#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k25 s ILE 68 N 0.00 0.02 -0.40 1.69 1.01 -1.13 -4.98 121.20 117.41 1k25 s ILE 68 Ca 0.00 -0.16 0.08 0.00 0.00 0.00 0.00 60.65 60.57 1k25 s ILE 68 Cb 0.00 -0.69 0.26 0.00 0.01 0.00 0.00 42.46 42.05 1k25 s ILE 68 CO 0.00 -0.09 0.61 0.35 0.00 0.00 0.00 174.94 175.81 1k25 n THR 69 N 2.00 -0.52 -1.69 2.92 -2.24 -1.24 -0.33 114.28 113.16 1k25 n THR 69 Ca -0.17 -3.71 -0.44 0.00 -2.27 0.00 0.00 64.05 57.46 1k25 n THR 69 Cb 0.57 -1.21 -0.03 0.00 -2.10 0.00 0.00 70.33 67.55 1k25 n THR 69 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1k25 n ARG 70 N 1.26 2.36 -4.38 -0.78 1.74 0.10 -4.52 116.66 112.44 1k25 n ARG 70 Ca 0.20 0.85 -0.33 0.00 -0.77 0.00 0.00 57.85 57.80 1k25 n ARG 70 Cb 0.56 -2.62 -0.16 0.00 -1.02 0.00 0.00 32.46 29.22 1k25 n ARG 70 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1k25 s THR 71 N 0.73 2.03 -0.38 0.55 2.01 -1.26 -1.08 115.64 118.24 1k25 s THR 71 Ca 0.75 -0.94 -0.16 0.00 0.31 0.00 0.00 61.69 61.65 1k25 s THR 71 Cb -0.61 -1.82 0.01 0.00 0.01 0.00 0.00 72.50 70.09 1k25 s THR 71 CO 0.39 0.54 0.36 -0.69 -0.69 0.00 0.00 174.62 174.53 1k25 s VAL 72 N 1.07 5.17 0.23 3.82 1.01 -0.99 -4.98 120.40 125.74 1k25 s VAL 72 Ca -0.01 -0.26 -0.31 0.00 0.00 0.00 0.00 61.98 61.40 1k25 s VAL 72 Cb -0.14 -3.91 -0.11 0.00 0.00 0.00 0.00 36.38 32.22 1k25 s VAL 72 CO -0.08 -0.24 1.64 -2.16 0.00 0.00 0.00 175.10 174.27 1k25 s PRO 73 N 1.96 4.15 0.11 2.72 0.04 -1.26 -3.23 135.00 139.49 1k25 s PRO 73 Ca 0.10 2.54 -0.18 0.00 0.04 0.00 0.00 61.00 63.50 1k25 s PRO 73 Cb -0.17 -3.07 -0.07 0.00 0.04 0.00 0.00 34.50 31.22 1k25 s PRO 73 CO 0.12 -0.67 0.59 0.00 0.04 0.00 0.00 177.00 177.08 1k25 s ALA 74 N 0.74 3.56 -0.41 8.56 0.00 -1.26 -4.98 121.76 127.97 1k25 s ALA 74 Ca 0.70 0.03 -0.35 0.00 0.00 0.00 0.00 51.96 52.33 1k25 s ALA 74 Cb -0.48 -2.65 -0.12 0.00 0.00 0.00 0.00 23.12 19.88 1k25 s ALA 74 CO 0.37 0.40 2.23 1.17 0.00 0.00 0.00 175.76 179.94 1k25 n LYS 75 N 1.39 0.93 -1.28 0.00 4.81 -1.26 -4.84 118.16 117.91 1k25 n LYS 75 Ca -0.08 0.23 -0.35 0.00 -0.87 0.00 0.00 58.31 57.24 1k25 n LYS 75 Cb 0.51 -2.40 0.10 0.00 0.02 0.00 0.00 35.03 33.26 1k25 n LYS 75 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1k25 n ARG 76 N 8.23 0.43 -1.45 1.64 0.63 -1.26 -3.42 116.66 121.45 1k25 n ARG 76 Ca 0.44 0.21 -0.29 0.00 -0.92 0.00 0.00 57.85 57.29 1k25 n ARG 76 Cb 0.22 -2.33 0.15 0.00 0.45 0.00 0.00 32.46 30.95 1k25 n ARG 76 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1k25 s GLY 77 N -1.81 1.58 -0.17 5.14 0.00 0.88 -4.63 107.32 108.31 1k25 s GLY 77 Ca 0.74 -0.57 -0.00 0.00 0.00 0.00 0.00 44.72 44.89 1k25 s GLY 77 CO 0.50 0.04 -0.15 -0.51 0.00 0.00 0.00 173.10 172.98 1k25 s THR 78 N -3.23 2.64 -0.95 0.90 -4.23 -1.26 -4.68 115.64 104.83 1k25 s THR 78 Ca 0.65 -0.76 -0.24 0.00 -1.18 0.00 0.00 61.69 60.16 1k25 s THR 78 Cb -0.15 -2.13 0.04 0.00 1.34 0.00 0.00 72.50 71.60 1k25 s THR 78 CO 0.54 0.50 1.46 -0.63 -0.54 0.00 0.00 174.62 175.96 1k25 s ILE 79 N 1.05 3.83 0.09 2.99 1.01 -0.93 -1.93 121.20 127.32 1k25 s ILE 79 Ca -0.01 -0.47 -0.02 0.00 0.00 0.00 0.00 60.65 60.15 1k25 s ILE 79 Cb -0.15 -4.93 0.02 0.00 0.01 0.00 0.00 42.46 37.42 1k25 s ILE 79 CO -0.04 -1.83 0.13 -1.22 0.00 0.00 0.00 174.94 171.98 1k25 n TYR 80 N 9.45 -3.93 -4.47 3.97 4.01 -0.46 -2.38 117.16 123.35 1k25 n TYR 80 Ca 0.27 -0.11 -0.28 0.00 -0.16 0.00 0.00 57.90 57.62 1k25 n TYR 80 Cb 0.50 -0.10 -0.09 0.00 -0.31 0.00 0.00 39.34 39.34 1k25 n TYR 80 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 1k25 s ASP 81 N -1.49 4.11 0.48 7.72 -4.77 -0.85 -2.92 116.67 118.95 1k25 s ASP 81 Ca 0.07 -1.32 0.00 0.00 -3.30 0.00 0.00 52.55 48.00 1k25 s ASP 81 Cb -0.00 -0.25 0.00 0.00 -1.09 0.00 0.00 42.92 41.58 1k25 s ASP 81 CO 0.05 -0.57 0.73 -1.14 0.70 0.00 0.00 175.17 174.95 1k25 n ARG 82 N -1.13 0.02 -0.06 2.11 0.63 -0.48 -1.08 116.66 116.67 1k25 n ARG 82 Ca -0.06 0.69 0.01 0.00 -0.92 0.00 0.00 57.85 57.57 1k25 n ARG 82 Cb 0.66 -1.90 0.01 0.00 0.45 0.00 0.00 32.46 31.68 1k25 n ARG 82 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1k25 n ASN 83 N -1.95 0.84 0.00 6.15 4.13 -1.26 -4.08 115.26 119.09 1k25 n ASN 83 Ca 0.00 -1.61 0.00 0.00 1.68 0.00 0.00 54.58 54.65 1k25 n ASN 83 Cb 0.73 -0.06 0.00 0.00 -1.54 0.00 0.00 39.78 38.92 1k25 n ASN 83 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1k25 n GLY 84 N -0.28 2.77 3.69 7.41 0.00 -0.24 -4.85 105.19 113.70 1k25 n GLY 84 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1k25 n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k25 s VAL 85 N -2.47 2.56 0.45 1.61 1.01 -1.26 -4.64 120.40 117.65 1k25 s VAL 85 Ca 0.00 0.05 -0.25 0.00 0.00 0.00 0.00 61.98 61.78 1k25 s VAL 85 Cb 0.00 -3.03 -0.08 0.00 0.00 0.00 0.00 36.38 33.27 1k25 s VAL 85 CO 0.00 -0.00 1.42 -2.84 0.00 0.00 0.00 175.10 173.68 1k25 s PRO 86 N 2.83 3.71 0.03 2.72 0.02 -1.26 -2.00 135.00 141.06 1k25 s PRO 86 Ca 0.81 2.40 -0.00 0.00 0.02 0.00 0.00 61.00 64.23 1k25 s PRO 86 Cb -0.46 -2.67 -0.00 0.00 0.02 0.00 0.00 34.50 31.39 1k25 s PRO 86 CO 0.37 -0.79 -0.01 -0.89 -0.33 0.00 0.00 177.00 175.35 1k25 n ILE 87 N -0.16 0.48 -3.84 2.83 5.41 -1.00 -4.88 119.36 118.20 1k25 n ILE 87 Ca 0.05 0.15 -0.27 0.00 1.00 0.00 0.00 62.75 63.68 1k25 n ILE 87 Cb 0.42 -1.54 -0.17 0.00 -0.71 0.00 0.00 39.64 37.64 1k25 n ILE 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1k25 s ALA 88 N -2.01 1.21 0.21 -1.39 0.00 -1.14 -4.11 121.76 114.53 1k25 s ALA 88 Ca -0.01 -0.60 -0.00 0.00 0.00 0.00 0.00 51.96 51.35 1k25 s ALA 88 Cb 0.00 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 1k25 s ALA 88 CO 0.01 -0.70 0.12 -1.83 0.00 0.00 0.00 175.76 173.35 1k25 s GLU 89 N 1.76 1.23 0.44 0.00 -1.05 -0.13 -2.19 118.70 118.76 1k25 s GLU 89 Ca 0.02 -1.65 -0.25 0.00 -0.15 0.00 0.00 54.97 52.95 1k25 s GLU 89 Cb -0.14 0.14 -0.08 0.00 -0.44 0.00 0.00 34.13 33.61 1k25 s GLU 89 CO -0.07 -0.36 1.29 0.34 0.95 0.00 0.00 175.26 177.41 1k25 s ASP 90 N -3.19 6.13 -0.05 0.83 2.15 -1.26 -0.30 116.67 120.98 1k25 s ASP 90 Ca 0.38 2.61 0.22 0.00 0.43 0.00 0.00 52.55 56.19 1k25 s ASP 90 Cb 0.07 -2.63 0.42 0.00 -0.30 0.00 0.00 42.92 40.48 1k25 s ASP 90 CO 0.12 -0.97 1.18 0.00 -0.17 0.00 0.00 175.17 175.32 1k25 n ALA 91 N -0.15 2.66 -1.46 3.66 0.00 0.43 -4.67 120.51 120.97 1k25 n ALA 91 Ca 0.05 -2.55 -0.54 0.00 0.00 0.00 0.00 53.44 50.40 1k25 n ALA 91 Cb 0.44 -0.64 -0.06 0.00 0.00 0.00 0.00 19.45 19.19 1k25 n ALA 91 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1k25 n THR 92 N 0.11 0.90 -4.37 0.00 5.66 -1.26 -3.85 114.28 111.46 1k25 n THR 92 Ca 0.09 -0.22 -0.23 0.00 -3.05 0.00 0.00 64.05 60.64 1k25 n THR 92 Cb 1.03 -0.07 -0.11 0.00 -1.55 0.00 0.00 70.33 69.64 1k25 n THR 92 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1k25 s SER 93 N -0.41 2.98 -0.11 1.09 0.15 0.19 -4.87 113.70 112.72 1k25 s SER 93 Ca 0.78 -0.90 -0.01 0.00 0.70 0.00 0.00 55.95 56.53 1k25 s SER 93 Cb -1.10 -0.20 0.03 0.00 -1.71 0.00 0.00 66.02 63.04 1k25 s SER 93 CO 0.56 0.00 -0.05 -0.31 1.20 0.00 0.00 173.24 174.65 1k25 s TYR 94 N -2.09 1.25 -0.32 3.44 1.51 -1.26 0.64 117.35 120.52 1k25 s TYR 94 Ca 0.19 -0.60 -0.04 0.00 -1.01 0.00 0.00 57.07 55.61 1k25 s TYR 94 Cb -0.06 -1.11 0.05 0.00 -0.11 0.00 0.00 41.96 40.73 1k25 s TYR 94 CO 0.08 -0.47 0.05 0.54 -1.11 0.00 0.00 175.55 174.65 1k25 s ASN 95 N 1.78 5.11 0.69 2.29 2.20 -1.13 -5.00 114.94 120.88 1k25 s ASN 95 Ca 0.05 -1.22 -0.16 0.00 -0.94 0.00 0.00 52.86 50.59 1k25 s ASN 95 Cb -0.13 -1.79 0.02 0.00 -2.00 0.00 0.00 41.25 37.35 1k25 s ASN 95 CO -0.07 -0.30 1.18 0.54 -2.94 0.00 0.00 177.10 175.51 1k25 s VAL 96 N 1.33 2.59 -0.16 3.54 0.11 -1.26 -3.10 120.40 123.44 1k25 s VAL 96 Ca -0.03 0.30 -0.10 0.00 -2.93 0.00 0.00 61.98 59.21 1k25 s VAL 96 Cb -0.20 -2.88 0.05 0.00 -1.53 0.00 0.00 36.38 31.83 1k25 s VAL 96 CO 0.01 -0.15 0.40 -0.72 -3.33 0.00 0.00 175.10 171.31 1k25 s TYR 97 N -2.01 -0.55 -0.15 1.54 -0.85 -1.26 -4.90 117.35 109.17 1k25 s TYR 97 Ca 0.73 1.21 -0.06 0.00 -0.52 0.00 0.00 57.07 58.43 1k25 s TYR 97 Cb -0.27 0.23 -0.04 0.00 0.38 0.00 0.00 41.96 42.26 1k25 s TYR 97 CO 0.42 -0.31 0.06 0.00 -1.52 0.00 0.00 175.55 174.21 1k25 s ALA 98 N 1.10 3.47 0.23 9.51 0.00 -1.26 -4.97 121.76 129.84 1k25 s ALA 98 Ca -0.07 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.15 1k25 s ALA 98 Cb -0.07 -1.84 0.00 0.00 0.00 0.00 0.00 23.12 21.21 1k25 s ALA 98 CO -0.09 0.35 0.00 1.33 0.00 0.00 0.00 175.76 177.34 1k25 n VAL 99 N 2.96 0.00 0.00 0.00 0.24 -1.26 -5.37 118.33 114.90 1k25 n VAL 99 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1k25 n VAL 99 Cb 0.53 -0.36 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 1k25 n VAL 99 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1k25 n THR 181 N -3.13 0.00 -3.73 3.34 -1.04 -1.18 -5.38 114.28 103.16 1k25 n THR 181 Ca 0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.73 1k25 n THR 181 Cb 0.00 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.35 1k25 n THR 181 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1k25 s THR 182 N -2.00 0.52 -0.34 12.58 -1.32 -1.26 -2.86 115.64 120.96 1k25 s THR 182 Ca 0.00 -0.60 -0.09 0.00 -1.21 0.00 0.00 61.69 59.79 1k25 s THR 182 Cb 0.00 -1.05 0.02 0.00 -1.51 0.00 0.00 72.50 69.96 1k25 s THR 182 CO 0.00 -0.24 0.15 -0.94 -2.21 0.00 0.00 174.62 171.38 1k25 s SER 183 N 1.86 5.50 0.50 8.08 1.04 0.21 -4.79 113.70 126.10 1k25 s SER 183 Ca -0.00 -0.88 -0.21 0.00 0.48 0.00 0.00 55.95 55.33 1k25 s SER 183 Cb -0.17 -1.96 -0.07 0.00 0.10 0.00 0.00 66.02 63.92 1k25 s SER 183 CO -0.09 -0.30 1.13 -2.16 0.98 0.00 0.00 173.24 172.80 1k25 s PRO 184 N 1.52 3.57 0.21 4.02 0.04 -1.26 0.55 135.00 143.65 1k25 s PRO 184 Ca 0.02 1.65 -0.05 0.00 0.04 0.00 0.00 61.00 62.66 1k25 s PRO 184 Cb -0.18 -2.18 -0.03 0.00 0.04 0.00 0.00 34.50 32.15 1k25 s PRO 184 CO 0.05 -0.68 0.23 1.21 0.04 0.00 0.00 177.00 177.85 1k25 s ASN 185 N -1.63 0.09 -0.14 6.66 2.47 -1.25 -4.83 114.94 116.31 1k25 s ASN 185 Ca 0.68 -1.23 -0.00 0.00 0.42 0.00 0.00 52.86 52.73 1k25 s ASN 185 Cb -0.25 0.43 0.03 0.00 -1.45 0.00 0.00 41.25 40.02 1k25 s ASN 185 CO 0.29 -0.92 -0.07 -0.60 -3.72 0.00 0.00 177.10 172.09 1k25 s ARG 186 N -4.11 1.54 -0.15 0.43 6.06 -1.26 -0.43 118.95 121.03 1k25 s ARG 186 Ca 0.33 -0.42 -0.04 0.00 -2.50 0.00 0.00 55.73 53.09 1k25 s ARG 186 Cb 0.05 -1.85 -0.03 0.00 0.06 0.00 0.00 34.95 33.17 1k25 s ARG 186 CO 0.10 -0.35 -0.01 0.45 -2.50 0.00 0.00 175.30 172.99 1k25 s SER 187 N 1.65 5.06 -0.57 -2.12 0.15 0.59 -4.92 113.70 113.54 1k25 s SER 187 Ca 0.03 -0.03 0.04 0.00 0.70 0.00 0.00 55.95 56.69 1k25 s SER 187 Cb -0.14 -1.76 0.15 0.00 -1.71 0.00 0.00 66.02 62.56 1k25 s SER 187 CO -0.08 0.21 0.35 -0.31 1.20 0.00 0.00 173.24 174.61 1k25 s TYR 188 N 0.12 3.00 0.35 3.44 1.51 -1.26 -0.95 117.35 123.56 1k25 s TYR 188 Ca 0.01 -3.06 0.19 0.00 -1.01 0.00 0.00 57.07 53.20 1k25 s TYR 188 Cb -0.13 -2.49 1.06 0.00 -0.11 0.00 0.00 41.96 40.28 1k25 s TYR 188 CO 0.02 -0.68 1.54 -1.00 -1.11 0.00 0.00 175.55 174.33 1k25 h PRO 189 N 6.05 0.00 0.04 -1.71 0.13 -1.91 -2.79 132.00 131.81 1k25 h PRO 189 Ca 0.04 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.79 1k25 h PRO 189 Cb 0.84 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.92 1k25 h PRO 189 CO 0.65 0.00 -2.32 0.09 -0.23 0.00 0.00 178.00 176.19 1k25 n ASN 190 N -2.44 2.03 0.00 1.44 3.02 -1.26 -5.08 115.26 112.96 1k25 n ASN 190 Ca -0.01 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 1k25 n ASN 190 Cb 0.40 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 1k25 n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k25 n GLY 191 N 2.16 0.98 3.55 7.41 0.00 -1.05 -4.73 105.19 113.51 1k25 n GLY 191 Ca -0.41 -1.02 -0.28 0.00 0.00 0.00 0.00 46.02 44.30 1k25 n GLY 191 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1k25 s GLN 192 N 0.00 1.99 -0.30 1.61 0.74 -1.26 -3.02 119.66 119.42 1k25 s GLN 192 Ca 0.00 0.96 -0.01 0.00 0.05 0.00 0.00 55.36 56.36 1k25 s GLN 192 Cb 0.00 -4.66 0.19 0.00 1.10 0.00 0.00 33.01 29.64 1k25 s GLN 192 CO 0.00 -3.64 0.59 0.12 -0.55 0.00 0.00 175.29 171.81 1k25 s PHE 193 N 12.76 -1.57 0.00 1.67 2.19 -1.26 -4.86 117.98 126.90 1k25 s PHE 193 Ca 0.92 1.68 0.00 0.00 0.33 0.00 0.00 56.93 59.86 1k25 s PHE 193 Cb -0.15 0.54 0.00 0.00 -1.31 0.00 0.00 43.02 42.11 1k25 s PHE 193 CO 0.18 -0.87 0.00 0.00 1.83 0.00 0.00 175.22 176.36 1k25 n ALA 194 N 5.43 0.00 0.00 11.12 0.00 -1.26 -4.70 120.51 131.09 1k25 n ALA 194 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1k25 n ALA 194 Cb 0.51 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.70 1k25 n ALA 194 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1k25 n SER 195 N 0.82 0.00 -0.19 0.00 7.64 -1.26 0.11 113.62 120.74 1k25 n SER 195 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 1k25 n SER 195 Cb 0.04 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.20 1k25 n SER 195 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1k25 n SER 196 N -0.91 -0.47 0.01 6.43 7.64 -1.26 -2.11 113.62 122.94 1k25 n SER 196 Ca 0.00 0.96 -0.02 0.00 1.01 0.00 0.00 58.87 60.82 1k25 n SER 196 Cb 0.00 -0.19 -0.01 0.00 -1.01 0.00 0.00 64.21 63.00 1k25 n SER 196 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1k25 h PHE 197 N 0.00 -0.22 -0.24 1.43 3.57 0.39 -3.27 116.94 118.60 1k25 h PHE 197 Ca 0.07 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.60 1k25 h PHE 197 Cb 0.18 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1k25 h PHE 197 CO -0.62 -0.08 -0.24 0.82 -2.23 0.00 0.00 178.31 175.96 1k25 h ILE 198 N -0.09 0.00 0.00 1.41 1.08 -1.20 -1.22 117.51 117.48 1k25 h ILE 198 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1k25 h ILE 198 Cb 0.10 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.85 1k25 h ILE 198 CO -0.05 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.02 1k25 n GLY 199 N -1.14 -0.46 2.95 5.37 0.00 -1.04 0.86 105.19 111.73 1k25 n GLY 199 Ca -0.01 -2.23 -0.12 0.00 0.00 0.00 0.00 46.02 43.66 1k25 n GLY 199 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k25 s LEU 200 N 0.00 1.79 -0.42 0.99 1.43 -1.01 -4.79 118.68 116.67 1k25 s LEU 200 Ca 0.00 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 1k25 s LEU 200 Cb 0.00 0.23 0.11 0.00 0.03 0.00 0.00 46.19 46.56 1k25 s LEU 200 CO 0.00 -0.07 0.18 0.00 0.23 0.00 0.00 176.35 176.70 1k25 s ALA 201 N -0.18 3.13 0.98 4.21 0.00 -1.25 -0.19 121.76 128.46 1k25 s ALA 201 Ca -0.02 -2.71 -0.16 0.00 0.00 0.00 0.00 51.96 49.07 1k25 s ALA 201 Cb -0.02 -2.25 0.22 0.00 0.00 0.00 0.00 23.12 21.07 1k25 s ALA 201 CO 0.00 -1.82 1.33 -0.65 0.00 0.00 0.00 175.76 174.62 1k25 s GLN 202 N 0.75 0.42 -0.43 0.00 -0.21 -0.41 -4.67 119.66 115.11 1k25 s GLN 202 Ca 0.11 -0.59 -0.17 0.00 0.02 0.00 0.00 55.36 54.73 1k25 s GLN 202 Cb -0.21 -1.86 0.02 0.00 1.00 0.00 0.00 33.01 31.96 1k25 s GLN 202 CO -0.05 -2.53 0.45 -1.17 -2.12 0.00 0.00 175.29 169.87 1k25 s LEU 203 N -5.91 4.87 -0.02 2.90 2.96 -1.26 -2.18 118.68 120.04 1k25 s LEU 203 Ca 0.76 -0.69 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 1k25 s LEU 203 Cb -0.02 -2.40 -0.04 0.00 0.50 0.00 0.00 46.19 44.23 1k25 s LEU 203 CO 0.53 -0.60 0.11 -2.28 -1.32 0.00 0.00 176.35 172.79 1k25 s HIS 204 N 2.17 3.38 -0.25 5.38 5.65 -1.13 -4.90 115.29 125.60 1k25 s HIS 204 Ca 0.12 0.28 -0.05 0.00 0.25 0.00 0.00 55.06 55.66 1k25 s HIS 204 Cb -0.17 -1.78 -0.01 0.00 -1.18 0.00 0.00 32.58 29.44 1k25 s HIS 204 CO 0.14 0.59 0.01 -2.00 -0.65 0.00 0.00 174.74 172.83 1k25 s GLU 205 N -1.66 3.34 0.91 2.88 2.12 -1.26 -0.27 118.70 124.75 1k25 s GLU 205 Ca 0.23 -0.67 -0.15 0.00 0.36 0.00 0.00 54.97 54.74 1k25 s GLU 205 Cb -0.12 -3.17 0.23 0.00 0.26 0.00 0.00 34.13 31.33 1k25 s GLU 205 CO 0.13 -0.27 0.72 0.09 -0.54 0.00 0.00 175.26 175.39 1k25 n ASN 206 N 4.83 -2.30 -1.66 -1.70 3.02 -1.01 -4.79 115.26 111.66 1k25 n ASN 206 Ca -0.17 -0.86 -0.02 0.00 -0.03 0.00 0.00 54.58 53.50 1k25 n ASN 206 Cb 0.50 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 38.94 1k25 n ASN 206 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1k25 n GLU 207 N -4.08 1.08 0.00 3.52 0.28 -1.26 -4.23 120.64 115.94 1k25 n GLU 207 Ca 0.10 -0.19 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 1k25 n GLU 207 Cb 0.41 -1.24 0.00 0.00 1.43 0.00 0.00 31.44 32.04 1k25 n GLU 207 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1k25 n ASP 208 N 1.76 0.00 0.00 -1.84 5.68 -1.26 -5.08 116.55 115.81 1k25 n ASP 208 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.37 1k25 n ASP 208 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1k25 n ASP 208 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k25 n GLY 209 N 0.00 0.01 0.00 6.12 0.00 -1.26 -4.69 105.19 105.37 1k25 n GLY 209 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1k25 n GLY 209 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k25 n SER 210 N 0.02 0.00 -4.95 1.61 3.41 -1.26 -4.05 113.62 108.40 1k25 n SER 210 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 1k25 n SER 210 Cb 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1k25 n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1k25 s LYS 211 N 0.00 2.63 0.00 4.33 -0.14 -1.26 -2.39 119.74 122.91 1k25 s LYS 211 Ca 0.00 -0.47 0.00 0.00 -1.36 0.00 0.00 55.97 54.14 1k25 s LYS 211 Cb 0.00 -2.39 0.00 0.00 -1.68 0.00 0.00 37.83 33.76 1k25 s LYS 211 CO 0.00 -0.74 0.00 -1.13 -0.76 0.00 0.00 175.35 172.72 1k25 n SER 212 N -2.47 0.00 -4.56 2.83 3.41 0.63 -4.83 113.62 108.63 1k25 n SER 212 Ca 0.06 0.00 -0.52 0.00 -0.26 0.00 0.00 58.87 58.16 1k25 n SER 212 Cb 0.59 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.48 1k25 n SER 212 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1k25 n LEU 213 N 0.00 2.52 -4.37 1.04 4.32 -1.26 -2.82 117.00 116.43 1k25 n LEU 213 Ca 0.00 0.68 -0.29 0.00 -0.02 0.00 0.00 56.01 56.38 1k25 n LEU 213 Cb 0.00 -1.27 -0.13 0.00 -1.62 0.00 0.00 43.42 40.40 1k25 n LEU 213 CO 0.00 -0.51 -0.57 -0.22 -1.22 0.00 0.00 177.39 174.88 1k25 s LEU 214 N 5.79 2.28 -0.15 2.23 1.98 -0.93 -4.94 118.68 124.96 1k25 s LEU 214 Ca 1.03 -0.71 -0.21 0.00 -2.89 0.00 0.00 54.13 51.36 1k25 s LEU 214 Cb -0.85 -1.21 -0.03 0.00 0.66 0.00 0.00 46.19 44.75 1k25 s LEU 214 CO 0.53 0.19 0.60 -0.83 -1.89 0.00 0.00 176.35 174.95 1k25 s GLY 215 N -1.85 2.27 0.00 7.98 0.00 -1.26 -1.29 107.32 113.17 1k25 s GLY 215 Ca 0.13 -0.16 0.08 0.00 0.00 0.00 0.00 44.72 44.77 1k25 s GLY 215 CO 0.05 1.12 0.73 -1.30 0.00 0.00 0.00 173.10 173.70 1k25 n THR 216 N 4.20 0.00 -3.54 0.90 -2.24 0.73 -4.50 114.28 109.83 1k25 n THR 216 Ca -0.03 -0.49 -0.08 0.00 -2.27 0.00 0.00 64.05 61.18 1k25 n THR 216 Cb 0.51 1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.87 1k25 n THR 216 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1k25 s SER 217 N -0.78 -0.32 0.80 3.42 1.04 -1.25 -4.92 113.70 111.70 1k25 s SER 217 Ca 0.09 0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.64 1k25 s SER 217 Cb 0.07 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1k25 s SER 217 CO 0.12 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.50 1k25 n GLY 218 N 0.09 -0.50 0.30 7.32 0.00 -1.26 -2.41 105.19 108.73 1k25 n GLY 218 Ca -0.07 -0.80 0.10 0.00 0.00 0.00 0.00 46.02 45.25 1k25 n GLY 218 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1k25 h MET 219 N 0.00 0.11 -0.96 1.61 2.86 0.17 0.18 114.93 118.90 1k25 h MET 219 Ca 0.00 -0.01 0.18 0.00 -2.06 0.00 0.00 59.70 57.81 1k25 h MET 219 Cb 0.00 -0.02 -0.17 0.00 0.06 0.00 0.00 31.60 31.46 1k25 h MET 219 CO 0.00 0.07 -0.28 -1.91 1.06 0.00 0.00 176.91 175.86 1k25 n GLU 220 N -5.35 -0.12 0.14 1.72 4.07 0.20 0.97 120.64 122.26 1k25 n GLU 220 Ca 0.19 1.49 -0.23 0.00 -0.06 0.00 0.00 57.16 58.54 1k25 n GLU 220 Cb 0.61 -2.22 -0.15 0.00 -0.06 0.00 0.00 31.44 29.62 1k25 n GLU 220 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1k25 h SER 221 N 0.00 0.79 0.12 4.31 0.87 -0.51 -2.97 113.55 116.16 1k25 h SER 221 Ca 0.42 -0.83 -0.09 0.00 -1.23 0.00 0.00 61.79 60.07 1k25 h SER 221 Cb 0.66 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 1k25 h SER 221 CO -0.98 1.65 -0.29 0.28 -0.53 0.00 0.00 176.83 176.96 1k25 h SER 222 N 0.15 0.27 -0.63 6.23 0.02 0.16 -2.88 113.55 116.87 1k25 h SER 222 Ca -0.23 -0.09 -0.38 0.00 -0.84 0.00 0.00 61.79 60.25 1k25 h SER 222 Cb 2.12 -0.07 -0.23 0.00 0.14 0.00 0.00 62.40 64.36 1k25 h SER 222 CO 0.26 0.56 0.06 0.18 -1.14 0.00 0.00 176.83 176.76 1k25 n LEU 223 N -4.12 5.28 0.13 5.07 4.32 0.27 -4.83 117.00 123.12 1k25 n LEU 223 Ca -0.01 -4.02 -0.05 0.00 -0.02 0.00 0.00 56.01 51.91 1k25 n LEU 223 Cb 0.40 -0.68 -0.02 0.00 -1.62 0.00 0.00 43.42 41.49 1k25 n LEU 223 CO 0.40 1.42 0.46 -1.13 -1.22 0.00 0.00 177.39 177.33 1k25 h ASN 224 N 1.38 -0.28 -0.84 -1.43 -1.24 -1.33 -1.78 115.58 110.06 1k25 h ASN 224 Ca 0.38 0.01 0.20 0.00 0.71 0.00 0.00 56.30 57.60 1k25 h ASN 224 Cb 1.68 0.07 -0.15 0.00 0.73 0.00 0.00 38.32 40.65 1k25 h ASN 224 CO 0.77 -0.18 0.02 0.77 -1.29 0.00 0.00 177.43 177.52 1k25 h SER 225 N -0.35 -0.37 -0.51 1.15 4.64 -1.88 0.77 113.55 117.01 1k25 h SER 225 Ca -0.03 0.22 0.04 0.00 -0.47 0.00 0.00 61.79 61.55 1k25 h SER 225 Cb 0.25 0.38 -0.04 0.00 -0.31 0.00 0.00 62.40 62.68 1k25 h SER 225 CO 0.05 -0.23 0.27 0.40 -0.87 0.00 0.00 176.83 176.46 1k25 h ILE 226 N 0.09 0.98 -0.13 0.95 2.04 -1.94 -2.76 117.51 116.75 1k25 h ILE 226 Ca 0.48 -0.18 -0.13 0.00 1.00 0.00 0.00 64.86 66.03 1k25 h ILE 226 Cb 0.89 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1k25 h ILE 226 CO -0.74 0.10 -0.42 -0.07 0.00 0.00 0.00 178.15 177.01 1k25 h LEU 227 N 0.53 0.59 -0.40 1.44 3.38 0.85 -1.20 115.31 120.49 1k25 h LEU 227 Ca 0.22 -0.61 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 1k25 h LEU 227 Cb 0.10 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1k25 h LEU 227 CO -0.14 1.09 -0.02 0.00 0.09 0.00 0.00 178.44 179.46 1k25 h ALA 228 N 0.51 0.99 -0.95 1.53 0.00 0.26 0.25 119.26 121.85 1k25 h ALA 228 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1k25 h ALA 228 Cb 1.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1k25 h ALA 228 CO 0.09 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.78 1k25 n GLY 229 N 0.81 1.91 3.31 0.00 0.00 -1.04 -3.74 105.19 106.44 1k25 n GLY 229 Ca 0.03 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.36 1k25 n GLY 229 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k25 s THR 230 N 0.00 1.66 0.41 2.61 2.01 0.42 -4.81 115.64 117.93 1k25 s THR 230 Ca 0.00 -1.91 0.01 0.00 0.31 0.00 0.00 61.69 60.11 1k25 s THR 230 Cb 0.00 -1.79 -0.01 0.00 0.01 0.00 0.00 72.50 70.71 1k25 s THR 230 CO 0.00 -0.39 0.61 -1.81 -0.69 0.00 0.00 174.62 172.33 1k25 s ASP 231 N -2.71 5.96 -0.33 3.53 -0.00 -1.26 -0.84 116.67 121.01 1k25 s ASP 231 Ca 0.15 0.24 -0.09 0.00 -0.00 0.00 0.00 52.55 52.85 1k25 s ASP 231 Cb -0.05 -1.59 0.02 0.00 -0.00 0.00 0.00 42.92 41.30 1k25 s ASP 231 CO 0.05 -0.56 0.15 -0.83 -0.00 0.00 0.00 175.17 173.98 1k25 s GLY 232 N -4.17 1.87 -0.22 0.21 0.00 -1.20 -3.56 107.32 100.25 1k25 s GLY 232 Ca 0.46 -1.58 -0.17 0.00 0.00 0.00 0.00 44.72 43.43 1k25 s GLY 232 CO 0.36 0.75 0.44 -0.42 0.00 0.00 0.00 173.10 174.23 1k25 s ILE 233 N 1.53 5.16 -0.21 0.90 1.01 -1.17 -2.34 121.20 126.09 1k25 s ILE 233 Ca 0.02 0.77 0.01 0.00 0.00 0.00 0.00 60.65 61.45 1k25 s ILE 233 Cb -0.18 -3.76 0.05 0.00 0.01 0.00 0.00 42.46 38.57 1k25 s ILE 233 CO 0.05 0.20 -0.09 -0.63 0.00 0.00 0.00 174.94 174.47 1k25 s ILE 234 N 1.59 1.63 -0.19 2.92 1.01 -0.24 -3.09 121.20 124.83 1k25 s ILE 234 Ca 0.20 -1.09 -0.02 0.00 0.00 0.00 0.00 60.65 59.74 1k25 s ILE 234 Cb -0.15 -1.76 -0.01 0.00 0.01 0.00 0.00 42.46 40.55 1k25 s ILE 234 CO 0.09 0.08 -0.09 0.42 0.00 0.00 0.00 174.94 175.44 1k25 s THR 235 N 1.39 3.14 0.00 2.92 -4.23 -0.73 0.03 115.64 118.16 1k25 s THR 235 Ca -0.03 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1k25 s THR 235 Cb -0.17 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.28 1k25 s THR 235 CO -0.07 0.47 0.00 -1.22 -0.54 0.00 0.00 174.62 173.25 1k25 n TYR 236 N 4.38 0.00 0.00 3.99 0.53 0.55 -1.92 117.16 124.69 1k25 n TYR 236 Ca -0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.70 1k25 n TYR 236 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.82 1k25 n TYR 236 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1k25 n GLY 242 N 5.00 0.00 3.19 2.72 0.00 -1.26 -2.82 105.19 112.02 1k25 n GLY 242 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1k25 n GLY 242 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1k25 s ASN 243 N 0.00 3.25 0.50 1.61 3.84 -1.26 -5.13 114.94 117.76 1k25 s ASN 243 Ca 0.00 -0.57 -0.19 0.00 0.21 0.00 0.00 52.86 52.31 1k25 s ASN 243 Cb 0.00 -1.48 -0.08 0.00 -0.55 0.00 0.00 41.25 39.15 1k25 s ASN 243 CO 0.00 0.08 1.03 -0.63 -2.79 0.00 0.00 177.10 174.79 1k25 s ILE 244 N 0.83 3.91 0.00 -5.21 1.01 -1.26 -5.02 121.20 115.45 1k25 s ILE 244 Ca -0.06 1.11 0.00 0.00 0.00 0.00 0.00 60.65 61.70 1k25 s ILE 244 Cb -0.15 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.85 1k25 s ILE 244 CO -0.02 -0.33 0.40 0.52 0.00 0.00 0.00 174.94 175.52 1k25 n VAL 245 N -1.17 0.00 0.02 2.92 0.31 -1.26 -3.52 118.33 115.64 1k25 n VAL 245 Ca 0.09 0.77 0.00 0.00 -0.01 0.00 0.00 64.34 65.19 1k25 n VAL 245 Cb 0.53 -1.51 0.01 0.00 -0.91 0.00 0.00 33.84 31.96 1k25 n VAL 245 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1k25 n PRO 246 N -0.99 0.01 -0.21 5.55 -0.04 -1.26 -3.88 135.00 134.18 1k25 n PRO 246 Ca 0.00 0.27 -0.08 0.00 -0.04 0.00 0.00 63.50 63.65 1k25 n PRO 246 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 1k25 n PRO 246 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1k25 h GLY 247 N 0.08 -1.42 -3.12 0.55 0.00 -1.94 -3.43 103.07 93.79 1k25 h GLY 247 Ca 0.00 0.86 -0.41 0.00 0.00 0.00 0.00 47.33 47.78 1k25 h GLY 247 CO 0.00 -0.32 -0.17 2.41 0.00 0.00 0.00 176.54 178.46 1k25 n THR 248 N -4.49 0.69 -3.63 4.70 -1.04 -1.25 -4.58 114.28 104.67 1k25 n THR 248 Ca -0.00 -0.17 -0.07 0.00 -2.04 0.00 0.00 64.05 61.77 1k25 n THR 248 Cb 0.20 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.64 1k25 n THR 248 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 1k25 s GLU 249 N -0.34 0.36 -0.82 -2.82 1.03 -0.81 -4.97 118.70 110.33 1k25 s GLU 249 Ca 0.43 0.34 0.02 0.00 0.03 0.00 0.00 54.97 55.79 1k25 s GLU 249 Cb -0.62 0.17 0.28 0.00 -0.80 0.00 0.00 34.13 33.17 1k25 s GLU 249 CO 0.33 -0.06 1.10 -0.11 -1.33 0.00 0.00 175.26 175.19 1k25 n LEU 250 N 1.68 5.04 -2.68 1.83 7.94 -1.26 -1.77 117.00 127.78 1k25 n LEU 250 Ca -0.11 -5.38 -0.24 0.00 -1.11 0.00 0.00 56.01 49.17 1k25 n LEU 250 Cb 0.57 -0.91 -0.09 0.00 0.53 0.00 0.00 43.42 43.51 1k25 n LEU 250 CO 0.04 1.95 1.32 0.55 -1.11 0.00 0.00 177.39 180.15 1k25 n VAL 251 N 0.85 0.00 -0.92 1.96 3.14 -1.18 -3.30 118.33 118.89 1k25 n VAL 251 Ca 0.30 -0.02 0.00 0.00 -2.96 0.00 0.00 64.34 61.66 1k25 n VAL 251 Cb 0.37 -0.28 0.00 0.00 -1.06 0.00 0.00 33.84 32.87 1k25 n VAL 251 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1k25 n SER 252 N 6.06 0.00 -3.49 6.55 3.41 -1.26 -4.56 113.62 120.33 1k25 n SER 252 Ca 0.39 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.78 1k25 n SER 252 Cb 0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.84 1k25 n SER 252 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1k25 s GLN 253 N -0.51 0.22 -0.72 4.33 -1.52 -1.21 -5.00 119.66 115.25 1k25 s GLN 253 Ca 0.00 -0.18 -0.02 0.00 -1.95 0.00 0.00 55.36 53.20 1k25 s GLN 253 Cb 0.00 -1.07 0.18 0.00 -0.22 0.00 0.00 33.01 31.90 1k25 s GLN 253 CO 0.00 -0.90 0.56 -0.65 -0.25 0.00 0.00 175.29 174.05 1k25 s GLN 254 N 2.24 2.82 0.00 2.91 1.11 -1.26 -3.02 119.66 124.46 1k25 s GLN 254 Ca 0.08 -2.82 0.00 0.00 0.01 0.00 0.00 55.36 52.63 1k25 s GLN 254 Cb -0.15 -3.81 0.00 0.00 -1.01 0.00 0.00 33.01 28.04 1k25 s GLN 254 CO -0.27 -1.21 0.00 2.41 0.01 0.00 0.00 175.29 176.23 1k25 n THR 255 N 3.04 0.00 -3.97 -0.19 -1.04 -1.23 -4.85 114.28 106.04 1k25 n THR 255 Ca 0.13 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.83 1k25 n THR 255 Cb 0.38 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 68.73 1k25 n THR 255 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1k25 s VAL 256 N 0.00 1.95 -0.02 12.58 1.01 -0.02 -4.89 120.40 131.00 1k25 s VAL 256 Ca 0.00 -1.99 -0.37 0.00 0.00 0.00 0.00 61.98 59.61 1k25 s VAL 256 Cb 0.00 -2.38 -0.16 0.00 0.00 0.00 0.00 36.38 33.84 1k25 s VAL 256 CO 0.00 -0.50 1.49 0.47 0.00 0.00 0.00 175.10 176.56 1k25 n ASP 257 N 4.42 2.02 -4.43 3.32 8.00 -1.26 -0.44 116.55 128.17 1k25 n ASP 257 Ca -0.01 1.10 -0.31 0.00 0.71 0.00 0.00 54.79 56.28 1k25 n ASP 257 Cb 0.42 -1.20 0.18 0.00 -0.02 0.00 0.00 41.12 40.50 1k25 n ASP 257 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k25 n GLY 258 N 3.13 -1.86 3.83 0.44 0.00 -1.22 -4.76 105.19 104.75 1k25 n GLY 258 Ca 0.21 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 1k25 n GLY 258 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k25 s LYS 259 N -3.94 4.13 0.54 1.61 1.02 -0.45 -4.40 119.74 118.25 1k25 s LYS 259 Ca 0.61 0.97 -0.13 0.00 0.02 0.00 0.00 55.97 57.44 1k25 s LYS 259 Cb -0.20 -2.24 -0.06 0.00 -0.52 0.00 0.00 37.83 34.81 1k25 s LYS 259 CO 0.65 -0.02 0.97 -0.51 -0.92 0.00 0.00 175.35 175.52 1k25 s ASP 260 N -2.35 6.45 -0.18 2.83 1.01 -1.20 -4.37 116.67 118.87 1k25 s ASP 260 Ca 0.59 1.43 -0.02 0.00 0.71 0.00 0.00 52.55 55.27 1k25 s ASP 260 Cb -0.09 -2.46 0.05 0.00 1.01 0.00 0.00 42.92 41.43 1k25 s ASP 260 CO 0.17 -0.67 0.00 -0.69 0.21 0.00 0.00 175.17 174.19 1k25 s VAL 261 N -2.81 0.74 -0.34 -1.27 1.01 -0.81 -1.89 120.40 115.03 1k25 s VAL 261 Ca 0.56 -0.56 -0.25 0.00 0.00 0.00 0.00 61.98 61.74 1k25 s VAL 261 Cb -0.10 -1.10 0.01 0.00 0.00 0.00 0.00 36.38 35.18 1k25 s VAL 261 CO 0.40 -0.06 0.86 -0.31 0.00 0.00 0.00 175.10 175.99 1k25 s TYR 262 N 1.77 3.14 0.00 5.22 1.51 0.12 -1.36 117.35 127.75 1k25 s TYR 262 Ca -0.00 0.78 0.00 0.00 -1.01 0.00 0.00 57.07 56.84 1k25 s TYR 262 Cb -0.16 -3.44 0.00 0.00 -0.11 0.00 0.00 41.96 38.25 1k25 s TYR 262 CO -0.07 -0.70 0.00 0.25 -1.11 0.00 0.00 175.55 173.91 1k25 n THR 263 N 5.76 0.00 -0.01 -0.71 -2.24 -1.15 -0.13 114.28 115.80 1k25 n THR 263 Ca 0.05 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.86 1k25 n THR 263 Cb 0.48 -1.58 -0.05 0.00 -2.10 0.00 0.00 70.33 67.08 1k25 n THR 263 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1k25 n THR 264 N 0.00 0.06 -1.56 4.28 -2.24 0.21 -3.17 114.28 111.86 1k25 n THR 264 Ca 0.00 -0.17 -0.42 0.00 -2.27 0.00 0.00 64.05 61.19 1k25 n THR 264 Cb 0.00 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 1k25 n THR 264 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1k25 n LEU 265 N -1.81 1.76 -4.24 3.22 4.77 -1.10 -4.22 117.00 115.38 1k25 n LEU 265 Ca -0.03 1.03 -0.40 0.00 -0.03 0.00 0.00 56.01 56.58 1k25 n LEU 265 Cb 0.25 -1.28 -0.09 0.00 -2.33 0.00 0.00 43.42 39.97 1k25 n LEU 265 CO 0.14 -1.83 -0.08 -0.55 -1.33 0.00 0.00 177.39 173.74 1k25 s SER 266 N -0.77 5.65 0.20 -1.43 0.15 0.10 -1.38 113.70 116.23 1k25 s SER 266 Ca 0.62 -1.68 -0.22 0.00 0.70 0.00 0.00 55.95 55.38 1k25 s SER 266 Cb -0.60 -1.99 0.14 0.00 -1.71 0.00 0.00 66.02 61.85 1k25 s SER 266 CO 0.58 -0.60 1.55 0.28 1.20 0.00 0.00 173.24 176.25 1k25 h SER 267 N 8.41 -1.57 0.26 5.45 0.02 -1.93 0.67 113.55 124.87 1k25 h SER 267 Ca -0.22 0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 1k25 h SER 267 Cb 1.08 0.77 -0.01 0.00 0.14 0.00 0.00 62.40 64.38 1k25 h SER 267 CO 0.80 -0.29 -0.23 1.55 -1.14 0.00 0.00 176.83 177.52 1k25 h PRO 268 N -0.05 0.00 0.04 3.45 0.13 -1.97 -0.68 132.00 132.92 1k25 h PRO 268 Ca 0.27 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.31 1k25 h PRO 268 Cb 0.55 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.69 1k25 h PRO 268 CO -0.91 0.23 -0.37 1.25 -0.23 0.00 0.00 178.00 177.97 1k25 h LEU 269 N 0.00 0.26 -1.11 1.56 5.85 -1.45 -2.21 115.31 118.21 1k25 h LEU 269 Ca -0.00 -0.89 -0.02 0.00 0.84 0.00 0.00 57.88 57.81 1k25 h LEU 269 Cb 0.43 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1k25 h LEU 269 CO 0.03 1.12 0.39 -0.61 -0.34 0.00 0.00 178.44 179.03 1k25 h GLN 270 N -0.57 1.01 0.35 1.25 5.75 0.37 0.30 115.11 123.58 1k25 h GLN 270 Ca -0.06 -0.11 -0.02 0.00 -0.15 0.00 0.00 58.65 58.31 1k25 h GLN 270 Cb 1.21 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 29.57 1k25 h GLN 270 CO 0.07 0.75 -0.17 0.77 -2.65 0.00 0.00 178.83 177.60 1k25 h SER 271 N 1.01 -0.40 -0.60 -0.69 0.02 -1.20 -1.91 113.55 109.78 1k25 h SER 271 Ca 0.25 -0.12 0.09 0.00 -0.84 0.00 0.00 61.79 61.17 1k25 h SER 271 Cb 0.04 0.10 -0.07 0.00 0.14 0.00 0.00 62.40 62.62 1k25 h SER 271 CO -0.04 -0.09 0.23 0.15 -1.14 0.00 0.00 176.83 175.94 1k25 h PHE 272 N -0.72 0.40 -0.81 3.45 3.57 -1.01 0.11 116.94 121.94 1k25 h PHE 272 Ca -0.05 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.59 1k25 h PHE 272 Cb 0.50 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.09 1k25 h PHE 272 CO 0.01 0.11 0.53 1.98 -2.23 0.00 0.00 178.31 178.71 1k25 h MET 273 N 0.42 0.69 0.69 1.11 4.05 -0.30 -0.29 114.93 121.31 1k25 h MET 273 Ca 0.30 -0.04 -0.03 0.00 -0.28 0.00 0.00 59.70 59.64 1k25 h MET 273 Cb 0.35 -0.16 0.01 0.00 -0.80 0.00 0.00 31.60 31.00 1k25 h MET 273 CO -0.29 0.46 -0.33 0.93 0.23 0.00 0.00 176.91 177.91 1k25 h GLU 274 N 0.71 -0.90 -0.92 0.39 4.39 0.02 -0.73 114.58 117.54 1k25 h GLU 274 Ca 0.38 0.06 0.16 0.00 0.34 0.00 0.00 59.36 60.30 1k25 h GLU 274 Cb 0.51 0.20 -0.16 0.00 -0.10 0.00 0.00 28.75 29.20 1k25 h GLU 274 CO -0.15 -0.59 -0.30 2.41 -1.16 0.00 0.00 179.01 179.22 1k25 n THR 275 N -5.48 -0.44 0.12 1.13 -1.04 -0.48 -1.45 114.28 106.64 1k25 n THR 275 Ca -0.14 2.13 -0.05 0.00 -2.04 0.00 0.00 64.05 63.96 1k25 n THR 275 Cb 0.38 -2.87 -0.02 0.00 -1.82 0.00 0.00 70.33 66.00 1k25 n THR 275 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 1k25 h GLN 276 N 0.00 -0.30 -1.29 -2.82 1.08 -0.91 -3.04 115.11 107.83 1k25 h GLN 276 Ca 0.37 0.02 0.41 0.00 -1.45 0.00 0.00 58.65 58.00 1k25 h GLN 276 Cb 0.60 0.07 -0.12 0.00 -0.05 0.00 0.00 27.48 27.98 1k25 h GLN 276 CO -0.93 -0.20 0.83 1.98 -0.95 0.00 0.00 178.83 179.56 1k25 h MET 277 N -0.37 0.12 -0.33 1.46 4.05 -0.53 1.31 114.93 120.65 1k25 h MET 277 Ca -0.03 -0.01 -0.11 0.00 -0.28 0.00 0.00 59.70 59.27 1k25 h MET 277 Cb 0.24 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 1k25 h MET 277 CO 0.05 0.08 -0.21 -0.44 0.23 0.00 0.00 176.91 176.62 1k25 h ASP 278 N 0.12 0.75 -0.73 1.39 3.32 -1.29 1.14 116.42 121.12 1k25 h ASP 278 Ca 0.79 -0.43 -0.04 0.00 0.02 0.00 0.00 57.03 57.37 1k25 h ASP 278 Cb 2.44 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 41.74 1k25 h ASP 278 CO -0.39 1.02 0.32 0.00 -1.72 0.00 0.00 179.24 178.47 1k25 h ALA 279 N 0.76 1.16 -0.13 3.45 0.00 0.15 0.18 119.26 124.83 1k25 h ALA 279 Ca 0.07 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 1k25 h ALA 279 Cb 0.76 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1k25 h ALA 279 CO 0.06 0.62 -0.67 0.35 0.00 0.00 0.00 179.25 179.60 1k25 h PHE 280 N 1.08 0.67 -0.21 0.00 3.57 0.42 -2.80 116.94 119.67 1k25 h PHE 280 Ca 0.25 -0.28 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 1k25 h PHE 280 Cb 0.16 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1k25 h PHE 280 CO 0.02 1.03 -0.21 1.25 -2.23 0.00 0.00 178.31 178.17 1k25 h LEU 281 N 0.37 0.37 0.56 0.59 5.85 0.20 -2.77 115.31 120.48 1k25 h LEU 281 Ca -0.02 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 1k25 h LEU 281 Cb 1.24 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 42.18 1k25 h LEU 281 CO 0.12 0.59 -0.27 -0.33 -0.34 0.00 0.00 178.44 178.22 1k25 h GLU 282 N 0.34 -0.73 -0.95 1.25 4.39 -0.90 1.65 114.58 119.64 1k25 h GLU 282 Ca 0.06 0.05 0.25 0.00 0.34 0.00 0.00 59.36 60.05 1k25 h GLU 282 Cb 0.57 0.17 -0.06 0.00 -0.10 0.00 0.00 28.75 29.32 1k25 h GLU 282 CO 0.04 -0.44 0.65 -0.22 -1.16 0.00 0.00 179.01 177.88 1k25 h LYS 283 N -1.13 0.21 0.00 2.33 3.64 -1.46 -3.17 116.57 116.99 1k25 h LYS 283 Ca -0.08 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1k25 h LYS 283 Cb 0.62 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1k25 h LYS 283 CO 0.13 0.14 -0.46 1.33 -2.27 0.00 0.00 179.45 178.32 1k25 n VAL 284 N -4.41 0.00 -3.34 2.00 0.24 -1.05 -4.74 118.33 107.03 1k25 n VAL 284 Ca 0.21 -0.16 -0.17 0.00 -2.04 0.00 0.00 64.34 62.18 1k25 n VAL 284 Cb 0.88 0.64 0.00 0.00 -1.47 0.00 0.00 33.84 33.89 1k25 n VAL 284 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1k25 n LYS 285 N -1.01 -1.03 -3.14 7.34 4.76 0.56 -1.89 118.16 123.76 1k25 n LYS 285 Ca 0.00 0.50 -0.39 0.00 -2.87 0.00 0.00 58.31 55.55 1k25 n LYS 285 Cb 0.00 -1.45 -0.06 0.00 -1.84 0.00 0.00 35.03 31.68 