0.21 -4.82 117.35 114.76 3gyr s TYR 304 Ca 0.53 -0.32 0.00 0.00 -1.01 0.00 0.00 57.07 56.27 3gyr s TYR 304 Cb -0.25 -1.04 0.02 0.00 -0.11 0.00 0.00 41.96 40.58 3gyr s TYR 304 CO 0.30 0.70 -0.15 0.50 -1.11 0.00 0.00 175.55 175.78 3gyr s ARG 305 N -3.54 2.40 -0.18 -0.62 3.52 0.38 -1.15 118.95 119.76 3gyr s ARG 305 Ca 0.30 -0.61 -0.05 0.00 -0.13 0.00 0.00 55.73 55.24 3gyr s ARG 305 Cb -0.05 -2.19 -0.03 0.00 -1.56 0.00 0.00 34.95 31.12 3gyr s ARG 305 CO 0.16 -0.24 -0.01 -0.51 -0.81 0.00 0.00 175.30 173.88 3gyr s LEU 306 N 1.45 3.26 -0.76 -0.88 1.43 0.82 0.14 118.68 124.14 3gyr s LEU 306 Ca 0.05 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.86 3gyr s LEU 306 Cb -0.13 -1.81 0.20 0.00 0.03 0.00 0.00 46.19 44.48 3gyr s LEU 306 CO -0.11 0.11 0.68 -0.13 0.23 0.00 0.00 176.35 177.13 3gyr s ARG 307 N 0.74 3.35 -0.23 1.70 1.81 -0.44 -0.64 118.95 125.25 3gyr s ARG 307 Ca -0.01 -2.41 -0.20 0.00 -1.72 0.00 0.00 55.73 51.40 3gyr s ARG 307 Cb -0.14 -4.29 -0.02 0.00 -0.45 0.00 0.00 34.95 30.05 3gyr s ARG 307 CO 0.02 -1.27 0.60 -1.17 -0.68 0.00 0.00 175.30 172.80 3gyr s LEU 308 N 0.25 4.10 -0.03 2.53 2.96 -0.32 -0.64 118.68 127.54 3gyr s LEU 308 Ca 0.16 0.72 0.05 0.00 -0.22 0.00 0.00 54.13 54.85 3gyr s LEU 308 Cb -0.14 -2.82 -0.01 0.00 0.50 0.00 0.00 46.19 43.73 3gyr s LEU 308 CO -0.07 -0.29 -0.18 0.54 -1.32 0.00 0.00 176.35 175.03 3gyr s VAL 309 N 2.12 1.47 -0.39 1.68 0.11 -0.29 -0.28 120.40 124.82 3gyr s VAL 309 Ca 0.26 -0.77 -0.20 0.00 -2.93 0.00 0.00 61.98 58.34 3gyr s VAL 309 Cb -0.16 -1.24 0.01 0.00 -1.53 0.00 0.00 36.38 33.47 3gyr s VAL 309 CO 0.09 0.42 0.59 0.21 -3.33 0.00 0.00 175.10 173.08 3gyr s ASN 310 N -0.23 6.34 -0.18 3.54 3.84 -1.21 -1.62 114.94 125.43 3gyr s ASN 310 Ca 0.02 -0.14 0.16 0.00 0.21 0.00 0.00 52.86 53.11 3gyr s ASN 310 Cb -0.09 -2.30 0.70 0.00 -0.55 0.00 0.00 41.25 39.00 3gyr s ASN 310 CO 0.01 -0.63 1.61 0.00 -2.79 0.00 0.00 177.10 175.30 3gyr n ALA 311 N 6.01 3.35 -1.77 1.71 0.00 0.74 -0.15 120.51 130.40 3gyr n ALA 311 Ca -0.03 -1.89 -0.35 0.00 0.00 0.00 0.00 53.44 51.17 3gyr n ALA 311 Cb 0.48 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 -1.11 5.78 0.24 0.00 0.01 -1.24 -4.86 113.70 112.52 3gyr s SER 312 Ca 0.49 2.21 -0.05 0.00 1.31 0.00 0.00 55.95 59.92 3gyr s SER 312 Cb 0.36 -2.59 0.41 0.00 0.21 0.00 0.00 66.02 64.41 3gyr s SER 312 CO 0.17 -1.18 1.76 0.78 0.41 0.00 0.00 173.24 175.18 3gyr h ASN 313 N 1.35 0.44 0.00 2.44 4.21 -1.87 -3.42 115.58 118.72 3gyr h ASN 313 Ca -0.50 0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.09 3gyr h ASN 313 Cb 1.26 0.01 0.00 0.00 -1.12 0.00 0.00 38.32 38.47 3gyr h ASN 313 CO 0.57 0.22 0.00 0.00 -1.29 0.00 0.00 177.43 176.93 3gyr n ALA 314 N -2.44 0.00 -2.16 -0.83 0.00 -1.25 -0.92 120.51 112.91 3gyr n ALA 314 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 3gyr n ALA 314 Cb 0.34 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.76 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 0.00 4.38 -0.34 0.00 3.52 -1.26 -4.75 118.95 120.50 3gyr s ARG 315 Ca 0.00 1.98 -0.20 0.00 -0.13 0.00 0.00 55.73 57.39 3gyr s ARG 315 Cb 0.00 -3.25 -0.00 0.00 -1.56 0.00 0.00 34.95 30.13 3gyr s ARG 315 CO 0.00 -0.31 0.59 0.42 -0.81 0.00 0.00 175.30 175.19 3gyr s ILE 316 N 0.68 4.95 -0.06 4.11 1.01 -1.26 -4.04 121.20 126.58 3gyr s ILE 316 Ca 0.60 0.60 -0.30 0.00 0.00 0.00 0.00 60.65 61.55 3gyr s ILE 316 Cb -0.35 -4.01 -0.02 0.00 0.01 0.00 0.00 42.46 38.09 3gyr s ILE 316 CO 0.33 -0.22 1.06 -0.31 0.00 0.00 0.00 174.94 175.80 3gyr s TYR 317 N 2.57 3.47 -0.66 3.97 2.02 -0.53 -4.90 117.35 123.29 3gyr s TYR 317 Ca 0.23 1.51 -0.09 0.00 -0.37 0.00 0.00 57.07 58.35 3gyr s TYR 317 Cb -0.15 -3.24 0.17 0.00 -0.40 0.00 0.00 41.96 38.34 3gyr s TYR 317 CO 0.13 -0.49 0.55 -0.80 -1.57 0.00 0.00 175.55 173.37 3gyr s ASN 318 N 1.16 5.99 0.16 2.29 -0.87 -1.26 -0.75 114.94 121.65 3gyr s ASN 318 Ca 0.51 -2.50 -0.27 0.00 -1.57 0.00 0.00 52.86 49.03 3gyr s ASN 318 Cb -0.21 -2.05 -0.08 0.00 -0.02 0.00 0.00 41.25 38.90 3gyr s ASN 318 CO 0.22 -0.55 0.84 -0.76 -2.57 0.00 0.00 177.10 174.28 3gyr s LEU 319 N 0.47 4.57 -0.03 0.60 1.43 0.40 -0.67 118.68 125.45 3gyr s LEU 319 Ca 0.14 1.72 0.01 0.00 -1.03 0.00 0.00 54.13 54.96 3gyr s LEU 319 Cb -0.18 -3.41 0.02 0.00 0.03 0.00 0.00 46.19 42.65 3gyr s LEU 319 CO -0.04 0.13 -0.02 -0.69 0.23 0.00 0.00 176.35 175.96 3gyr s VAL 320 N -0.82 0.27 -0.24 -1.59 1.01 -0.59 -0.66 120.40 117.79 3gyr s VAL 320 Ca 0.39 0.00 -0.22 0.00 0.00 0.00 0.00 61.98 62.16 3gyr s VAL 320 Cb -0.23 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 3gyr s VAL 320 CO 0.28 0.15 0.68 -0.22 0.00 0.00 0.00 175.10 175.99 3gyr s LEU 321 N 0.85 4.08 0.25 3.92 2.96 -1.26 -1.12 118.68 128.36 3gyr s LEU 321 Ca -0.09 0.82 0.10 0.00 -0.22 0.00 0.00 54.13 54.74 3gyr s LEU 321 Cb -0.12 -2.95 -0.05 0.00 0.50 0.00 0.00 46.19 43.57 3gyr s LEU 321 CO -0.01 -0.39 -0.18 0.27 -1.32 0.00 0.00 176.35 174.72 3gyr s ILE 322 N 2.46 2.19 0.00 6.68 -4.36 0.67 -1.55 121.20 127.29 3gyr s ILE 322 Ca 0.29 -2.31 0.00 0.00 -0.26 0.00 0.00 60.65 58.37 3gyr s ILE 322 Cb -0.16 -2.19 0.00 0.00 1.25 0.00 0.00 42.46 41.37 3gyr s ILE 322 CO 0.09 -0.46 0.00 -0.90 0.24 0.00 0.00 174.94 173.91 3gyr n ASP 323 N -0.47 0.00 0.27 4.36 5.68 -0.51 0.03 116.55 125.91 3gyr n ASP 323 Ca -0.07 -0.76 0.18 0.00 -0.50 0.00 0.00 54.79 53.64 3gyr n ASP 323 Cb 0.60 0.00 0.77 0.00 -1.14 0.00 0.00 41.12 41.35 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 -0.56 0.11 3.07 -1.90 0.38 114.58 115.68 3gyr h GLU 324 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3gyr h GLU 324 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3gyr h GLU 324 CO 0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 3gyr n ASP 325 N -2.96 4.69 -0.17 1.42 9.92 -1.26 -4.94 116.55 123.25 3gyr n ASP 325 Ca -0.00 -2.58 -0.02 0.00 -0.53 0.00 0.00 54.79 51.66 3gyr n ASP 325 Cb 0.24 -0.57 -0.01 0.00 -0.64 0.00 0.00 41.12 40.14 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 0.76 -4.24 -4.71 -2.24 9.92 0.12 -4.99 116.55 111.17 3gyr n ASP 326 Ca 0.24 0.05 -0.40 0.00 -0.53 0.00 0.00 54.79 54.15 3gyr n ASP 326 Cb 0.91 -1.93 -0.04 0.00 -0.64 0.00 0.00 41.12 39.42 3gyr n ASP 326 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 3gyr s ARG 327 N -1.32 4.45 0.44 -1.24 3.52 -1.26 -4.72 118.95 118.81 3gyr s ARG 327 Ca 0.00 1.03 -0.25 0.00 -0.13 0.00 0.00 55.73 56.38 3gyr s ARG 327 Cb 0.00 -3.47 -0.08 0.00 -1.56 0.00 0.00 34.95 29.84 3gyr s ARG 327 CO 0.00 -0.02 1.35 -2.14 -0.81 0.00 0.00 175.30 173.68 3gyr s PRO 328 N 1.05 3.75 -0.44 5.12 0.02 -1.26 -1.42 135.00 141.83 3gyr s PRO 328 Ca 0.41 2.24 -0.15 0.00 0.02 0.00 0.00 61.00 63.52 3gyr s PRO 328 Cb -0.18 -2.64 0.04 0.00 0.02 0.00 0.00 34.50 31.74 3gyr s PRO 328 CO 0.20 -0.70 0.34 0.08 -0.33 0.00 0.00 177.00 176.58 3gyr s VAL 329 N -1.26 5.24 0.76 3.83 1.01 -0.59 -4.88 120.40 124.51 3gyr s VAL 329 Ca 0.60 -0.83 -0.09 0.00 0.00 0.00 0.00 61.98 61.67 3gyr s VAL 329 Cb -0.40 -4.01 0.07 0.00 0.00 0.00 0.00 36.38 32.04 3gyr s VAL 329 CO 0.51 -0.42 1.09 -2.16 0.00 0.00 0.00 175.10 174.12 3gyr s PRO 330 N 1.66 2.08 -1.65 2.72 0.04 -1.26 -4.43 135.00 134.16 3gyr s PRO 330 Ca 0.05 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.01 3gyr s PRO 330 Cb -0.21 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.27 3gyr s PRO 330 CO 0.09 -1.42 0.00 0.41 0.04 0.00 0.00 177.00 176.12 3gyr n GLY 331 N -3.12 -0.27 0.00 0.56 0.00 -1.26 -4.81 105.19 96.29 3gyr n GLY 331 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.70 0.00 -3.84 1.61 0.31 -1.26 -4.90 118.33 106.55 3gyr n VAL 332 Ca -0.22 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.74 3gyr n VAL 332 Cb 0.67 -0.34 -0.06 0.00 -0.91 0.00 0.00 33.84 33.19 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 -1.50 5.47 -0.07 2.52 1.01 -1.26 -0.19 120.40 126.38 3gyr s VAL 333 Ca 0.00 0.25 -0.00 0.00 0.00 0.00 0.00 61.98 62.22 3gyr s VAL 333 Cb 0.00 -3.43 0.03 0.00 0.00 0.00 0.00 36.38 32.98 3gyr s VAL 333 CO 0.00 0.60 -0.02 -1.00 0.00 0.00 0.00 175.10 174.68 3gyr s HIS 334 N -0.88 0.77 0.01 5.22 3.76 0.48 -1.82 115.29 122.84 3gyr s HIS 334 Ca 0.15 -0.23 -0.29 0.00 -0.15 0.00 0.00 55.06 54.54 3gyr s HIS 334 Cb -0.12 -0.79 -0.04 0.00 1.11 0.00 0.00 32.58 32.74 3gyr s HIS 334 CO 0.04 -0.30 0.91 -1.14 -0.85 0.00 0.00 174.74 173.41 3gyr s GLN 335 N 1.57 4.56 0.00 1.40 0.74 0.18 -0.84 119.66 127.27 3gyr s GLN 335 Ca -0.01 1.31 0.00 0.00 0.05 0.00 0.00 55.36 56.71 3gyr s GLN 335 Cb -0.13 -3.43 0.00 0.00 1.10 0.00 0.00 33.01 30.55 3gyr s GLN 335 CO -0.04 0.04 0.01 0.44 -0.55 0.00 0.00 175.29 175.19 3gyr n ILE 336 N 3.58 0.00 -3.81 -2.34 -5.35 0.68 -0.53 119.36 111.59 3gyr n ILE 336 Ca 0.03 -0.46 -0.09 0.00 -0.27 0.00 0.00 62.75 61.96 3gyr n ILE 336 Cb 0.51 1.00 -0.07 0.00 -1.74 0.00 0.00 39.64 39.34 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 -0.90 0.00 0.03 3.28 0.00 -1.14 -0.00 107.32 108.59 3gyr s GLY 337 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 44.72 44.30 3gyr s GLY 337 CO 0.00 -0.62 0.02 -1.14 0.00 0.00 0.00 173.10 171.36 3gyr n SER 338 N 0.07 0.02 -0.31 1.64 3.41 -0.22 -1.43 113.62 116.80 3gyr n SER 338 Ca -0.16 -1.18 0.03 0.00 -0.26 0.00 0.00 58.87 57.30 3gyr n SER 338 Cb 0.62 0.13 0.10 0.00 -0.26 0.00 0.00 64.21 64.80 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 -2.82 -0.36 -1.12 4.04 8.00 -1.18 -1.40 116.55 121.70 3gyr n ASP 339 Ca 0.01 1.44 0.08 0.00 0.71 0.00 0.00 54.79 57.03 3gyr n ASP 339 Cb 0.05 -0.41 0.27 0.00 -0.02 0.00 0.00 41.12 41.02 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 -1.49 3.27 0.00 0.44 0.00 -0.78 -4.39 105.19 102.24 3gyr n GLY 340 Ca 0.12 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 0.31 0.82 3.75 -0.02 0.00 -0.49 -4.77 105.19 104.79 3gyr n GLY 341 Ca 0.21 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 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 4.55 -4.82 0.99 4.77 -1.26 -1.05 117.00 120.18 3gyr n LEU 342 Ca 0.00 1.18 -0.31 0.00 -0.03 0.00 0.00 56.01 56.85 3gyr n LEU 342 Cb 0.00 -1.58 0.05 0.00 -2.33 0.00 0.00 43.42 39.57 3gyr n LEU 342 CO 0.00 -0.15 0.71 -0.76 -1.33 0.00 0.00 177.39 175.86 3gyr s LEU 343 N -1.99 3.05 0.27 2.23 1.43 1.00 -4.71 118.68 119.96 3gyr s LEU 343 Ca 0.57 1.55 0.01 0.00 -1.03 0.00 0.00 54.13 55.23 3gyr s LEU 343 Cb -0.49 -4.39 0.39 0.00 0.03 0.00 0.00 46.19 41.72 3gyr s LEU 343 CO 0.61 -1.50 1.72 1.55 0.23 0.00 0.00 176.35 178.96 3gyr h PRO 344 N -0.76 0.54 -4.89 1.29 0.13 -1.89 -3.30 132.00 123.12 3gyr h PRO 344 Ca -0.44 -0.20 -0.32 0.00 -0.87 0.00 0.00 66.00 64.18 3gyr h PRO 344 Cb 1.22 -0.04 -0.19 0.00 0.13 0.00 0.00 31.00 32.12 3gyr h PRO 344 CO 0.57 0.72 -0.74 1.03 -0.23 0.00 0.00 178.00 179.36 3gyr s ARG 345 N -4.57 0.75 0.52 0.86 0.52 -1.26 -0.07 118.95 115.70 3gyr s ARG 345 Ca -0.07 -1.02 -0.20 0.00 -0.52 0.00 0.00 55.73 53.91 3gyr s ARG 345 Cb 0.14 -0.49 -0.06 0.00 0.52 0.00 0.00 34.95 35.05 3gyr s ARG 345 CO 0.80 0.08 1.13 -2.14 0.02 0.00 0.00 175.30 175.19 3gyr s PRO 346 N -2.35 3.47 -0.27 3.54 0.02 -1.26 -4.86 135.00 133.30 3gyr s PRO 346 Ca 0.00 1.63 0.03 0.00 0.02 0.00 0.00 61.00 62.68 3gyr s PRO 346 Cb -0.05 -2.09 0.06 0.00 0.02 0.00 0.00 34.50 32.44 3gyr s PRO 346 CO 0.00 -0.76 -0.09 0.08 -0.33 0.00 0.00 177.00 175.90 3gyr s VAL 347 N -1.74 2.13 0.26 3.83 1.01 0.31 -4.95 120.40 121.25 3gyr s VAL 347 Ca 0.71 -1.68 -0.31 0.00 0.00 0.00 0.00 61.98 60.70 3gyr s VAL 347 Cb -0.24 -2.28 -0.12 0.00 0.00 0.00 0.00 36.38 33.73 3gyr s VAL 347 CO 0.28 -0.09 1.58 -2.65 0.00 0.00 0.00 175.10 174.22 3gyr n PRO 348 N 4.43 2.55 -3.94 2.72 -0.02 -1.26 0.47 135.00 139.95 3gyr n PRO 348 Ca -0.12 0.91 -0.32 0.00 -2.02 0.00 0.00 63.50 61.95 3gyr n PRO 348 Cb 0.42 -2.68 -0.14 0.00 -0.02 0.00 0.00 33.50 31.09 3gyr n PRO 348 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3gyr s VAL 349 N 0.25 2.63 -1.37 -1.45 1.01 -0.75 -4.85 120.40 115.87 3gyr s VAL 349 Ca 0.68 -2.51 0.12 0.00 0.00 0.00 0.00 61.98 60.27 3gyr s VAL 349 Cb -0.54 -2.87 0.17 0.00 0.00 0.00 0.00 36.38 33.14 3gyr s VAL 349 CO 0.45 -0.67 1.01 0.47 0.00 0.00 0.00 175.10 176.36 3gyr n ASP 350 N 4.06 2.33 -4.07 3.32 8.00 -1.26 -4.08 116.55 124.84 3gyr n ASP 350 Ca 0.03 -1.66 -0.33 0.00 0.71 0.00 0.00 54.79 53.54 3gyr n ASP 350 Cb 0.40 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.42 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 0.66 -2.02 0.00 1.24 3.01 -0.75 -4.26 117.46 115.35 3gyr n PHE 351 Ca 0.09 0.85 0.00 0.00 1.01 0.00 0.00 57.45 59.40 3gyr n PHE 351 Cb 0.35 -3.46 0.00 0.00 -0.01 0.00 0.00 39.48 36.36 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 -2.75 0.00 0.00 4.37 5.68 -1.16 -4.75 116.55 117.95 3gyr n ASP 352 Ca 0.06 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.35 3gyr n ASP 352 Cb 0.51 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.49 3gyr n ASP 352 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3gyr n ASP 353 N 0.00 0.00 -0.02 -1.12 8.00 -1.26 -4.15 116.55 118.00 3gyr n ASP 353 Ca 0.00 0.00 0.23 0.00 0.71 0.00 0.00 54.79 55.73 3gyr n ASP 353 Cb 0.00 0.02 0.65 0.00 -0.02 0.00 0.00 41.12 41.77 3gyr n ASP 353 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 3gyr h THR 354 N 0.00 0.24 -0.77 -3.53 2.02 -2.00 -3.34 112.91 105.53 3gyr h THR 354 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 3gyr h THR 354 Cb 0.00 0.43 -0.17 0.00 -1.74 0.00 0.00 68.15 66.67 3gyr h THR 354 CO 0.00 0.00 -0.37 -0.22 0.37 0.00 0.00 175.52 175.30 3gyr s LEU 355 N -7.10 -1.14 0.20 2.58 2.96 -1.26 -4.86 118.68 110.05 3gyr s LEU 355 Ca -0.04 -1.02 -0.07 0.00 -0.22 0.00 0.00 54.13 52.78 3gyr s LEU 355 Cb 0.15 1.48 0.14 0.00 0.50 0.00 0.00 46.19 48.46 3gyr s LEU 355 CO 0.52 -0.08 1.65 1.55 -1.32 0.00 0.00 176.35 178.68 3gyr h PRO 356 N 5.52 0.96 -5.59 0.98 0.13 -1.72 -1.95 132.00 130.32 3gyr h PRO 356 Ca 0.03 -0.32 -0.45 0.00 -0.87 0.00 0.00 66.00 64.39 3gyr h PRO 356 Cb 1.16 -0.08 -0.16 0.00 0.13 0.00 0.00 31.00 32.05 3gyr h PRO 356 CO 0.01 0.99 -0.74 0.14 -0.23 0.00 0.00 178.00 178.16 3gyr s VAL 357 N -4.89 1.67 -0.44 1.56 -7.23 -1.26 -4.38 120.40 105.44 3gyr s VAL 357 Ca -0.11 -2.09 -0.19 0.00 -1.81 0.00 0.00 61.98 57.79 3gyr s VAL 357 Cb 0.14 -1.93 0.03 0.00 0.56 0.00 0.00 36.38 35.17 3gyr s VAL 357 CO 0.85 -0.53 0.52 -0.22 -0.31 0.00 0.00 175.10 175.41 3gyr s LEU 358 N -3.07 4.78 -0.40 1.32 2.96 0.16 -4.87 118.68 119.56 3gyr s LEU 358 Ca 0.19 -0.62 -0.16 0.00 -0.22 0.00 0.00 54.13 53.32 3gyr s LEU 358 Cb -0.02 -2.50 0.01 0.00 0.50 0.00 0.00 46.19 44.19 3gyr s LEU 358 CO 0.06 -0.69 0.39 -0.55 -1.32 0.00 0.00 176.35 174.24 3gyr s SER 359 N 2.00 6.17 -0.41 3.68 0.15 -1.26 -0.45 113.70 123.58 3gyr s SER 359 Ca 0.16 -0.65 -0.04 0.00 0.70 0.00 0.00 55.95 56.11 3gyr s SER 359 Cb -0.17 -2.20 0.10 0.00 -1.71 0.00 0.00 66.02 62.04 3gyr s SER 359 CO 0.15 -0.50 0.21 0.00 1.20 0.00 0.00 173.24 174.30 3gyr s ALA 360 N 2.00 3.17 0.80 5.45 0.00 0.07 -4.99 121.76 128.25 3gyr s ALA 360 Ca 0.10 -2.39 -0.11 0.00 0.00 0.00 0.00 51.96 49.55 3gyr s ALA 360 Cb -0.17 -2.44 0.07 0.00 0.00 0.00 0.00 23.12 20.57 3gyr s ALA 360 CO 0.12 -1.73 1.10 0.00 0.00 0.00 0.00 175.76 175.25 3gyr s ALA 361 N 1.22 2.25 0.21 0.00 0.00 -1.26 -1.45 121.76 122.73 3gyr s ALA 361 Ca 0.06 -0.21 -0.32 0.00 0.00 0.00 0.00 51.96 51.49 3gyr s ALA 361 Cb -0.23 -3.11 -0.14 0.00 0.00 0.00 0.00 23.12 19.65 3gyr s ALA 361 CO -0.03 -1.73 1.41 -2.30 0.00 0.00 0.00 175.76 173.12 3gyr n PRO 362 N -3.43 1.91 -0.10 0.00 -0.02 -1.26 -2.71 135.00 129.39 3gyr n PRO 362 Ca 0.07 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3gyr n PRO 362 Cb 0.56 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 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 2.21 0.00 -1.78 3.55 0.00 0.79 -4.95 120.51 120.33 3gyr n ALA 363 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.21 3gyr n ALA 363 Cb 0.29 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.72 3gyr n ALA 363 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3gyr s GLU 364 N -0.31 3.96 0.05 0.00 2.02 -1.10 -4.86 118.70 118.46 3gyr s GLU 364 Ca 0.00 1.59 0.07 0.00 0.02 0.00 0.00 54.97 56.65 3gyr s GLU 364 Cb 0.00 -2.42 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 3gyr s GLU 364 CO 0.00 -0.34 -0.18 1.03 0.02 0.00 0.00 175.26 175.79 3gyr s ARG 365 N -2.68 2.04 -0.10 1.61 0.52 -1.26 -3.29 118.95 115.79 3gyr s ARG 365 Ca 0.61 -1.00 -0.01 0.00 -0.52 0.00 0.00 55.73 54.81 3gyr s ARG 365 Cb -0.24 -2.18 0.03 0.00 0.52 0.00 0.00 34.95 33.08 3gyr s ARG 365 CO 0.29 0.53 -0.05 -0.06 0.02 0.00 0.00 175.30 176.03 3gyr s PHE 366 N -0.95 1.27 -0.44 -0.53 0.08 0.62 -3.42 117.98 114.60 3gyr s PHE 366 Ca 0.15 -0.60 -0.21 0.00 0.12 0.00 0.00 56.93 56.40 3gyr s PHE 366 Cb -0.10 -1.12 0.02 0.00 -0.57 0.00 0.00 43.02 41.25 3gyr s PHE 366 CO 0.06 -0.47 0.63 0.34 -0.10 0.00 0.00 175.22 175.68 3gyr s ASP 367 N 1.78 6.32 -0.16 1.36 -1.08 -0.52 -1.17 116.67 123.20 3gyr s ASP 367 Ca 0.05 -0.34 -0.03 0.00 -0.52 0.00 0.00 52.55 51.71 3gyr s ASP 367 Cb -0.13 -2.32 -0.02 0.00 -1.46 0.00 0.00 42.92 39.00 3gyr s ASP 367 CO -0.07 -0.77 -0.06 -0.76 0.52 0.00 0.00 175.17 174.02 3gyr s LEU 368 N 2.79 3.04 -0.01 -1.34 1.43 0.19 -0.23 118.68 124.54 3gyr s LEU 368 Ca 0.22 -0.23 -0.19 0.00 -1.03 0.00 0.00 54.13 52.90 3gyr s LEU 368 Cb -0.14 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 3gyr s LEU 368 CO 0.19 0.14 0.53 -0.76 0.23 0.00 0.00 176.35 176.68 3gyr s LEU 369 N 0.55 4.42 -0.08 1.79 1.43 -0.02 -0.13 118.68 126.64 3gyr s LEU 369 Ca -0.05 1.07 0.03 0.00 -1.03 0.00 0.00 54.13 54.15 3gyr s LEU 369 Cb -0.15 -2.81 0.01 0.00 0.03 0.00 0.00 46.19 43.27 3gyr s LEU 369 CO 0.03 0.15 -0.17 0.68 0.23 0.00 0.00 176.35 177.27 3gyr s VAL 370 N -0.32 1.48 -0.63 -1.59 -7.23 -0.30 -0.38 120.40 111.43 3gyr s VAL 370 Ca 0.28 -0.68 -0.13 0.00 -1.81 0.00 0.00 61.98 59.64 3gyr s VAL 370 Cb -0.17 -1.32 0.16 0.00 0.56 0.00 0.00 36.38 35.61 3gyr s VAL 370 CO 0.15 0.43 0.56 -0.62 -0.31 0.00 0.00 175.10 175.31 3gyr s ASP 371 N 0.56 6.22 0.00 4.85 2.15 0.73 -1.04 116.67 130.13 3gyr s ASP 371 Ca -0.16 -2.21 0.17 0.00 0.43 0.00 0.00 52.55 50.78 3gyr s ASP 371 Cb -0.17 -2.14 0.67 0.00 -0.30 0.00 0.00 42.92 40.98 3gyr s ASP 371 CO 0.06 -0.69 1.48 0.49 -0.17 0.00 0.00 175.17 176.33 3gyr n PHE 372 N 4.60 0.22 -0.31 -5.34 3.72 -0.74 -4.52 117.46 115.10 3gyr n PHE 372 Ca -0.01 -0.11 0.17 0.00 -0.05 0.00 0.00 57.45 57.45 3gyr n PHE 372 Cb 0.42 0.00 0.43 0.00 -0.94 0.00 0.00 39.48 39.39 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 1.71 0.54 -0.04 -1.08 3.08 -1.71 0.25 114.38 117.13 3gyr h ARG 373 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3gyr h ARG 373 Cb 0.38 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.31 3gyr h ARG 373 CO 0.00 0.36 0.00 0.00 -1.07 0.00 0.00 179.97 179.26 3gyr n ALA 374 N -2.43 2.56 -0.73 0.04 0.00 -1.26 -4.45 120.51 114.24 3gyr n ALA 374 Ca 0.22 -0.47 0.08 0.00 0.00 0.00 0.00 53.44 53.27 3gyr n ALA 374 Cb 0.68 -1.14 0.24 0.00 0.00 0.00 0.00 19.45 19.23 3gyr n ALA 374 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gyr n LEU 375 N 0.24 3.68 -4.59 0.00 4.77 0.08 -5.00 117.00 116.18 3gyr n LEU 375 Ca 0.18 -2.69 -0.46 0.00 -0.03 0.00 0.00 56.01 53.02 3gyr n LEU 375 Cb 0.36 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 40.97 3gyr n LEU 375 CO 0.16 0.69 0.63 0.61 -1.33 0.00 0.00 177.39 178.15 3gyr n GLY 376 N -0.12 -0.15 3.34 -0.72 0.00 -1.26 -1.08 105.19 105.21 3gyr n GLY 376 Ca 0.19 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 1.53 1.19 3.96 -0.02 0.00 -0.08 -4.76 105.19 107.02 3gyr n GLY 377 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.18 3.40 -0.16 1.61 1.81 -0.24 -4.91 118.95 120.28 3gyr s ARG 378 Ca 0.00 -0.79 0.00 0.00 -1.72 0.00 0.00 55.73 53.23 3gyr s ARG 378 Cb 0.00 -2.87 0.00 0.00 -0.45 0.00 0.00 34.95 31.63 3gyr s ARG 378 CO 0.00 0.41 -0.16 1.03 -0.68 0.00 0.00 175.30 175.90 3gyr s ARG 379 N -3.98 3.16 0.12 3.54 0.52 -1.26 -1.17 118.95 119.88 3gyr s ARG 379 Ca 0.34 -0.77 0.10 0.00 -0.52 0.00 0.00 55.73 54.89 3gyr s ARG 379 Cb -0.09 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.73 3gyr s ARG 379 CO 0.29 -0.04 -0.25 -0.51 0.02 0.00 0.00 175.30 174.81 3gyr s LEU 380 N 0.94 2.40 -0.02 2.53 1.43 0.09 -3.71 118.68 122.33 3gyr s LEU 380 Ca -0.03 -0.70 0.08 0.00 -1.03 0.00 0.00 54.13 52.44 3gyr s LEU 380 Cb -0.15 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.76 3gyr s LEU 380 CO -0.03 0.18 -0.25 -0.13 0.23 0.00 0.00 176.35 176.36 3gyr s ARG 381 N -2.05 2.06 -0.09 1.70 0.52 0.10 0.15 118.95 121.34 3gyr s ARG 381 Ca 0.15 -0.89 -0.22 0.00 -0.52 0.00 0.00 55.73 54.25 3gyr s ARG 381 Cb -0.10 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.36 3gyr s ARG 381 CO 0.07 0.53 0.63 -1.17 0.02 0.00 0.00 175.30 175.37 3gyr s LEU 382 N -0.56 4.30 0.12 2.53 2.96 0.19 -0.24 118.68 127.99 3gyr s LEU 382 Ca 0.09 1.06 0.05 0.00 -0.22 0.00 0.00 54.13 55.10 3gyr s LEU 382 Cb -0.10 -2.95 -0.04 0.00 0.50 0.00 0.00 46.19 43.60 3gyr s LEU 382 CO -0.01 -0.08 -0.11 0.68 -1.32 0.00 0.00 176.35 175.51 3gyr s VAL 383 N 0.78 1.15 -0.13 1.68 -7.23 -0.27 -1.51 120.40 114.88 3gyr s VAL 383 Ca 0.34 -1.83 -0.21 0.00 -1.81 0.00 0.00 61.98 58.46 3gyr s VAL 383 Cb -0.17 -1.60 -0.03 0.00 0.56 0.00 0.00 36.38 35.14 3gyr s VAL 383 CO 0.15 -0.59 0.63 -0.62 -0.31 0.00 0.00 175.10 174.37 3gyr s ASP 384 N -2.73 6.82 -0.22 4.85 2.15 0.35 -1.53 116.67 126.36 3gyr s ASP 384 Ca 0.11 0.99 -0.16 0.00 0.43 0.00 0.00 52.55 53.92 3gyr s ASP 384 Cb -0.01 -2.36 -0.04 0.00 -0.30 0.00 0.00 42.92 40.20 3gyr s ASP 384 CO 0.01 -0.16 0.40 -0.75 -0.17 0.00 0.00 175.17 174.51 3gyr s LYS 385 N 1.19 4.13 0.48 4.34 2.20 0.15 -4.60 119.74 127.63 3gyr s LYS 385 Ca 0.32 0.17 -0.19 0.00 -0.36 0.00 0.00 55.97 55.91 3gyr s LYS 385 Cb -0.16 -3.57 -0.09 0.00 -1.51 0.00 0.00 37.83 32.49 3gyr s LYS 385 CO 0.13 -0.11 0.99 0.20 -0.36 0.00 0.00 175.35 176.20 3gyr s GLY 386 N 1.21 2.31 0.56 5.54 0.00 -1.26 -4.66 107.32 111.01 3gyr s GLY 386 Ca 0.18 0.38 0.24 0.00 0.00 0.00 0.00 44.72 45.53 3gyr s GLY 386 CO 0.08 0.67 2.11 -0.56 0.00 0.00 0.00 173.10 175.41 3gyr h PRO 387 N 1.46 0.00 -0.00 2.90 0.13 -1.93 -3.18 132.00 131.38 3gyr h PRO 387 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3gyr h PRO 387 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3gyr h PRO 387 CO 0.60 0.00 -0.76 0.41 -0.23 0.00 0.00 178.00 178.02 3gyr n GLY 388 N -1.48 -0.93 3.18 1.56 0.00 -1.26 -4.98 105.19 101.27 3gyr n GLY 388 Ca 0.01 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 3gyr n GLY 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 389 N -2.92 -0.13 0.89 4.61 0.00 -1.20 -5.06 121.76 117.95 3gyr s ALA 389 Ca 0.11 -0.65 -0.10 0.00 0.00 0.00 0.00 51.96 51.31 3gyr s ALA 389 Cb 0.17 0.41 0.13 0.00 0.00 0.00 0.00 23.12 23.83 3gyr s ALA 389 CO 0.77 -0.46 1.12 -2.14 0.00 0.00 0.00 175.76 175.06 3gyr s PRO 390 N -3.62 1.25 0.25 0.00 0.02 -1.26 -4.38 135.00 127.27 3gyr s PRO 390 Ca 0.03 1.38 -0.31 0.00 0.02 0.00 0.00 61.00 62.12 3gyr s PRO 390 Cb 0.04 -1.77 -0.12 0.00 0.02 0.00 0.00 34.50 32.67 3gyr s PRO 390 CO -0.10 -2.41 1.61 0.00 -0.33 0.00 0.00 177.00 175.78 3gyr n ALA 391 N -4.07 2.41 0.00 -1.55 0.00 -1.26 -1.51 120.51 114.53 3gyr n ALA 391 Ca 0.10 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.93 3gyr n ALA 391 Cb 0.53 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.52 3gyr n ALA 391 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gyr n GLY 392 N 2.78 3.17 3.69 0.00 0.00 -1.26 -4.87 105.19 108.69 3gyr n GLY 392 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.91 5.12 0.19 2.61 2.01 -0.57 -4.85 115.64 117.24 3gyr s THR 393 Ca 0.00 1.03 -0.33 0.00 0.31 0.00 0.00 61.69 62.70 3gyr s THR 393 Cb 0.00 -3.86 -0.15 0.00 0.01 0.00 0.00 72.50 68.50 3gyr s THR 393 CO 0.00 0.23 1.31 -2.65 -0.69 0.00 0.00 174.62 172.82 3gyr n PRO 394 N 4.34 1.58 -3.32 4.92 -0.02 -1.26 -4.67 135.00 136.57 3gyr n PRO 394 Ca -0.05 0.57 -0.26 0.00 -2.02 0.00 0.00 63.50 61.74 3gyr n PRO 394 Cb 0.51 -2.16 -0.07 0.00 -0.02 0.00 0.00 33.50 31.75 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 2.25 2.78 -0.20 2.55 2.03 0.14 -4.87 116.55 121.24 3gyr n ASP 395 Ca 0.14 -3.25 -0.00 0.00 0.52 0.00 0.00 54.79 52.20 3gyr n ASP 395 Cb 0.27 -0.65 0.23 0.00 -0.72 0.00 0.00 41.12 40.25 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 4.02 0.97 -0.82 -0.67 0.13 -1.84 0.88 132.00 134.66 3gyr h PRO 396 Ca 0.16 -0.08 0.05 0.00 -0.87 0.00 0.00 66.00 65.26 3gyr h PRO 396 Cb 0.72 -0.21 -0.05 0.00 0.13 0.00 0.00 31.00 31.59 3gyr h PRO 396 CO 0.73 0.68 0.54 -0.07 -0.23 0.00 0.00 178.00 179.64 3gyr h LEU 397 N 0.98 0.82 -1.64 1.56 3.38 -1.92 -2.11 115.31 116.39 3gyr h LEU 397 Ca 0.26 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3gyr h LEU 397 Cb -0.04 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.53 3gyr h LEU 397 CO -0.05 0.55 0.00 0.61 0.09 0.00 0.00 178.44 179.64 3gyr n GLY 398 N -1.42 1.16 1.67 0.83 0.00 0.10 -4.84 105.19 102.70 3gyr n GLY 398 Ca 0.12 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.93 0.54 2.38 -0.02 0.00 -0.79 -4.63 105.19 103.60 3gyr n GLY 399 Ca 0.13 -0.39 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.84 0.52 -0.30 1.61 0.31 -0.05 -4.92 118.33 112.66 3gyr n VAL 400 Ca 0.00 -4.43 -0.03 0.00 -0.01 0.00 0.00 64.34 59.87 3gyr n VAL 400 Cb 0.00 -1.99 0.08 0.00 -0.91 0.00 0.00 33.84 31.02 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 4.46 1.06 -4.66 5.55 2.43 -1.84 0.40 114.38 121.77 3gyr h ARG 401 Ca 0.15 -0.06 -0.66 0.00 -0.81 0.00 0.00 59.98 58.60 3gyr h ARG 401 Cb 0.80 -0.24 -0.40 0.00 -0.42 0.00 0.00 29.97 29.71 3gyr h ARG 401 CO 0.60 0.70 -0.72 0.71 -1.51 0.00 0.00 179.97 179.75 3gyr s TYR 402 N -6.13 3.71 0.36 2.20 1.51 -1.26 -4.43 117.35 113.32 3gyr s TYR 402 Ca -0.13 -2.97 0.09 0.00 -1.01 0.00 0.00 57.07 53.05 3gyr s TYR 402 Cb 0.16 -2.88 0.82 0.00 -0.11 0.00 0.00 41.96 39.95 3gyr s TYR 402 CO 0.79 -0.95 1.90 -1.35 -1.11 0.00 0.00 175.55 174.83 3gyr h PRO 403 N 7.63 0.66 -6.60 -1.71 0.11 -1.81 -3.45 132.00 126.82 3gyr h PRO 403 Ca -0.04 -0.04 -0.57 0.00 0.11 0.00 0.00 66.00 65.45 3gyr h PRO 403 Cb 1.02 -0.15 0.08 0.00 0.11 0.00 0.00 31.00 32.06 3gyr h PRO 403 CO 0.52 0.44 0.72 -0.85 -0.21 0.00 0.00 178.00 178.62 3gyr n GLU 404 N -4.53 2.20 0.00 1.05 0.00 -1.26 -0.49 120.64 117.60 3gyr n GLU 404 Ca 0.15 0.79 0.00 0.00 0.00 0.00 0.00 57.16 58.10 3gyr n GLU 404 Cb 0.41 -2.50 0.00 0.00 0.00 0.00 0.00 31.44 29.35 3gyr n GLU 404 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3gyr n VAL 405 N 2.44 0.00 -3.93 3.84 0.31 -0.57 -4.52 118.33 115.90 3gyr n VAL 405 Ca 0.13 0.25 -0.09 0.00 -0.01 0.00 0.00 64.34 64.61 3gyr n VAL 405 Cb 0.32 -1.25 -0.06 0.00 -0.91 0.00 0.00 33.84 31.94 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 -0.99 1.36 0.01 5.55 0.23 -1.14 -3.97 119.30 120.35 3gyr s MET 406 Ca 0.00 -1.15 0.07 0.00 -1.03 0.00 0.00 55.69 53.58 3gyr s MET 406 Cb 0.00 0.44 -0.03 0.00 -1.53 0.00 0.00 34.83 33.71 3gyr s MET 406 CO 0.00 -0.54 -0.20 -2.00 -2.03 0.00 0.00 175.02 170.24 3gyr s GLU 407 N -3.97 2.10 -0.13 3.16 2.12 -0.85 -0.63 118.70 120.49 3gyr s GLU 407 Ca 0.18 -0.95 -0.02 0.00 0.36 0.00 0.00 54.97 54.54 3gyr s GLU 407 Cb 0.01 -2.15 -0.03 0.00 0.26 0.00 0.00 34.13 32.22 3gyr s GLU 407 CO 0.03 0.55 -0.06 -0.06 -0.54 0.00 0.00 175.26 175.19 3gyr s PHE 408 N -0.81 2.98 -0.39 5.30 0.40 0.39 -0.08 117.98 125.76 3gyr s PHE 408 Ca 0.13 -0.27 -0.06 0.00 -0.60 0.00 0.00 56.93 56.13 3gyr s PHE 408 Cb -0.10 -1.88 0.08 0.00 0.51 0.00 0.00 43.02 41.62 3gyr s PHE 408 CO 0.03 0.03 0.19 1.03 0.70 0.00 0.00 175.22 177.20 3gyr s ARG 409 N 0.08 2.39 -0.22 0.44 0.52 0.21 -0.73 118.95 121.64 3gyr s ARG 409 Ca -0.01 -1.53 -0.24 0.00 -0.52 0.00 0.00 55.73 53.43 3gyr s ARG 409 Cb -0.14 -3.61 -0.01 0.00 0.52 0.00 0.00 34.95 31.71 3gyr s ARG 409 CO 0.03 -0.93 0.79 0.08 0.02 0.00 0.00 175.30 175.30 3gyr s VAL 410 N 1.31 4.88 0.05 3.52 1.01 -0.32 -0.84 120.40 130.01 3gyr s VAL 410 Ca 0.03 1.50 -0.22 0.00 0.00 0.00 0.00 61.98 63.30 3gyr s VAL 410 Cb -0.22 -4.09 -0.06 0.00 0.00 0.00 0.00 36.38 32.01 3gyr s VAL 410 CO -0.00 -0.02 0.64 -0.60 0.00 0.00 0.00 175.10 175.11 3gyr s ARG 411 N 2.57 4.35 -0.37 2.72 3.52 0.24 -0.90 118.95 131.08 3gyr s ARG 411 Ca 0.34 0.85 -0.27 0.00 -0.13 0.00 0.00 55.73 56.53 3gyr s ARG 411 Cb -0.16 -3.30 0.02 0.00 -1.56 0.00 0.00 34.95 29.95 3gyr s ARG 411 CO 0.09 0.47 0.98 -2.00 -0.81 0.00 0.00 175.30 174.02 3gyr s GLU 412 N -0.59 3.87 0.56 5.12 2.12 -1.26 -1.88 118.70 126.64 3gyr s GLU 412 Ca 0.32 0.67 0.09 0.00 0.36 0.00 0.00 54.97 56.42 3gyr s GLU 412 Cb -0.20 -3.80 0.08 0.00 0.26 0.00 0.00 34.13 30.47 3gyr s GLU 412 CO 0.20 -0.99 0.77 0.99 -0.54 0.00 0.00 175.26 175.69 3gyr s THR 413 N 3.62 2.23 -0.55 -1.70 2.01 -1.26 -4.95 115.64 115.04 3gyr s THR 413 Ca 0.41 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 61.42 3gyr s THR 413 Cb -0.11 -2.23 0.43 0.00 0.01 0.00 0.00 72.50 70.59 3gyr s THR 413 CO 0.20 0.00 1.59 0.00 -0.69 0.00 0.00 174.62 175.72 3gyr s GLU 415 N -3.75 2.35 -0.32 0.00 2.02 -1.26 -5.10 118.70 112.63 3gyr s GLU 415 Ca 0.55 -1.53 -0.02 0.00 0.02 0.00 0.00 54.97 53.98 3gyr s GLU 415 Cb 0.44 -2.16 0.06 0.00 0.10 0.00 0.00 34.13 32.57 3gyr s GLU 415 CO -0.12 0.16 0.05 -1.21 0.02 0.00 0.00 175.26 174.17 3gyr s GLU 416 N -3.80 2.37 -0.46 1.61 0.41 -1.26 -5.05 118.70 112.52 3gyr s GLU 416 Ca 0.36 -1.36 -0.16 0.00 -0.41 0.00 0.00 54.97 53.40 3gyr s GLU 416 Cb -0.03 -3.29 0.05 0.00 -1.78 0.00 0.00 34.13 29.08 3gyr s GLU 416 CO 0.22 -0.71 0.43 0.34 -0.49 0.00 0.00 175.26 175.05 3gyr s ASP 417 N 1.37 6.16 -0.30 -0.19 -1.08 -1.26 -4.91 116.67 116.46 3gyr s ASP 417 Ca -0.02 -1.05 0.09 0.00 -0.52 0.00 0.00 52.55 51.05 3gyr s ASP 417 Cb -0.20 -2.21 0.69 0.00 -1.46 0.00 0.00 42.92 39.74 3gyr s ASP 417 CO -0.01 -0.64 1.72 -1.54 0.52 0.00 0.00 175.17 175.22 3gyr n SER 418 N 5.45 4.63 -4.61 -0.34 3.41 -1.26 -5.00 113.62 115.89 3gyr n SER 418 Ca -0.10 -3.11 -0.44 0.00 -0.26 0.00 0.00 58.87 54.96 3gyr n SER 418 Cb 0.45 -0.73 -0.02 0.00 -0.26 0.00 0.00 64.21 63.66 3gyr n SER 418 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3gyr n PHE 419 N -0.09 1.52 -4.83 7.33 7.35 -1.26 -4.96 117.46 122.51 3gyr n PHE 419 Ca 0.38 0.66 -0.33 0.00 -0.76 0.00 0.00 57.45 57.40 3gyr n PHE 419 Cb 1.31 -2.30 -0.15 0.00 0.35 0.00 0.00 39.48 38.70 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 -0.96 2.56 -0.41 3.13 0.00 -1.26 -5.10 121.76 119.72 3gyr s ALA 420 Ca 0.59 -0.90 -0.08 0.00 0.00 0.00 0.00 51.96 51.58 3gyr s ALA 420 Cb -0.68 -1.16 0.09 0.00 0.00 0.00 0.00 23.12 21.36 3gyr s ALA 420 CO 0.59 0.25 0.24 -1.17 0.00 0.00 0.00 175.76 175.68 3gyr s LEU 421 N 0.35 5.15 0.52 0.00 2.96 -1.26 -5.05 118.68 121.34 3gyr s LEU 421 Ca -0.12 -1.63 -0.21 0.00 -0.22 0.00 0.00 54.13 51.95 3gyr s LEU 421 Cb -0.16 -1.94 -0.06 0.00 0.50 0.00 0.00 46.19 44.52 3gyr s LEU 421 CO 0.06 -0.54 1.16 -2.16 -1.32 0.00 0.00 176.35 173.55 3gyr s PRO 422 N 1.35 3.47 0.36 0.98 0.04 -1.26 -4.93 135.00 135.01 3gyr s PRO 422 Ca 0.04 1.72 0.07 0.00 0.04 0.00 0.00 61.00 62.86 3gyr s PRO 422 Cb -0.23 -2.16 0.76 0.00 0.04 0.00 0.00 34.50 32.90 3gyr s PRO 422 CO 0.00 -0.78 1.93 0.93 0.04 0.00 0.00 177.00 179.13 3gyr h GLU 423 N 1.51 0.72 -5.75 4.56 4.39 -1.98 -3.39 114.58 114.65 3gyr h GLU 423 Ca -0.50 -0.04 -0.66 0.00 0.34 0.00 0.00 59.36 58.49 3gyr h GLU 423 Cb 1.26 -0.16 -0.21 0.00 -0.10 0.00 0.00 28.75 29.54 3gyr h GLU 423 CO 0.58 0.48 -0.69 0.08 -1.16 0.00 0.00 179.01 178.30 3gyr s VAL 424 N -5.68 3.69 -0.21 3.13 1.01 -1.26 -4.30 120.40 116.79 3gyr s VAL 424 Ca -0.10 -0.46 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 3gyr s VAL 424 Cb 0.20 -2.55 -0.10 0.00 0.00 0.00 0.00 36.38 33.92 3gyr s VAL 424 CO 0.78 0.55 -0.24 -0.11 0.00 0.00 0.00 175.10 176.08 3gyr n LEU 425 N 2.84 2.00 -4.38 3.92 7.94 0.90 -4.94 117.00 125.27 3gyr n LEU 425 Ca -0.18 0.14 -0.33 0.00 -1.11 0.00 0.00 56.01 54.53 3gyr n LEU 425 Cb 0.53 -0.65 -0.14 0.00 0.53 0.00 0.00 43.42 43.69 3gyr n LEU 425 CO 0.29 0.57 -0.43 -0.55 -1.11 0.00 0.00 177.39 176.17 3gyr s SER 426 N -6.59 4.10 0.10 1.96 0.15 -1.19 -4.99 113.70 107.25 3gyr s SER 426 Ca -0.29 -0.31 0.04 0.00 0.70 0.00 0.00 55.95 56.09 3gyr s SER 426 Cb 0.10 -1.64 -0.23 0.00 -1.71 0.00 0.00 66.02 62.54 3gyr s SER 426 CO 0.40 0.15 1.22 1.23 1.20 0.00 0.00 173.24 177.45 3gyr h GLY 427 N 6.82 0.09 2.00 9.45 0.00 -1.92 -3.36 103.07 116.15 3gyr h GLY 427 Ca -0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 3gyr h GLY 427 CO 0.57 0.20 -0.14 1.48 0.00 0.00 0.00 176.54 178.64 3gyr h SER 428 N 0.02 0.00 -2.68 0.19 4.64 -2.00 -3.45 113.55 110.27 3gyr h SER 428 Ca -0.05 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.74 3gyr h SER 428 Cb 1.83 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.97 3gyr h SER 428 CO 0.15 0.14 1.00 0.12 -0.87 0.00 0.00 176.83 177.37 3gyr s PHE 429 N -3.58 2.67 -0.16 4.77 5.36 -1.26 -4.98 117.98 120.80 3gyr s PHE 429 Ca 0.02 0.32 0.00 0.00 -0.96 0.00 0.00 56.93 56.31 3gyr s PHE 429 Cb 0.09 -4.06 0.03 0.00 -0.34 0.00 0.00 43.02 38.74 3gyr s PHE 429 CO 0.61 -4.14 -0.12 1.03 -1.46 0.00 0.00 175.22 171.15 3gyr s ARG 430 N 1.82 2.14 0.06 10.12 1.81 -1.26 -5.07 118.95 128.56 3gyr s ARG 430 Ca 0.75 -0.59 -0.34 0.00 -1.72 0.00 0.00 55.73 53.83 3gyr s ARG 430 Cb -0.45 -2.12 -0.13 0.00 -0.45 0.00 0.00 34.95 31.80 3gyr s ARG 430 CO 0.33 -0.29 1.70 -2.13 -0.68 0.00 0.00 175.30 174.23 3gyr n ARG 431 N 4.77 2.14 -1.68 3.54 3.00 -1.26 -4.97 116.66 122.20 3gyr n ARG 431 Ca -0.16 0.78 -0.43 0.00 -0.00 0.00 0.00 57.85 58.04 3gyr n ARG 431 Cb 0.49 -2.58 -0.03 0.00 0.00 0.00 0.00 32.46 30.34 3gyr n ARG 431 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 3gyr n MET 432 N 4.74 2.69 -3.60 -0.14 2.81 -1.26 -5.02 117.12 117.33 3gyr n MET 432 Ca 0.19 0.98 -0.36 0.00 -1.81 0.00 0.00 57.70 56.70 3gyr n MET 432 Cb 0.29 -2.87 -0.07 0.00 -0.71 0.00 0.00 33.22 29.85 3gyr n MET 432 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3gyr s SER 433 N 2.97 6.34 0.61 7.83 0.15 -1.26 -4.95 113.70 125.40 3gyr s SER 433 Ca 0.84 0.39 0.28 0.00 0.70 0.00 0.00 55.95 58.17 3gyr s SER 433 Cb -0.51 -2.15 1.49 0.00 -1.71 0.00 0.00 66.02 63.14 3gyr s SER 433 CO 0.40 0.12 1.88 -0.74 1.20 0.00 0.00 173.24 176.09 3gyr h HIS 434 N 6.75 0.00 0.00 3.44 2.76 -2.02 -1.41 115.15 124.67 3gyr h HIS 434 Ca -0.41 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 3gyr h HIS 434 Cb 1.16 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.12 3gyr h HIS 434 CO 0.60 0.00 0.00 -0.44 -1.30 0.00 0.00 177.93 176.79 3gyr h ASP 435 N 0.00 0.00 -2.78 3.26 3.32 -2.02 -3.43 116.42 114.78 3gyr h ASP 435 Ca 0.15 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.67 3gyr h ASP 435 Cb 1.05 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.64 3gyr h ASP 435 CO -0.00 0.00 0.92 -0.63 -1.72 0.00 0.00 179.24 177.81 3gyr s ILE 436 N -3.56 2.63 0.24 0.35 1.01 -0.53 -4.94 121.20 116.40 3gyr s ILE 436 Ca 0.02 0.40 -0.31 0.00 0.00 0.00 0.00 60.65 60.76 3gyr s ILE 436 Cb 0.09 -3.26 -0.13 0.00 0.01 0.00 0.00 42.46 39.17 3gyr s ILE 436 CO 0.46 0.02 1.49 -2.65 0.00 0.00 0.00 174.94 174.27 3gyr n PRO 437 N 4.29 2.23 -3.70 2.79 -0.02 -1.26 -4.99 135.00 134.35 3gyr n PRO 437 Ca 0.14 0.80 -0.14 0.00 -2.02 0.00 0.00 63.50 62.28 3gyr n PRO 437 Cb 0.38 -2.51 -0.08 0.00 -0.02 0.00 0.00 33.50 31.28 3gyr n PRO 437 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3gyr s HIS 438 N 0.18 -0.28 1.02 6.00 -3.43 -1.26 -4.46 115.29 113.06 3gyr s HIS 438 Ca 0.69 0.42 -0.17 0.00 -0.80 0.00 0.00 55.06 55.20 3gyr s HIS 438 Cb -0.62 0.18 0.23 0.00 -1.43 0.00 0.00 32.58 30.94 3gyr s HIS 438 CO 0.46 -0.47 1.32 0.20 -2.00 0.00 0.00 174.74 174.25 3gyr s GLY 439 N -1.44 1.78 -0.01 -1.38 0.00 -0.87 -4.87 107.32 100.54 3gyr s GLY 439 Ca -0.11 -1.26 0.02 0.00 0.00 0.00 0.00 44.72 43.37 3gyr s GLY 439 CO 0.04 -0.43 -0.07 0.30 0.00 0.00 0.00 173.10 172.94 3gyr s HIS 440 N -3.82 0.66 0.01 1.90 3.76 -1.26 -1.32 115.29 115.22 3gyr s HIS 440 Ca 0.75 -0.13 0.07 0.00 -0.15 0.00 0.00 55.06 55.60 3gyr s HIS 440 Cb -0.03 -0.43 -0.02 0.00 1.11 0.00 0.00 32.58 33.21 3gyr s HIS 440 CO 0.54 -0.02 -0.20 1.03 -0.85 0.00 0.00 174.74 175.24 3gyr s ARG 441 N -0.14 1.49 -0.20 1.40 1.81 0.01 -4.96 118.95 118.37 3gyr s ARG 441 Ca 0.02 -0.81 -0.02 0.00 -1.72 0.00 0.00 55.73 53.21 3gyr s ARG 441 Cb -0.03 -1.51 -0.00 0.00 -0.45 0.00 0.00 34.95 32.96 3gyr s ARG 441 CO -0.00 0.40 -0.10 -1.17 -0.68 0.00 0.00 175.30 173.75 3gyr s LEU 442 N -0.78 2.67 -0.22 2.53 2.96 -1.26 -0.82 118.68 123.76 3gyr s LEU 442 Ca 0.07 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.55 3gyr s LEU 442 Cb -0.08 -1.65 0.04 0.00 0.50 0.00 0.00 46.19 45.00 3gyr s LEU 442 CO 0.00 0.01 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.29 3gyr s ILE 443 N 1.25 1.94 -0.10 6.68 -1.09 0.39 -2.39 121.20 127.89 3gyr s ILE 443 Ca 0.03 -1.24 -0.12 0.00 -2.23 0.00 0.00 60.65 57.08 3gyr s ILE 443 Cb -0.14 -1.97 -0.05 0.00 -1.58 0.00 0.00 42.46 38.72 3gyr s ILE 443 CO -0.04 0.17 0.29 -0.69 -1.23 0.00 0.00 174.94 173.44 3gyr s VAL 444 N 1.26 5.27 -0.29 2.92 1.01 -0.20 0.77 120.40 131.14 3gyr s VAL 444 Ca -0.03 0.55 -0.07 0.00 0.00 0.00 0.00 61.98 62.43 3gyr s VAL 444 Cb -0.17 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.62 3gyr s VAL 444 CO -0.08 0.51 0.08 -0.76 0.00 0.00 0.00 175.10 174.85 3gyr s LEU 445 N -0.39 3.80 0.22 3.92 1.43 -0.05 0.63 118.68 128.25 3gyr s LEU 445 Ca 0.18 -0.65 -0.06 0.00 -1.03 0.00 0.00 54.13 52.57 3gyr s LEU 445 Cb -0.14 -1.89 -0.06 0.00 0.03 0.00 0.00 46.19 44.14 3gyr s LEU 445 CO 0.07 -0.17 0.49 0.42 0.23 0.00 0.00 176.35 177.39 3gyr s THR 446 N 1.51 5.04 0.66 5.49 -4.23 -0.76 -1.28 115.64 122.07 3gyr s THR 446 Ca 0.03 0.17 -0.16 0.00 -1.18 0.00 0.00 61.69 60.55 3gyr s THR 446 Cb -0.17 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 70.01 3gyr s THR 446 CO 0.03 -0.13 1.16 -2.16 -0.54 0.00 0.00 174.62 172.97 3gyr s PRO 447 N -3.05 2.65 0.33 3.99 0.04 -1.26 -3.63 135.00 134.08 3gyr s PRO 447 Ca 0.44 1.60 0.02 0.00 0.04 0.00 0.00 61.00 63.10 3gyr s PRO 447 Cb -0.11 -1.91 0.60 0.00 0.04 0.00 0.00 34.50 33.11 3gyr s PRO 447 CO 0.25 -1.40 1.97 -1.35 0.04 0.00 0.00 177.00 176.51 3gyr h PRO 448 N 0.15 0.90 -0.80 0.56 0.11 -1.84 -2.91 132.00 128.17 3gyr h PRO 448 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3gyr h PRO 448 Cb 1.27 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3gyr h PRO 448 CO 0.53 0.60 0.00 0.41 -0.21 0.00 0.00 178.00 179.33 3gyr n GLY 449 N -1.43 1.32 3.75 -0.55 0.00 -1.26 -2.42 105.19 104.59 3gyr n GLY 449 Ca 0.10 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3gyr n GLY 449 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gyr s THR 450 N -1.34 3.16 0.02 2.61 2.01 -1.10 -4.73 115.64 116.27 3gyr s THR 450 Ca 0.07 1.02 -0.38 0.00 0.31 0.00 0.00 61.69 62.71 3gyr s THR 450 Cb 0.05 -3.65 -0.17 0.00 0.01 0.00 0.00 72.50 68.74 3gyr s THR 450 CO 0.02 0.18 1.38 1.17 -0.69 0.00 0.00 174.62 176.69 3gyr n LYS 451 N 2.06 1.05 -0.63 4.92 4.81 0.10 -2.00 118.16 128.47 3gyr n LYS 451 Ca 0.04 0.38 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 3gyr n LYS 451 Cb 0.43 -2.02 0.00 0.00 0.02 0.00 0.00 35.03 33.46 3gyr n LYS 451 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gyr n GLY 452 N 2.72 0.69 0.21 3.14 0.00 -1.26 -4.83 105.19 105.85 3gyr n GLY 452 Ca 0.20 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.29 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 1.23 -1.90 1.61 3.41 -0.85 -4.95 113.62 112.18 3gyr n SER 453 Ca 0.00 -1.12 -0.19 0.00 -0.26 0.00 0.00 58.87 57.30 3gyr n SER 453 Cb 0.00 0.69 -0.04 0.00 -0.26 0.00 0.00 64.21 64.60 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 1.22 0.54 1.54 5.00 0.00 -1.26 -2.97 105.19 109.27 3gyr n GLY 454 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.84 0.58 3.61 -0.02 0.00 -1.21 -4.92 105.19 102.37 3gyr n GLY 455 Ca -0.21 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 3gyr n GLY 455 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3gyr s HIS 456 N -2.00 3.02 0.78 1.61 3.76 -1.02 -4.50 115.29 116.94 3gyr s HIS 456 Ca 0.00 0.04 -0.14 0.00 -0.15 0.00 0.00 55.06 54.81 3gyr s HIS 456 Cb 0.00 -1.77 0.07 0.00 1.11 0.00 0.00 32.58 31.99 3gyr s HIS 456 CO 0.00 0.33 1.22 -1.25 -0.85 0.00 0.00 174.74 174.19 3gyr s PRO 457 N -0.69 1.79 0.05 8.40 0.04 -1.26 -4.57 135.00 138.76 3gyr s PRO 457 Ca 0.11 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.96 3gyr s PRO 457 Cb -0.11 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 3gyr s PRO 457 CO 0.02 -2.11 -0.04 -1.21 0.04 0.00 0.00 177.00 173.69 3gyr s GLU 458 N -4.01 0.59 -0.06 4.56 2.02 -1.24 -4.78 118.70 115.78 3gyr s GLU 458 Ca 0.75 -1.06 -0.24 0.00 0.02 0.00 0.00 54.97 54.43 3gyr s GLU 458 Cb -0.30 0.03 -0.03 0.00 0.10 0.00 0.00 34.13 33.93 3gyr s GLU 458 CO 0.49 -0.06 0.74 0.42 0.02 0.00 0.00 175.26 176.87 3gyr s ILE 459 N -3.03 5.01 -0.19 -1.63 1.01 -1.26 -1.84 121.20 119.29 3gyr s ILE 459 Ca 0.01 1.54 -0.01 0.00 0.00 0.00 0.00 60.65 62.19 3gyr s ILE 459 Cb 0.01 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.41 3gyr s ILE 459 CO -0.06 0.23 -0.14 0.26 0.00 0.00 0.00 174.94 175.23 3gyr s TRP 460 N 0.91 2.84 0.23 3.97 0.52 0.21 -4.03 118.94 123.58 3gyr s TRP 460 Ca 0.39 -1.25 -0.29 0.00 0.02 0.00 0.00 56.10 54.98 3gyr s TRP 460 Cb -0.18 -1.97 -0.09 0.00 -1.15 0.00 0.00 33.47 30.08 3gyr s TRP 460 CO 0.19 -0.63 0.91 -1.21 0.02 0.00 0.00 176.95 176.23 3gyr s GLU 461 N 1.21 4.76 -0.06 4.98 2.02 -0.56 -1.03 118.70 130.02 3gyr s GLU 461 Ca 0.02 1.40 0.03 0.00 0.02 0.00 0.00 54.97 56.44 3gyr s GLU 461 Cb -0.14 -3.22 0.01 0.00 0.10 0.00 0.00 34.13 30.88 3gyr s GLU 461 CO -0.06 0.50 -0.16 -1.64 0.02 0.00 0.00 175.26 173.92 3gyr s MET 462 N -1.28 1.92 -0.06 1.61 -1.94 -1.00 -0.96 119.30 117.59 3gyr s MET 462 Ca 0.41 -0.55 -0.01 0.00 -1.71 0.00 0.00 55.69 53.82 3gyr s MET 462 Cb -0.24 -1.58 -0.04 0.00 2.01 0.00 0.00 34.83 34.98 3gyr s MET 462 CO 0.30 0.13 0.03 0.00 -0.01 0.00 0.00 175.02 175.47 3gyr s ALA 463 N 0.38 3.40 0.30 3.03 0.00 0.30 -4.43 121.76 124.74 3gyr s ALA 463 Ca -0.11 -0.83 -0.28 0.00 0.00 0.00 0.00 51.96 50.74 3gyr s ALA 463 Cb -0.14 -1.52 -0.09 0.00 0.00 0.00 0.00 23.12 21.36 3gyr s ALA 463 CO 0.04 0.62 1.07 -2.00 0.00 0.00 0.00 175.76 175.49 3gyr s GLU 464 N -1.17 4.57 0.17 0.00 2.12 -1.26 0.14 118.70 123.27 3gyr s GLU 464 Ca 0.16 1.70 0.04 