1k25 n LYS 285 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1k25 s GLY 286 N -2.60 2.74 0.43 0.72 0.00 -1.26 -3.63 107.32 103.72 1k25 s GLY 286 Ca 0.01 0.16 0.37 0.00 0.00 0.00 0.00 44.72 45.25 1k25 s GLY 286 CO 0.59 0.74 1.29 0.28 0.00 0.00 0.00 173.10 176.00 1k25 n LYS 287 N 2.10 -0.01 -3.73 2.90 4.76 -0.33 -4.18 118.16 119.67 1k25 n LYS 287 Ca -0.07 0.95 -0.12 0.00 -2.87 0.00 0.00 58.31 56.19 1k25 n LYS 287 Cb 0.50 -2.07 -0.10 0.00 -1.84 0.00 0.00 35.03 31.52 1k25 n LYS 287 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1k25 s TYR 288 N -4.69 -0.48 0.41 2.13 2.02 -1.17 -4.63 117.35 110.94 1k25 s TYR 288 Ca -0.05 1.13 0.05 0.00 -0.37 0.00 0.00 57.07 57.83 1k25 s TYR 288 Cb 0.23 0.18 -0.06 0.00 -0.40 0.00 0.00 41.96 41.91 1k25 s TYR 288 CO 0.72 -0.25 0.02 -1.64 -1.57 0.00 0.00 175.55 172.83 1k25 s MET 289 N 0.55 1.95 -0.21 -0.62 -1.94 -0.92 -0.56 119.30 117.55 1k25 s MET 289 Ca -0.03 -2.14 -0.36 0.00 -1.71 0.00 0.00 55.69 51.46 1k25 s MET 289 Cb -0.04 -1.45 0.14 0.00 2.01 0.00 0.00 34.83 35.49 1k25 s MET 289 CO -0.03 -0.15 1.25 0.99 -0.01 0.00 0.00 175.02 177.07 1k25 s THR 290 N -2.86 0.00 0.00 2.05 2.01 0.02 -2.89 115.64 113.97 1k25 s THR 290 Ca 0.29 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.29 1k25 s THR 290 Cb 0.08 -1.04 0.00 0.00 0.01 0.00 0.00 72.50 71.55 1k25 s THR 290 CO 0.15 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.08 1k25 n ALA 291 N -0.09 0.00 -2.71 7.40 0.00 -1.01 -1.59 120.51 122.51 1k25 n ALA 291 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.25 1k25 n ALA 291 Cb 0.58 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.88 1k25 n ALA 291 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1k25 s THR 292 N 0.00 0.91 -0.25 0.00 2.01 -0.21 -2.72 115.64 115.38 1k25 s THR 292 Ca 0.00 -0.48 -0.03 0.00 0.31 0.00 0.00 61.69 61.49 1k25 s THR 292 Cb 0.00 -0.77 0.02 0.00 0.01 0.00 0.00 72.50 71.76 1k25 s THR 292 CO 0.00 0.26 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.93 1k25 s LEU 293 N -0.17 3.22 0.15 4.42 0.20 -0.38 -0.90 118.68 125.23 1k25 s LEU 293 Ca 0.03 -0.77 0.08 0.00 0.69 0.00 0.00 54.13 54.16 1k25 s LEU 293 Cb -0.06 -1.70 -0.04 0.00 -0.43 0.00 0.00 46.19 43.96 1k25 s LEU 293 CO -0.00 -0.12 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.15 1k25 s VAL 294 N 1.38 3.20 -0.58 1.68 1.01 0.41 -1.68 120.40 125.81 1k25 s VAL 294 Ca 0.02 -1.54 -0.19 0.00 0.00 0.00 0.00 61.98 60.26 1k25 s VAL 294 Cb -0.16 -2.55 0.09 0.00 0.00 0.00 0.00 36.38 33.75 1k25 s VAL 294 CO -0.03 -0.03 0.72 -0.55 0.00 0.00 0.00 175.10 175.20 1k25 s SER 295 N -2.60 6.20 0.03 3.32 0.15 0.04 0.73 113.70 121.56 1k25 s SER 295 Ca 0.23 -1.22 -0.09 0.00 0.70 0.00 0.00 55.95 55.57 1k25 s SER 295 Cb -0.10 -2.32 -0.04 0.00 -1.71 0.00 0.00 66.02 61.86 1k25 s SER 295 CO 0.14 -1.10 1.15 0.00 1.20 0.00 0.00 173.24 174.63 1k25 h ALA 296 N 9.19 -0.66 -1.20 5.45 0.00 0.25 1.30 119.26 133.59 1k25 h ALA 296 Ca -0.29 -0.03 0.39 0.00 0.00 0.00 0.00 54.91 54.98 1k25 h ALA 296 Cb 1.09 0.58 -0.09 0.00 0.00 0.00 0.00 17.79 19.37 1k25 h ALA 296 CO 1.08 -0.70 0.81 1.63 0.00 0.00 0.00 179.25 182.06 1k25 n LYS 297 N -3.27 -0.02 -0.00 0.00 4.76 -1.25 -1.80 118.16 116.57 1k25 n LYS 297 Ca -0.02 0.91 0.00 0.00 -2.87 0.00 0.00 58.31 56.33 1k25 n LYS 297 Cb 0.11 -1.88 -0.01 0.00 -1.84 0.00 0.00 35.03 31.40 1k25 n LYS 297 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 1k25 n THR 298 N -3.97 0.03 -1.88 -0.18 5.66 -1.06 -5.01 114.28 107.88 1k25 n THR 298 Ca 0.32 -0.04 0.00 0.00 -3.05 0.00 0.00 64.05 61.27 1k25 n THR 298 Cb 1.30 0.01 0.00 0.00 -1.55 0.00 0.00 70.33 70.09 1k25 n THR 298 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1k25 n GLY 299 N 2.57 0.95 3.41 1.09 0.00 0.44 -4.44 105.19 109.22 1k25 n GLY 299 Ca -0.01 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 1k25 n GLY 299 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k25 s GLU 300 N -3.77 3.49 -0.55 1.61 2.02 -1.11 -0.96 118.70 119.43 1k25 s GLU 300 Ca 0.00 -0.62 -0.28 0.00 0.02 0.00 0.00 54.97 54.09 1k25 s GLU 300 Cb 0.00 -2.76 0.00 0.00 0.10 0.00 0.00 34.13 31.47 1k25 s GLU 300 CO 0.00 0.20 1.59 0.42 0.02 0.00 0.00 175.26 177.49 1k25 s ILE 301 N 0.42 3.62 -0.95 -1.63 1.01 -1.04 -0.78 121.20 121.85 1k25 s ILE 301 Ca -0.07 0.50 0.27 0.00 0.00 0.00 0.00 60.65 61.35 1k25 s ILE 301 Cb -0.15 -4.21 0.18 0.00 0.01 0.00 0.00 42.46 38.29 1k25 s ILE 301 CO 0.04 -1.02 1.75 0.18 0.00 0.00 0.00 174.94 175.89 1k25 n LEU 302 N 10.55 0.26 0.00 2.97 4.77 -0.68 -2.70 117.00 132.16 1k25 n LEU 302 Ca 0.16 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 1k25 n LEU 302 Cb 0.50 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1k25 n LEU 302 CO 0.71 0.01 0.00 0.00 -1.33 0.00 0.00 177.39 176.77 1k25 n ALA 303 N -1.55 0.00 -2.62 -1.18 0.00 -1.18 0.02 120.51 113.99 1k25 n ALA 303 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.40 1k25 n ALA 303 Cb 0.36 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.70 1k25 n ALA 303 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1k25 s THR 304 N 0.00 0.35 -0.07 0.00 -1.32 -1.26 -1.25 115.64 112.09 1k25 s THR 304 Ca 0.00 -1.32 -0.30 0.00 -1.21 0.00 0.00 61.69 58.87 1k25 s THR 304 Cb 0.00 -0.86 0.11 0.00 -1.51 0.00 0.00 72.50 70.24 1k25 s THR 304 CO 0.00 -0.64 0.92 0.28 -2.21 0.00 0.00 174.62 172.98 1k25 s THR 305 N -2.32 0.00 0.05 5.08 -1.32 -1.10 -4.16 115.64 111.86 1k25 s THR 305 Ca -0.05 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.40 1k25 s THR 305 Cb -0.04 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.93 1k25 s THR 305 CO -0.03 0.00 0.03 0.00 -2.21 0.00 0.00 174.62 172.41 1k25 s GLN 306 N -2.19 0.63 -0.02 7.08 -2.07 -1.26 -2.39 119.66 119.43 1k25 s GLN 306 Ca 0.01 -1.04 0.04 0.00 -1.82 0.00 0.00 55.36 52.55 1k25 s GLN 306 Cb -0.01 0.23 -0.01 0.00 -1.09 0.00 0.00 33.01 32.14 1k25 s GLN 306 CO -0.04 -0.14 -0.14 1.03 -1.32 0.00 0.00 175.29 174.68 1k25 s ARG 307 N -3.49 1.32 0.20 9.60 1.81 -1.14 -3.87 118.95 123.38 1k25 s ARG 307 Ca 0.03 -0.51 -0.30 0.00 -1.72 0.00 0.00 55.73 53.23 1k25 s ARG 307 Cb 0.04 -1.22 -0.08 0.00 -0.45 0.00 0.00 34.95 33.24 1k25 s ARG 307 CO -0.09 0.26 1.00 -1.25 -0.68 0.00 0.00 175.30 174.54 1k25 s PRO 308 N -0.13 4.74 0.00 3.54 0.04 -1.26 -2.16 135.00 139.76 1k25 s PRO 308 Ca 0.01 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.62 1k25 s PRO 308 Cb -0.08 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.17 1k25 s PRO 308 CO 0.00 0.31 0.00 0.25 0.04 0.00 0.00 177.00 177.61 1k25 n THR 309 N 1.98 0.00 -3.60 1.26 -2.24 -1.25 -5.01 114.28 105.41 1k25 n THR 309 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1k25 n THR 309 Cb 0.47 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.64 1k25 n THR 309 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1k25 s PHE 310 N 3.06 -0.43 -0.54 4.78 -0.71 -1.26 -4.63 117.98 118.25 1k25 s PHE 310 Ca 0.00 0.90 -0.27 0.00 -1.04 0.00 0.00 56.93 56.52 1k25 s PHE 310 Cb 0.00 0.41 -0.01 0.00 -1.21 0.00 0.00 43.02 42.21 1k25 s PHE 310 CO 0.00 -0.30 1.70 1.21 -1.34 0.00 0.00 175.22 176.49 1k25 s ASN 311 N -0.49 5.68 0.39 1.98 3.84 0.11 -4.07 114.94 122.38 1k25 s ASN 311 Ca 0.00 0.52 0.19 0.00 0.21 0.00 0.00 52.86 53.77 1k25 s ASN 311 Cb -0.03 -2.53 1.11 0.00 -0.55 0.00 0.00 41.25 39.25 1k25 s ASN 311 CO -0.02 -2.02 1.75 0.00 -2.79 0.00 0.00 177.10 174.02 1k25 h ALA 312 N 13.26 2.23 -0.16 1.71 0.00 -1.84 0.89 119.26 135.35 1k25 h ALA 312 Ca -0.28 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1k25 h ALA 312 Cb 1.14 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1k25 h ALA 312 CO 1.17 -0.67 0.00 -3.47 0.00 0.00 0.00 179.25 176.28 1k25 n ASP 313 N -4.67 0.00 0.00 0.00 2.03 -1.26 -3.85 116.55 108.79 1k25 n ASP 313 Ca 0.27 0.57 0.00 0.00 0.52 0.00 0.00 54.79 56.15 1k25 n ASP 313 Cb 0.92 -0.47 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 1k25 n ASP 313 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1k25 n THR 314 N -1.92 0.00 -1.15 5.18 -2.24 -1.18 -4.77 114.28 108.20 1k25 n THR 314 Ca 0.00 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.72 1k25 n THR 314 Cb 0.00 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 67.84 1k25 n THR 314 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1k25 n LYS 315 N -0.51 -1.19 -2.44 -0.78 4.76 0.30 -4.87 118.16 113.43 1k25 n LYS 315 Ca 0.00 0.38 -0.41 0.00 -2.87 0.00 0.00 58.31 55.42 1k25 n LYS 315 Cb 0.00 -4.46 -0.04 0.00 -1.84 0.00 0.00 35.03 28.69 1k25 n LYS 315 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1k25 s GLU 316 N -2.47 4.55 0.00 1.97 2.12 -1.14 -2.98 118.70 120.75 1k25 s GLU 316 Ca 0.00 1.81 0.00 0.00 0.36 0.00 0.00 54.97 57.14 1k25 s GLU 316 Cb 0.00 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 31.15 1k25 s GLU 316 CO 0.00 0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.16 1k25 n GLY 317 N 1.94 0.21 3.43 -1.50 0.00 -1.26 0.07 105.19 108.08 1k25 n GLY 317 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1k25 n GLY 317 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k25 s ILE 318 N -2.00 4.84 0.48 -0.61 1.01 -1.16 -4.72 121.20 119.04 1k25 s ILE 318 Ca 0.00 -0.61 0.05 0.00 0.00 0.00 0.00 60.65 60.09 1k25 s ILE 318 Cb 0.00 -3.61 -0.02 0.00 0.01 0.00 0.00 42.46 38.84 1k25 s ILE 318 CO 0.00 -0.14 0.18 0.42 0.00 0.00 0.00 174.94 175.39 1k25 s THR 319 N 1.62 1.78 0.20 2.92 -4.23 -1.26 -5.01 115.64 111.66 1k25 s THR 319 Ca 0.04 -1.75 -0.13 0.00 -1.18 0.00 0.00 61.69 58.67 1k25 s THR 319 Cb -0.18 -2.52 0.18 0.00 1.34 0.00 0.00 72.50 71.31 1k25 s THR 319 CO 0.08 0.00 1.65 -0.08 -0.54 0.00 0.00 174.62 175.73 1k25 h GLU 320 N 1.24 0.05 -2.18 3.99 4.81 -2.02 -1.87 114.58 118.60 1k25 h GLU 320 Ca -0.42 -0.00 -0.73 0.00 -0.13 0.00 0.00 59.36 58.08 1k25 h GLU 320 Cb 1.28 -0.01 -0.23 0.00 0.63 0.00 0.00 28.75 30.42 1k25 h GLU 320 CO 0.68 0.04 1.15 -0.40 -0.73 0.00 0.00 179.01 179.75 1k25 n ASP 321 N -5.33 7.38 -4.61 1.04 5.75 -1.26 -4.96 116.55 114.56 1k25 n ASP 321 Ca 0.07 -3.57 -0.38 0.00 -0.01 0.00 0.00 54.79 50.89 1k25 n ASP 321 Cb 0.31 -1.18 -0.10 0.00 -1.03 0.00 0.00 41.12 39.13 1k25 n ASP 321 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1k25 s PHE 322 N -3.30 3.25 -0.62 2.11 5.36 -0.71 -5.04 117.98 119.03 1k25 s PHE 322 Ca 0.49 0.30 -0.28 0.00 -0.96 0.00 0.00 56.93 56.49 1k25 s PHE 322 Cb 0.31 -2.47 0.03 0.00 -0.34 0.00 0.00 43.02 40.55 1k25 s PHE 322 CO -0.24 -0.16 1.21 0.08 -1.46 0.00 0.00 175.22 174.64 1k25 s VAL 323 N 1.82 3.95 -1.94 3.12 1.01 -1.26 -4.86 120.40 122.24 1k25 s VAL 323 Ca 0.12 0.73 0.00 0.00 0.00 0.00 0.00 61.98 62.83 1k25 s VAL 323 Cb -0.16 -4.78 0.00 0.00 0.00 0.00 0.00 36.38 31.45 1k25 s VAL 323 CO 0.10 -1.48 0.79 0.79 0.00 0.00 0.00 175.10 175.30 1k25 n TRP 324 N 8.67 0.00 -1.85 5.22 7.02 -1.26 -4.86 117.44 130.37 1k25 n TRP 324 Ca 0.07 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.13 1k25 n TRP 324 Cb 0.49 -0.01 -0.03 0.00 -2.42 0.00 0.00 31.31 29.35 1k25 n TRP 324 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1k25 s ARG 325 N -1.94 4.18 -0.43 -0.99 3.52 -1.26 -4.98 118.95 117.06 1k25 s ARG 325 Ca 0.00 2.47 -0.13 0.00 -0.13 0.00 0.00 55.73 57.94 1k25 s ARG 325 Cb 0.00 -3.10 0.05 0.00 -1.56 0.00 0.00 34.95 30.34 1k25 s ARG 325 CO 0.00 -0.63 0.31 0.34 -0.81 0.00 0.00 175.30 174.51 1k25 s ASP 326 N 0.91 5.97 0.21 -2.12 -1.08 -1.26 -4.98 116.67 114.31 1k25 s ASP 326 Ca 0.68 -1.18 -0.10 0.00 -0.52 0.00 0.00 52.55 51.44 1k25 s ASP 326 Cb -0.46 -2.11 0.25 0.00 -1.46 0.00 0.00 42.92 39.14 1k25 s ASP 326 CO 0.37 -0.52 1.77 0.40 0.52 0.00 0.00 175.17 177.71 1k25 h ILE 327 N 5.80 0.87 0.00 4.11 2.04 -1.94 0.96 117.51 129.36 1k25 h ILE 327 Ca -0.26 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1k25 h ILE 327 Cb 1.11 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1k25 h ILE 327 CO 0.78 0.10 0.13 -0.11 0.00 0.00 0.00 178.15 179.04 1k25 n LEU 328 N -4.90 0.00 0.00 1.44 7.94 -1.26 -3.38 117.00 116.84 1k25 n LEU 328 Ca 0.08 0.15 0.00 0.00 -1.11 0.00 0.00 56.01 55.13 1k25 n LEU 328 Cb 0.22 -0.15 0.00 0.00 0.53 0.00 0.00 43.42 44.02 1k25 n LEU 328 CO 0.26 -0.15 0.00 0.00 -1.11 0.00 0.00 177.39 176.39 1k25 n TYR 329 N -1.04 0.00 -2.76 1.96 4.11 -0.88 -3.14 117.16 115.41 1k25 n TYR 329 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.90 57.69 1k25 n TYR 329 Cb 0.13 0.06 -0.01 0.00 -0.00 0.00 0.00 39.34 39.52 1k25 n TYR 329 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 1k25 n GLN 330 N 0.00 2.38 -3.64 -3.48 6.02 0.33 -1.96 117.38 117.02 1k25 n GLN 330 Ca 0.00 -4.08 -0.03 0.00 -0.01 0.00 0.00 57.00 52.88 1k25 n GLN 330 Cb 0.13 -1.90 -0.07 0.00 1.02 0.00 0.00 30.24 29.43 1k25 n GLN 330 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1k25 s SER 331 N -3.22 -0.39 -0.46 1.08 0.15 -1.26 -4.54 113.70 105.06 1k25 s SER 331 Ca 0.42 0.64 -0.12 0.00 0.70 0.00 0.00 55.95 57.59 1k25 s SER 331 Cb 0.38 1.03 0.09 0.00 -1.71 0.00 0.00 66.02 65.81 1k25 s SER 331 CO -0.10 -0.10 0.35 0.20 1.20 0.00 0.00 173.24 174.78 1k25 s ASN 332 N 1.00 5.88 0.48 5.45 0.01 -1.26 -4.36 114.94 122.14 1k25 s ASN 332 Ca -0.05 -1.56 0.04 0.00 -0.71 0.00 0.00 52.86 50.57 1k25 s ASN 332 Cb -0.04 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.51 1k25 s ASN 332 CO -0.13 -0.64 0.07 -0.72 -1.51 0.00 0.00 177.10 174.17 1k25 s TYR 333 N 1.50 2.07 -0.38 2.20 1.13 -1.04 -4.82 117.35 118.01 1k25 s TYR 333 Ca 0.04 -0.84 -0.08 0.00 -1.41 0.00 0.00 57.07 54.78 1k25 s TYR 333 Cb -0.25 -1.72 0.05 0.00 -1.10 0.00 0.00 41.96 38.95 1k25 s TYR 333 CO 0.03 0.20 0.18 -1.21 -2.51 0.00 0.00 175.55 172.24 1k25 s GLU 334 N -3.88 2.63 0.21 -3.49 2.02 -1.26 -0.39 118.70 114.53 1k25 s GLU 334 Ca 0.19 -1.28 -0.08 0.00 0.02 0.00 0.00 54.97 53.82 1k25 s GLU 334 Cb 0.03 -3.63 0.31 0.00 0.10 0.00 0.00 34.13 30.95 1k25 s GLU 334 CO 0.10 -0.79 1.21 -0.35 0.02 0.00 0.00 175.26 175.46 1k25 n PRO 335 N 4.87 -0.10 0.00 0.39 -0.04 -1.22 -4.53 135.00 134.37 1k25 n PRO 335 Ca -0.11 1.21 0.00 0.00 -0.04 0.00 0.00 63.50 64.56 1k25 n PRO 335 Cb 0.44 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 1k25 n PRO 335 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1k25 n GLY 336 N -1.46 1.55 0.13 0.55 0.00 -0.90 -4.19 105.19 100.87 1k25 n GLY 336 Ca 0.11 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 1k25 n GLY 336 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1k25 h SER 337 N 0.00 -0.18 -1.55 1.61 0.02 -1.78 -2.20 113.55 109.47 1k25 h SER 337 Ca 0.00 -0.34 0.45 0.00 -0.84 0.00 0.00 61.79 61.06 1k25 h SER 337 Cb 0.00 0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 1k25 h SER 337 CO 0.00 0.30 1.31 0.00 -1.14 0.00 0.00 176.83 177.29 1k25 h ALA 338 N -0.03 3.47 0.00 3.77 0.00 -1.87 3.19 119.26 127.79 1k25 h ALA 338 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1k25 h ALA 338 Cb 0.51 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1k25 h ALA 338 CO 0.04 -2.11 0.00 1.98 0.00 0.00 0.00 179.25 179.16 1k25 h MET 339 N 0.00 0.00 -0.74 0.00 -1.53 -1.84 -3.09 114.93 107.74 1k25 h MET 339 Ca 0.74 0.00 -0.05 0.00 -3.44 0.00 0.00 59.70 56.95 1k25 h MET 339 Cb 3.35 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 34.36 1k25 h MET 339 CO -0.01 0.00 0.27 0.87 0.14 0.00 0.00 176.91 178.18 1k25 h LYS 340 N 0.00 1.12 -0.96 0.39 1.57 0.57 -2.55 116.57 116.71 1k25 h LYS 340 Ca 0.00 -0.21 0.12 0.00 -1.87 0.00 0.00 60.65 58.69 1k25 h LYS 340 Cb 0.57 -0.18 -0.08 0.00 0.08 0.00 0.00 32.23 32.62 1k25 h LYS 340 CO 0.00 0.92 0.61 0.28 -0.57 0.00 0.00 179.45 180.70 1k25 h VAL 341 N 1.09 0.91 -0.04 0.50 2.07 -1.66 0.93 116.25 120.04 1k25 h VAL 341 Ca 0.25 -0.31 -0.12 0.00 0.82 0.00 0.00 66.70 67.34 1k25 h VAL 341 Cb 0.24 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.92 1k25 h VAL 341 CO -0.02 0.17 -0.51 0.24 0.02 0.00 0.00 177.57 177.47 1k25 h MET 342 N 0.91 0.11 -0.20 1.57 2.86 -1.64 -0.28 114.93 118.27 1k25 h MET 342 Ca 0.47 -0.06 -0.19 0.00 -2.06 0.00 0.00 59.70 57.86 1k25 h MET 342 Cb 0.53 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.20 1k25 h MET 342 CO -0.24 0.60 -0.64 1.15 1.06 0.00 0.00 176.91 178.84 1k25 h THR 343 N 0.09 1.29 -0.22 2.22 2.02 -0.81 0.17 112.91 117.67 1k25 h THR 343 Ca 0.00 -1.84 -0.03 0.00 0.77 0.00 0.00 66.41 65.30 1k25 h THR 343 Cb 0.93 1.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 1k25 h THR 343 CO 0.07 0.59 0.00 0.25 0.37 0.00 0.00 175.52 176.80 1k25 h LEU 344 N 0.51 0.37 0.39 2.58 5.85 -0.77 -0.05 115.31 124.20 1k25 h LEU 344 Ca -0.02 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 1k25 h LEU 344 Cb 1.26 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 1k25 h LEU 344 CO 0.14 0.58 -0.35 0.00 -0.34 0.00 0.00 178.44 178.47 1k25 h ALA 345 N 0.80 -0.78 0.00 1.25 0.00 -1.01 -0.46 119.26 119.07 1k25 h ALA 345 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1k25 h ALA 345 Cb 0.39 0.49 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1k25 h ALA 345 CO 0.01 -0.97 0.00 0.43 0.00 0.00 0.00 179.25 178.72 1k25 n SER 346 N -5.46 0.62 -0.02 0.00 7.64 0.58 -0.98 113.62 116.00 1k25 n SER 346 Ca -0.10 0.75 -0.21 0.00 1.01 0.00 0.00 58.87 60.32 1k25 n SER 346 Cb 0.36 -0.84 -0.13 0.00 -1.01 0.00 0.00 64.21 62.59 1k25 n SER 346 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1k25 h SER 347 N 0.00 0.28 0.64 6.43 0.87 -0.22 -3.27 113.55 118.28 1k25 h SER 347 Ca 0.00 -0.81 -0.05 0.00 -1.23 0.00 0.00 61.79 59.70 1k25 h SER 347 Cb 0.10 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1k25 h SER 347 CO 0.00 1.53 -0.23 0.40 -0.53 0.00 0.00 176.83 178.00 1k25 h ILE 348 N -0.49 0.70 -0.00 2.23 2.04 -0.43 -2.16 117.51 119.39 1k25 h ILE 348 Ca -0.28 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.58 1k25 h ILE 348 Cb 1.60 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 39.32 1k25 h ILE 348 CO 0.01 0.23 -0.10 -0.67 0.00 0.00 0.00 178.15 177.61 1k25 n ASP 349 N -3.58 0.25 -0.47 1.72 2.03 -0.15 -3.05 116.55 113.30 1k25 n ASP 349 Ca -0.01 -0.19 0.08 0.00 0.52 0.00 0.00 54.79 55.20 1k25 n ASP 349 Cb 0.37 -0.19 0.18 0.00 -0.72 0.00 0.00 41.12 40.77 1k25 n ASP 349 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1k25 n ASN 350 N -1.22 3.05 -3.70 1.67 5.15 -0.83 -4.96 115.26 114.42 1k25 n ASN 350 Ca 0.12 -2.90 -0.30 0.00 -0.60 0.00 0.00 54.58 50.90 1k25 n ASN 350 Cb 0.29 -0.43 -0.06 0.00 -0.53 0.00 0.00 39.78 39.05 1k25 n ASN 350 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1k25 n ASN 351 N -0.81 -1.16 0.00 1.20 2.85 -1.16 -4.80 115.26 111.38 1k25 n ASN 351 Ca 0.17 -0.90 0.00 0.00 -0.11 0.00 0.00 54.58 53.74 1k25 n ASN 351 Cb 0.71 -1.15 0.00 0.00 1.24 0.00 0.00 39.78 40.58 1k25 n ASN 351 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1k25 n THR 352 N -3.10 0.00 -2.68 -0.44 -2.24 -1.14 -5.06 114.28 99.63 1k25 n THR 352 Ca 0.06 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.84 1k25 n THR 352 Cb 0.34 -0.52 -0.01 0.00 -2.10 0.00 0.00 70.33 68.04 1k25 n THR 352 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1k25 n PHE 353 N -0.19 -0.73 -0.19 4.78 7.35 -1.25 -4.94 117.46 122.28 1k25 n PHE 353 Ca 0.00 0.43 -0.13 0.00 -0.76 0.00 0.00 57.45 56.99 1k25 n PHE 353 Cb 0.00 -1.46 0.13 0.00 0.35 0.00 0.00 39.48 38.50 1k25 n PHE 353 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1k25 n PRO 354 N 2.27 -2.32 0.00 -7.13 -0.02 -1.26 -5.09 135.00 121.45 1k25 n PRO 354 Ca -0.05 -0.63 0.00 0.00 -2.02 0.00 0.00 63.50 60.81 1k25 n PRO 354 Cb 0.07 -0.