0.00 0.36 0.00 0.00 54.97 57.23 3gyr s GLU 464 Cb -0.12 -3.06 -0.04 0.00 0.26 0.00 0.00 34.13 31.17 3gyr s GLU 464 CO 0.06 0.18 0.22 0.08 -0.54 0.00 0.00 175.26 175.26 3gyr s VAL 465 N -1.27 4.92 -0.36 3.70 1.01 0.34 -4.87 120.40 123.87 3gyr s VAL 465 Ca 0.47 -0.91 0.13 0.00 0.00 0.00 0.00 61.98 61.67 3gyr s VAL 465 Cb -0.29 -3.54 0.44 0.00 0.00 0.00 0.00 36.38 32.99 3gyr s VAL 465 CO 0.37 -0.13 1.00 -0.62 0.00 0.00 0.00 175.10 175.72 3gyr n GLU 466 N -0.56 1.95 0.00 2.72 4.71 -1.26 -4.74 120.64 123.46 3gyr n GLU 466 Ca -0.08 -3.70 0.00 0.00 -0.01 0.00 0.00 57.16 53.37 3gyr n GLU 466 Cb 0.55 -1.61 0.00 0.00 -1.01 0.00 0.00 31.44 29.37 3gyr n GLU 466 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 3gyr n GLN 472 N -0.20 0.00 -4.31 3.49 6.02 -1.26 -5.21 117.38 115.91 3gyr n GLN 472 Ca 0.20 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.96 3gyr n GLN 472 Cb 0.76 0.00 -0.17 0.00 1.02 0.00 0.00 30.24 31.85 3gyr n GLN 472 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3gyr s VAL 473 N 0.00 0.88 0.20 5.09 1.01 -1.26 -3.60 120.40 122.72 3gyr s VAL 473 Ca 0.00 -0.30 -0.25 0.00 0.00 0.00 0.00 61.98 61.43 3gyr s VAL 473 Cb 0.00 -0.85 -0.08 0.00 0.00 0.00 0.00 36.38 35.45 3gyr s VAL 473 CO 0.00 0.31 0.81 -2.16 0.00 0.00 0.00 175.10 174.06 3gyr s PRO 474 N 0.96 4.55 -0.03 2.72 0.04 -1.26 -5.17 135.00 136.81 3gyr s PRO 474 Ca -0.10 1.17 -0.17 0.00 0.04 0.00 0.00 61.00 61.95 3gyr s PRO 474 Cb -0.15 -3.14 0.03 0.00 0.04 0.00 0.00 34.50 31.28 3gyr s PRO 474 CO 0.00 0.50 0.36 0.00 0.04 0.00 0.00 177.00 177.90 3gyr s ALA 475 N -1.27 -0.92 0.18 8.56 0.00 -1.24 -5.10 121.76 121.97 3gyr s ALA 475 Ca 0.39 0.51 -0.32 0.00 0.00 0.00 0.00 51.96 52.54 3gyr s ALA 475 Cb -0.22 0.00 -0.12 0.00 0.00 0.00 0.00 23.12 22.79 3gyr s ALA 475 CO 0.26 -0.27 1.75 -1.91 0.00 0.00 0.00 175.76 175.59 3gyr n GLU 476 N 1.37 2.72 -0.82 0.00 2.13 -1.26 -1.67 120.64 123.12 3gyr n GLU 476 Ca -0.21 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.60 3gyr n GLU 476 Cb 0.56 -2.84 0.00 0.00 0.27 0.00 0.00 31.44 29.43 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 4.00 0.74 3.57 8.31 0.00 0.21 -4.94 105.19 117.08 3gyr n GLY 477 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 3gyr n GLY 477 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gyr s VAL 478 N -2.75 4.14 -0.02 1.61 1.01 -0.67 -0.52 120.40 123.20 3gyr s VAL 478 Ca 0.00 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.71 3gyr s VAL 478 Cb 0.00 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.59 3gyr s VAL 478 CO 0.00 0.52 -0.03 -0.63 0.00 0.00 0.00 175.10 174.95 3gyr s ILE 479 N 0.04 0.36 -0.03 2.22 1.01 0.35 -1.24 121.20 123.91 3gyr s ILE 479 Ca 0.02 -0.09 0.03 0.00 0.00 0.00 0.00 60.65 60.61 3gyr s ILE 479 Cb -0.13 -0.38 -0.03 0.00 0.01 0.00 0.00 42.46 41.93 3gyr s ILE 479 CO 0.02 0.15 -0.11 -1.10 0.00 0.00 0.00 174.94 173.91 3gyr s GLN 480 N 0.56 2.54 -0.15 2.79 -0.21 -1.26 -0.33 119.66 123.60 3gyr s GLN 480 Ca -0.06 -0.69 -0.01 0.00 0.02 0.00 0.00 55.36 54.62 3gyr s GLN 480 Cb -0.10 -2.45 0.04 0.00 1.00 0.00 0.00 33.01 31.50 3gyr s GLN 480 CO -0.01 0.62 -0.05 0.08 -2.12 0.00 0.00 175.29 173.82 3gyr s VAL 481 N -0.84 1.02 -0.65 1.09 1.01 -0.00 0.05 120.40 122.08 3gyr s VAL 481 Ca 0.13 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.36 3gyr s VAL 481 Cb -0.11 -1.17 0.04 0.00 0.00 0.00 0.00 36.38 35.14 3gyr s VAL 481 CO 0.03 0.18 1.10 -0.89 0.00 0.00 0.00 175.10 175.51 3gyr s THR 482 N 1.68 4.10 0.66 3.92 2.01 0.78 -0.57 115.64 128.21 3gyr s THR 482 Ca 0.02 0.25 -0.11 0.00 0.31 0.00 0.00 61.69 62.16 3gyr s THR 482 Cb -0.15 -4.73 0.16 0.00 0.01 0.00 0.00 72.50 67.80 3gyr s THR 482 CO -0.08 -1.48 0.57 0.61 -0.69 0.00 0.00 174.62 173.55 3gyr n GLY 483 N 5.25 -2.70 0.24 4.40 0.00 -0.20 -2.12 105.19 110.06 3gyr n GLY 483 Ca 0.02 -1.46 0.09 0.00 0.00 0.00 0.00 46.02 44.67 3gyr n GLY 483 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr h ALA 484 N -2.42 1.44 -0.32 4.61 0.00 -1.93 -2.46 119.26 118.18 3gyr h ALA 484 Ca -0.22 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3gyr h ALA 484 Cb 0.66 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3gyr h ALA 484 CO 0.14 0.20 0.00 -0.40 0.00 0.00 0.00 179.25 179.19 3gyr n ASP 485 N -3.92 3.26 0.00 0.00 5.68 -1.26 -4.90 116.55 115.41 3gyr n ASP 485 Ca -0.02 -2.40 0.00 0.00 -0.50 0.00 0.00 54.79 51.87 3gyr n ASP 485 Cb 0.25 -0.54 0.00 0.00 -1.14 0.00 0.00 41.12 39.69 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 0.48 2.36 3.76 6.12 0.00 -0.93 -4.98 105.19 112.00 3gyr n GLY 486 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3gyr n GLY 486 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gyr s ARG 487 N 0.00 4.55 -0.28 1.61 3.52 -1.26 -4.82 118.95 122.27 3gyr s ARG 487 Ca 0.00 1.91 -0.10 0.00 -0.13 0.00 0.00 55.73 57.41 3gyr s ARG 487 Cb 0.00 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.18 3gyr s ARG 487 CO 0.00 0.07 0.15 0.99 -0.81 0.00 0.00 175.30 175.70 3gyr s THR 488 N -0.96 4.92 0.14 4.11 2.01 -1.26 -1.03 115.64 123.57 3gyr s THR 488 Ca 0.47 -0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.45 3gyr s THR 488 Cb -0.34 -3.36 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 3gyr s THR 488 CO 0.43 0.24 0.29 -0.54 -0.69 0.00 0.00 174.62 174.34 3gyr s LYS 489 N 1.70 3.45 -0.14 4.92 1.02 0.27 -4.91 119.74 126.05 3gyr s LYS 489 Ca 0.06 -0.54 0.02 0.00 0.02 0.00 0.00 55.97 55.53 3gyr s LYS 489 Cb -0.16 -2.96 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 3gyr s LYS 489 CO 0.08 0.52 -0.19 0.99 -0.92 0.00 0.00 175.35 175.83 3gyr s THR 490 N -1.72 2.38 0.05 2.17 2.01 -1.26 -0.82 115.64 118.44 3gyr s THR 490 Ca 0.35 -0.88 0.08 0.00 0.31 0.00 0.00 61.69 61.55 3gyr s THR 490 Cb -0.11 -1.97 -0.03 0.00 0.01 0.00 0.00 72.50 70.40 3gyr s THR 490 CO 0.28 0.53 -0.23 -0.31 -0.69 0.00 0.00 174.62 174.21 3gyr s TYR 491 N 0.72 1.98 -0.06 4.92 1.51 0.55 -0.50 117.35 126.47 3gyr s TYR 491 Ca -0.08 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.62 3gyr s TYR 491 Cb -0.16 -1.18 -0.03 0.00 -0.11 0.00 0.00 41.96 40.49 3gyr s TYR 491 CO 0.01 0.11 -0.12 0.50 -1.11 0.00 0.00 175.55 174.94 3gyr s ARG 492 N -1.23 2.60 0.07 -0.62 3.52 0.12 -0.49 118.95 122.92 3gyr s ARG 492 Ca 0.09 -0.64 -0.30 0.00 -0.13 0.00 0.00 55.73 54.75 3gyr s ARG 492 Cb -0.09 -2.46 -0.05 0.00 -1.56 0.00 0.00 34.95 30.79 3gyr s ARG 492 CO 0.02 0.64 1.06 0.50 -0.81 0.00 0.00 175.30 176.71 3gyr s ARG 493 N -0.75 4.56 -0.00 5.12 3.52 0.32 -0.54 118.95 131.17 3gyr s ARG 493 Ca 0.12 1.58 0.03 0.00 -0.13 0.00 0.00 55.73 57.33 3gyr s ARG 493 Cb -0.11 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.87 3gyr s ARG 493 CO 0.01 -0.03 0.11 0.25 -0.81 0.00 0.00 175.30 174.82 3gyr n THR 494 N 3.41 0.00 -3.60 4.11 -2.24 -0.13 -4.92 114.28 110.90 3gyr n THR 494 Ca 0.05 -0.30 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 3gyr n THR 494 Cb 0.48 0.79 -0.07 0.00 -2.10 0.00 0.00 70.33 69.44 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 -1.62 -1.82 0.00 6.98 0.00 -1.24 -4.89 121.76 119.17 3gyr s ALA 495 Ca 0.00 1.78 0.00 0.00 0.00 0.00 0.00 51.96 53.74 3gyr s ALA 495 Cb 0.02 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.28 3gyr s ALA 495 CO 0.13 -0.33 0.21 2.89 0.00 0.00 0.00 175.76 178.66 3gyr n ARG 496 N 1.98 2.10 -3.52 0.00 1.85 -1.26 -1.50 116.66 116.31 3gyr n ARG 496 Ca -0.15 -0.21 -0.09 0.00 -1.00 0.00 0.00 57.85 56.40 3gyr n ARG 496 Cb 0.56 -0.66 -0.02 0.00 -1.05 0.00 0.00 32.46 31.29 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 -0.36 0.00 0.20 8.89 -1.32 -1.26 -4.19 115.64 117.60 3gyr s THR 497 Ca 0.00 -0.12 -0.20 0.00 -1.21 0.00 0.00 61.69 60.15 3gyr s THR 497 Cb 0.00 -1.16 0.15 0.00 -1.51 0.00 0.00 72.50 69.98 3gyr s THR 497 CO 0.00 0.00 1.57 0.15 -2.21 0.00 0.00 174.62 174.13 3gyr h PHE 498 N 2.00 -1.05 -0.14 9.09 3.04 -1.16 0.21 116.94 128.93 3gyr h PHE 498 Ca -0.26 0.09 0.00 0.00 3.98 0.00 0.00 57.97 61.78 3gyr h PHE 498 Cb 1.26 0.57 0.00 0.00 2.56 0.00 0.00 35.95 40.34 3gyr h PHE 498 CO 0.27 -0.39 0.00 0.09 -2.02 0.00 0.00 178.31 176.26 3gyr n ASN 499 N -5.44 0.81 -4.75 0.41 5.03 -1.26 -4.55 115.26 105.50 3gyr n ASN 499 Ca 0.06 -2.01 -0.32 0.00 0.87 0.00 0.00 54.58 53.18 3gyr n ASN 499 Cb 0.37 -0.11 0.08 0.00 -1.02 0.00 0.00 39.78 39.10 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 -0.97 4.54 0.35 6.41 1.01 0.72 -4.93 116.67 123.80 3gyr s ASP 500 Ca 0.10 2.04 -0.23 0.00 0.71 0.00 0.00 52.55 55.17 3gyr s ASP 500 Cb 0.05 -2.55 -0.16 0.00 1.01 0.00 0.00 42.92 41.27 3gyr s ASP 500 CO 0.06 -2.01 0.24 0.61 0.21 0.00 0.00 175.17 174.29 3gyr n GLY 501 N -0.46 -2.36 3.54 0.21 0.00 -1.26 -4.86 105.19 100.00 3gyr n GLY 501 Ca 0.11 0.09 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 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 2.15 1.12 -0.02 0.99 7.94 -1.26 -4.93 117.00 122.99 3gyr n LEU 502 Ca 0.13 1.08 -0.03 0.00 -1.11 0.00 0.00 56.01 56.08 3gyr n LEU 502 Cb 0.36 -1.22 -0.01 0.00 0.53 0.00 0.00 43.42 43.08 3gyr n LEU 502 CO 0.55 -1.97 -0.60 0.61 -1.11 0.00 0.00 177.39 174.87 3gyr n GLY 503 N 1.45 -0.05 3.48 -3.96 0.00 -1.26 -5.01 105.19 99.83 3gyr n GLY 503 Ca 0.11 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.06 3.20 -0.12 1.61 0.08 -1.26 -5.03 117.98 114.39 3gyr s PHE 504 Ca -0.04 -0.44 -0.01 0.00 0.12 0.00 0.00 56.93 56.57 3gyr s PHE 504 Cb 0.01 -2.78 -0.02 0.00 -0.57 0.00 0.00 43.02 39.66 3gyr s PHE 504 CO 0.06 -0.65 -0.10 0.99 -0.10 0.00 0.00 175.22 175.42 3gyr s THR 505 N 1.97 3.34 -0.05 0.64 2.01 -1.26 -1.10 115.64 121.20 3gyr s THR 505 Ca 0.10 -0.57 0.00 0.00 0.31 0.00 0.00 61.69 61.53 3gyr s THR 505 Cb -0.18 -2.41 0.02 0.00 0.01 0.00 0.00 72.50 69.95 3gyr s THR 505 CO 0.12 0.53 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.93 3gyr s ILE 506 N 0.15 0.42 0.09 1.82 1.01 0.70 -4.97 121.20 120.42 3gyr s ILE 506 Ca -0.05 -0.01 -0.31 0.00 0.00 0.00 0.00 60.65 60.28 3gyr s ILE 506 Cb -0.15 -0.50 -0.07 0.00 0.01 0.00 0.00 42.46 41.75 3gyr s ILE 506 CO 0.04 0.22 1.39 -0.83 0.00 0.00 0.00 174.94 175.76 3gyr s GLY 507 N 1.25 1.96 0.28 6.18 0.00 -1.26 -1.65 107.32 114.08 3gyr s GLY 507 Ca -0.06 1.06 -0.30 0.00 0.00 0.00 0.00 44.72 45.42 3gyr s GLY 507 CO -0.02 2.38 1.30 -2.21 0.00 0.00 0.00 173.10 174.55 3gyr n GLU 508 N 4.28 1.92 -0.13 2.90 0.00 0.26 -2.09 120.64 127.79 3gyr n GLU 508 Ca 0.12 0.68 0.00 0.00 0.00 0.00 0.00 57.16 57.96 3gyr n GLU 508 Cb 0.43 -2.26 0.00 0.00 0.00 0.00 0.00 31.44 29.60 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 1.56 1.40 3.86 8.31 0.00 0.37 -4.53 105.19 116.15 3gyr n GLY 509 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.66 4.56 0.01 2.61 -4.23 -0.89 -4.79 115.64 110.26 3gyr s THR 510 Ca 0.00 0.88 -0.01 0.00 -1.18 0.00 0.00 61.69 61.38 3gyr s THR 510 Cb 0.00 -3.76 -0.04 0.00 1.34 0.00 0.00 72.50 70.04 3gyr s THR 510 CO 0.00 -1.03 0.14 -1.00 -0.54 0.00 0.00 174.62 172.19 3gyr s HIS 511 N -3.08 3.41 0.02 3.99 3.76 -1.26 -1.76 115.29 120.37 3gyr s HIS 511 Ca 0.56 0.26 0.01 0.00 -0.15 0.00 0.00 55.06 55.74 3gyr s HIS 511 Cb -0.11 -1.76 -0.01 0.00 1.11 0.00 0.00 32.58 31.80 3gyr s HIS 511 CO 0.51 0.59 -0.05 -1.21 -0.85 0.00 0.00 174.74 173.73 3gyr s GLU 512 N -2.00 0.37 -0.21 1.40 2.02 -0.27 -2.05 118.70 117.95 3gyr s GLU 512 Ca 0.27 -0.42 -0.14 0.00 0.02 0.00 0.00 54.97 54.71 3gyr s GLU 512 Cb -0.12 -0.22 -0.04 0.00 0.10 0.00 0.00 34.13 33.85 3gyr s GLU 512 CO 0.19 0.05 0.30 -1.14 0.02 0.00 0.00 175.26 174.67 3gyr s GLN 513 N -0.81 4.14 -0.12 1.61 0.74 -0.43 -1.42 119.66 123.36 3gyr s GLN 513 Ca -0.05 0.01 -0.03 0.00 0.05 0.00 0.00 55.36 55.33 3gyr s GLN 513 Cb -0.06 -3.53 -0.03 0.00 1.10 0.00 0.00 33.01 30.49 3gyr s GLN 513 CO -0.00 0.02 0.00 -1.58 -0.55 0.00 0.00 175.29 173.18 3gyr s TRP 514 N 1.16 3.15 -0.19 1.67 0.52 0.15 -0.81 118.94 124.60 3gyr s TRP 514 Ca 0.14 0.04 -0.04 0.00 0.02 0.00 0.00 56.10 56.27 3gyr s TRP 514 Cb -0.14 -1.89 -0.02 0.00 -1.15 0.00 0.00 33.47 30.27 3gyr s TRP 514 CO 0.06 0.28 -0.04 0.99 0.02 0.00 0.00 176.95 178.26 3gyr s THR 515 N -0.31 3.66 -0.32 2.01 2.01 0.00 -0.92 115.64 121.78 3gyr s THR 515 Ca 0.07 -0.42 -0.15 0.00 0.31 0.00 0.00 61.69 61.50 3gyr s THR 515 Cb -0.12 -2.63 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 3gyr s THR 515 CO 0.02 0.45 0.36 -0.36 -0.69 0.00 0.00 174.62 174.41 3gyr s PHE 516 N 0.91 3.22 -0.41 4.92 0.40 0.12 -0.46 117.98 126.67 3gyr s PHE 516 Ca -0.00 0.11 -0.04 0.00 -0.60 0.00 0.00 56.93 56.39 3gyr s PHE 516 Cb -0.15 -2.64 0.10 0.00 0.51 0.00 0.00 43.02 40.85 3gyr s PHE 516 CO 0.01 -0.37 0.21 -1.17 0.70 0.00 0.00 175.22 174.61 3gyr s LEU 517 N 2.04 5.19 -0.27 -0.37 2.96 0.23 -0.52 118.68 127.93 3gyr s LEU 517 Ca 0.13 -1.90 -0.19 0.00 -0.22 0.00 0.00 54.13 51.95 3gyr s LEU 517 Cb -0.16 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 3gyr s LEU 517 CO 0.11 -0.54 0.57 0.21 -1.32 0.00 0.00 176.35 175.38 3gyr s ASN 518 N 1.92 6.48 0.00 3.68 3.84 0.24 -0.87 114.94 130.23 3gyr s ASN 518 Ca 0.06 0.54 0.24 0.00 0.21 0.00 0.00 52.86 53.91 3gyr s ASN 518 Cb -0.23 -2.31 0.25 0.00 -0.55 0.00 0.00 41.25 38.41 3gyr s ASN 518 CO -0.03 -0.35 1.25 0.18 -2.79 0.00 0.00 177.10 175.36 3gyr n LEU 519 N 5.66 1.75 -4.86 3.21 4.77 -0.40 -0.49 117.00 126.64 3gyr n LEU 519 Ca -0.03 -0.61 -0.22 0.00 -0.03 0.00 0.00 56.01 55.12 3gyr n LEU 519 Cb 0.49 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 3gyr n LEU 519 CO 0.42 0.32 -0.02 -0.94 -1.33 0.00 0.00 177.39 175.85 3gyr s SER 520 N -2.46 4.86 0.00 -1.43 1.04 -1.25 -4.70 113.70 109.76 3gyr s SER 520 Ca 0.21 -0.89 0.19 0.00 0.48 0.00 0.00 55.95 55.94 3gyr s SER 520 Cb 0.19 -0.39 0.51 0.00 0.10 0.00 0.00 66.02 66.43 3gyr s SER 520 CO 0.55 -0.71 1.42 -0.81 0.98 0.00 0.00 173.24 174.67 3gyr n PRO 521 N -1.53 2.21 -2.79 4.02 -0.04 -1.26 -2.57 135.00 133.05 3gyr n PRO 521 Ca 0.02 -1.87 -0.42 0.00 -0.04 0.00 0.00 63.50 61.19 3gyr n PRO 521 Cb 0.63 -1.43 -0.03 0.00 -0.04 0.00 0.00 33.50 32.62 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 -1.40 4.88 -0.15 0.52 1.01 -1.26 -4.10 121.20 120.70 3gyr s ILE 522 Ca 0.36 1.88 -0.29 0.00 0.00 0.00 0.00 60.65 62.60 3gyr s ILE 522 Cb 0.19 -4.24 -0.01 0.00 0.01 0.00 0.00 42.46 38.42 3gyr s ILE 522 CO 0.26 0.11 1.05 -0.22 0.00 0.00 0.00 174.94 176.14 3gyr s LEU 523 N 1.46 4.19 -0.17 2.97 0.20 -1.26 -4.14 118.68 121.92 3gyr s LEU 523 Ca 0.46 1.51 -0.02 0.00 0.69 0.00 0.00 54.13 56.77 3gyr s LEU 523 Cb -0.19 -3.55 -0.01 0.00 -0.43 0.00 0.00 46.19 42.01 3gyr s LEU 523 CO 0.21 -0.56 -0.08 -1.00 -0.29 0.00 0.00 176.35 174.63 3gyr s HIS 524 N 2.54 2.91 -0.67 5.38 3.76 -0.88 -4.94 115.29 123.39 3gyr s HIS 524 Ca 0.48 -0.71 -0.27 0.00 -0.15 0.00 0.00 55.06 54.41 3gyr s HIS 524 Cb -0.18 -1.97 0.03 0.00 1.11 0.00 0.00 32.58 31.57 3gyr s HIS 524 CO 0.14 -0.32 1.21 -1.25 -0.85 0.00 0.00 174.74 173.66 3gyr s PRO 525 N 0.82 3.29 0.07 8.40 0.04 -1.26 -0.67 135.00 145.69 3gyr s PRO 525 Ca -0.03 -0.14 -0.21 0.00 0.04 0.00 0.00 61.00 60.67 3gyr s PRO 525 Cb -0.15 -4.12 -0.06 0.00 0.04 0.00 0.00 34.50 30.20 3gyr s PRO 525 CO 0.01 -1.94 0.62 -1.64 0.04 0.00 0.00 177.00 174.10 3gyr s MET 526 N 5.25 4.31 -0.01 4.56 -1.94 0.13 -0.37 119.30 131.22 3gyr s MET 526 Ca 0.36 0.83 0.03 0.00 -1.71 0.00 0.00 55.69 55.20 3gyr s MET 526 Cb -0.09 -3.28 -0.00 0.00 2.01 0.00 0.00 34.83 33.47 3gyr s MET 526 CO 0.18 0.54 -0.09 -1.58 -0.01 0.00 0.00 175.02 174.06 3gyr s HIS 527 N -0.82 0.81 -0.10 -0.03 5.04 -0.16 -0.17 115.29 119.86 3gyr s HIS 527 Ca 0.31 -0.16 0.04 0.00 -1.54 0.00 0.00 55.06 53.71 3gyr s HIS 527 Cb -0.20 -0.53 -0.01 0.00 0.04 0.00 0.00 32.58 31.88 3gyr s HIS 527 CO 0.20 -0.03 -0.22 0.42 -2.34 0.00 0.00 174.74 172.77 3gyr s ILE 528 N -0.13 2.25 1.08 0.89 1.01 -1.10 -1.06 121.20 124.14 3gyr s ILE 528 Ca 0.02 -0.96 -0.16 0.00 0.00 0.00 0.00 60.65 59.55 3gyr s ILE 528 Cb -0.04 -1.87 0.23 0.00 0.01 0.00 0.00 42.46 40.79 3gyr s ILE 528 CO -0.00 0.56 1.13 -1.00 0.00 0.00 0.00 174.94 175.62 3gyr s HIS 529 N 0.22 1.40 0.00 3.97 3.76 -0.17 -4.36 115.29 120.11 3gyr s HIS 529 Ca -0.14 0.69 0.00 0.00 -0.15 0.00 0.00 55.06 55.46 3gyr s HIS 529 Cb -0.17 -3.44 0.00 0.00 1.11 0.00 0.00 32.58 30.09 3gyr s HIS 529 CO 0.07 -3.26 0.00 -0.11 -0.85 0.00 0.00 174.74 170.59 3gyr n LEU 530 N -4.36 0.00 -4.78 0.89 7.94 -1.26 -4.88 117.00 110.55 3gyr n LEU 530 Ca 0.10 0.00 -0.24 0.00 -1.11 0.00 0.00 56.01 54.75 3gyr n LEU 530 Cb 0.59 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.48 3gyr n LEU 530 CO 0.51 0.00 -0.22 0.00 -1.11 0.00 0.00 177.39 176.57 3gyr s ALA 531 N 0.00 3.50 -0.04 1.96 0.00 -1.26 -4.27 121.76 121.64 3gyr s ALA 531 Ca 0.00 -1.34 -0.13 0.00 0.00 0.00 0.00 51.96 50.49 3gyr s ALA 531 Cb 0.00 -1.25 -0.05 0.00 0.00 0.00 0.00 23.12 21.82 3gyr s ALA 531 CO 0.00 0.39 0.34 -0.51 0.00 0.00 0.00 175.76 175.98 3gyr s ASP 532 N -3.40 6.68 0.18 0.00 1.01 -1.26 -4.75 116.67 115.13 3gyr s ASP 532 Ca 0.31 0.81 0.07 0.00 0.71 0.00 0.00 52.55 54.45 3gyr s ASP 532 Cb -0.09 -2.20 -0.05 0.00 1.01 0.00 0.00 42.92 41.59 3gyr s ASP 532 CO 0.23 0.32 -0.13 -0.36 0.21 0.00 0.00 175.17 175.44 3gyr s PHE 533 N -0.92 1.54 0.05 4.23 0.40 -0.41 -3.84 117.98 119.04 3gyr s PHE 533 Ca 0.21 -0.63 0.09 0.00 -0.60 0.00 0.00 56.93 56.00 3gyr s PHE 533 Cb -0.15 -0.74 -0.03 0.00 0.51 0.00 0.00 43.02 42.61 3gyr s PHE 533 CO 0.10 0.25 -0.25 -0.65 0.70 0.00 0.00 175.22 175.38 3gyr s GLN 534 N -3.59 1.64 -0.24 0.44 -0.21 -0.59 -0.90 119.66 116.22 3gyr s GLN 534 Ca 0.19 -1.07 -0.29 0.00 0.02 0.00 0.00 55.36 54.21 3gyr s GLN 534 Cb -0.00 -1.82 0.01 0.00 1.00 0.00 0.00 33.01 32.20 3gyr s GLN 534 CO 0.04 0.47 1.08 0.08 -2.12 0.00 0.00 175.29 174.84 3gyr s VAL 535 N -0.82 4.59 -0.04 1.09 1.01 -1.26 -1.33 120.40 123.65 3gyr s VAL 535 Ca 0.10 1.91 0.06 0.00 0.00 0.00 0.00 61.98 64.06 3gyr s VAL 535 Cb -0.10 -4.30 -0.24 0.00 0.00 0.00 0.00 36.38 31.75 3gyr s VAL 535 CO 0.02 -0.24 0.68 -0.07 0.00 0.00 0.00 175.10 175.49 3gyr h LEU 536 N 9.63 0.13 0.00 3.92 3.38 -1.03 -3.48 115.31 127.86 3gyr h LEU 536 Ca -0.20 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3gyr h LEU 536 Cb 1.07 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.77 3gyr h LEU 536 CO 0.99 1.23 0.00 0.61 0.09 0.00 0.00 178.44 181.36 3gyr n GLY 537 N 1.64 1.09 3.08 0.83 0.00 -1.07 -4.98 105.19 105.77 3gyr n GLY 537 Ca -0.18 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.00 1.11 -0.00 1.61 0.52 -1.26 -0.50 118.95 118.43 3gyr s ARG 538 Ca 0.00 -0.45 0.03 0.00 -0.52 0.00 0.00 55.73 54.79 3gyr s ARG 538 Cb 0.00 -1.05 -0.01 0.00 0.52 0.00 0.00 34.95 34.41 3gyr s ARG 538 CO 0.00 0.24 -0.11 -0.51 0.02 0.00 0.00 175.30 174.95 3gyr s ASP 539 N -0.18 1.25 0.27 0.23 1.11 0.23 -4.33 116.67 115.25 3gyr s ASP 539 Ca 0.03 -0.22 -0.23 0.00 0.18 0.00 0.00 52.55 52.30 3gyr s ASP 539 Cb -0.06 -0.13 -0.09 0.00 1.07 0.00 0.00 42.92 43.71 3gyr s ASP 539 CO -0.00 0.11 0.83 0.00 1.18 0.00 0.00 175.17 177.29 3gyr s ALA 540 N -0.32 3.32 0.06 5.23 0.00 -1.26 -0.92 121.76 127.87 3gyr s ALA 540 Ca 0.03 0.35 0.07 0.00 0.00 0.00 0.00 51.96 52.41 3gyr s ALA 540 Cb -0.04 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.04 3gyr s ALA 540 CO -0.00 0.25 -0.19 0.71 0.00 0.00 0.00 175.76 176.53 3gyr s TYR 541 N -1.53 1.62 -0.48 0.00 2.02 -1.14 -0.77 117.35 117.06 3gyr s TYR 541 Ca 0.46 -0.39 -0.26 0.00 -0.37 0.00 0.00 57.07 56.51 3gyr s TYR 541 Cb -0.18 -0.94 0.03 0.00 -0.40 0.00 0.00 41.96 40.47 3gyr s TYR 541 CO 0.23 0.11 0.99 0.34 -1.57 0.00 0.00 175.55 175.64 3gyr s ASP 542 N -1.42 6.50 -0.20 2.29 -1.08 0.24 -4.70 116.67 118.30 3gyr s ASP 542 Ca 0.05 0.12 0.15 0.00 -0.52 0.00 0.00 52.55 52.36 3gyr s ASP 542 Cb -0.09 -2.47 0.78 0.00 -1.46 0.00 0.00 42.92 39.67 3gyr s ASP 542 CO 0.02 -1.14 1.70 0.00 0.52 0.00 0.00 175.17 176.27 3gyr n ALA 543 N 7.42 3.63 0.25 3.66 0.00 -1.26 -1.44 120.51 132.77 3gyr n ALA 543 Ca 0.07 -1.89 0.14 0.00 0.00 0.00 0.00 53.44 51.76 3gyr n ALA 543 Cb 0.49 -1.06 0.61 0.00 0.00 0.00 0.00 19.45 19.48 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 3.83 0.00 0.55 0.00 4.64 -1.92 -2.48 113.55 118.17 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 1.82 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.91 3gyr h SER 544 CO 0.41 0.12 -0.00 1.23 -0.87 0.00 0.00 176.83 177.71 3gyr h GLY 545 N 1.84 0.00 -4.88 -0.77 0.00 -1.81 -3.42 103.07 94.03 3gyr h GLY 545 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.78 3gyr h GLY 545 CO 0.02 0.00 0.80 -0.12 0.00 0.00 0.00 176.54 177.23 3gyr s PHE 546 N -3.90 2.95 -0.25 5.60 2.19 -0.94 -0.10 117.98 123.54 3gyr s PHE 546 Ca -0.02 0.98 -0.04 0.00 0.33 0.00 0.00 56.93 58.18 3gyr s PHE 546 Cb 0.11 -3.56 0.01 0.00 -1.31 0.00 0.00 43.02 38.27 3gyr s PHE 546 CO 0.48 -1.95 -0.02 0.34 1.83 0.00 0.00 175.22 175.90 3gyr s ASP 547 N 1.79 4.49 0.32 6.13 -1.08 -0.32 -4.95 116.67 123.04 3gyr s ASP 547 Ca 0.60 -0.63 0.04 0.00 -0.52 0.00 0.00 52.55 52.03 3gyr s ASP 547 Cb -0.28 -1.74 0.53 0.00 -1.46 0.00 0.00 42.92 39.97 3gyr s ASP 547 CO 0.23 -0.10 1.81 -0.07 0.52 0.00 0.00 175.17 177.56 3gyr h LEU 548 N 8.10 0.46 0.00 -1.34 3.38 -1.90 -0.55 115.31 123.47 3gyr h LEU 548 Ca -0.36 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3gyr h LEU 548 Cb 1.13 