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 1k25 n PRO 354 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1k25 n SER 355 N -3.12 0.00 0.00 2.55 3.41 -1.26 -4.92 113.62 110.27 1k25 n SER 355 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1k25 n SER 355 Cb 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1k25 n SER 355 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k25 n GLY 356 N 0.00 2.93 0.09 5.00 0.00 -1.26 -4.62 105.19 107.32 1k25 n GLY 356 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1k25 n GLY 356 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1k25 h GLU 357 N 0.88 0.12 -1.01 1.61 4.57 -2.00 -3.29 114.58 115.47 1k25 h GLU 357 Ca 0.00 -0.21 0.36 0.00 -1.18 0.00 0.00 59.36 58.33 1k25 h GLU 357 Cb 0.00 0.08 -0.16 0.00 -0.16 0.00 0.00 28.75 28.51 1k25 h GLU 357 CO 0.00 1.10 0.57 1.88 -1.18 0.00 0.00 179.01 181.38 1k25 h TYR 358 N -0.74 0.88 0.00 0.92 0.05 -1.93 2.89 116.97 119.04 1k25 h TYR 358 Ca -0.08 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.74 1k25 h TYR 358 Cb 1.28 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 38.80 1k25 h TYR 358 CO 0.24 -0.28 0.00 1.19 -1.05 0.00 0.00 178.16 178.25 1k25 n PHE 359 N -5.11 0.00 -0.02 4.88 3.01 -1.24 -0.04 117.46 118.94 1k25 n PHE 359 Ca 0.34 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.75 1k25 n PHE 359 Cb 1.11 -0.02 -0.12 0.00 -0.01 0.00 0.00 39.48 40.43 1k25 n PHE 359 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1k25 n ASN 360 N -0.29 0.69 -0.33 4.37 6.94 0.97 -3.96 115.26 123.63 1k25 n ASN 360 Ca 0.00 0.32 0.16 0.00 -0.02 0.00 0.00 54.58 55.04 1k25 n ASN 360 Cb 0.05 0.27 0.39 0.00 -2.36 0.00 0.00 39.78 38.13 1k25 n ASN 360 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1k25 h SER 361 N 0.00 0.67 -1.08 0.53 4.64 -0.48 -0.05 113.55 117.77 1k25 h SER 361 Ca -0.28 0.09 0.36 0.00 -0.47 0.00 0.00 61.79 61.50 1k25 h SER 361 Cb 1.87 -0.02 -0.14 0.00 -0.31 0.00 0.00 62.40 63.79 1k25 h SER 361 CO 0.06 0.21 0.64 0.77 -0.87 0.00 0.00 176.83 177.63 1k25 h SER 362 N 0.63 0.41 -1.00 4.97 4.64 -1.73 0.41 113.55 121.88 1k25 h SER 362 Ca 0.58 0.18 0.18 0.00 -0.47 0.00 0.00 61.79 62.26 1k25 h SER 362 Cb 1.08 0.15 -0.10 0.00 -0.31 0.00 0.00 62.40 63.22 1k25 h SER 362 CO -0.36 -0.18 0.62 -0.08 -0.87 0.00 0.00 176.83 175.96 1k25 h GLU 363 N 0.22 0.77 0.00 4.77 4.81 -1.28 -3.54 114.58 120.32 1k25 h GLU 363 Ca 0.76 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.95 1k25 h GLU 363 Cb 1.97 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 31.18 1k25 h GLU 363 CO -0.56 0.51 0.00 1.28 -0.73 0.00 0.00 179.01 179.50 1k25 n LEU 364 N -4.72 0.00 0.00 1.64 4.77 0.14 -5.20 117.00 113.62 1k25 n LEU 364 Ca 0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1k25 n LEU 364 Cb 0.54 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1k25 n LEU 364 CO 0.23 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.75 1k25 n SER 395 N 0.00 0.00 -0.04 -1.43 3.41 -1.26 -5.16 113.62 109.14 1k25 n SER 395 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1k25 n SER 395 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 1k25 n SER 395 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1k25 n SER 396 N 0.00 1.60 0.00 4.04 2.88 -1.26 -4.97 113.62 115.91 1k25 n SER 396 Ca 0.00 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 1k25 n SER 396 Cb 0.00 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 1k25 n SER 396 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1k25 n ASN 397 N -4.07 0.00 -0.01 -3.46 3.02 -1.26 -3.22 115.26 106.26 1k25 n ASN 397 Ca -0.10 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.49 1k25 n ASN 397 Cb 0.34 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.44 1k25 n ASN 397 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1k25 n VAL 398 N 0.00 0.05 -0.02 2.41 0.31 -1.26 -4.68 118.33 115.14 1k25 n VAL 398 Ca 0.00 -0.20 -0.16 0.00 -0.01 0.00 0.00 64.34 63.97 1k25 n VAL 398 Cb 0.00 0.20 -0.10 0.00 -0.91 0.00 0.00 33.84 33.03 1k25 n VAL 398 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1k25 h GLY 399 N 1.51 0.44 1.29 2.92 0.00 -1.93 -3.21 103.07 104.10 1k25 h GLY 399 Ca -0.02 -0.66 0.09 0.00 0.00 0.00 0.00 47.33 46.74 1k25 h GLY 399 CO 0.00 0.58 0.27 -0.33 0.00 0.00 0.00 176.54 177.07 1k25 h MET 400 N -0.08 0.00 0.00 4.80 2.86 -1.84 1.38 114.93 122.05 1k25 h MET 400 Ca -0.04 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 1k25 h MET 400 Cb 1.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 1k25 h MET 400 CO 0.09 0.00 -0.41 0.66 1.06 0.00 0.00 176.91 178.31 1k25 h SER 401 N 0.00 0.00 1.00 1.22 4.64 -1.83 -2.83 113.55 115.75 1k25 h SER 401 Ca 0.14 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.29 1k25 h SER 401 Cb 0.68 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.75 1k25 h SER 401 CO -0.00 0.41 -1.06 -0.07 -0.87 0.00 0.00 176.83 175.23 1k25 h LEU 402 N 0.00 0.00 -0.66 5.97 3.38 0.17 0.35 115.31 124.52 1k25 h LEU 402 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1k25 h LEU 402 Cb 1.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 1k25 h LEU 402 CO 0.05 0.69 0.20 -0.07 0.09 0.00 0.00 178.44 179.40 1k25 h LEU 403 N 0.00 0.96 -0.06 1.67 3.38 -0.55 -1.53 115.31 119.18 1k25 h LEU 403 Ca -0.10 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.56 1k25 h LEU 403 Cb 1.61 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 1k25 h LEU 403 CO 0.07 0.92 -0.51 -0.08 0.09 0.00 0.00 178.44 178.93 1k25 h GLU 404 N 0.96 0.00 0.00 1.13 4.22 -1.51 -2.74 114.58 116.63 1k25 h GLU 404 Ca 0.21 0.00 -0.09 0.00 0.08 0.00 0.00 59.36 59.57 1k25 h GLU 404 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1k25 h GLU 404 CO -0.01 0.51 -0.41 1.96 -2.18 0.00 0.00 179.01 178.88 1k25 h GLN 405 N 0.00 0.00 0.00 1.92 1.08 0.44 -1.08 115.11 117.47 1k25 h GLN 405 Ca -0.01 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 1k25 h GLN 405 Cb 1.37 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.80 1k25 h GLN 405 CO 0.07 0.41 -1.71 1.17 -0.95 0.00 0.00 178.83 177.82 1k25 n LYS 406 N -3.79 0.64 0.08 1.46 4.81 -0.65 -4.29 118.16 116.42 1k25 n LYS 406 Ca -0.01 -0.08 0.01 0.00 -0.87 0.00 0.00 58.31 57.36 1k25 n LYS 406 Cb 0.48 -1.62 -0.03 0.00 0.02 0.00 0.00 35.03 33.87 1k25 n LYS 406 CO 0.00 0.00 0.00 1.98 1.17 0.00 0.00 177.40 180.55 1k25 h MET 407 N 0.00 0.00 0.00 1.64 4.05 -1.35 -3.50 114.93 115.77 1k25 h MET 407 Ca -0.03 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1k25 h MET 407 Cb 1.08 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.88 1k25 h MET 407 CO 0.00 0.42 0.00 0.41 0.23 0.00 0.00 176.91 177.97 1k25 n GLY 408 N 1.31 -2.07 0.00 1.39 0.00 -0.42 -3.77 105.19 101.63 1k25 n GLY 408 Ca -0.04 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1k25 n GLY 408 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1k25 n ASP 409 N -0.83 0.00 0.00 1.61 8.00 -1.26 -1.11 116.55 122.95 1k25 n ASP 409 Ca 0.00 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.84 1k25 n ASP 409 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1k25 n ASP 409 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1k25 n ALA 410 N -0.52 0.00 -0.21 2.24 0.00 -1.26 -3.81 120.51 116.95 1k25 n ALA 410 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 53.44 53.25 1k25 n ALA 410 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 1k25 n ALA 410 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1k25 h THR 411 N 0.00 0.47 0.72 0.00 2.02 -1.60 0.35 112.91 114.86 1k25 h THR 411 Ca 0.00 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.11 1k25 h THR 411 Cb 0.00 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 66.76 1k25 h THR 411 CO 0.00 0.02 -0.44 -0.25 0.37 0.00 0.00 175.52 175.22 1k25 h TRP 412 N 0.10 -1.17 -0.98 3.16 -0.00 -1.27 0.14 115.95 115.93 1k25 h TRP 412 Ca 0.33 -0.01 0.12 0.00 -0.00 0.00 0.00 58.89 59.33 1k25 h TRP 412 Cb 0.53 0.42 -0.08 0.00 -0.00 0.00 0.00 29.16 30.03 1k25 h TRP 412 CO -0.38 -0.66 0.62 1.25 -0.00 0.00 0.00 178.44 179.26 1k25 h LEU 413 N -1.09 0.88 0.60 0.65 7.12 -1.43 -0.03 115.31 122.01 1k25 h LEU 413 Ca -0.09 0.05 -0.02 0.00 0.13 0.00 0.00 57.88 57.94 1k25 h LEU 413 Cb 0.88 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.87 1k25 h LEU 413 CO 0.09 0.47 -0.37 -0.78 -0.13 0.00 0.00 178.44 177.72 1k25 h ASP 414 N 0.94 -0.93 -0.97 1.25 3.58 -0.01 0.90 116.42 121.19 1k25 h ASP 414 Ca 0.49 0.05 0.31 0.00 0.42 0.00 0.00 57.03 58.30 1k25 h ASP 414 Cb 0.52 0.27 -0.17 0.00 1.72 0.00 0.00 39.33 41.68 1k25 h ASP 414 CO -0.25 -0.58 0.30 1.88 -2.88 0.00 0.00 179.24 177.71 1k25 h TYR 415 N -0.92 0.44 0.78 0.28 0.05 0.11 1.04 116.97 118.75 1k25 h TYR 415 Ca -0.07 0.05 -0.04 0.00 0.05 0.00 0.00 58.73 58.72 1k25 h TYR 415 Cb 0.74 -0.03 0.01 0.00 1.01 0.00 0.00 36.73 38.46 1k25 h TYR 415 CO -0.10 -0.35 -0.38 -0.07 -1.05 0.00 0.00 178.16 176.21 1k25 h LEU 416 N 0.10 -0.89 -1.61 3.88 3.38 -0.34 -0.06 115.31 119.76 1k25 h LEU 416 Ca 0.68 0.03 0.44 0.00 0.09 0.00 0.00 57.88 59.11 1k25 h LEU 416 Cb 1.55 0.23 -0.10 0.00 0.09 0.00 0.00 40.66 42.43 1k25 h LEU 416 CO -0.77 -0.60 0.96 0.11 0.09 0.00 0.00 178.44 178.23 1k25 h LYS 417 N -1.13 0.08 -0.08 1.13 1.57 0.30 3.02 116.57 121.46 1k25 h LYS 417 Ca -0.11 -0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.52 1k25 h LYS 417 Cb 0.81 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1k25 h LYS 417 CO 0.18 0.05 -0.59 -0.09 -0.57 0.00 0.00 179.45 178.43 1k25 h ARG 418 N 0.08 0.28 -0.07 3.15 2.43 0.17 -2.81 114.38 117.61 1k25 h ARG 418 Ca 0.79 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.77 1k25 h ARG 418 Cb 2.69 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 32.27 1k25 h ARG 418 CO -0.26 0.79 0.00 1.19 -1.51 0.00 0.00 179.97 180.18 1k25 n PHE 419 N -3.89 0.09 -0.74 2.20 3.72 1.00 -4.66 117.46 115.19 1k25 n PHE 419 Ca -0.02 -0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1k25 n PHE 419 Cb 0.61 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 1k25 n PHE 419 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1k25 n LYS 420 N -0.35 -0.31 -1.46 -1.08 5.02 -0.68 -4.69 118.16 114.61 1k25 n LYS 420 Ca 0.13 0.08 -0.37 0.00 -2.02 0.00 0.00 58.31 56.13 1k25 n LYS 420 Cb 0.15 -3.98 0.07 0.00 -0.02 0.00 0.00 35.03 31.24 1k25 n LYS 420 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1k25 n PHE 421 N -2.07 0.29 0.00 2.13 3.72 -1.24 -1.95 117.46 118.33 1k25 n PHE 421 Ca 0.00 0.41 0.00 0.00 -0.05 0.00 0.00 57.45 57.81 1k25 n PHE 421 Cb 0.08 -2.06 0.00 0.00 -0.94 0.00 0.00 39.48 36.56 1k25 n PHE 421 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1k25 n GLY 422 N 1.36 2.14 2.88 1.37 0.00 -1.24 -4.73 105.19 106.97 1k25 n GLY 422 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 1k25 n GLY 422 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k25 s VAL 423 N -2.32 0.50 0.51 1.61 1.01 -0.82 -4.58 120.40 116.32 1k25 s VAL 423 Ca 0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 61.98 61.70 1k25 s VAL 423 Cb 0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 36.38 35.73 1k25 s VAL 423 CO 0.00 0.22 0.42 -2.65 0.00 0.00 0.00 175.10 173.10 1k25 n PRO 424 N 4.16 0.45 -0.00 2.72 -0.02 -1.26 -4.91 135.00 136.15 1k25 n PRO 424 Ca -0.23 0.17 -0.18 0.00 -2.02 0.00 0.00 63.50 61.24 1k25 n PRO 424 Cb 0.51 -1.53 -0.09 0.00 -0.02 0.00 0.00 33.50 32.37 1k25 n PRO 424 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1k25 h THR 425 N 0.37 1.31 -4.00 3.45 1.35 -1.93 -3.48 112.91 109.98 1k25 h THR 425 Ca -0.43 -2.04 -0.24 0.00 -0.55 0.00 0.00 66.41 63.15 1k25 h THR 425 Cb 1.41 2.23 0.09 0.00 -1.73 0.00 0.00 68.15 70.14 1k25 h THR 425 CO 0.47 0.63 -0.42 0.54 -0.25 0.00 0.00 175.52 176.49 1k25 n ARG 426 N -4.01 -4.75 0.00 4.72 1.74 -1.26 -4.92 116.66 108.18 1k25 n ARG 426 Ca -0.09 0.51 0.09 0.00 -0.77 0.00 0.00 57.85 57.59 1k25 n ARG 426 Cb 0.75 -4.57 0.48 0.00 -1.02 0.00 0.00 32.46 28.11 1k25 n ARG 426 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1k25 n PHE 427 N -3.86 0.00 0.00 -1.55 -1.74 -1.26 -4.22 117.46 104.83 1k25 n PHE 427 Ca -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.87 1k25 n PHE 427 Cb 0.55 -0.19 0.00 0.00 1.52 0.00 0.00 39.48 41.35 1k25 n PHE 427 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1k25 n GLY 428 N 0.21 0.41 2.88 4.97 0.00 -1.26 -4.62 105.19 107.77 1k25 n GLY 428 Ca 0.10 -0.03 -0.49 0.00 0.00 0.00 0.00 46.02 45.60 1k25 n GLY 428 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k25 n LEU 429 N 0.00 0.15 -4.76 0.99 4.77 -1.26 -4.81 117.00 112.08 1k25 n LEU 429 Ca 0.00 0.95 -0.36 0.00 -0.03 0.00 0.00 56.01 56.57 1k25 n LEU 429 Cb 0.00 -0.74 0.02 0.00 -2.33 0.00 0.00 43.42 40.37 1k25 n LEU 429 CO 0.00 -1.41 0.84 0.42 -1.33 0.00 0.00 177.39 175.91 1k25 s THR 430 N 0.40 2.80 -0.47 -5.08 -4.23 -1.26 -4.12 115.64 103.68 1k25 s THR 430 Ca 0.76 0.52 -0.00 0.00 -1.18 0.00 0.00 61.69 61.79 1k25 s THR 430 Cb -1.06 -3.23 -0.01 0.00 1.34 0.00 0.00 72.50 69.55 1k25 s THR 430 CO 0.50 -0.08 0.39 0.47 -0.54 0.00 0.00 174.62 175.36 1k25 n ASP 431 N -1.28 -2.38 -4.86 3.99 8.00 -1.26 -5.05 116.55 113.70 1k25 n ASP 431 Ca 0.12 -0.25 -0.31 0.00 0.71 0.00 0.00 54.79 55.05 1k25 n ASP 431 Cb 0.49 -2.35 -0.04 0.00 -0.02 0.00 0.00 41.12 39.20 1k25 n ASP 431 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1k25 s GLU 432 N -4.34 3.86 0.24 -1.24 2.12 -1.26 -4.73 118.70 113.35 1k25 s GLU 432 Ca 0.04 0.58 -0.05 0.00 0.36 0.00 0.00 54.97 55.89 1k25 s GLU 432 Cb -0.00 -2.38 -0.06 0.00 0.26 0.00 0.00 34.13 31.95 1k25 s GLU 432 CO 0.29 -0.01 0.50 0.71 -0.54 0.00 0.00 175.26 176.21 1k25 s TYR 433 N -2.29 3.47 -0.15 5.30 1.51 -0.83 -4.98 117.35 119.39 1k25 s TYR 433 Ca 0.53 0.64 -0.20 0.00 -1.01 0.00 0.00 57.07 57.02 1k25 s TYR 433 Cb -0.10 -2.09 -0.24 0.00 -0.11 0.00 0.00 41.96 39.42 1k25 s TYR 433 CO 0.27 0.27 0.47 0.00 -1.11 0.00 0.00 175.55 175.46 1k25 h ALA 434 N 2.13 0.18 0.00 3.71 0.00 -1.92 -3.35 119.26 120.01 1k25 h ALA 434 Ca -0.47 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.42 1k25 h ALA 434 Cb 1.18 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1k25 h ALA 434 CO 0.68 0.62 0.00 0.41 0.00 0.00 0.00 179.25 180.96 1k25 n GLY 435 N 1.61 -1.14 3.23 0.00 0.00 -1.26 -3.05 105.19 104.58 1k25 n GLY 435 Ca -0.25 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.04 1k25 n GLY 435 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1k25 s GLN 436 N -1.38 0.38 0.52 1.61 0.74 -0.52 -4.61 119.66 116.40 1k25 s GLN 436 Ca 0.00 0.62 -0.20 0.00 0.05 0.00 0.00 55.36 55.82 1k25 s GLN 436 Cb 0.00 0.07 -0.06 0.00 1.10 0.00 0.00 33.01 34.11 1k25 s GLN 436 CO 0.00 -0.11 1.13 -0.51 -0.55 0.00 0.00 175.29 175.25 1k25 s LEU 437 N 0.81 3.82 1.03 3.68 2.01 -1.26 -2.24 118.68 126.53 1k25 s LEU 437 Ca -0.05 2.20 -0.19 0.00 0.01 0.00 0.00 54.13 56.10 1k25 s LEU 437 Cb -0.06 -4.49 -0.03 0.00 0.01 0.00 0.00 46.19 41.62 1k25 s LEU 437 CO -0.06 -1.12 -0.39 -0.81 1.01 0.00 0.00 176.35 174.98 1k25 n PRO 438 N -1.07 -0.60 -1.18 1.29 -0.04 -1.25 -4.93 135.00 127.22 1k25 n PRO 438 Ca 0.10 -0.16 -0.29 0.00 -0.04 0.00 0.00 63.50 63.12 1k25 n PRO 438 Cb 0.50 -1.45 0.17 0.00 -0.04 0.00 0.00 33.50 32.68 1k25 n PRO 438 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1k25 s ALA 439 N -2.18 1.09 -0.05 0.55 0.00 -1.26 -4.89 121.76 115.02 1k25 s ALA 439 Ca 0.49 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.15 1k25 s ALA 439 Cb -0.11 -3.13 0.06 0.00 0.00 0.00 0.00 23.12 19.95 1k25 s ALA 439 CO 0.70 -2.73 1.18 -3.47 0.00 0.00 0.00 175.76 171.44 1k25 n ASP 440 N -4.11 3.31 -4.45 0.00 2.03 -1.26 -4.17 116.55 107.90 1k25 n ASP 440 Ca 0.06 -2.20 -0.23 0.00 0.52 0.00 0.00 54.79 52.94 1k25 n ASP 440 Cb 0.57 -0.59 -0.10 0.00 -0.72 0.00 0.00 41.12 40.28 1k25 n ASP 440 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1k25 s ASN 441 N 0.85 3.44 0.15 1.67 2.20 -1.26 -5.06 114.94 116.93 1k25 s ASN 441 Ca 0.06 -1.02 -0.17 0.00 -0.94 0.00 0.00 52.86 50.78 1k25 s ASN 441 Cb 0.05 -0.27 0.05 0.00 -2.00 0.00 0.00 41.25 39.08 1k25 s ASN 441 CO 0.01 0.01 1.72 0.16 -2.94 0.00 0.00 177.10 176.06 1k25 h ILE 442 N 2.35 0.80 0.14 0.54 3.07 -2.00 -2.58 117.51 119.83 1k25 h ILE 442 Ca -0.40 -0.05 -0.00 0.00 1.55 0.00 0.00 64.86 65.96 1k25 h ILE 442 Cb 1.25 0.65 -0.01 0.00 -0.27 0.00 0.00 36.82 38.45 1k25 h ILE 442 CO 0.60 0.03 -0.11 0.58 -1.05 0.00 0.00 178.15 178.19 1k25 h VAL 443 N 0.14 0.76 0.00 0.16 2.07 -1.97 0.51 116.25 117.92 1k25 h VAL 443 Ca 0.16 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.68 1k25 h VAL 443 Cb 0.19 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1k25 h VAL 443 CO -0.23 0.00 -0.23 0.28 0.02 0.00 0.00 177.57 177.41 1k25 h SER 444 N -0.26 -0.71 -0.49 0.57 0.02 -1.83 0.70 113.55 111.54 1k25 h SER 444 Ca -0.01 0.08 0.10 0.00 -0.84 0.00 0.00 61.79 61.12 1k25 h SER 444 Cb 0.23 0.27 -0.09 0.00 0.14 0.00 0.00 62.40 62.95 1k25 h SER 444 CO -0.01 -0.23 -0.11 0.40 -1.14 0.00 0.00 176.83 175.74 1k25 h ILE 445 N -0.29 0.51 -0.43 3.27 2.04 -1.37 1.01 117.51 122.25 1k25 h ILE 445 Ca 0.00 -0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1k25 h ILE 445 Cb 0.31 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1k25 h ILE 445 CO -0.15 0.00 0.28 0.00 0.00 0.00 0.00 178.15 178.28 1k25 h ALA 446 N 1.49 1.82 0.00 1.87 0.00 0.62 -0.75 119.26 124.31 1k25 h ALA 446 Ca 0.24 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.91 1k25 h ALA 446 Cb 0.36 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1k25 h ALA 446 CO -0.50 0.13 -1.21 1.96 0.00 0.00 0.00 179.25 179.64 1k25 h GLN 447 N 0.47 0.00 0.00 0.00 4.20 0.26 -3.23 115.11 116.81 1k25 h GLN 447 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1k25 h GLN 447 Cb 0.11 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1k25 h GLN 447 CO -0.04 0.69 0.00 -1.13 -0.67 0.00 0.00 178.83 177.68 1k25 n SER 448 N -3.19 0.00 -0.08 1.46 3.41 0.33 -1.13 113.62 114.42 1k25 n SER 448 Ca -0.06 -0.76 -0.08 0.00 -0.26 0.00 0.00 58.87 57.71 1k25 n SER 448 Cb 0.94 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.75 1k25 n SER 448 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1k25 n SER 449 N -0.56 0.70 -2.09 4.04 3.41 -1.14 -4.60 113.62 113.38 1k25 n SER 449 Ca 0.01 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.36 1k25 n SER 449 Cb 0.00 0.97 0.03 0.00 -0.26 0.00 0.00 64.21 64.95 1k25 n SER 449 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1k25 n PHE 450 N -2.62 2.86 0.00 7.33 -0.00 -0.29 -4.37 117.46 120.37 1k25 n PHE 450 Ca -0.27 -2.39 0.00 0.00 -0.00 0.00 0.00 57.45 54.79 1k25 n PHE 450 Cb 1.04 -0.52 0.00 0.00 -0.00 0.00 0.00 39.48 40.00 1k25 n PHE 450 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1k25 n GLY 451 N -0.74 2.94 3.96 4.97 0.00 -0.83 -4.58 105.19 110.92 1k25 n GLY 451 Ca 0.47 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.30 1k25 n GLY 451 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k25 s GLN 452 N -0.00 2.84 0.00 1.61 -1.52 -1.07 -2.11 119.66 119.41 1k25 s GLN 452 Ca 0.00 -1.24 0.00 0.00 -1.95 0.00 0.00 55.36 52.17 1k25 s GLN 452 Cb 0.00 -2.67 0.00 0.00 -0.22 0.00 0.00 33.01 30.12 1k25 s GLN 452 CO 0.00 -0.12 0.00 0.41 -0.25 0.00 0.00 175.29 175.33 1k25 n GLY 453 N -1.68 2.79 3.13 3.09 0.00 -1.26 -1.75 105.19 109.51 1k25 n GLY 453 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 1k25 n GLY 453 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1k25 s ILE 454 N -2.74 1.26 -0.13 -0.61 2.07 -1.26 -3.86 121.20 115.93 1k25 s ILE 454 Ca 0.00 -0.66 -0.03 0.00 -1.41 0.00 0.00 60.65 58.55 1k25 s ILE 454 Cb 0.00 -1.06 -0.03 0.00 0.13 0.00 0.00 42.46 41.50 1k25 s ILE 454 CO 0.00 0.36 -0.02 -0.94 -1.91 0.00 0.00 174.94 172.43 1k25 s SER 455 N -0.23 5.00 0.38 4.50 1.04 -0.95 -4.32 113.70 119.12 1k25 s SER 455 Ca 0.03 -0.01 0.04 0.00 0.48 0.00 0.00 55.95 56.48 1k25 s SER 455 Cb -0.08 -1.64 -0.04 0.00 0.10 0.00 0.00 66.02 64.37 1k25 s SER 455 CO 0.00 0.26 0.09 0.68 0.98 0.00 0.00 173.24 175.25 1k25 s VAL 456 N -0.15 0.87 -0.02 5.02 -7.23 0.47 -1.44 120.40 117.93 1k25 s VAL 456 Ca 0.04 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.26 1k25 s VAL 456 Cb -0.13 -2.52 -0.01 0.00 0.56 0.00 0.00 36.38 34.28 1k25 s VAL 456 CO 0.02 0.00 -0.19 0.42 -0.31 0.00 0.00 175.10 175.04 1k25 s THR 457 N -3.23 1.55 0.14 5.32 -4.23 -1.26 -2.50 115.64 111.43 1k25 s THR 457 Ca 0.28 -0.83 -0.04 0.00 -1.18 0.00 0.00 61.69 59.92 1k25 s THR 457 Cb 0.05 -1.29 0.23 0.00 1.34 0.00 0.00 72.50 72.82 1k25 s THR 457 CO 0.14 0.44 0.79 0.00 -0.54 0.00 0.00 174.62 175.45 1k25 n GLN 458 N 2.69 -0.05 0.02 3.99 1.13 -1.26 0.15 117.38 124.05 1k25 n GLN 458 Ca -0.16 0.79 -0.13 0.00 -1.94 0.00 0.00 57.00 55.57 1k25 n GLN 458 Cb 0.53 -1.18 -0.09 0.00 0.11 0.00 0.00 30.24 29.61 1k25 n GLN 458 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1k25 h THR 459 N 0.00 1.23 -0.88 5.09 1.35 -1.87 0.13 112.91 117.95 1k25 h THR 459 Ca 0.24 -0.89 0.23 0.00 -0.55 0.00 0.00 66.41 65.43 1k25 h THR 459 Cb 0.37 1.82 -0.16 0.00 -1.73 0.00 0.00 68.15 68.45 1k25 h THR 459 CO -0.52 0.23 0.07 1.56 -0.25 0.00 0.00 175.52 176.60 1k25 h GLN 460 N -0.45 0.08 0.14 4.72 4.20 0.98 1.21 115.11 125.99 1k25 h GLN 460 Ca -0.01 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1k25 h GLN 460 Cb 0.41 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1k25 h GLN 460 CO 0.01 0.06 -0.07 0.52 -0.67 0.00 0.00 178.83 178.68 1k25 h MET 461 N 0.09 -0.18 -0.93 1.46 2.86 -0.91 -2.48 114.93 114.83 1k25 h MET 461 Ca 0.52 0.01 0.25 0.00 -2.06 0.00 0.00 59.70 58.43 1k25 h MET 461 Cb 1.03 0.04 -0.17 0.00 0.06 0.00 0.00 31.60 32.56 1k25 h MET 461 CO -0.77 -0.12 0.07 -0.07 1.06 0.00 0.00 176.91 177.07 1k25 h LEU 462 N -0.23 -0.37 0.10 1.22 3.38 0.10 0.57 115.31 120.08 1k25 h LEU 462 Ca -0.02 0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1k25 h LEU 462 Cb 0.14 0.43 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1k25 h LEU 462 CO 0.03 -0.30 -0.24 -0.09 0.09 0.00 0.00 178.44 177.93 1k25 h ARG 463 N 0.05 -0.36 -0.62 1.13 2.43 0.14 -0.66 114.38 116.49 1k25 h ARG 463 Ca 0.57 0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.89 1k25 h ARG 463 Cb 1.16 0.08 -0.11 0.00 -0.42 0.00 0.00 29.97 30.68 1k25 h ARG 463 CO -0.84 -0.24 -0.08 0.00 -1.51 0.00 0.00 179.97 177.30 1k25 h ALA 464 N -1.16 0.50 -1.34 2.80 0.00 -0.49 0.51 119.26 120.08 1k25 h ALA 464 Ca -0.01 0.22 0.39 0.00 0.00 0.00 0.00 54.91 55.51 1k25 h ALA 464 Cb 0.36 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 1k25 h ALA 464 CO -0.11 -0.42 0.99 0.74 0.00 0.00 0.00 179.25 180.46 1k25 h PHE 465 N 0.05 0.00 -0.18 0.00 0.04 0.87 0.92 116.94 118.64 1k25 h PHE 465 Ca 0.31 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.94 1k25 h PHE 465 Cb 0.49 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 1k25 h PHE 465 CO -0.44 0.00 -0.50 1.79 -0.60 0.00 0.00 178.31 178.56 1k25 h THR 466 N 0.00 1.32 -0.03 -1.55 1.35 0.15 -2.71 112.91 111.44 1k25 h THR 466 Ca 0.63 -1.73 0.02 0.00 -0.55 0.00 0.00 66.41 64.78 1k25 h THR 466 Cb 2.61 1.73 -0.02 0.00 -1.73 0.00 0.00 68.15 70.73 1k25 h THR 466 CO -0.01 0.53 -0.06 0.00 -0.25 0.00 0.00 175.52 175.73 1k25 h ALA 467 N 1.07 -0.04 0.51 6.62 0.00 -0.87 0.49 119.26 127.04 1k25 h ALA 467 Ca 0.02 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1k25 h ALA 467 Cb 1.01 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1k25 h ALA 467 CO 0.09 -0.55 -0.48 0.82 0.00 0.00 0.00 179.25 179.14 1k25 h ILE 468 N -0.10 0.06 0.00 0.00 1.08 -1.61 2.14 117.51 119.09 1k25 h ILE 468 Ca 0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 1k25 h ILE 468 Cb 0.14 0.06 0.00 0.00 -3.07 0.00 0.00 36.82 33.95 1k25 h ILE 468 CO -0.09 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.37 1k25 n ALA 469 N -2.78 1.13 -3.24 1.87 0.00 -1.02 -3.72 120.51 112.75 1k25 n ALA 469 Ca -0.12 -0.01 -0.25 0.00 0.00 0.00 0.00 53.44 53.07 1k25 n ALA 469 Cb 0.45 -1.02 -0.08 0.00 0.00 0.00 0.00 19.45 18.80 1k25 n ALA 469 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1k25 n ASN 470 N -1.43 0.14 -0.88 0.00 5.15 0.17 -4.44 115.26 113.97 1k25 n ASN 470 Ca 0.00 -2.64 -0.02 0.00 -0.60 0.00 0.00 54.58 51.32 1k25 n ASN 470 Cb 0.01 -0.62 -0.01 0.00 -0.53 0.00 0.00 39.78 38.64 1k25 n ASN 470 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1k25 n ASP 471 N 1.71 -0.50 0.00 1.20 8.00 -1.20 -0.10 116.55 125.66 1k25 n ASP 471 Ca 0.23 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.77 1k25 n ASP 471 Cb 0.52 -0.87 0.00 0.00 -0.02 0.00 0.00 41.12 40.74 1k25 n ASP 471 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k25 n GLY 472 N -0.01 0.81 3.01 0.44 0.00 0.71 -2.09 105.19 108.06 1k25 n GLY 472 Ca -0.02 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 1k25 n GLY 472 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k25 s VAL 473 N -2.00 2.29 0.38 1.61 1.01 0.86 -3.22 120.40 121.33 1k25 s VAL 473 Ca 0.00 -2.42 -0.28 0.00 0.00 0.00 0.00 61.98 59.28 1k25 s VAL 473 Cb 0.00 -2.69 -0.11 0.00 0.00 0.00 0.00 36.38 33.58 1k25 s VAL 473 CO 0.00 -0.62 1.45 0.23 0.00 0.00 0.00 175.10 176.16 1k25 n MET 474 N 4.16 2.56 -4.87 2.72 2.81 -0.54 -4.34 117.12 119.63 1k25 n MET 474 Ca 0.04 0.90 -0.26 0.00 -1.81 0.00 0.00 57.70 56.57 1k25 n MET 474 Cb 0.41 -2.61 -0.15 0.00 -0.71 0.00 0.00 33.22 30.16 1k25 n MET 474 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1k25 s LEU 475 N -1.91 2.08 0.21 4.03 1.43 -1.26 -0.68 118.68 122.58 1k25 s LEU 475 Ca 0.54 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 52.92 1k25 s LEU 475 Cb -0.49 -1.02 -0.08 0.00 0.03 0.00 0.00 46.19 44.63 1k25 s LEU 475 CO 0.63 0.22 1.14 -0.70 0.23 0.00 0.00 176.35 177.87 1k25 s GLU 476 N -0.72 4.56 0.03 1.70 2.56 0.06 -4.72 118.70 122.18 1k25 s GLU 476 Ca 0.08 1.80 -0.30 0.00 0.00 0.00 0.00 54.97 56.54 1k25 s GLU 476 Cb -0.08 -3.24 -0.07 0.00 2.00 0.00 0.00 34.13 32.74 1k25 s GLU 476 CO 0.00 0.05 1.57 -2.14 -0.56 0.00 0.00 175.26 174.17 1k25 s PRO 477 N -0.59 4.22 0.28 4.30 0.02 -1.26 -4.66 135.00 137.31 1k25 s PRO 477 Ca 0.49 2.19 0.08 0.00 0.02 0.00 0.00 61.00 63.79 1k25 s PRO 477 Cb -0.31 -3.62 -0.04 0.00 0.02 0.00 0.00 34.50 30.55 1k25 s PRO 477 CO 0.37 -0.69 0.11 0.15 -0.33 0.00 0.00 177.00 176.61 1k25 s LYS 478 N 2.67 2.53 0.00 5.54 1.02 -0.13 -4.69 119.74 126.68 1k25 s LYS 478 Ca 0.70 -1.33 0.00 0.00 0.02 0.00 0.00 55.97 55.37 1k25 s LYS 478 Cb -0.36 -2.31 0.00 0.00 -0.52 0.00 0.00 37.83 34.64 1k25 s LYS 478 CO 0.30 0.30 0.00 1.97 -0.92 0.00 0.00 175.35 177.00 1k25 n PHE 479 N -1.07 0.00 -2.91 3.18 1.16 -1.26 -2.50 117.46 114.06 1k25 n PHE 479 Ca -0.06 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.09 1k25 n PHE 479 Cb 0.59 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.42 1k25 n PHE 479 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1k25 s ILE 480 N -0.71 4.50 -0.42 1.97 1.01 -1.26 0.65 121.20 126.94 1k25 s ILE 480 Ca 0.00 0.17 0.23 0.00 0.00 0.00 0.00 60.65 61.05 1k25 s ILE 480 Cb 0.00 -4.47 0.05 0.00 0.01 0.00 0.00 42.46 38.05 1k25 s ILE 480 CO 0.00 -1.01 1.21 -1.28 0.00 0.00 0.00 174.94 173.86 1k25 h SER 481 N 9.22 0.00 0.00 3.58 0.87 -1.03 -3.45 113.55 122.74 1k25 h SER 481 Ca -0.26 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 1k25 h SER 481 Cb 1.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1k25 h SER 481 CO 1.05 0.04 0.00 0.00 -0.53 0.00 0.00 176.83 177.40 1k25 n ALA 482 N -2.03 0.00 -3.92 6.23 0.00 0.81 -2.34 120.51 119.26 1k25 n ALA 482 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 1k25 n ALA 482 Cb 0.50 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.79 1k25 n ALA 482 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1k25 s ILE 483 N -2.00 1.37 0.63 0.00 1.01 -0.51 0.15 121.20 121.85 1k25 s ILE 483 Ca 0.00 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.69 1k25 s ILE 483 Cb 0.00 -1.59 0.09 0.00 0.01 0.00 0.00 42.46 40.96 1k25 s ILE 483 CO 0.00 0.01 0.87 -0.47 0.00 0.00 0.00 174.94 175.34 1k25 s TYR 484 N 1.49 1.98 -0.34 3.97 5.04 -0.80 -1.36 117.35 127.33 1k25 s TYR 484 Ca -0.03 -0.30 0.01 0.00 -2.44 0.00 0.00 57.07 54.31 1k25 s TYR 484 Cb -0.17 -2.74 0.14 0.00 0.35 0.00 0.00 41.96 39.54 1k25 s TYR 484 CO -0.07 -1.30 0.30 0.34 -1.34 0.00 0.00 175.55 173.48 1k25 s ASP 485 N -4.61 1.83 0.62 4.32 -1.08 -0.38 -3.21 116.67 114.15 1k25 s ASP 485 Ca 0.62 -1.41 0.25 0.00 -0.52 0.00 0.00 52.55 51.49 1k25 s ASP 485 Cb -0.07 0.30 1.15 0.00 -1.46 0.00 0.00 42.92 42.84 1k25 s ASP 485 CO 0.41 -0.32 1.60 0.74 0.52 0.00 0.00 175.17 178.12 1k25 h THR 486 N 5.54 0.14 0.00 1.71 2.02 -1.87 -1.84 112.91 118.61 1k25 h THR 486 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1k25 h THR 486 Cb 1.04 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1k25 h THR 486 CO 0.27 0.00 0.00 0.59 0.37 0.00 0.00 175.52 176.75 1k25 n ASN 487 N -3.29 0.00 -0.01 4.18 3.02 -1.26 -4.09 115.26 113.81 1k25 n ASN 487 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 1k25 n ASN 487 Cb 0.96 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.13 1k25 n ASN 487 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1k25 n ASN 488 N 0.00 0.01 -3.60 6.41 6.94 -1.24 -4.80 115.26 118.97 1k25 n ASN 488 Ca 0.00 -0.89 -0.23 0.00 -0.02 0.00 0.00 54.58 53.44 1k25 n ASN 488 Cb 0.00 -0.00 0.08 0.00 -2.36 0.00 0.00 39.78 37.49 1k25 n ASN 488 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1k25 n GLN 489 N -0.49 -7.60 -3.92 -3.83 3.00 -0.70 -5.01 117.38 98.84 1k25 n GLN 489 Ca 0.00 0.81 -0.26 0.00 -0.01 0.00 0.00 57.00 57.54 1k25 n GLN 489 Cb 0.00 -5.85 -0.01 0.00 0.00 0.00 0.00 30.24 24.38 1k25 n GLN 489 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1k25 s SER 490 N -3.48 4.62 0.34 1.08 1.04 -1.17 -4.88 113.70 111.24 1k25 s SER 490 Ca 0.50 -1.24 0.03 0.00 0.48 0.00 0.00 55.95 55.72 1k25 s SER 490 Cb -0.22 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 1k25 s SER 490 CO 0.74 -1.06 0.38 -0.69 0.98 0.00 0.00 173.24 173.58 1k25 s VAL 491 N -2.76 0.00 -0.37 5.02 1.01 -1.26 -1.25 120.40 120.79 1k25 s VAL 491 Ca 0.34 -1.80 0.06 0.00 0.00 0.00 0.00 61.98 60.58 1k25 s VAL 491 Cb -0.02 -2.58 0.19 0.00 0.00 0.00 0.00 36.38 33.97 1k25 s VAL 491 CO 0.21 0.00 0.65 -0.13 0.00 0.00 0.00 175.10 175.82 1k25 s ARG 492 N -3.23 0.71 0.35 2.72 0.52 -0.47 0.12 118.95 119.68 1k25 s ARG 492 Ca 0.36 -0.02 -0.06 0.00 -0.52 0.00 0.00 55.73 55.48 1k25 s ARG 492 Cb 0.01 0.14 -0.05 0.00 0.52 0.00 0.00 34.95 35.56 1k25 s ARG 492 CO 0.24 -1.09 0.65 0.15 0.02 0.00 0.00 175.30 175.27 1k25 s LYS 493 N 2.14 3.66 0.28 3.54 1.02 -1.26 -1.42 119.74 127.69 1k25 s LYS 493 Ca 0.15 0.15 0.03 0.00 0.02 0.00 0.00 55.97 56.31 1k25 s LYS 493 Cb -0.05 -2.54 -0.03 0.00 -0.52 0.00 0.00 37.83 34.69 1k25 s LYS 493 CO -0.13 0.08 0.43 0.45 -0.92 0.00 0.00 175.35 175.26 1k25 s SER 494 N -3.34 6.31 -0.11 2.83 0.15 -0.99 -4.58 113.70 113.98 1k25 s SER 494 Ca 0.46 0.21 -0.09 0.00 0.70 0.00 0.00 55.95 57.23 1k25 s SER 494 Cb -0.10 -1.92 0.03 0.00 -1.71 0.00 0.00 66.02 62.32 1k25 s SER 494 CO 0.33 -0.15 0.28 -1.10 1.20 0.00 0.00 173.24 173.80 1k25 s GLN 495 N -4.09 0.31 0.61 5.44 -1.52 -1.26 -5.01 119.66 114.13 1k25 s GLN 495 Ca 0.36 0.46 -0.17 0.00 -1.95 0.00 0.00 55.36 54.06 1k25 s GLN 495 Cb -0.09 0.08 -0.14 0.00 -0.22 0.00 0.00 33.01 32.64 1k25 s GLN 495 CO 0.31 -0.08 -0.30 0.36 -0.25 0.00 0.00 175.29 175.33 1k25 n LYS 496 N 3.34 0.00 -3.90 2.91 2.85 -1.26 -4.97 118.16 117.13 1k25 n LYS 496 Ca -0.17 0.00 -0.30 0.00 -1.05 0.00 0.00 58.31 56.80 1k25 n LYS 496 Cb 0.57 -0.94 -0.16 0.00 -0.65 0.00 0.00 35.03 33.85 1k25 n LYS 496 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 1k25 s GLU 497 N -1.22 1.45 -0.35 -1.58 2.12 -1.26 -5.05 118.70 112.81 1k25 s GLU 497 Ca 0.49 -0.86 -0.29 0.00 0.36 0.00 0.00 54.97 54.67 1k25 s GLU 497 Cb -0.38 -2.46 0.01 0.00 0.26 0.00 0.00 34.13 31.56 1k25 s GLU 497 CO 0.67 -0.59 1.19 0.42 -0.54 0.00 0.00 175.26 176.40 1k25 s ILE 498 N 1.49 4.28 -2.07 -3.70 1.01 -1.26 -0.76 121.20 120.19 1k25 s ILE 498 Ca -0.04 1.43 0.12 0.00 0.00 0.00 0.00 60.65 62.16 1k25 s ILE 498 Cb -0.18 -4.35 0.32 0.00 0.01 0.00 0.00 42.46 38.25 1k25 s ILE 498 CO -0.07 -0.60 1.34 1.33 0.00 0.00 0.00 174.94 176.94 1k25 n VAL 499 N 6.26 0.26 0.00 2.92 0.24 0.15 -4.88 118.33 123.28 1k25 n VAL 499 Ca 0.13 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 1k25 n VAL 499 Cb 0.47 0.17 0.00 0.00 -1.47 0.00 0.00 33.84 33.01 1k25 n VAL 499 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k25 n GLY 500 N 0.95 0.92 2.85 7.63 0.00 -1.23 -4.95 105.19 111.35 1k25 n GLY 500 Ca 0.11 -2.17 -0.30 0.00 0.00 0.00 0.00 46.02 43.66 1k25 n GLY 500 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1k25 s ASN 501 N -0.22 3.87 -0.06 1.61 3.04 -1.26 -1.47 114.94 120.44 1k25 s ASN 501 Ca 0.00 -1.38 -0.22 0.00 0.04 0.00 0.00 52.86 51.30 1k25 s ASN 501 Cb 0.00 -1.05 -0.30 0.00 -1.54 0.00 0.00 41.25 38.36 1k25 s ASN 501 CO 0.00 -0.32 0.85 1.55 -3.04 0.00 0.00 177.10 176.14 1k25 h PRO 502 N 8.00 0.26 -3.55 0.43 0.13 -1.82 -3.48 132.00 131.98 1k25 h PRO 502 Ca -0.14 -0.45 -0.18 0.00 -0.87 0.00 0.00 66.00 64.36 1k25 h PRO 502 Cb 1.06 0.17 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 1k25 h PRO 502 CO 0.43 1.22 -0.57 0.14 -0.23 0.00 0.00 178.00 178.99 1k25 s VAL 503 N -2.41 0.05 0.87 1.56 -7.23 -1.24 -4.98 120.40 107.01 1k25 s VAL 503 Ca -0.15 -0.38 -0.17 0.00 -1.81 0.00 0.00 61.98 59.48 1k25 s VAL 503 Cb 0.01 -0.28 -0.11 0.00 0.56 0.00 0.00 36.38 36.56 1k25 s VAL 503 CO 0.81 -0.21 -0.38 -0.24 -0.31 0.00 0.00 175.10 174.77 1k25 n SER 504 N 2.25 -4.58 0.24 4.85 2.88 -1.26 -3.80 113.62 114.19 1k25 n SER 504 Ca -0.18 0.33 -0.15 0.00 -1.33 0.00 0.00 58.87 57.54 1k25 n SER 504 Cb 0.57 -0.88 -0.08 0.00 -0.75 0.00 0.00 64.21 63.07 1k25 n SER 504 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1k25 h LYS 505 N -0.82 -0.60 -0.96 -1.46 3.64 -1.77 -1.32 116.57 113.28 1k25 h LYS 505 Ca -0.43 0.04 0.18 0.00 -1.27 0.00 0.00 60.65 59.17 1k25 h LYS 505 Cb 1.33 0.14 -0.11 0.00 -0.41 0.00 0.00 32.23 33.18 1k25 h LYS 505 CO 0.30 -0.40 0.55 0.93 -2.27 0.00 0.00 179.45 178.56 1k25 h GLU 506 N -0.62 0.68 0.29 1.90 5.08 -1.91 -2.18 114.58 117.82 1k25 h GLU 506 Ca -0.04 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1k25 h GLU 506 Cb 0.51 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1k25 h GLU 506 CO 0.04 0.45 -0.29 0.00 -1.00 0.00 0.00 179.01 178.21 1k25 h ALA 507 N 1.63 -0.98 0.39 3.43 0.00 -1.58 -1.65 119.26 120.49 1k25 h ALA 507 Ca 0.55 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 1k25 h ALA 507 Cb 0.85 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 1k25 h ALA 507 CO -0.39 -1.00 -0.37 0.00 0.00 0.00 0.00 179.25 177.49 1k25 h ALA 508 N -1.28 -0.81 -0.92 0.00 0.00 -1.24 -1.92 119.26 113.09 1k25 h ALA 508 Ca -0.04 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 54.84 1k25 h ALA 508 Cb 0.50 0.52 -0.12 0.00 0.00 0.00 0.00 17.79 18.69 1k25 h ALA 508 CO -0.03 -0.99 -0.49 -1.13 0.00 0.00 0.00 179.25 176.61 1k25 n SER 509 N -5.47 -0.87 0.23 0.00 3.41 -0.84 0.20 113.62 110.28 1k25 n SER 509 Ca -0.10 1.63 0.16 0.00 -0.26 0.00 0.00 58.87 60.29 1k25 n SER 509 Cb 0.37 -0.26 0.65 0.00 -0.26 0.00 0.00 64.21 64.72 1k25 n SER 509 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1k25 h THR 510 N 0.00 0.00 0.01 6.66 1.35 -1.23 -0.50 112.91 119.20 1k25 h THR 510 Ca 0.20 -0.39 -0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1k25 h THR 510 Cb 0.43 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 1k25 h THR 510 CO -0.88 0.00 -0.00 0.74 -0.25 0.00 0.00 175.52 175.13 1k25 h THR 511 N 0.00 0.89 -0.00 6.82 2.02 0.31 -3.01 112.91 119.94 1k25 h THR 511 Ca 0.00 -1.64 0.01 0.00 0.77 0.00 0.00 66.41 65.55 1k25 h THR 511 Cb 0.43 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.47 1k25 h THR 511 CO 0.00 0.30 -0.38 0.03 0.37 0.00 0.00 175.52 175.84 1k25 h ARG 512 N -0.99 -0.46 -0.45 6.66 3.08 0.20 0.17 114.38 122.59 1k25 h ARG 512 Ca -0.00 0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.21 1k25 h ARG 512 Cb 0.50 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 1k25 h ARG 512 CO 0.00 -0.30 0.72 -0.91 -1.07 0.00 0.00 179.97 178.41 1k25 h ASN 513 N -0.47 0.00 1.23 7.04 4.21 -1.26 2.63 115.58 128.96 1k25 h ASN 513 Ca 0.01 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.52 1k25 h ASN 513 Cb 0.51 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.71 1k25 h ASN 513 CO -0.25 0.00 -0.37 -0.74 -1.29 0.00 0.00 177.43 174.78 1k25 h HIS 514 N 0.00 0.00 -0.00 1.19 2.76 -0.54 -3.24 115.15 115.33 1k25 h HIS 514 Ca 0.21 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.38 1k25 h HIS 514 Cb 1.65 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.61 1k25 h HIS 514 CO 0.00 0.00 -0.10 -1.33 -1.30 0.00 0.00 177.93 175.20 1k25 n MET 515 N -2.34 0.26 0.09 5.26 2.81 0.88 -3.46 117.12 120.63 1k25 n MET 515 Ca 0.04 -0.05 -0.14 0.00 -1.81 0.00 0.00 57.70 55.74 1k25 n MET 515 Cb 0.46 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.37 1k25 n MET 515 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1k25 h ILE 516 N 0.13 1.49 0.00 2.02 2.04 -1.56 -1.27 117.51 120.35 1k25 h ILE 516 Ca 0.00 -2.88 -0.01 0.00 1.00 0.00 0.00 64.86 62.98 1k25 h ILE 516 Cb 0.42 2.76 -0.00 0.00 -0.74 0.00 0.00 36.82 39.25 1k25 h ILE 516 CO 0.00 0.84 -0.03 -0.07 0.00 0.00 0.00 178.15 178.89 1k25 h LEU 517 N 0.11 0.00 -2.14 1.44 3.38 -1.75 -1.29 115.31 115.07 1k25 h LEU 517 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1k25 h LEU 517 Cb 1.