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3gyr h LEU 548 CO 0.59 0.62 -0.13 0.00 0.09 0.00 0.00 178.44 179.62 3gyr h ALA 549 N 1.43 0.92 0.15 1.53 0.00 -1.94 0.30 119.26 121.66 3gyr h ALA 549 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.66 3gyr h ALA 549 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3gyr h ALA 549 CO 0.03 0.00 -1.66 1.25 0.00 0.00 0.00 179.25 178.87 3gyr h LEU 550 N 0.00 0.51 0.11 0.00 5.85 -1.84 -3.44 115.31 116.50 3gyr h LEU 550 Ca 0.00 -0.74 -0.02 0.00 0.84 0.00 0.00 57.88 57.96 3gyr h LEU 550 Cb 0.83 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 3gyr h LEU 550 CO 0.00 1.62 -0.02 0.61 -0.34 0.00 0.00 178.44 180.31 3gyr n GLY 551 N 1.77 0.34 3.79 3.75 0.00 -0.26 -4.08 105.19 110.50 3gyr n GLY 551 Ca -0.21 -0.86 -0.03 0.00 0.00 0.00 0.00 46.02 44.92 3gyr n GLY 551 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gyr s GLY 552 N -2.97 -0.11 0.15 -0.02 0.00 -1.19 0.65 107.32 103.83 3gyr s GLY 552 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 44.72 44.56 3gyr s GLY 552 CO 0.00 0.97 0.57 -0.51 0.00 0.00 0.00 173.10 174.13 3gyr s THR 553 N -2.76 4.82 -0.23 0.90 -4.23 -0.38 -1.17 115.64 112.60 3gyr s THR 553 Ca 0.16 0.90 0.09 0.00 -1.18 0.00 0.00 61.69 61.66 3gyr s THR 553 Cb -0.01 -3.76 -0.20 0.00 1.34 0.00 0.00 72.50 69.87 3gyr s THR 553 CO 0.03 0.26 -0.10 0.54 -0.54 0.00 0.00 174.62 174.81 3gyr n ARG 554 N 0.86 0.69 -4.22 3.99 1.74 0.86 -4.58 116.66 116.01 3gyr n ARG 554 Ca -0.05 0.08 -0.20 0.00 -0.77 0.00 0.00 57.85 56.91 3gyr n ARG 554 Cb 0.52 -1.51 -0.12 0.00 -1.02 0.00 0.00 32.46 30.33 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 1.26 0.51 0.55 -4.23 -1.23 -4.94 115.64 105.07 3gyr s THR 555 Ca -0.24 -1.34 -0.22 0.00 -1.18 0.00 0.00 61.69 58.71 3gyr s THR 555 Cb 0.08 -1.19 -0.07 0.00 1.34 0.00 0.00 72.50 72.65 3gyr s THR 555 CO 0.68 -0.17 1.14 -2.65 -0.54 0.00 0.00 174.62 173.09 3gyr n PRO 556 N 1.28 1.43 -1.82 3.99 -0.02 -1.26 -4.17 135.00 134.44 3gyr n PRO 556 Ca -0.21 0.52 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 3gyr n PRO 556 Cb 0.54 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 3gyr n PRO 556 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3gyr s VAL 557 N -1.33 2.20 -0.14 -1.45 1.01 0.11 -4.58 120.40 116.22 3gyr s VAL 557 Ca 0.69 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.83 3gyr s VAL 557 Cb -0.47 -3.10 0.02 0.00 0.00 0.00 0.00 36.38 32.83 3gyr s VAL 557 CO 0.52 0.02 -0.13 -0.60 0.00 0.00 0.00 175.10 174.92 3gyr s ARG 558 N 0.10 2.12 0.13 2.72 3.52 -0.52 -0.16 118.95 126.86 3gyr s ARG 558 Ca 0.66 -0.49 -0.35 0.00 -0.13 0.00 0.00 55.73 55.43 3gyr s ARG 558 Cb -0.47 -1.98 -0.15 0.00 -1.56 0.00 0.00 34.95 30.80 3gyr s ARG 558 CO 0.42 -0.24 1.53 -0.11 -0.81 0.00 0.00 175.30 176.09 3gyr n LEU 559 N 4.79 2.72 -4.14 -0.88 0.00 -0.90 0.81 117.00 119.41 3gyr n LEU 559 Ca -0.16 1.09 -0.38 0.00 0.00 0.00 0.00 56.01 56.56 3gyr n LEU 559 Cb 0.50 -1.36 -0.09 0.00 0.00 0.00 0.00 43.42 42.47 3gyr n LEU 559 CO 0.20 -0.48 -0.01 -0.62 0.00 0.00 0.00 177.39 176.48 3gyr s ASP 560 N 0.94 5.44 0.00 1.96 2.15 0.05 -4.82 116.67 122.39 3gyr s ASP 560 Ca 0.81 -2.39 0.23 0.00 0.43 0.00 0.00 52.55 51.63 3gyr s ASP 560 Cb -0.76 -1.90 1.35 0.00 -0.30 0.00 0.00 42.92 41.31 3gyr s ASP 560 CO 0.41 -0.50 1.77 -2.65 -0.17 0.00 0.00 175.17 174.03 3gyr n PRO 561 N 4.16 0.64 0.10 4.34 -0.02 -1.26 -2.59 135.00 140.37 3gyr n PRO 561 Ca 0.02 0.02 0.12 0.00 -2.02 0.00 0.00 63.50 61.63 3gyr n PRO 561 Cb 0.40 -1.50 0.16 0.00 -0.02 0.00 0.00 33.50 32.54 3gyr n PRO 561 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3gyr h ASP 562 N 0.00 0.00 -4.00 2.55 5.19 -1.96 -3.39 116.42 114.80 3gyr h ASP 562 Ca 0.00 -0.11 -0.72 0.00 -0.62 0.00 0.00 57.03 55.58 3gyr h ASP 562 Cb 0.05 0.00 -0.33 0.00 0.18 0.00 0.00 39.33 39.23 3gyr h ASP 562 CO 0.00 0.05 -0.22 -0.89 -3.12 0.00 0.00 179.24 175.07 3gyr s THR 563 N -3.21 4.25 0.46 0.35 2.01 -1.07 -5.08 115.64 113.34 3gyr s THR 563 Ca 0.05 -2.98 -0.24 0.00 0.31 0.00 0.00 61.69 58.83 3gyr s THR 563 Cb 0.11 -3.71 -0.07 0.00 0.01 0.00 0.00 72.50 68.84 3gyr s THR 563 CO 0.72 -0.94 1.31 -2.84 -0.69 0.00 0.00 174.62 172.17 3gyr s PRO 564 N -0.20 3.68 -0.46 4.92 0.02 -1.26 -4.16 135.00 137.53 3gyr s PRO 564 Ca 0.19 2.15 0.03 0.00 0.02 0.00 0.00 61.00 63.39 3gyr s PRO 564 Cb -0.16 -2.56 0.12 0.00 0.02 0.00 0.00 34.50 31.93 3gyr s PRO 564 CO -0.06 -0.72 0.21 0.08 -0.33 0.00 0.00 177.00 176.18 3gyr s VAL 565 N -1.31 2.21 0.60 3.83 1.01 -1.26 -4.96 120.40 120.52 3gyr s VAL 565 Ca 0.62 -2.90 -0.19 0.00 0.00 0.00 0.00 61.98 59.52 3gyr s VAL 565 Cb -0.38 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 3gyr s VAL 565 CO 0.47 -0.77 1.27 -2.16 0.00 0.00 0.00 175.10 173.91 3gyr s PRO 566 N 0.15 2.85 0.44 2.72 0.04 -1.26 -4.36 135.00 135.58 3gyr s PRO 566 Ca 0.16 2.01 -0.25 0.00 0.04 0.00 0.00 61.00 62.95 3gyr s PRO 566 Cb -0.24 -1.98 -0.08 0.00 0.04 0.00 0.00 34.50 32.24 3gyr s PRO 566 CO -0.03 -1.35 1.39 -0.51 0.04 0.00 0.00 177.00 176.55 3gyr s LEU 567 N -4.05 4.14 0.39 -3.56 1.43 -1.26 -4.97 118.68 110.81 3gyr s LEU 567 Ca 0.78 2.85 -0.27 0.00 -1.03 0.00 0.00 54.13 56.46 3gyr s LEU 567 Cb -0.35 -3.92 -0.10 0.00 0.03 0.00 0.00 46.19 41.85 3gyr s LEU 567 CO 0.39 -1.08 1.38 0.00 0.23 0.00 0.00 176.35 177.27 3gyr s ALA 568 N -1.22 3.40 0.40 4.21 0.00 -1.26 -4.90 121.76 122.39 3gyr s ALA 568 Ca 0.60 1.39 0.39 0.00 0.00 0.00 0.00 51.96 54.34 3gyr s ALA 568 Cb -0.42 -3.54 1.98 0.00 0.00 0.00 0.00 23.12 21.14 3gyr s ALA 568 CO 0.54 -0.93 2.19 -1.35 0.00 0.00 0.00 175.76 176.21 3gyr h PRO 569 N 2.84 0.00 -0.55 0.00 0.11 -1.95 -2.11 132.00 130.35 3gyr h PRO 569 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3gyr h PRO 569 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3gyr h PRO 569 CO 0.63 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.69 3gyr n ASN 570 N -3.00 3.64 -1.19 -2.05 6.94 -1.26 -4.34 115.26 114.00 3gyr n ASN 570 Ca -0.02 -2.09 0.08 0.00 -0.02 0.00 0.00 54.58 52.53 3gyr n ASN 570 Cb 0.15 -0.40 0.30 0.00 -2.36 0.00 0.00 39.78 37.47 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 3.50 -0.29 -3.83 0.28 -0.79 -4.55 120.64 116.01 3gyr n GLU 571 Ca 0.19 -2.90 0.08 0.00 -0.16 0.00 0.00 57.16 54.38 3gyr n GLU 571 Cb 0.59 -1.94 0.24 0.00 1.43 0.00 0.00 31.44 31.76 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 -0.08 2.94 0.00 -1.84 4.77 -1.26 -4.28 117.00 117.25 3gyr n LEU 572 Ca 0.23 -1.47 0.00 0.00 -0.03 0.00 0.00 56.01 54.74 3gyr n LEU 572 Cb 0.96 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3gyr n LEU 572 CO 0.20 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 3gyr n GLY 573 N 1.32 2.75 3.68 -0.72 0.00 -1.26 -4.83 105.19 106.13 3gyr n GLY 573 Ca 0.18 -1.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 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 4.29 3.45 0.06 1.61 3.76 -1.26 -4.54 115.29 122.66 3gyr s HIS 574 Ca 0.00 0.99 0.04 0.00 -0.15 0.00 0.00 55.06 55.94 3gyr s HIS 574 Cb 0.00 -2.75 -0.03 0.00 1.11 0.00 0.00 32.58 30.91 3gyr s HIS 574 CO 0.00 -0.05 -0.13 0.15 -0.85 0.00 0.00 174.74 173.87 3gyr s LYS 575 N 1.40 0.74 0.00 1.40 -0.14 -0.08 -1.86 119.74 121.21 3gyr s LYS 575 Ca 0.30 -0.91 0.00 0.00 -1.36 0.00 0.00 55.97 54.00 3gyr s LYS 575 Cb -0.16 -0.69 0.00 0.00 -1.68 0.00 0.00 37.83 35.30 3gyr s LYS 575 CO 0.12 0.15 0.06 -0.40 -0.76 0.00 0.00 175.35 174.52 3gyr n ASP 576 N 1.32 0.12 -4.14 2.83 5.68 -1.26 -1.28 116.55 119.82 3gyr n ASP 576 Ca -0.22 -0.52 -0.29 0.00 -0.50 0.00 0.00 54.79 53.26 3gyr n ASP 576 Cb 0.54 0.16 -0.17 0.00 -1.14 0.00 0.00 41.12 40.51 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 -0.16 1.71 -0.09 2.12 1.01 -1.26 -2.70 120.40 121.04 3gyr s VAL 577 Ca 0.00 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.18 3gyr s VAL 577 Cb 0.00 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.89 3gyr s VAL 577 CO 0.00 0.48 -0.10 -0.36 0.00 0.00 0.00 175.10 175.12 3gyr s PHE 578 N 0.54 1.49 -0.02 5.22 0.40 0.76 -4.88 117.98 121.49 3gyr s PHE 578 Ca -0.16 -0.64 -0.30 0.00 -0.60 0.00 0.00 56.93 55.23 3gyr s PHE 578 Cb -0.17 -1.15 -0.06 0.00 0.51 0.00 0.00 43.02 42.15 3gyr s PHE 578 CO 0.06 -0.38 1.56 -0.65 0.70 0.00 0.00 175.22 176.50 3gyr s GLN 579 N 1.10 4.22 -0.65 0.44 -0.21 -1.26 -0.70 119.66 122.60 3gyr s GLN 579 Ca -0.06 2.13 -0.02 0.00 0.02 0.00 0.00 55.36 57.42 3gyr s GLN 579 Cb -0.14 -3.77 0.17 0.00 1.00 0.00 0.00 33.01 30.26 3gyr s GLN 579 CO -0.02 -0.74 0.46 0.08 -2.12 0.00 0.00 175.29 172.96 3gyr s VAL 580 N 3.23 3.71 0.80 1.09 1.01 0.15 -4.94 120.40 125.46 3gyr s VAL 580 Ca 0.70 -3.09 -0.11 0.00 0.00 0.00 0.00 61.98 59.48 3gyr s VAL 580 Cb -0.34 -3.41 0.07 0.00 0.00 0.00 0.00 36.38 32.70 3gyr s VAL 580 CO 0.28 -0.90 1.09 -2.16 0.00 0.00 0.00 175.10 173.42 3gyr s PRO 581 N -0.22 2.05 0.38 2.72 0.04 -1.26 -2.07 135.00 136.63 3gyr s PRO 581 Ca 0.18 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.32 3gyr s PRO 581 Cb -0.19 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.47 3gyr s PRO 581 CO -0.04 -1.77 0.00 0.41 0.04 0.00 0.00 177.00 175.64 3gyr n GLY 582 N -1.19 -2.12 3.55 0.56 0.00 -1.25 -3.76 105.19 100.98 3gyr n GLY 582 Ca 0.09 -1.14 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 3gyr n GLY 582 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gyr s PRO 583 N -2.53 2.08 0.00 1.61 0.04 -1.06 -4.52 135.00 130.62 3gyr s PRO 583 Ca 0.00 0.88 -0.29 0.00 0.04 0.00 0.00 61.00 61.63 3gyr s PRO 583 Cb 0.00 -4.65 0.07 0.00 0.04 0.00 0.00 34.50 29.96 3gyr s PRO 583 CO 0.00 -3.52 0.65 -1.14 0.04 0.00 0.00 177.00 173.03 3gyr s GLN 584 N 8.13 1.11 -0.06 4.56 0.74 0.36 -2.87 119.66 131.62 3gyr s GLN 584 Ca 0.89 0.07 0.05 0.00 0.05 0.00 0.00 55.36 56.42 3gyr s GLN 584 Cb -0.14 0.52 -0.01 0.00 1.10 0.00 0.00 33.01 34.48 3gyr s GLN 584 CO 0.18 -0.38 -0.22 0.20 -0.55 0.00 0.00 175.29 174.51 3gyr s GLY 585 N -1.57 1.19 -0.06 2.59 0.00 -0.10 0.82 107.32 110.19 3gyr s GLY 585 Ca -0.08 -0.92 0.05 0.00 0.00 0.00 0.00 44.72 43.77 3gyr s GLY 585 CO 0.04 -0.49 -0.22 -2.27 0.00 0.00 0.00 173.10 170.17 3gyr s LEU 586 N 0.00 2.00 -0.20 0.66 2.96 0.32 -0.60 118.68 123.82 3gyr s LEU 586 Ca -0.07 -0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 53.36 3gyr s LEU 586 Cb -0.14 -1.22 -0.01 0.00 0.50 0.00 0.00 46.19 45.32 3gyr s LEU 586 CO 0.04 0.19 -0.06 -0.13 -1.32 0.00 0.00 176.35 175.07 3gyr s ARG 587 N 0.02 3.39 0.16 1.98 0.52 0.35 0.11 118.95 125.48 3gyr s ARG 587 Ca -0.07 -0.63 0.10 0.00 -0.52 0.00 0.00 55.73 54.61 3gyr s ARG 587 Cb -0.14 -2.91 -0.04 0.00 0.52 0.00 0.00 34.95 32.38 3gyr s ARG 587 CO 0.04 -0.08 -0.21 0.14 0.02 0.00 0.00 175.30 175.21 3gyr s VAL 588 N 1.17 2.00 -0.04 3.52 -7.23 -0.09 -0.34 120.40 119.38 3gyr s VAL 588 Ca 0.02 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.32 3gyr s VAL 588 Cb -0.14 -1.90 0.01 0.00 0.56 0.00 0.00 36.38 34.91 3gyr s VAL 588 CO -0.02 -0.19 -0.09 -0.32 -0.31 0.00 0.00 175.10 174.17 3gyr s MET 589 N -2.59 1.11 0.07 4.82 1.75 -0.44 -0.67 119.30 123.35 3gyr s MET 589 Ca 0.16 -0.30 -0.05 0.00 -1.25 0.00 0.00 55.69 54.25 3gyr s MET 589 Cb -0.07 -1.01 -0.02 0.00 2.84 0.00 0.00 34.83 36.57 3gyr s MET 589 CO 0.07 0.06 0.09 0.20 -0.65 0.00 0.00 175.02 174.80 3gyr s GLY 590 N 0.42 0.28 -0.18 2.11 0.00 -0.51 -1.54 107.32 107.90 3gyr s GLY 590 Ca -0.07 -0.91 -0.04 0.00 0.00 0.00 0.00 44.72 43.71 3gyr s GLY 590 CO 0.01 -1.05 -0.04 1.25 0.00 0.00 0.00 173.10 173.27 3gyr s LYS 591 N -3.89 3.56 -0.52 2.90 2.20 -1.25 -1.11 119.74 121.62 3gyr s LYS 591 Ca 0.06 -0.56 -0.16 0.00 -0.36 0.00 0.00 55.97 54.95 3gyr s LYS 591 Cb 0.06 -2.94 0.11 0.00 -1.51 0.00 0.00 37.83 33.55 3gyr s LYS 591 CO -0.10 0.08 0.47 -0.06 -0.36 0.00 0.00 175.35 175.38 3gyr s PHE 592 N 0.77 3.23 -0.16 4.03 0.08 -0.72 -4.41 117.98 120.79 3gyr s PHE 592 Ca -0.02 -1.12 -0.08 0.00 0.12 0.00 0.00 56.93 55.83 3gyr s PHE 592 Cb -0.15 -3.57 0.06 0.00 -0.57 0.00 0.00 43.02 38.80 3gyr s PHE 592 CO 0.02 -0.95 0.39 0.34 -0.10 0.00 0.00 175.22 174.92 3gyr s ASP 593 N 3.20 -0.41 0.00 1.36 2.15 -1.26 0.14 116.67 121.85 3gyr s ASP 593 Ca 0.04 0.85 0.00 0.00 0.43 0.00 0.00 52.55 53.87 3gyr s ASP 593 Cb -0.27 0.81 0.00 0.00 -0.30 0.00 0.00 42.92 43.16 3gyr s ASP 593 CO 0.05 -0.20 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 3gyr n GLY 594 N 4.48 0.59 3.66 2.66 0.00 -1.26 -4.97 105.19 110.36 3gyr n GLY 594 Ca -0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.17 -1.66 0.22 4.61 0.00 -1.26 -4.75 121.76 116.75 3gyr s ALA 595 Ca 0.00 0.39 0.08 0.00 0.00 0.00 0.00 51.96 52.43 3gyr s ALA 595 Cb 0.00 0.61 -0.05 0.00 0.00 0.00 0.00 23.12 23.68 3gyr s ALA 595 CO 0.00 -0.91 -0.15 0.71 0.00 0.00 0.00 175.76 175.41 3gyr s TYR 596 N -3.32 1.82 -2.26 0.00 2.02 -1.26 -4.81 117.35 109.52 3gyr s TYR 596 Ca 0.09 -0.55 0.00 0.00 -0.37 0.00 0.00 57.07 56.24 3gyr s TYR 596 Cb -0.02 -0.85 0.00 0.00 -0.40 0.00 0.00 41.96 40.69 3gyr s TYR 596 CO -0.02 0.41 0.00 0.41 -1.57 0.00 0.00 175.55 174.78 3gyr n GLY 597 N -0.43 0.54 3.40 0.71 0.00 0.29 -1.42 105.19 108.27 3gyr n GLY 597 Ca -0.07 -1.91 -0.35 0.00 0.00 0.00 0.00 46.02 43.69 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 -0.91 3.53 0.48 1.61 3.52 -1.26 -1.19 118.95 124.73 3gyr s ARG 598 Ca 0.00 -0.56 0.02 0.00 -0.13 0.00 0.00 55.73 55.06 3gyr s ARG 598 Cb 0.00 -3.05 -0.01 0.00 -1.56 0.00 0.00 34.95 30.33 3gyr s ARG 598 CO 0.00 -0.06 0.06 -0.06 -0.81 0.00 0.00 175.30 174.43 3gyr s PHE 599 N 1.15 1.81 0.21 5.12 0.08 0.13 -4.63 117.98 121.86 3gyr s PHE 599 Ca 0.02 -1.11 0.09 0.00 0.12 0.00 0.00 56.93 56.06 3gyr s PHE 599 Cb -0.14 -1.42 -0.04 0.00 -0.57 0.00 0.00 43.02 40.84 3gyr s PHE 599 CO 0.01 -0.00 -0.09 -1.64 -0.10 0.00 0.00 175.22 173.40 3gyr s MET 600 N -3.80 2.07 0.04 0.44 -1.94 -1.26 -0.86 119.30 113.99 3gyr s MET 600 Ca 0.12 -1.35 0.01 0.00 -1.71 0.00 0.00 55.69 52.75 3gyr s MET 600 Cb 0.01 -2.12 -0.03 0.00 2.01 0.00 0.00 34.83 34.71 3gyr s MET 600 CO 0.07 0.41 -0.06 1.52 -0.01 0.00 0.00 175.02 176.95 3gyr s TYR 601 N -1.92 0.57 0.05 -0.03 -0.85 0.00 -1.00 117.35 114.17 3gyr s TYR 601 Ca 0.27 -0.58 -0.28 0.00 -0.52 0.00 0.00 57.07 55.95 3gyr s TYR 601 Cb -0.08 -0.35 0.10 0.00 0.38 0.00 0.00 41.96 42.00 3gyr s TYR 601 CO 0.16 -0.14 1.15 -3.38 -1.52 0.00 0.00 175.55 171.82 3gyr s HIS 602 N -1.78 -0.08 0.31 -3.49 -3.43 -0.23 -0.38 115.29 106.20 3gyr s HIS 602 Ca -0.08 -0.10 -0.28 0.00 -0.80 0.00 0.00 55.06 53.79 3gyr s HIS 602 Cb -0.07 0.58 -0.09 0.00 -1.43 0.00 0.00 32.58 31.57 3gyr s HIS 602 CO -0.01 -0.51 1.12 0.00 -2.00 0.00 0.00 174.74 173.34 3gyr n HIS 604 N 0.93 1.92 -2.97 0.00 -0.00 0.50 -4.29 115.22 111.31 3gyr n HIS 604 Ca 0.00 -0.72 -0.43 0.00 0.46 0.00 0.00 57.72 57.03 3gyr n HIS 604 Cb 0.45 -0.50 -0.05 0.00 -0.12 0.00 0.00 29.99 29.77 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 -2.48 4.20 0.42 0.27 1.43 -1.26 -4.67 118.68 116.59 3gyr s LEU 605 Ca 0.48 0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.74 3gyr s LEU 605 Cb 0.37 -2.98 0.89 0.00 0.03 0.00 0.00 46.19 44.50 3gyr s LEU 605 CO 0.14 -0.83 2.06 -0.07 0.23 0.00 0.00 176.35 177.88 3gyr h LEU 606 N 9.94 0.42 -1.25 1.79 3.38 -1.33 0.47 115.31 128.73 3gyr h LEU 606 Ca -0.25 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3gyr h LEU 606 Cb 1.09 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 3gyr h LEU 606 CO 0.93 0.32 0.29 -0.33 0.09 0.00 0.00 178.44 179.75 3gyr h GLU 607 N 0.49 0.81 -0.03 1.13 3.07 -1.92 0.32 114.58 118.46 3gyr h GLU 607 Ca 0.13 -0.09 -0.20 0.00 -0.50 0.00 0.00 59.36 58.70 3gyr h GLU 607 Cb -0.03 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.71 3gyr h GLU 607 CO -0.03 0.62 -0.83 0.45 -1.40 0.00 0.00 179.01 177.82 3gyr h HIS 608 N 0.81 0.46 -0.51 4.33 3.86 -0.47 -3.05 115.15 120.59 3gyr h HIS 608 Ca 0.21 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 59.15 3gyr h HIS 608 Cb 0.06 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 3gyr h HIS 608 CO 0.01 1.02 0.21 1.49 0.86 0.00 0.00 177.93 181.51 3gyr h GLU 609 N 0.20 0.76 0.00 2.45 4.81 -0.88 -2.06 114.58 119.86 3gyr h GLU 609 Ca -0.05 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 3gyr h GLU 609 Cb 1.43 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.69 3gyr h GLU 609 CO 0.14 0.67 0.00 -0.25 -0.73 0.00 0.00 179.01 178.84 3gyr n ASP 610 N -4.55 0.43 -2.26 1.04 8.00 0.07 -3.13 116.55 116.15 3gyr n ASP 610 Ca 0.02 0.59 -0.29 0.00 0.71 0.00 0.00 54.79 55.82 3gyr n ASP 610 Cb 0.15 -0.69 0.04 0.00 -0.02 0.00 0.00 41.12 40.61 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 -1.96 3.21 -0.14 -1.24 2.81 -0.83 -4.58 117.12 114.38 3gyr n MET 611 Ca 0.03 -3.86 0.00 0.00 -1.81 0.00 0.00 57.70 52.06 3gyr n MET 611 Cb 0.23 -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 -0.74 1.45 2.38 3.03 0.00 -1.18 -4.93 105.19 105.20 3gyr n GLY 612 Ca 0.51 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.16 3gyr n GLY 612 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3gyr n MET 613 N -2.00 3.91 -3.75 1.61 0.00 -0.84 -2.49 117.12 113.55 3gyr n MET 613 Ca 0.00 -2.71 -0.13 0.00 -0.00 0.00 0.00 57.70 54.86 3gyr n MET 613 Cb 0.00 -2.62 -0.08 0.00 0.00 0.00 0.00 33.22 30.52 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 0.26 0.70 -0.03 2.12 0.00 -1.26 -2.37 119.30 118.73 3gyr s MET 614 Ca 0.62 -0.22 -0.02 0.00 0.00 0.00 0.00 55.69 56.07 3gyr s MET 614 Cb 0.21 0.31 0.01 0.00 0.00 0.00 0.00 34.83 35.36 3gyr s MET 614 CO -0.08 -0.20 0.07 1.03 0.00 0.00 0.00 175.02 175.83 3gyr s ARG 615 N -1.48 0.08 0.49 4.11 1.81 0.49 -2.40 118.95 122.04 3gyr s ARG 615 Ca -0.12 0.10 -0.20 0.00 -1.72 0.00 0.00 55.73 53.79 3gyr s ARG 615 Cb -0.04 0.03 -0.08 0.00 -0.45 0.00 0.00 34.95 34.40 3gyr s ARG 615 CO 0.03 -0.02 1.03 -1.25 -0.68 0.00 0.00 175.30 174.42 3gyr s PRO 616 N 0.08 3.79 0.06 3.54 0.04 -1.26 -0.82 135.00 140.42 3gyr s PRO 616 Ca -0.00 1.32 -0.00 0.00 0.04 0.00 0.00 61.00 62.35 3gyr s PRO 616 Cb -0.01 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 3gyr s PRO 616 CO -0.00 -0.43 -0.04 -0.59 0.04 0.00 0.00 177.00 175.98 3gyr s PHE 617 N -2.06 0.57 -0.02 0.56 -0.71 -0.04 -4.51 117.98 111.77 3gyr s PHE 617 Ca 0.66 -0.95 0.07 0.00 -1.04 0.00 0.00 56.93 55.68 3gyr s PHE 617 Cb -0.16 -0.39 -0.02 0.00 -1.21 0.00 0.00 43.02 41.25 3gyr s PHE 617 CO 0.21 -0.30 -0.24 0.08 -1.34 0.00 0.00 175.22 173.63 3gyr s VAL 618 N -3.44 1.92 -0.04 -2.49 1.01 -0.25 0.21 120.40 117.33 3gyr s VAL 618 Ca 0.04 -1.04 0.04 0.00 0.00 0.00 0.00 61.98 61.03 3gyr s VAL 618 Cb 0.04 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 3gyr s VAL 618 CO -0.07 0.54 -0.15 -0.69 0.00 0.00 0.00 175.10 174.73 3gyr s VAL 619 N -0.51 1.25 0.09 2.92 1.01 -0.34 -0.21 120.40 124.61 3gyr s VAL 619 Ca 0.07 -0.62 -0.13 0.00 0.00 0.00 0.00 61.98 61.30 3gyr s VAL 619 Cb -0.10 -1.08 0.02 0.00 0.00 0.00 0.00 36.38 35.22 3gyr s VAL 619 CO -0.00 0.37 0.30 0.00 0.00 0.00 0.00 175.10 175.77 3gyr s MET 620 N 0.07 0.91 0.44 2.72 0.23 -0.66 -0.55 119.30 122.46 3gyr s MET 620 Ca -0.03 -0.72 -0.25 0.00 -1.03 0.00 0.00 55.69 53.66 3gyr s MET 620 Cb -0.11 0.39 -0.09 0.00 -1.53 0.00 0.00 34.83 33.50 3gyr s MET 620 CO 0.02 -0.32 1.31 -2.30 -2.03 0.00 0.00 175.02 171.70 3gyr n PRO 621 N 0.09 1.98 -0.23 3.16 -0.02 -1.26 -0.57 135.00 138.14 3gyr n PRO 621 Ca -0.17 0.71 0.22 0.00 -2.02 0.00 0.00 63.50 62.24 3gyr n PRO 621 Cb 0.62 -2.45 0.57 0.00 -0.02 0.00 0.00 33.50 32.22 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 2.07 0.28 -0.25 0.52 0.11 -1.89 -1.11 132.00 131.73 3gyr h PRO 622 Ca -0.49 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 3gyr h PRO 622 Cb 1.29 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3gyr h PRO 622 CO 0.60 0.18 -0.23 0.93 -0.21 0.00 0.00 178.00 179.27 3gyr h GLU 623 N 0.29 0.47 0.00 1.05 3.07 -1.98 -2.43 114.58 115.05 3gyr h GLU 623 Ca 0.47 -0.17 -0.11 0.00 -0.50 0.00 0.00 59.36 59.05 3gyr h GLU 623 Cb 1.37 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.23 3gyr h GLU 623 CO -0.14 0.67 -0.53 0.00 -1.40 0.00 0.00 179.01 177.61 3gyr h ALA 624 N 1.34 0.71 -0.81 3.43 0.00 -1.57 -3.17 119.26 119.20 3gyr h ALA 624 Ca 0.06 -0.48 0.07 0.00 0.00 0.00 0.00 54.91 54.55 3gyr h ALA 624 Cb 0.64 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 3gyr h ALA 624 CO 0.05 0.67 0.53 1.25 0.00 0.00 0.00 179.25 181.74 3gyr h LEU 625 N 0.00 0.77 -2.29 0.00 5.85 -1.00 -1.19 115.31 117.45 3gyr h LEU 625 Ca -0.01 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3gyr h LEU 625 Cb 1.31 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 3gyr h LEU 625 CO 0.07 0.49 0.22 0.11 -0.34 0.00 0.00 178.44 179.00 3gyr h LYS 626 N 0.87 0.00 -0.64 1.25 1.79 -1.52 0.78 116.57 119.10 3gyr h LYS 626 Ca 0.35 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.82 3gyr h LYS 626 Cb 0.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 3gyr h LYS 626 CO -0.12 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 179.44 3gyr n PHE 627 N -3.35 1.41 0.00 -1.35 3.72 -0.45 -5.17 117.46 112.26 3gyr n PHE 627 Ca -0.00 -0.60 0.00 0.00 -0.05 0.00 0.00 57.45 56.80 3gyr n PHE 627 Cb 0.32 -0.22 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 3gyr n PHE 627 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46