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.56 1k25 h LEU 517 CO 0.18 0.03 0.00 0.52 0.09 0.00 0.00 178.44 179.26 1k25 n VAL 518 N -3.15 0.86 -1.07 1.22 0.31 -1.19 -0.08 118.33 115.23 1k25 n VAL 518 Ca -0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1k25 n VAL 518 Cb 0.28 -0.94 0.00 0.00 -0.91 0.00 0.00 33.84 32.26 1k25 n VAL 518 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1k25 n GLY 519 N 0.72 0.54 0.71 2.92 0.00 -0.55 -4.84 105.19 104.69 1k25 n GLY 519 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1k25 n GLY 519 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1k25 n THR 520 N 0.00 0.93 -1.73 2.61 -1.04 0.88 -4.95 114.28 110.97 1k25 n THR 520 Ca 0.00 0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.68 1k25 n THR 520 Cb 0.14 -1.74 -0.03 0.00 -1.82 0.00 0.00 70.33 66.88 1k25 n THR 520 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1k25 s ASP 521 N -5.91 6.20 -0.02 8.00 -1.08 -0.20 -4.87 116.67 118.78 1k25 s ASP 521 Ca -0.12 2.32 0.02 0.00 -0.52 0.00 0.00 52.55 54.25 1k25 s ASP 521 Cb 0.03 -2.53 0.08 0.00 -1.46 0.00 0.00 42.92 39.05 1k25 s ASP 521 CO 0.16 -1.31 0.77 -0.81 0.52 0.00 0.00 175.17 174.51 1k25 n PRO 522 N 7.84 1.35 -0.54 4.34 -0.04 -1.26 -4.95 135.00 141.75 1k25 n PRO 522 Ca 0.22 -0.33 0.04 0.00 -0.04 0.00 0.00 63.50 63.40 1k25 n PRO 522 Cb 0.43 -1.41 0.20 0.00 -0.04 0.00 0.00 33.50 32.67 1k25 n PRO 522 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1k25 n LEU 523 N -0.04 3.19 0.00 1.53 4.32 -1.26 -5.26 117.00 119.48 1k25 n LEU 523 Ca 0.03 -3.60 0.00 0.00 -0.02 0.00 0.00 56.01 52.42 1k25 n LEU 523 Cb 0.26 -0.54 0.00 0.00 -1.62 0.00 0.00 43.42 41.52 1k25 n LEU 523 CO 0.03 1.14 0.00 -0.38 -1.22 0.00 0.00 177.39 176.96 1k25 n ILE 536 N -1.12 0.00 -2.13 -0.08 5.41 -1.26 -5.28 119.36 114.90 1k25 n ILE 536 Ca 0.23 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.63 1k25 n ILE 536 Cb 0.81 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.75 1k25 n ILE 536 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1k25 s ILE 537 N 0.00 3.18 -0.30 1.39 1.01 -1.26 -4.92 121.20 120.30 1k25 s ILE 537 Ca 0.00 0.69 -0.12 0.00 0.00 0.00 0.00 60.65 61.21 1k25 s ILE 537 Cb 0.00 -3.24 0.18 0.00 0.01 0.00 0.00 42.46 39.41 1k25 s ILE 537 CO 0.00 -0.20 1.04 0.28 0.00 0.00 0.00 174.94 176.05 1k25 s THR 538 N -1.91 -0.32 0.27 2.92 -1.32 -1.26 -4.99 115.64 109.03 1k25 s THR 538 Ca 0.71 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.96 1k25 s THR 538 Cb -0.23 -0.78 -0.09 0.00 -1.51 0.00 0.00 72.50 69.89 1k25 s THR 538 CO 0.31 0.00 0.85 -0.69 -2.21 0.00 0.00 174.62 172.87 1k25 s VAL 539 N 2.95 4.35 -0.38 5.08 1.01 -1.26 -4.87 120.40 127.28 1k25 s VAL 539 Ca 0.08 1.63 -0.27 0.00 0.00 0.00 0.00 61.98 63.41 1k25 s VAL 539 Cb -0.08 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1k25 s VAL 539 CO -0.15 0.22 2.07 -2.84 0.00 0.00 0.00 175.10 174.40 1k25 s PRO 540 N -1.89 2.89 0.00 2.72 0.02 -1.26 -3.02 135.00 134.45 1k25 s PRO 540 Ca 0.46 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.95 1k25 s PRO 540 Cb -0.19 -4.36 0.00 0.00 0.02 0.00 0.00 34.50 29.97 1k25 s PRO 540 CO 0.23 -2.38 0.00 0.41 -0.33 0.00 0.00 177.00 174.94 1k25 n GLY 541 N 5.69 0.50 3.35 0.52 0.00 -1.26 -5.05 105.19 108.95 1k25 n GLY 541 Ca 0.28 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 1k25 n GLY 541 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k25 s GLN 542 N -0.76 1.34 -0.22 1.61 -0.21 -1.17 -5.13 119.66 115.12 1k25 s GLN 542 Ca 0.00 -1.62 -0.09 0.00 0.02 0.00 0.00 55.36 53.67 1k25 s GLN 542 Cb 0.00 -1.04 -0.04 0.00 1.00 0.00 0.00 33.01 32.93 1k25 s GLN 542 CO 0.00 0.13 0.11 -0.80 -2.12 0.00 0.00 175.29 172.61 1k25 s ASN 543 N -3.32 5.82 -0.26 5.90 0.01 -1.26 -4.62 114.94 117.20 1k25 s ASN 543 Ca 0.23 0.06 -0.11 0.00 -0.71 0.00 0.00 52.86 52.34 1k25 s ASN 543 Cb 0.01 -2.03 -0.05 0.00 0.41 0.00 0.00 41.25 39.59 1k25 s ASN 543 CO 0.07 0.09 0.17 -0.69 -1.51 0.00 0.00 177.10 175.24 1k25 s VAL 544 N 0.88 5.33 0.04 1.60 1.01 -1.26 0.88 120.40 128.88 1k25 s VAL 544 Ca 0.06 0.17 -0.26 0.00 0.00 0.00 0.00 61.98 61.95 1k25 s VAL 544 Cb -0.13 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1k25 s VAL 544 CO 0.03 0.30 0.81 0.00 0.00 0.00 0.00 175.10 176.24 1k25 s ALA 545 N 1.40 3.32 0.31 5.51 0.00 -1.01 -4.15 121.76 127.14 1k25 s ALA 545 Ca 0.07 0.33 -0.06 0.00 0.00 0.00 0.00 51.96 52.31 1k25 s ALA 545 Cb -0.15 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 19.91 1k25 s ALA 545 CO 0.08 0.00 0.47 0.14 0.00 0.00 0.00 175.76 176.44 1k25 s VAL 546 N 0.16 0.00 -0.30 0.00 -7.23 -0.49 0.57 120.40 113.12 1k25 s VAL 546 Ca 0.41 -1.55 -0.10 0.00 -1.81 0.00 0.00 61.98 58.93 1k25 s VAL 546 Cb -0.21 -2.53 0.18 0.00 0.56 0.00 0.00 36.38 34.38 1k25 s VAL 546 CO 0.24 0.00 0.99 -0.75 -0.31 0.00 0.00 175.10 175.27 1k25 s LYS 547 N -3.33 0.22 -0.10 4.82 2.47 -0.47 -4.65 119.74 118.70 1k25 s LYS 547 Ca 0.28 0.31 0.02 0.00 -1.56 0.00 0.00 55.97 55.02 1k25 s LYS 547 Cb -0.00 0.16 -0.02 0.00 -1.46 0.00 0.00 37.83 36.51 1k25 s LYS 547 CO 0.16 -0.31 -0.14 -1.54 0.16 0.00 0.00 175.35 173.68 1k25 s SER 548 N 2.94 3.97 0.00 1.43 1.04 -1.26 -2.33 113.70 119.50 1k25 s SER 548 Ca 0.11 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1k25 s SER 548 Cb -0.07 -1.29 0.00 0.00 0.10 0.00 0.00 66.02 64.75 1k25 s SER 548 CO -0.17 0.24 0.00 0.61 0.98 0.00 0.00 173.24 174.90 1k25 n GLY 549 N 3.04 3.60 3.21 7.32 0.00 -0.74 -5.01 105.19 116.61 1k25 n GLY 549 Ca -0.18 -0.85 -0.18 0.00 0.00 0.00 0.00 46.02 44.81 1k25 n GLY 549 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k25 s THR 550 N -2.09 1.22 0.37 2.61 2.01 -1.26 -2.85 115.64 115.65 1k25 s THR 550 Ca 0.00 -1.56 0.08 0.00 0.31 0.00 0.00 61.69 60.52 1k25 s THR 550 Cb 0.00 -1.36 -0.06 0.00 0.01 0.00 0.00 72.50 71.09 1k25 s THR 550 CO 0.00 -0.36 -0.01 0.00 -0.69 0.00 0.00 174.62 173.57 1k25 s ALA 551 N -1.85 3.15 -0.21 7.40 0.00 -0.67 -3.02 121.76 126.56 1k25 s ALA 551 Ca 0.05 -2.11 0.00 0.00 0.00 0.00 0.00 51.96 49.90 1k25 s ALA 551 Cb -0.07 -0.12 0.05 0.00 0.00 0.00 0.00 23.12 22.99 1k25 s ALA 551 CO 0.02 -0.00 -0.06 -0.65 0.00 0.00 0.00 175.76 175.07 1k25 s GLN 552 N -3.70 1.67 -0.22 0.00 -0.21 -1.26 -2.80 119.66 113.14 1k25 s GLN 552 Ca 0.35 -0.83 -0.29 0.00 0.02 0.00 0.00 55.36 54.61 1k25 s GLN 552 Cb 0.04 -2.40 0.01 0.00 1.00 0.00 0.00 33.01 31.65 1k25 s GLN 552 CO 0.18 -0.52 1.04 0.42 -2.12 0.00 0.00 175.29 174.30 1k25 s ILE 553 N 1.46 4.69 0.33 1.08 1.01 -1.26 -4.90 121.20 123.60 1k25 s ILE 553 Ca -0.03 2.03 -0.29 0.00 0.00 0.00 0.00 60.65 62.36 1k25 s ILE 553 Cb -0.17 -4.31 -0.11 0.00 0.01 0.00 0.00 42.46 37.88 1k25 s ILE 553 CO -0.07 -0.17 1.45 0.00 0.00 0.00 0.00 174.94 176.14 1k25 s ALA 554 N 3.13 3.59 -1.10 9.38 0.00 -1.26 -2.42 121.76 133.09 1k25 s ALA 554 Ca 0.44 1.44 -0.22 0.00 0.00 0.00 0.00 51.96 53.62 1k25 s ALA 554 Cb -0.15 -3.57 0.02 0.00 0.00 0.00 0.00 23.12 19.41 1k25 s ALA 554 CO 0.07 -0.87 1.70 0.34 0.00 0.00 0.00 175.76 176.99 1k25 s ASP 555 N -0.03 6.11 0.09 0.00 -1.08 -1.16 -4.72 116.67 115.88 1k25 s ASP 555 Ca 0.55 -1.61 0.05 0.00 -0.52 0.00 0.00 52.55 51.02 1k25 s ASP 555 Cb -0.44 -2.57 0.29 0.00 -1.46 0.00 0.00 42.92 38.73 1k25 s ASP 555 CO 0.54 -1.89 1.11 1.21 0.52 0.00 0.00 175.17 176.67 1k25 n GLU 556 N 8.66 0.03 -0.07 4.34 2.13 -1.26 -0.03 120.64 134.44 1k25 n GLU 556 Ca 0.41 0.49 -0.11 0.00 0.66 0.00 0.00 57.16 58.60 1k25 n GLU 556 Cb 0.48 -1.68 -0.15 0.00 0.27 0.00 0.00 31.44 30.37 1k25 n GLU 556 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1k25 n LYS 557 N -1.65 0.67 -1.67 5.31 5.02 -1.26 -4.53 118.16 120.05 1k25 n LYS 557 Ca -0.00 0.12 -0.03 0.00 -2.02 0.00 0.00 58.31 56.38 1k25 n LYS 557 Cb 0.07 -1.61 0.08 0.00 -0.02 0.00 0.00 35.03 33.55 1k25 n LYS 557 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1k25 n ASN 558 N -2.95 2.19 0.00 4.39 6.94 -0.86 -5.11 115.26 119.86 1k25 n ASN 558 Ca -0.30 -2.91 0.00 0.00 -0.02 0.00 0.00 54.58 51.35 1k25 n ASN 558 Cb 1.10 -0.41 0.00 0.00 -2.36 0.00 0.00 39.78 38.11 1k25 n ASN 558 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1k25 n GLY 559 N -0.46 2.67 7.00 4.83 0.00 0.95 -4.82 105.19 115.37 1k25 n GLY 559 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1k25 n GLY 559 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k25 n GLY 560 N 0.00 1.43 3.04 -0.02 0.00 -1.26 -2.98 105.19 105.40 1k25 n GLY 560 Ca 0.00 -0.27 -0.12 0.00 0.00 0.00 0.00 46.02 45.63 1k25 n GLY 560 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k25 s TYR 561 N 0.00 -0.14 0.03 1.61 2.02 -1.26 -3.67 117.35 115.94 1k25 s TYR 561 Ca 0.00 0.33 -0.34 0.00 -0.37 0.00 0.00 57.07 56.69 1k25 s TYR 561 Cb 0.00 0.04 -0.13 0.00 -0.40 0.00 0.00 41.96 41.47 1k25 s TYR 561 CO 0.00 -0.11 1.74 1.28 -1.57 0.00 0.00 175.55 176.90 1k25 n LEU 562 N 2.80 3.31 -5.00 -1.29 4.77 -1.02 -4.69 117.00 115.88 1k25 n LEU 562 Ca -0.14 1.02 -0.19 0.00 -0.03 0.00 0.00 56.01 56.67 1k25 n LEU 562 Cb 0.58 -1.40 0.03 0.00 -2.33 0.00 0.00 43.42 40.31 1k25 n LEU 562 CO 0.21 -0.15 0.28 0.54 -1.33 0.00 0.00 177.39 176.94 1k25 s VAL 563 N 2.63 2.71 0.00 4.08 0.11 -1.26 -4.82 120.40 123.84 1k25 s VAL 563 Ca 0.86 -0.86 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1k25 s VAL 563 Cb -0.68 -2.86 0.00 0.00 -1.53 0.00 0.00 36.38 31.32 1k25 s VAL 563 CO 0.45 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.83 1k25 n GLY 564 N -2.14 -3.26 3.96 6.54 0.00 -1.26 -4.79 105.19 104.25 1k25 n GLY 564 Ca 0.10 -1.93 -0.22 0.00 0.00 0.00 0.00 46.02 43.97 1k25 n GLY 564 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1k25 s SER 565 N -1.49 5.97 0.00 1.61 0.15 -1.26 -4.34 113.70 114.33 1k25 s SER 565 Ca 0.00 0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1k25 s SER 565 Cb 0.00 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.73 1k25 s SER 565 CO 0.00 -0.55 0.00 0.35 1.20 0.00 0.00 173.24 174.24 1k25 n THR 566 N -1.91 0.00 -0.57 6.45 -2.24 -1.26 -4.68 114.28 110.06 1k25 n THR 566 Ca -0.01 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.73 1k25 n THR 566 Cb 0.57 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.74 1k25 n THR 566 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1k25 n ASN 567 N 0.07 4.05 -2.60 3.42 4.13 -1.26 -3.35 115.26 119.72 1k25 n ASN 567 Ca 0.00 -2.16 -0.07 0.00 1.68 0.00 0.00 54.58 54.03 1k25 n ASN 567 Cb 0.00 -0.97 -0.01 0.00 -1.54 0.00 0.00 39.78 37.26 1k25 n ASN 567 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1k25 n TYR 568 N 2.11 -0.21 -3.63 3.10 0.53 -1.26 -4.36 117.16 113.44 1k25 n TYR 568 Ca 0.16 -0.54 -0.29 0.00 -1.02 0.00 0.00 57.90 56.21 1k25 n TYR 568 Cb 0.54 -0.08 -0.13 0.00 -1.03 0.00 0.00 39.34 38.64 1k25 n TYR 568 CO 0.00 0.00 0.00 0.42 -1.02 0.00 0.00 176.86 176.26 1k25 s ILE 569 N -1.16 0.91 0.11 -0.72 1.01 -1.12 -0.97 121.20 119.26 1k25 s ILE 569 Ca 0.02 -2.11 -0.30 0.00 0.00 0.00 0.00 60.65 58.25 1k25 s ILE 569 Cb -0.00 -1.65 -0.06 0.00 0.01 0.00 0.00 42.46 40.76 1k25 s ILE 569 CO 0.01 -0.90 1.16 -0.36 0.00 0.00 0.00 174.94 174.86 1k25 s PHE 570 N 0.76 3.49 0.01 3.97 0.40 -0.22 -1.67 117.98 124.72 1k25 s PHE 570 Ca 0.17 1.42 -0.10 0.00 -0.60 0.00 0.00 56.93 57.82 1k25 s PHE 570 Cb -0.23 -3.37 0.01 0.00 0.51 0.00 0.00 43.02 39.93 1k25 s PHE 570 CO -0.03 -1.04 0.19 -1.54 0.70 0.00 0.00 175.22 173.51 1k25 s SER 571 N 0.61 -0.02 0.03 1.36 1.04 -1.13 0.14 113.70 115.72 1k25 s SER 571 Ca 0.55 -0.19 -0.06 0.00 0.48 0.00 0.00 55.95 56.73 1k25 s SER 571 Cb -0.30 0.25 -0.01 0.00 0.10 0.00 0.00 66.02 66.07 1k25 s SER 571 CO 0.32 -0.44 0.12 0.00 0.98 0.00 0.00 173.24 174.22 1k25 s ALA 572 N -1.69 -0.17 0.01 5.32 0.00 0.13 -1.80 121.76 123.57 1k25 s ALA 572 Ca -0.12 -0.40 -0.05 0.00 0.00 0.00 0.00 51.96 51.39 1k25 s ALA 572 Cb -0.05 0.21 -0.00 0.00 0.00 0.00 0.00 23.12 23.28 1k25 s ALA 572 CO 0.01 -0.29 0.09 0.54 0.00 0.00 0.00 175.76 176.11 1k25 s VAL 573 N -2.24 0.09 0.38 0.00 0.11 -0.98 0.55 120.40 118.30 1k25 s VAL 573 Ca -0.08 -0.75 0.06 0.00 -2.93 0.00 0.00 61.98 58.27 1k25 s VAL 573 Cb -0.03 -0.38 -0.02 0.00 -1.53 0.00 0.00 36.38 34.41 1k25 s VAL 573 CO -0.03 -0.41 0.21 0.35 -3.33 0.00 0.00 175.10 171.89 1k25 n THR 574 N 1.49 0.00 -2.85 5.04 -2.24 0.32 -1.36 114.28 114.68 1k25 n THR 574 Ca -0.23 -2.43 -0.02 0.00 -2.27 0.00 0.00 64.05 59.10 1k25 n THR 574 Cb 0.55 1.02 0.01 0.00 -2.10 0.00 0.00 70.33 69.82 1k25 n THR 574 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1k25 s MET 575 N -3.48 0.68 -0.07 -0.78 -1.94 0.19 -3.56 119.30 110.35 1k25 s MET 575 Ca 0.29 -0.53 0.01 0.00 -1.71 0.00 0.00 55.69 53.76 1k25 s MET 575 Cb 0.01 0.01 -0.03 0.00 2.01 0.00 0.00 34.83 36.83 1k25 s MET 575 CO 0.21 -0.89 -0.09 0.54 -0.01 0.00 0.00 175.02 174.78 1k25 s ASN 576 N 1.29 4.45 -0.24 3.03 4.22 -1.20 -1.48 114.94 125.00 1k25 s ASN 576 Ca 0.23 -0.09 -0.29 0.00 -2.14 0.00 0.00 52.86 50.57 1k25 s ASN 576 Cb 0.03 -1.12 0.01 0.00 1.28 0.00 0.00 41.25 41.44 1k25 s ASN 576 CO -0.08 0.34 1.03 -2.16 -2.04 0.00 0.00 177.10 174.19 1k25 s PRO 577 N -0.69 4.23 0.00 3.55 0.04 -1.26 -3.15 135.00 137.72 1k25 s PRO 577 Ca 0.10 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.44 1k25 s PRO 577 Cb -0.11 -3.65 0.00 0.00 0.04 0.00 0.00 34.50 30.78 1k25 s PRO 577 CO 0.01 -0.65 0.20 0.00 0.04 0.00 0.00 177.00 176.60 1k25 n ALA 578 N 6.36 0.00 -0.17 8.56 0.00 0.26 -1.34 120.51 134.17 1k25 n ALA 578 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.54 1k25 n ALA 578 Cb 0.46 0.10 -0.01 0.00 0.00 0.00 0.00 19.45 20.01 1k25 n ALA 578 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1k25 n GLU 579 N -0.73 -0.13 -3.45 0.00 4.71 -1.26 -3.38 120.64 116.39 1k25 n GLU 579 Ca 0.00 0.66 -0.28 0.00 -0.01 0.00 0.00 57.16 57.53 1k25 n GLU 579 Cb 0.00 -0.97 -0.12 0.00 -1.01 0.00 0.00 31.44 29.34 1k25 n GLU 579 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 1k25 s ASN 580 N -5.18 2.76 0.72 1.62 3.04 -0.45 -5.04 114.94 112.41 1k25 s ASN 580 Ca -0.06 -2.21 -0.16 0.00 0.04 0.00 0.00 52.86 50.47 1k25 s ASN 580 Cb 0.07 -0.34 0.01 0.00 -1.54 0.00 0.00 41.25 39.44 1k25 s ASN 580 CO 0.29 -0.30 0.95 -2.65 -3.04 0.00 0.00 177.10 172.35 1k25 n PRO 581 N 3.97 0.49 0.00 0.43 -0.02 -0.69 -4.28 135.00 134.90 1k25 n PRO 581 Ca 0.13 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1k25 n PRO 581 Cb 0.38 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1k25 n PRO 581 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1k25 n ASP 582 N -1.63 0.00 -4.70 2.55 8.00 -1.23 -4.42 116.55 115.12 1k25 n ASP 582 Ca 0.13 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.25 1k25 n ASP 582 Cb 0.49 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.53 1k25 n ASP 582 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1k25 s PHE 583 N -0.86 3.45 -0.19 1.24 0.08 -1.19 0.23 117.98 120.74 1k25 s PHE 583 Ca 0.00 0.75 -0.04 0.00 0.12 0.00 0.00 56.93 57.76 1k25 s PHE 583 Cb 0.00 -2.52 -0.02 0.00 -0.57 0.00 0.00 43.02 39.91 1k25 s PHE 583 CO 0.00 0.10 -0.03 0.42 -0.10 0.00 0.00 175.22 175.61 1k25 s ILE 584 N 0.90 3.69 -0.12 0.64 1.01 0.22 -3.25 121.20 124.29 1k25 s ILE 584 Ca 0.22 -0.40 0.03 0.00 0.00 0.00 0.00 60.65 60.50 1k25 s ILE 584 Cb -0.15 -2.66 0.01 0.00 0.01 0.00 0.00 42.46 39.67 1k25 s ILE 584 CO 0.08 0.44 -0.22 -0.22 0.00 0.00 0.00 174.94 175.02 1k25 s LEU 585 N 0.99 2.13 -0.24 2.97 2.96 -1.23 0.15 118.68 126.41 1k25 s LEU 585 Ca 0.01 -0.58 -0.01 0.00 -0.22 0.00 0.00 54.13 53.33 1k25 s LEU 585 Cb -0.15 -1.44 0.07 0.00 0.50 0.00 0.00 46.19 45.18 1k25 s LEU 585 CO 0.01 0.11 0.01 -0.47 -1.32 0.00 0.00 176.35 174.69 1k25 s TYR 586 N 0.62 1.91 -0.01 5.38 5.04 -0.08 -0.52 117.35 129.68 1k25 s TYR 586 Ca -0.12 -1.53 0.04 0.00 -2.44 0.00 0.00 57.07 53.02 1k25 s TYR 586 Cb -0.17 -1.49 -0.03 0.00 0.35 0.00 0.00 41.96 40.62 1k25 s TYR 586 CO 0.03 -0.75 -0.10 0.08 -1.34 0.00 0.00 175.55 173.47 1k25 s VAL 587 N 1.56 3.44 0.01 3.14 1.01 0.19 -1.04 120.40 128.70 1k25 s VAL 587 Ca -0.01 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.19 1k25 s VAL 587 Cb -0.18 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1k25 s VAL 587 CO -0.10 0.44 -0.04 0.42 0.00 0.00 0.00 175.10 175.82 1k25 s THR 588 N -0.92 0.29 -0.24 3.92 -4.23 -0.62 0.22 115.64 114.06 1k25 s THR 588 Ca 0.15 -0.36 -0.04 0.00 -1.18 0.00 0.00 61.69 60.27 1k25 s THR 588 Cb -0.11 -0.29 0.09 0.00 1.34 0.00 0.00 72.50 73.53 1k25 s THR 588 CO 0.05 -0.05 0.16 -0.69 -0.54 0.00 0.00 174.62 173.56 1k25 s VAL 589 N -0.40 -0.18 -0.09 2.29 1.01 0.38 -0.80 120.40 122.60 1k25 s VAL 589 Ca -0.02 -0.43 -0.13 0.00 0.00 0.00 0.00 61.98 61.41 1k25 s VAL 589 Cb -0.03 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.49 1k25 s VAL 589 CO -0.00 -0.46 0.31 -1.58 0.00 0.00 0.00 175.10 173.36 1k25 s GLN 590 N 2.20 3.94 -1.41 2.72 0.74 0.27 -1.05 119.66 127.06 1k25 s GLN 590 Ca 0.07 0.17 -0.11 0.00 0.05 0.00 0.00 55.36 55.54 1k25 s GLN 590 Cb -0.16 -3.29 0.01 0.00 1.10 0.00 0.00 33.01 30.68 1k25 s GLN 590 CO -0.24 0.54 0.29 1.04 -0.55 0.00 0.00 175.29 176.37 1k25 n GLN 591 N 2.53 -1.05 -2.67 1.67 6.02 -0.14 -1.19 117.38 122.55 1k25 n GLN 591 Ca -0.14 0.14 -0.31 0.00 -0.01 0.00 0.00 57.00 56.67 1k25 n GLN 591 Cb 0.53 -3.41 -0.03 0.00 1.02 0.00 0.00 30.24 28.35 1k25 n GLN 591 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1k25 s PRO 592 N -7.24 3.87 0.17 -1.09 0.04 -1.21 -3.20 135.00 126.33 1k25 s PRO 592 Ca 0.17 0.69 -0.10 0.00 0.04 0.00 0.00 61.00 61.81 1k25 s PRO 592 Cb -0.09 -2.28 0.04 0.00 0.04 0.00 0.00 34.50 32.21 1k25 s PRO 592 CO 0.97 -0.13 1.59 0.93 0.04 0.00 0.00 177.00 180.40 1k25 h GLU 593 N 1.16 1.03 -2.81 4.56 5.08 -1.44 -3.44 114.58 118.72 1k25 h GLU 593 Ca -0.47 -0.39 -0.13 0.00 -1.00 0.00 0.00 59.36 57.37 1k25 h GLU 593 Cb 1.19 -0.06 -0.24 0.00 0.50 0.00 0.00 28.75 30.13 1k25 h GLU 593 CO 0.63 1.09 -0.27 -1.01 -1.00 0.00 0.00 179.01 178.44 1k25 s HIS 594 N -4.82 -0.42 -0.22 4.33 3.76 -1.24 -5.01 115.29 111.66 1k25 s HIS 594 Ca -0.11 1.02 -0.04 0.00 -0.15 0.00 0.00 55.06 55.78 1k25 s HIS 594 Cb 0.13 0.15 0.09 0.00 1.11 0.00 0.00 32.58 34.05 1k25 s HIS 594 CO 0.87 -0.20 0.15 -0.47 -0.85 0.00 0.00 174.74 174.24 1k25 s TYR 595 N 0.25 0.05 0.20 1.40 5.04 -1.26 -4.37 117.35 118.66 1k25 s TYR 595 Ca -0.00 -0.33 -0.13 0.00 -2.44 0.00 0.00 57.07 54.17 1k25 s TYR 595 Cb -0.03 -0.65 -0.07 0.00 0.35 0.00 0.00 41.96 41.56 1k25 s TYR 595 CO 0.00 -0.66 0.58 0.45 -1.34 0.00 0.00 175.55 174.58 1k25 s SER 596 N 2.20 6.75 0.35 4.32 0.15 -1.26 -4.96 113.70 121.25 1k25 s SER 596 Ca 0.06 1.06 0.03 0.00 0.70 0.00 0.00 55.95 57.80 1k25 s SER 596 Cb -0.16 -2.28 0.67 0.00 -1.71 0.00 0.00 66.02 62.54 1k25 s SER 596 CO -0.20 -0.00 2.00 1.23 1.20 0.00 0.00 173.24 177.46 1k25 h GLY 597 N 3.01 0.91 0.77 9.45 0.00 -2.02 -2.76 103.07 112.43 1k25 h GLY 597 Ca -0.48 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 46.51 1k25 h GLY 597 CO 0.67 0.30 -0.14 -2.22 0.00 0.00 0.00 176.54 175.15 1k25 h ILE 598 N 0.83 0.76 -0.66 2.60 2.04 -2.00 -3.28 117.51 117.80 1k25 h ILE 598 Ca 0.26 -0.44 0.06 0.00 1.00 0.00 0.00 64.86 65.74 1k25 h ILE 598 Cb 0.01 1.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.01 1k25 h ILE 598 CO -0.07 0.09 -0.39 0.00 0.00 0.00 0.00 178.15 177.79 1k25 n GLN 599 N -5.15 -0.29 -0.07 2.37 3.00 -1.04 0.11 117.38 116.30 1k25 n GLN 599 Ca -0.10 1.03 -0.08 0.00 -0.01 0.00 0.00 57.00 57.84 1k25 n GLN 599 Cb 0.24 -1.52 -0.02 0.00 0.00 0.00 0.00 30.24 28.94 1k25 n GLN 599 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 1k25 h LEU 600 N 0.00 -0.92 -0.69 1.08 5.85 -1.66 -1.88 115.31 117.09 1k25 h LEU 600 Ca 0.11 0.16 0.13 0.00 0.84 0.00 0.00 57.88 59.12 1k25 h LEU 600 Cb 0.27 0.43 -0.13 0.00 0.37 0.00 0.00 40.66 41.60 1k25 h LEU 600 CO -0.62 -0.31 -0.21 1.23 -0.34 0.00 0.00 178.44 178.19 1k25 h GLY 601 N -0.27 0.38 0.33 3.75 0.00 0.69 0.58 103.07 108.53 1k25 h GLY 601 Ca 0.15 0.28 0.11 0.00 0.00 0.00 0.00 47.33 47.86 1k25 h GLY 601 CO -0.44 -0.26 0.26 0.83 0.00 0.00 0.00 176.54 176.93 1k25 h GLU 602 N -0.03 0.43 0.13 4.80 5.08 -0.30 -1.88 114.58 122.80 1k25 h GLU 602 Ca 0.32 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 1k25 h GLU 602 Cb 0.53 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1k25 h GLU 602 CO -0.72 0.28 -0.06 0.35 -1.00 0.00 0.00 179.01 177.85 1k25 h PHE 603 N 0.44 -0.17 0.03 4.33 3.57 0.15 -3.36 116.94 121.93 1k25 h PHE 603 Ca 0.34 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.84 1k25 h PHE 603 Cb 0.44 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1k25 h PHE 603 CO -0.16 -0.10 -0.07 0.00 -2.23 0.00 0.00 178.31 175.74 1k25 h ALA 604 N -1.80 -0.67 -0.36 2.41 0.00 0.03 -3.33 119.26 115.54 1k25 h ALA 604 Ca -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1k25 h ALA 604 Cb 0.14 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1k25 h ALA 604 CO 0.03 -0.68 -0.21 2.41 0.00 0.00 0.00 179.25 180.80 1k25 n THR 605 N -2.80 -0.24 -0.49 0.00 -1.04 -0.72 -0.37 114.28 108.62 1k25 n THR 605 Ca -0.01 1.42 0.43 0.00 -2.04 0.00 0.00 64.05 63.85 1k25 n THR 605 Cb 0.06 -1.81 0.78 0.00 -1.82 0.00 0.00 70.33 67.53 1k25 n THR 605 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1k25 h PRO 606 N 0.00 0.01 0.08 -2.82 0.11 -1.71 1.33 132.00 129.00 1k25 h PRO 606 Ca 0.06 -0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.91 1k25 h PRO 606 Cb 0.15 -0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.26 1k25 h PRO 606 CO -0.34 0.01 -1.14 0.82 -0.21 0.00 0.00 178.00 177.14 1k25 h ILE 607 N 0.01 1.42 0.00 4.15 1.08 -0.83 0.07 117.51 123.40 1k25 h ILE 607 Ca 0.73 -2.72 -0.17 0.00 -0.39 0.00 0.00 64.86 62.31 1k25 h ILE 607 Cb 2.91 2.71 -0.02 0.00 -3.07 0.00 0.00 36.82 39.35 1k25 h ILE 607 CO -0.02 0.81 -0.83 -0.07 -0.69 0.00 0.00 178.15 177.34 1k25 h LEU 608 N 0.16 0.00 0.29 1.44 3.38 -0.31 0.15 115.31 120.42 1k25 h LEU 608 Ca -0.13 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1k25 h LEU 608 Cb 1.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.57 1k25 h LEU 608 CO 0.20 0.83 -0.14 -0.08 0.09 0.00 0.00 178.44 179.34 1k25 h GLU 609 N 0.00 -0.38 0.22 1.13 4.81 0.16 -0.66 114.58 119.87 1k25 h GLU 609 Ca -0.01 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1k25 h GLU 609 Cb 1.52 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.99 1k25 h GLU 609 CO 0.11 -0.19 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.01 1k25 h ARG 610 N -0.48 -0.28 0.09 1.92 9.65 -0.97 -2.94 114.38 121.37 1k25 h ARG 610 Ca -0.04 0.02 0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1k25 h ARG 610 Cb 0.36 0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.96 1k25 h ARG 610 CO 0.07 0.10 -0.39 0.00 2.80 0.00 0.00 179.97 182.55 1k25 h ALA 611 N -0.21 -0.66 0.28 2.80 0.00 -0.75 0.32 119.26 121.04 1k25 h ALA 611 Ca -0.03 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1k25 h ALA 611 Cb 0.51 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1k25 h ALA 611 CO 0.05 -0.94 -0.39 0.77 0.00 0.00 0.00 179.25 178.74 1k25 h SER 612 N -0.60 -1.11 -0.47 0.00 0.02 -1.23 1.24 113.55 111.39 1k25 h SER 612 Ca 0.03 0.10 0.09 0.00 -0.84 0.00 0.00 61.79 61.17 1k25 h SER 612 Cb 0.65 0.38 -0.09 0.00 0.14 0.00 0.00 62.40 63.48 1k25 h SER 612 CO -0.25 -0.48 -0.12 0.00 -1.14 0.00 0.00 176.83 174.84 1k25 h ALA 613 N -1.00 0.29 0.00 3.77 0.00 -1.43 -2.55 119.26 118.35 1k25 h ALA 613 Ca -0.03 0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1k25 h ALA 613 Cb 0.63 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1k25 h ALA 613 CO -0.11 -0.45 -0.66 0.52 0.00 0.00 0.00 179.25 178.55 1k25 h MET 614 N -0.01 0.00 0.00 0.00 2.07 -0.14 -3.40 114.93 113.45 1k25 h MET 614 Ca 0.22 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.85 1k25 h MET 614 Cb 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.08 1k25 h MET 614 CO -0.48 0.66 0.00 1.17 1.07 0.00 0.00 176.91 179.33 1k25 n LYS 615 N -3.41 0.00 -0.16 1.72 4.81 0.42 -0.60 118.16 120.95 1k25 n LYS 615 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.36 1k25 n LYS 615 Cb 0.74 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.76 1k25 n LYS 615 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1k25 h GLU 616 N 0.00 -0.26 -0.69 1.64 3.07 -1.82 -2.77 114.58 113.76 1k25 h GLU 616 Ca 0.00 0.02 0.07 0.00 -0.50 0.00 0.00 59.36 58.95 1k25 h GLU 616 Cb 0.00 0.06 -0.06 0.00 -0.84 0.00 0.00 28.75 27.91 1k25 h GLU 616 CO 0.00 -0.17 0.37 0.66 -1.40 0.00 0.00 179.01 178.46 1k25 h SER 617 N -0.27 0.52 0.00 1.42 4.64 -1.22 -2.48 113.55 116.17 1k25 h SER 617 Ca 0.17 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1k25 h SER 617 Cb 0.57 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1k25 h SER 617 CO -0.62 0.32 0.00 0.00 -0.87 0.00 0.00 176.83 175.66 1k25 n LEU 618 N -4.82 0.00 0.00 5.97 -0.00 -1.05 -4.82 117.00 112.29 1k25 n LEU 618 Ca 0.10 -0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.10 1k25 n LEU 618 Cb 0.22 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.63 1k25 n LEU 618 CO 0.27 0.00 0.00 0.59 -0.00 0.00 0.00 177.39 178.25 1k25 n ASN 619 N -0.49 0.00 0.00 1.45 5.03 -0.93 -4.73 115.26 115.59 1k25 n ASN 619 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 1k25 n ASN 619 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1k25 n ASN 619 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1k25 n LEU 620 N 0.00 0.00 0.00 3.41 4.32 -1.26 -3.85 117.00 119.62 1k25 n LEU 620 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1k25 n LEU 620 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1k25 n LEU 620 CO 0.00 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.17 1k25 n GLN 621 N 0.00 0.00 -2.62 3.23 1.13 -1.26 -4.92 117.38 112.94 1k25 n GLN 621 Ca 0.00 0.24 -0.39 0.00 -1.94 0.00 0.00 57.00 54.91 1k25 n GLN 621 Cb 0.00 -0.72 -0.05 0.00 0.11 0.00 0.00 30.24 29.58 1k25 n GLN 621 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1k25 s SER 622 N -2.14 7.32 0.00 1.08 0.15 -1.25 -5.07 113.70 113.79 1k25 s SER 622 Ca 0.00 2.07 0.00 0.00 0.70 0.00 0.00 55.95 58.72 1k25 s SER 622 Cb 0.00 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1k25 s SER 622 CO 0.00 -0.09 0.00 -2.65 1.20 0.00 0.00 173.24 171.70 1k25 n PRO 623 N 1.00 3.75 -2.65 5.44 -0.02 -1.26 -4.72 135.00 136.54 1k25 n PRO 623 Ca -0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.05 1k25 n PRO 623 Cb 0.47 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.93 1k25 n PRO 623 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k25 s ALA 624 N -3.57 3.56 0.53 3.55 0.00 -1.26 -4.93 121.76 119.64 1k25 s ALA 624 Ca 0.00 0.31 0.24 0.00 0.00 0.00 0.00 51.96 52.51 1k25 s ALA 624 Cb 0.00 -3.50 1.52 0.00 0.00 0.00 0.00 23.12 21.14 1k25 s ALA 624 CO 0.00 -0.85 2.17 0.87 0.00 0.00 0.00 175.76 177.95 1k25 h LYS 625 N 7.35 0.00 -0.41 0.00 1.57 -1.91 0.03 116.57 123.19 1k25 h LYS 625 Ca -0.25 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 1k25 h LYS 625 Cb 1.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 1k25 h LYS 625 CO 0.92 0.04 0.23 -0.91 -0.57 0.00 0.00 179.45 179.17 1k25 h ASN 626 N 0.00 0.50 0.21 0.86 4.21 -1.92 -1.25 115.58 118.19 1k25 h ASN 626 Ca -0.00 -0.08 -0.03 0.00 1.21 0.00 0.00 56.30 57.40 1k25 h ASN 626 Cb 0.10 -0.13 -0.00 0.00 -1.12 0.00 0.00 38.32 37.17 1k25 h ASN 626 CO 0.01 0.43 -0.14 -0.07 -1.29 0.00 0.00 177.43 176.37 1k25 h LEU 627 N 0.53 0.00 -0.53 1.61 -0.00 -1.41 -3.32 115.31 112.19 1k25 h LEU 627 Ca 0.14 0.00 0.08 0.00 -0.00 0.00 0.00 57.88 58.10 1k25 h LEU 627 Cb 0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 40.61 1k25 h LEU 627 CO -0.02 0.14 -0.21 0.47 -0.00 0.00 0.00 178.44 178.82 1k25 n ASP 628 N -4.09 -0.35 -4.67 -0.43 9.92 -0.47 -4.34 116.55 112.12 1k25 n ASP 628 Ca -0.02 0.92 -0.37 0.00 -0.53 0.00 0.00 54.79 54.79 1k25 n ASP 628 Cb 0.22 -0.21 0.07 0.00 -0.64 0.00 0.00 41.12 40.57 1k25 n ASP 628 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1k25 n LYS 629 N -4.77 0.85 -0.27 -1.24 4.01 -1.25 -4.88 118.16 110.61 1k25 n LYS 629 Ca 0.05 0.35 0.00 0.00 -0.51 0.00 0.00 58.31 58.20 1k25 n LYS 629 Cb 0.21 -2.36 0.00 0.00 -0.51 0.00 0.00 35.03 32.37 1k25 n LYS 629 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 1k25 n VAL 630 N -2.10 0.00 0.00 -0.18 0.24 -1.26 -5.08 118.33 109.95 1k25 n VAL 630 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.45 1k25 n VAL 630 Cb 0.48 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 1k25 n VAL 630 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1k25 n THR 631 N 9.00 0.00 0.00 3.34 -2.24 -1.26 -5.05 114.28 118.07 1k25 n THR 631 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1k25 n THR 631 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1k25 n THR 631 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1k25 n THR 632 N 1.52 0.00 0.00 4.28 -1.04 -1.26 -4.76 114.28 113.01 1k25 n THR 632 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1k25 n THR 632 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1k25 n THR 632 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1k25 n GLU 633 N 0.00 0.00 -1.53 -2.82 1.02 -1.24 -4.25 120.64 111.82 1k25 n GLU 633 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1k25 n GLU 633 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 1k25 n GLU 633 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1k25 n SER 634 N 0.00 2.30 -4.32 1.62 7.64 0.33 -4.82 113.62 116.37 1k25 n SER 634 Ca 0.00 -0.02 -0.37 0.00 1.01 0.00 0.00 58.87 59.49 1k25 n SER 634 Cb 0.00 -1.43 0.04 0.00 -1.01 0.00 0.00 64.21 61.82 1k25 n SER 634 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1k25 n SER 635 N 12.72 -2.72 -3.68 6.43 3.41 -1.26 -4.91 113.62 123.61 1k25 n SER 635 Ca 0.39 0.56 -0.12 0.00 -0.26 0.00 0.00 58.87 59.44 1k25 n SER 635 Cb 0.39 -1.03 -0.12 0.00 -0.26 0.00 0.00 64.21 63.19 1k25 n SER 635 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1k25 s TYR 636 N -1.94 -0.49 0.61 7.33 5.04 -1.26 -5.05 117.35 121.59 1k25 s TYR 636 Ca 0.59 1.06 -0.15 0.00 -2.44 0.00 0.00 57.07 56.13 1k25 s TYR 636 Cb -0.37 0.09 -0.03 0.00 0.35 0.00 0.00 41.96 42.00 1k25 s TYR 636 CO 0.64 -0.34 1.06 0.00 -1.34 0.00 0.00 175.55 175.57 1k25 s ALA 637 N 1.98 2.73 -0.52 3.97 0.00 -1.26 -2.24 121.76 126.42 1k25 s ALA 637 Ca -0.04 0.36 -0.20 0.00 0.00 0.00 0.00 51.96 52.08 1k25 s ALA 637 Cb -0.11 -3.23 0.06 0.00 0.00 0.00 0.00 23.12 19.84 1k25 s ALA 637 CO -0.10 -0.87 0.69 1.41 0.00 0.00 0.00 175.76 176.89 1k25 s MET 638 N -4.19 3.16 0.43 0.00 1.75 -1.07 -4.89 119.30 114.49 1k25 s MET 638 Ca 0.63 -0.79 -0.22 0.00 -1.25 0.00 0.00 55.69 54.06 1k25 s MET 638 Cb -0.16 -4.09 -0.12 0.00 2.84 0.00 0.00 34.83 33.30 1k25 s MET 638 CO 0.39 -1.28 0.62 -2.30 -0.65 0.00 0.00 175.02 171.80 1k25 n PRO 639 N 6.41 0.68 -1.67 4.11 -0.02 -1.26 -1.91 135.00 141.35 1k25 n PRO 639 Ca -0.05 0.25 -0.44 0.00 -2.02 0.00 0.00 63.50 61.24 1k25 n PRO 639 Cb 0.46 -1.61 -0.02 0.00 -0.02 0.00 0.00 33.50 32.31 1k25 n PRO 639 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1k25 n SER 640 N 1.08 2.61 -3.80 2.55 2.88 -1.26 -4.77 113.62 112.90 1k25 n SER 640 Ca 0.11 1.16 -0.42 0.00 -1.33 0.00 0.00 58.87 58.39 1k25 n SER 640 Cb 0.40 -1.42 0.01 0.00 -0.75 0.00 0.00 64.21 62.45 1k25 n SER 640 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1k25 n ILE 641 N 1.39 5.72 -3.83 2.46 -0.00 -1.26 -4.95 119.36 118.90 1k25 n ILE 641 Ca 0.10 -5.89 -0.14 0.00 -0.00 0.00 0.00 62.75 56.82 1k25 n ILE 641 Cb 0.32 -1.82 -0.15 0.00 -0.00 0.00 0.00 39.64 37.99 1k25 n ILE 641 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 1k25 s LYS 642 N -3.46 -0.01 -1.40 6.28 2.47 -1.26 -4.81 119.74 117.56 1k25 s LYS 642 Ca 0.36 0.09 -0.08 0.00 -1.56 0.00 0.00 55.97 54.77 1k25 s LYS 642 Cb 0.12 -0.14 0.04 0.00 -1.46 0.00 0.00 37.83 36.39 1k25 s LYS 642 CO -0.02 -0.08 1.02 -0.25 0.16 0.00 0.00 175.35 176.18 1k25 n ASP 643 N 3.64 -4.52 -3.71 1.43 8.00 -1.26 -4.98 116.55 115.14 1k25 n ASP 643 Ca -0.20 -0.68 -0.11 0.00 0.71 0.00 0.00 54.79 54.51 1k25 n ASP 643 Cb 0.55 -4.48 -0.11 0.00 -0.02 0.00 0.00 41.12 37.06 1k25 n ASP 643 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1k25 s ILE 644 N -3.37 -0.02 0.21 0.53 2.07 -1.26 -5.14 121.20 114.22 1k25 s ILE 644 Ca 0.46 0.07 -0.30 0.00 -1.41 0.00 0.00 60.65 59.48 1k25 s ILE 644 Cb -0.22 -0.58 -0.09 0.00 0.13 0.00 0.00 42.46 41.71 1k25 s ILE 644 CO 0.78 0.03 1.21 -0.94 -1.91 0.00 0.00 174.94 174.11 1k25 s SER 645 N 1.10 7.06 0.55 4.50 1.04 -1.25 -3.88 113.70 122.83 1k25 s SER 645 Ca -0.07 2.29 0.41 0.00 0.48 0.00 0.00 55.95 59.06 1k25 s SER 645 Cb -0.07 -2.61 1.41 0.00 0.10 0.00 0.00 66.02 64.85 1k25 s SER 645 CO -0.09 -0.37 1.42 -2.65 0.98 0.00 0.00 173.24 172.53 1k25 n PRO 646 N 2.21 0.00 0.05 4.02 -0.02 -1.25 -1.52 135.00 138.48 1k25 n PRO 646 Ca 0.03 1.03 -0.02 0.00 -2.02 0.00 0.00 63.50 62.52 1k25 n PRO 646 Cb 0.44 -2.43 -0.01 0.00 -0.02 0.00 0.00 33.50 31.48 1k25 n PRO 646 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1k25 h GLY 647 N 0.00 -0.17 0.91 -1.23 0.00 -1.90 0.15 103.07 100.83 1k25 h GLY 647 Ca 0.77 0.06 0.00 0.00 0.00 0.00 0.00 47.33 48.16 1k25 h GLY 647 CO -0.01 -0.06 0.28 -1.84 0.00 0.00 0.00 176.54 174.91 1k25 n GLU 648 N -3.18 0.00 -0.12 4.80 0.28 -0.58 0.24 120.64 122.08 1k25 n GLU 648 Ca -0.02 0.24 -0.21 0.00 -0.16 0.00 0.00 57.16 57.01 1k25 n GLU 648 Cb 0.06 -1.79 -0.08 0.00 1.43 0.00 0.00 31.44 31.07 1k25 n GLU 648 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1k25 n LEU 649 N -1.26 1.93 -0.33 -1.84 0.00 -1.09 -2.69 117.00 111.72 1k25 n LEU 649 Ca -0.00 0.36 0.22 0.00 0.00 0.00 0.00 56.01 56.60 1k25 n LEU 649 Cb 0.28 -0.82 0.49 0.00 0.00 0.00 0.00 43.42 43.38 1k25 n LEU 649 CO 0.00 0.24 1.21 0.00 0.00 0.00 0.00 177.39 178.84 1k25 h ALA 650 N -0.94 2.18 -0.11 1.96 0.00 0.44 0.85 119.26 123.63 1k25 h ALA 650 Ca -0.42 0.07 -0.24 0.00 0.00 0.00 0.00 54.91 54.32 1k25 h ALA 650 Cb 1.34 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.17 1k25 h ALA 650 CO -0.26 -0.60 -0.86 0.93 0.00 0.00 0.00 179.25 178.47 1k25 h GLU 651 N 0.42 0.76 0.15 0.00 5.08 0.30 -3.04 114.58 118.25 1k25 h GLU 651 Ca 0.61 -0.67 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1k25 h GLU 651 Cb 1.48 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.89 1k25 h GLU 651 CO -0.32 1.27 -0.07 0.00 -1.00 0.00 0.00 179.01 178.88 1k25 h ALA 652 N 0.52 -0.91 -1.30 3.43 0.00 0.56 -3.00 119.26 118.56 1k25 h ALA 652 Ca -0.07 -0.05 0.42 0.00 0.00 0.00 0.00 54.91 55.21 1k25 h ALA 652 Cb 1.49 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 19.26 1k25 h ALA 652 CO 0.17 -0.90 0.87 1.28 0.00 0.00 0.00 179.25 180.68 1k25 n LEU 653 N -2.63 0.12 0.15 0.00 4.77 0.23 0.12 117.00 119.76 1k25 n LEU 653 Ca -0.03 1.05 0.00 0.00 -0.03 0.00 0.00 56.01 57.01 1k25 n LEU 653 Cb 0.08 -0.52 0.20 0.00 -2.33 0.00 0.00 43.42 40.85 1k25 n LEU 653 CO 0.06 -1.12 0.53 0.03 -1.33 0.00 0.00 177.39 175.56 1k25 h ARG 654 N 0.00 0.00 0.00 3.23 3.08 -1.40 -1.92 114.38 117.37 1k25 h ARG 654 Ca 0.75 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.80 1k25 h ARG 654 Cb 2.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.65 1k25 h ARG 654 CO -0.27 0.57 0.00 0.54 -1.07 0.00 0.00 179.97 179.74 1k25 n ARG 655 N -3.69 0.84 -0.14 0.04 1.74 0.33 -2.45 116.66 113.33 1k25 n ARG 655 Ca -0.01 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.11 1k25 n ARG 655 Cb 0.60 -1.44 0.05 0.00 -1.02 0.00 0.00 32.46 30.66 1k25 n ARG 655 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1k25 n ASN 656 N -0.94 1.36 -3.10 0.55 3.02 -1.02 -5.03 115.26 110.10 1k25 n ASN 656 Ca 0.18 -2.25 -0.07 0.00 -0.03 0.00 0.00 54.58 52.41 1k25 n ASN 656 Cb 0.08 -0.20 0.03 0.00 -0.61 0.00 0.00 39.78 39.08 1k25 n ASN 656 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1k25 n ILE 657 N -0.65 -9.47 -4.14 2.41 -0.00 -1.03 -4.83 119.36 101.65 1k25 n ILE 657 Ca 0.06 -0.74 -0.09 0.00 -0.00 0.00 0.00 62.75 61.98 1k25 n ILE 657 Cb 0.54 -6.65 -0.10 0.00 -0.00 0.00 0.00 39.64 33.42 1k25 n ILE 657 CO 0.00 0.00 0.00 -0.69 -0.00 0.00 0.00 176.55 175.86 1k25 s VAL 658 N -3.18 0.32 -0.39 1.39 1.01 -0.75 0.18 120.40 118.98 1k25 s VAL 658 Ca 0.21 -1.88 0.01 0.00 0.00 0.00 0.00 61.98 60.32 1k25 s VAL 658 Cb -0.03 -1.76 0.12 0.00 0.00 0.00 0.00 36.38 34.71 1k25 s VAL 658 CO 0.72 -0.77 0.18 -1.10 0.00 0.00 0.00 175.10 174.13 1k25 s GLN 659 N -3.94 1.09 1.05 2.72 -0.21 -0.09 -4.16 119.66 116.12 1k25 s GLN 659 Ca 0.14 -1.67 -0.17 0.00 0.02 0.00 0.00 55.36 53.68 1k25 s GLN 659 Cb 0.07 -2.26 0.23 0.00 1.00 0.00 0.00 33.01 32.05 1k25 s GLN 659 CO -0.04 -1.09 1.26 -1.25 -2.12 0.00 0.00 175.29 172.05 1k25 s PRO 660 N 0.83 -0.02 -0.28 2.91 0.04 -1.26 -1.90 135.00 135.32 1k25 s PRO 660 Ca 0.14 -0.32 0.01 0.00 0.04 0.00 0.00 61.00 60.88 1k25 s PRO 660 Cb -0.22 -1.76 0.16 0.00 0.04 0.00 0.00 34.50 32.72 1k25 s PRO 660 CO -0.09 -2.87 0.42 0.42 0.04 0.00 0.00 177.00 174.92 1k25 s ILE 661 N -3.61 -0.67 -0.32 0.56 1.01 -0.80 -4.70 121.20 112.67 1k25 s ILE 661 Ca 0.73 -0.22 -0.25 0.00 0.00 0.00 0.00 60.65 60.92 1k25 s ILE 661 Cb -0.05 -0.96 0.01 0.00 0.01 0.00 0.00 42.46 41.46 1k25 s ILE 661 CO 0.54 -0.22 0.86 -0.69 0.00 0.00 0.00 174.94 175.43 1k25 s VAL 662 N 2.58 4.71 -0.33 2.92 1.01 -1.26 -0.66 120.40 129.37 1k25 s VAL 662 Ca 0.11 1.27 -0.26 0.00 0.00 0.00 0.00 61.98 63.10 1k25 s VAL 662 Cb -0.13 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.04 1k25 s VAL 662 CO -0.27 -0.34 0.91 -0.69 0.00 0.00 0.00 175.10 174.72 1k25 s VAL 663 N 3.15 4.65 0.00 2.92 1.01 -0.14 -4.91 120.40 127.07 1k25 s VAL 663 Ca 0.35 1.34 0.00 0.00 0.00 0.00 0.00 61.98 63.67 1k25 s VAL 663 Cb -0.13 -4.28 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1k25 s VAL 663 CO 0.14 -0.41 0.00 0.61 0.00 0.00 0.00 175.10 175.44 1k25 n GLY 664 N 4.17 -1.40 1.93 4.51 0.00 -1.26 -1.93 105.19 111.20 1k25 n GLY 664 Ca 0.07 -1.58 -0.19 0.00 0.00 0.00 0.00 46.02 44.32 1k25 n GLY 664 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k25 n THR 665 N -1.33 2.80 -3.27 2.61 -2.24 -1.15 -4.77 114.28 106.93 1k25 n THR 665 Ca 0.00 -1.73 -0.36 0.00 -2.27 0.00 0.00 64.05 59.69 1k25 n THR 665 Cb 0.00 -1.06 -0.06 0.00 -2.10 0.00 0.00 70.33 67.11 1k25 n THR 665 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1k25 s GLY 666 N -0.41 2.55 0.37 3.38 0.00 -1.19 -4.92 107.32 107.09 1k25 s GLY 666 Ca 0.39 -0.01 0.20 0.00 0.00 0.00 0.00 44.72 45.29 1k25 s GLY 666 CO 0.02 0.32 1.61 -0.91 0.00 0.00 0.00 173.10 174.14 1k25 h THR 667 N 2.94 0.57 -3.07 0.90 1.35 -1.92 -3.41 112.91 110.26 1k25 h THR 667 Ca -0.49 -1.60 -0.62 0.00 -0.55 0.00 0.00 66.41 63.16 1k25 h THR 667 Cb 1.20 2.12 -0.10 0.00 -1.73 0.00 0.00 68.15 69.63 1k25 h THR 667 CO 0.65 0.30 -0.64 -0.54 -0.25 0.00 0.00 175.52 175.04 1k25 s LYS 668 N -3.23 2.60 -0.78 4.72 1.02 -1.26 -3.84 119.74 118.97 1k25 s LYS 668 Ca 0.04 -0.91 -0.18 0.00 0.02 0.00 0.00 55.97 54.93 1k25 s LYS 668 Cb 0.08 -2.52 0.14 0.00 -0.52 0.00 0.00 37.83 35.00 1k25 s LYS 668 CO 0.69 0.51 0.91 0.42 -0.92 0.00 0.00 175.35 176.95 1k25 s ILE 669 N -1.53 4.90 0.37 2.17 1.01 -1.25 0.71 121.20 127.58 1k25 s ILE 669 Ca 0.28 -1.47 0.13 0.00 0.00 0.00 0.00 60.65 59.58 1k25 s ILE 669 Cb -0.11 -4.62 0.35 0.00 0.01 0.00 0.00 42.46 38.09 1k25 s ILE 669 CO 0.20 -1.29 1.81 0.50 0.00 0.00 0.00 174.94 176.16 1k25 h LYS 670 N 8.79 0.55 0.00 2.79 3.64 0.00 -3.47 116.57 128.88 1k25 h LYS 670 Ca -0.03 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.40 1k25 h LYS 670 Cb 1.05 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 1k25 h LYS 670 CO 1.04 0.36 0.26 0.39 -2.27 0.00 0.00 179.45 179.23 1k25 n GLU 671 N -4.63 0.15 -3.92 1.90 1.02 -1.23 -5.03 120.64 108.90 1k25 n GLU 671 Ca 0.22 -0.40 -0.09 0.00 -0.02 0.00 0.00 57.16 56.87 1k25 n GLU 671 Cb 0.66 0.58 -0.09 0.00 -0.02 0.00 0.00 31.44 32.58 1k25 n GLU 671 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1k25 s THR 672 N -2.26 0.15 -1.21 2.62 -4.23 -1.26 -3.19 115.64 106.26 1k25 s THR 672 Ca 0.09 -1.23 0.29 0.00 -1.18 0.00 0.00 61.69 59.67 1k25 s THR 672 Cb -0.01 -1.17 0.37 0.00 1.34 0.00 0.00 72.50 73.03 1k25 s THR 672 CO 0.01 -0.68 1.97 -1.54 -0.54 0.00 0.00 174.62 173.84 1k25 n SER 673 N 0.33 0.03 -3.66 3.99 3.41 -1.08 -4.60 113.62 112.04 1k25 n SER 673 Ca -0.17 0.17 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 1k25 n SER 673 Cb 0.60 -0.38 -0.17 0.00 -0.26 0.00 0.00 64.21 64.00 1k25 n SER 673 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1k25 s VAL 674 N -2.80 0.01 0.32 -3.33 1.01 -1.26 -4.93 120.40 109.43 1k25 s VAL 674 Ca 0.21 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.96 1k25 s VAL 674 Cb 0.20 -0.44 -0.11 0.00 0.00 0.00 0.00 36.38 36.02 1k25 s VAL 674 CO 0.50 -0.03 1.54 -1.61 0.00 0.00 0.00 175.10 175.50 1k25 s GLU 675 N 2.11 4.13 0.52 2.72 8.01 -1.26 -4.93 118.70 129.99 1k25 s GLU 675 Ca 0.03 2.55 -0.18 0.00 0.01 0.00 0.00 54.97 57.38 1k25 s GLU 675 Cb -0.14 -3.01 -0.15 0.00 -4.31 0.00 0.00 34.13 26.52 1k25 s GLU 675 CO -0.06 -0.57 -0.10 -1.91 0.01 0.00 0.00 175.26 172.63 1k25 n GLU 676 N 1.50 0.03 0.00 1.61 2.13 -1.26 -1.28 120.64 123.37 1k25 n GLU 676 Ca 0.05 0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.88 1k25 n GLU 676 Cb 0.38 -1.04 0.00 0.00 0.27 0.00 0.00 31.44 31.05 1k25 n GLU 676 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1k25 n GLY 677 N 2.48 1.06 3.36 8.31 0.00 -0.80 -4.90 105.19 114.70 1k25 n GLY 677 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1k25 n GLY 677 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k25 n THR 678 N 0.00 0.41 -1.73 2.61 -2.24 -0.41 -4.30 114.28 108.62 1k25 n THR 678 Ca 0.00 -0.29 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 1k25 n THR 678 Cb 0.00 -0.54 0.05 0.00 -2.10 0.00 0.00 70.33 67.74 1k25 n THR 678 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1k25 s ASN 679 N -1.72 5.33 -0.10 3.42 2.47 -1.26 -2.58 114.94 120.49 1k25 s ASN 679 Ca 0.56 1.33 -0.03 0.00 0.42 0.00 0.00 52.86 55.14 1k25 s ASN 679 Cb -0.24 -2.17 0.05 0.00 -1.45 0.00 0.00 41.25 37.43 1k25 s ASN 679 CO 0.68 -1.44 0.10 -0.22 -3.72 0.00 0.00 177.10 172.50 1k25 s LEU 680 N -5.47 0.14 0.63 3.21 2.96 -0.95 -4.87 118.68 114.34 1k25 s LEU 680 Ca 0.58 -0.12 -0.09 0.00 -0.22 0.00 0.00 54.13 54.28 1k25 s LEU 680 Cb -0.12 -0.05 -0.01 0.00 0.50 0.00 0.00 46.19 46.51 1k25 s LEU 680 CO 0.53 -0.29 1.00 0.00 -1.32 0.00 0.00 176.35 176.28 1k25 s ALA 681 N 2.20 3.09 -0.53 5.97 0.00 -1.26 -4.21 121.76 127.02 1k25 s ALA 681 Ca 0.04 -0.37 -0.35 0.00 0.00 0.00 0.00 51.96 51.28 1k25 s ALA 681 Cb -0.14 -2.90 -0.14 0.00 0.00 0.00 0.00 23.12 19.94 1k25 s ALA 681 CO -0.06 -0.86 2.32 -2.30 0.00 0.00 0.00 175.76 174.85 1k25 n PRO 682 N -2.77 0.66 -2.92 0.00 -0.02 -1.26 -1.84 135.00 126.86 1k25 n PRO 682 Ca 0.05 0.14 -0.10 0.00 -2.02 0.00 0.00 63.50 61.58 1k25 n PRO 682 Cb 0.56 -2.23 0.03 0.00 -0.02 0.00 0.00 33.50 31.84 1k25 n PRO 682 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1k25 n ASN 683 N 10.43 -3.64 -4.87 2.55 3.02 0.13 -4.97 115.26 117.91 1k25 n ASN 683 Ca 0.48 -0.23 -0.35 0.00 -0.03 0.00 0.00 54.58 54.46 1k25 n ASN 683 Cb 0.19 -2.37 -0.05 0.00 -0.61 0.00 0.00 39.78 36.93 1k25 n ASN 683 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1k25 s GLN 684 N -5.45 3.76 0.50 3.52 0.74 -0.76 -4.59 119.66 117.37 1k25 s GLN 684 Ca 0.22 0.18 -0.21 0.00 0.05 0.00 0.00 55.36 55.59 1k25 s GLN 684 Cb -0.10 -3.02 -0.07 0.00 1.10 0.00 0.00 33.01 30.93 1k25 s GLN 684 CO 0.30 0.58 1.15 -0.65 -0.55 0.00 0.00 175.29 176.12 1k25 s GLN 685 N -1.83 3.56 -0.35 1.67 -0.21 -1.25 -0.91 119.66 120.33 1k25 s GLN 685 Ca 0.32 1.70 0.02 0.00 0.02 0.00 0.00 55.36 57.42 1k25 s GLN 685 Cb -0.14 -2.21 0.15 0.00 1.00 0.00 0.00 33.01 31.81 1k25 s GLN 685 CO 0.17 -0.70 0.36 0.08 -2.12 0.00 0.00 175.29 173.08 1k25 s VAL 686 N -1.65 -0.34 0.52 1.09 1.01 -0.80 -4.89 120.40 115.33 1k25 s VAL 686 Ca 0.68 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 61.56 1k25 s VAL 686 Cb -0.26 -0.76 -0.07 0.00 0.00 0.00 0.00 36.38 35.29 1k25 s VAL 686 CO 0.31 -0.56 1.07 0.18 0.00 0.00 0.00 175.10 176.10 1k25 n LEU 687 N 4.49 3.65 -3.48 3.92 4.77 -1.26 -1.90 117.00 127.19 1k25 n LEU 687 Ca 0.08 0.94 -0.24 0.00 -0.03 0.00 0.00 56.01 56.76 1k25 n LEU 687 Cb 0.45 -1.42 -0.13 0.00 -2.33 0.00 0.00 43.42 40.00 1k25 n LEU 687 CO 0.07 -1.41 -0.27 -0.76 -1.33 0.00 0.00 177.39 173.69 1k25 s LEU 688 N -1.71 0.22 -0.11 2.23 1.43 0.16 -2.62 118.68 118.28 1k25 s LEU 688 Ca 0.69 -1.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.41 1k25 s LEU 688 Cb -0.47 0.01 -0.03 0.00 0.03 0.00 0.00 46.19 45.72 1k25 s LEU 688 CO 0.52 -0.42 1.43 -0.76 0.23 0.00 0.00 176.35 177.35 1k25 s LEU 689 N 2.19 4.24 0.42 1.79 1.43 -1.19 -0.97 118.68 126.59 1k25 s LEU 689 Ca 0.09 1.93 -0.08 0.00 -1.03 0.00 0.00 54.13 55.04 1k25 s LEU 689 Cb -0.15 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 1k25 s LEU 689 CO -0.35 -0.83 0.76 -0.94 0.23 0.00 0.00 176.35 175.22 1k25 s SER 690 N 2.55 6.44 0.00 2.29 1.04 -0.81 0.67 113.70 125.87 1k25 s SER 690 Ca 0.63 1.04 0.00 0.00 0.48 0.00 0.00 55.95 58.09 1k25 s SER 690 Cb -0.27 -2.29 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1k25 s SER 690 CO 0.21 -0.44 0.42 -0.90 0.98 0.00 0.00 173.24 173.52 1k25 n ASP 691 N -1.56 1.26 -3.15 7.02 5.75 0.22 -4.31 116.55 121.79 1k25 n ASP 691 Ca 0.01 -0.85 0.06 0.00 -0.01 0.00 0.00 54.79 54.00 1k25 n ASP 691 Cb 0.54 -0.21 -0.01 0.00 -1.03 0.00 0.00 41.12 40.41 1k25 n ASP 691 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1k25 s LYS 692 N 0.56 0.09 -0.31 0.11 2.20 -1.26 -4.91 119.74 116.21 1k25 s LYS 692 Ca 0.00 0.13 0.02 0.00 -0.36 0.00 0.00 55.97 55.76 1k25 s LYS 692 Cb 0.00 0.07 0.09 0.00 -1.51 0.00 0.00 37.83 36.48 1k25 s LYS 692 CO 0.00 -0.13 0.05 0.08 -0.36 0.00 0.00 175.35 174.98 1k25 s VAL 693 N 2.98 1.66 -0.16 4.02 1.01 -1.26 -2.92 120.40 125.72 1k25 s VAL 693 Ca 0.10 -1.81 0.17 0.00 0.00 0.00 0.00 61.98 60.43 1k25 s VAL 693 Cb -0.05 -2.17 0.37 0.00 0.00 0.00 0.00 36.38 34.52 1k25 s VAL 693 CO -0.15 -0.53 1.23 -0.62 0.00 0.00 0.00 175.10 175.04 1k25 n GLU 694 N 4.53 1.68 -3.68 2.72 1.02 -1.26 -4.98 120.64 120.68 1k25 n GLU 694 Ca -0.01 -2.78 -0.12 0.00 -0.02 0.00 0.00 57.16 54.23 1k25 n GLU 694 Cb 0.42 -1.61 -0.09 0.00 -0.02 0.00 0.00 31.44 30.15 1k25 n GLU 694 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1k25 s GLU 695 N -2.95 0.62 0.15 3.49 2.02 -1.26 -3.89 118.70 116.88 1k25 s GLU 695 Ca 0.36 0.85 -0.33 0.00 0.02 0.00 0.00 54.97 55.87 1k25 s GLU 695 Cb 0.31 0.23 -0.13 0.00 0.10 0.00 0.00 34.13 34.65 1k25 s GLU 695 CO 0.03 -0.10 1.67 1.51 0.02 0.00 0.00 175.26 178.38 1k25 n ILE 696 N 3.27 0.10 -1.47 -1.63 3.06 -0.41 -4.82 119.36 117.46 1k25 n ILE 696 Ca -0.16 -0.02 -0.29 0.00 -2.50 0.00 0.00 62.75 59.78 1k25 n ILE 696 Cb 0.56 -1.75 0.16 0.00 0.54 0.00 0.00 39.64 39.16 1k25 n ILE 696 CO 0.00 0.00 0.00 -2.84 -2.50 0.00 0.00 176.55 171.21 1k25 s PRO 697 N 1.47 0.59 -0.28 9.51 0.02 -1.26 -1.54 135.00 143.51 1k25 s PRO 697 Ca 0.79 0.17 -0.20 0.00 0.02 0.00 0.00 61.00 61.78 1k25 s PRO 697 Cb -0.61 -1.79 -0.01 0.00 0.02 0.00 0.00 34.50 32.11 1k25 s PRO 697 CO 0.38 -2.54 0.64 0.34 -0.33 0.00 0.00 177.00 175.48 1k25 s ASP 698 N -4.05 6.54 0.00 2.53 -1.08 -1.26 -4.54 116.67 114.81 1k25 s ASP 698 Ca 0.66 0.55 0.15 0.00 -0.52 0.00 0.00 52.55 53.39 1k25 s ASP 698 Cb -0.13 -2.34 0.09 0.00 -1.46 0.00 0.00 42.92 39.08 1k25 s ASP 698 CO 0.54 -0.44 0.92 0.23 0.52 0.00 0.00 175.17 176.94 1k25 n MET 699 N 5.82 1.25 -1.68 4.34 2.81 -1.26 -4.89 117.12 123.51 1k25 n MET 699 Ca -0.01 -1.22 -0.46 0.00 -1.81 0.00 0.00 57.70 54.20 1k25 n MET 699 Cb 0.49 -1.26 -0.04 0.00 -0.71 0.00 0.00 33.22 31.69 1k25 n MET 699 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 1k25 n TYR 700 N 0.58 2.39 0.00 2.03 4.19 -1.26 -1.23 117.16 123.86 1k25 n TYR 700 Ca 0.08 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.29 1k25 n TYR 700 Cb 0.35 -2.66 0.00 0.00 0.49 0.00 0.00 39.34 37.52 1k25 n TYR 700 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1k25 n GLY 701 N 4.12 2.81 3.70 2.98 0.00 0.15 -3.95 105.19 115.00 1k25 n GLY 701 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1k25 n GLY 701 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1k25 s TRP 702 N -2.56 2.36 0.50 1.61 0.52 -0.37 -4.57 118.94 116.43 1k25 s TRP 702 Ca 0.00 0.13 -0.23 0.00 0.02 0.00 0.00 56.10 56.02 1k25 s TRP 702 Cb 0.00 -4.12 -0.06 0.00 -1.15 0.00 0.00 33.47 28.13 1k25 s TRP 702 CO 0.00 -4.53 1.36 -1.59 0.02 0.00 0.00 176.95 172.21 1k25 s LYS 703 N 2.39 3.43 0.31 4.98 -2.85 -1.26 0.33 119.74 127.06 1k25 s LYS 703 Ca 0.78 2.26 0.02 0.00 -1.00 0.00 0.00 55.97 58.03 1k25 s LYS 703 Cb -0.45 -2.44 0.76 0.00 -2.06 0.00 0.00 37.83 33.64 1k25 s LYS 703 CO 0.35 -0.97 1.56 1.17 0.10 0.00 0.00 175.35 177.56 1k25 n LYS 704 N -0.62 -0.08 0.01 1.78 4.81 0.12 -0.77 118.16 123.41 1k25 n LYS 704 Ca 0.08 1.49 -0.13 0.00 -0.87 0.00 0.00 58.31 58.88 1k25 n LYS 704 Cb 0.44 -2.37 -0.09 0.00 0.02 0.00 0.00 35.03 33.03 1k25 n LYS 704 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 1k25 h GLU 705 N 0.00 -0.04 -1.09 1.64 9.09 -1.89 -3.02 114.58 119.27 1k25 h GLU 705 Ca 0.60 0.00 0.32 0.00 0.05 0.00 0.00 59.36 60.33 1k25 h GLU 705 Cb 1.24 0.01 -0.12 0.00 -1.65 0.00 0.00 28.75 28.23 1k25 h GLU 705 CO -0.94 0.34 0.68 1.15 0.05 0.00 0.00 179.01 180.29 1k25 h THR 706 N -0.42 0.38 -0.26 -1.06 2.02 -1.30 0.18 112.91 112.45 1k25 h THR 706 Ca -0.00 -0.11 -0.09 0.00 0.77 0.00 0.00 66.41 66.97 1k25 h THR 706 Cb 0.39 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 1k25 h THR 706 CO 0.01 0.06 -0.19 0.00 0.37 0.00 0.00 175.52 175.77 1k25 h ALA 707 N 1.68 0.38 -0.94 6.16 0.00 -1.34 -3.10 119.26 122.10 1k25 h ALA 707 Ca 0.69 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1k25 h ALA 707 Cb 1.77 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1k25 h ALA 707 CO -0.42 0.31 0.59 0.93 0.00 0.00 0.00 179.25 180.65 1k25 h GLU 708 N 0.32 1.26 -0.52 0.00 5.08 -0.55 -0.63 114.58 119.54 1k25 h GLU 708 Ca 0.05 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1k25 h GLU 708 Cb 0.73 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1k25 h GLU 708 CO 0.05 0.87 0.27 1.15 -1.00 0.00 0.00 179.01 180.34 1k25 h THR 709 N 1.29 1.17 -0.29 1.13 2.02 -1.34 0.26 112.91 117.15 1k25 h THR 709 Ca 0.34 -0.45 -0.19 0.00 0.77 0.00 0.00 66.41 66.88 1k25 h THR 709 Cb -0.09 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1k25 h THR 709 CO -0.07 0.19 -0.55 0.15 0.37 0.00 0.00 175.52 175.61 1k25 h PHE 710 N 0.73 1.10 -0.49 3.16 3.57 -1.34 -2.33 116.94 121.34 1k25 h PHE 710 Ca 0.18 -0.40 -0.04 0.00 3.53 0.00 0.00 57.97 61.25 1k25 h PHE 710 Cb 0.05 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 1k25 h PHE 710 CO 0.00 1.23 0.14 0.00 -2.23 0.00 0.00 178.31 177.45 1k25 h ALA 711 N 0.69 1.31 0.36 2.41 0.00 0.44 -2.97 119.26 121.51 1k25 h ALA 711 Ca 0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1k25 h ALA 711 Cb 1.16 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1k25 h ALA 711 CO 0.12 0.49 -0.17 -0.22 0.00 0.00 0.00 179.25 179.47 1k25 h LYS 712 N 0.72 -0.47 -0.89 0.00 3.64 -0.49 -0.32 116.57 118.75 1k25 h LYS 712 Ca 0.16 0.03 0.26 0.00 -1.27 0.00 0.00 60.65 59.83 1k25 h LYS 712 Cb 0.24 0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 1k25 h LYS 712 CO -0.01 -0.15 0.64 -1.49 -2.27 0.00 0.00 179.45 176.18 1k25 h TRP 713 N -0.90 0.02 -0.12 1.91 6.55 -1.36 -2.17 115.95 119.88 1k25 h TRP 713 Ca -0.05 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.79 1k25 h TRP 713 Cb 0.54 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 28.83 1k25 h TRP 713 CO 0.03 0.00 0.00 1.28 -1.05 0.00 0.00 178.44 178.70 1k25 n LEU 714 N -4.28 2.10 -3.15 -4.49 4.77 -1.13 -5.02 117.00 105.80 1k25 n LEU 714 Ca 0.18 -1.54 -0.15 0.00 -0.03 0.00 0.00 56.01 54.48 1k25 n LEU 714 Cb 0.95 -0.08 0.08 0.00 -2.33 0.00 0.00 43.42 42.04 1k25 n LEU 714 CO 0.39 0.49 0.08 -0.67 -1.33 0.00 0.00 177.39 176.35 1k25 n ASP 715 N 0.24 -2.90 -4.53 -1.43 2.03 -0.82 -5.04 116.55 104.11 1k25 n ASP 715 Ca 0.06 -0.57 -0.33 0.00 0.52 0.00 0.00 54.79 54.47 1k25 n ASP 715 Cb 0.27 -4.65 -0.12 0.00 -0.72 0.00 0.00 41.12 35.89 1k25 n ASP 715 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1k25 s ILE 716 N -3.33 3.35 -0.56 5.18 -0.00 -0.16 -4.98 121.20 120.69 1k25 s ILE 716 Ca 0.09 -0.66 -0.28 0.00 -0.00 0.00 0.00 60.65 59.79 1k25 s ILE 716 Cb -0.01 -2.35 0.02 0.00 -0.00 0.00 0.00 42.46 40.12 1k25 s ILE 716 CO 0.65 0.56 1.29 -0.70 -0.00 0.00 0.00 174.94 176.74 1k25 s GLU 717 N -0.86 3.44 0.53 0.37 2.12 0.26 -4.61 118.70 119.94 1k25 s GLU 717 Ca 0.13 0.37 -0.07 0.00 0.36 0.00 0.00 54.97 55.76 1k25 s GLU 717 Cb -0.11 -4.05 -0.03 0.00 0.26 0.00 0.00 34.13 30.19 1k25 s GLU 717 CO 0.02 -1.77 0.86 -0.51 -0.54 0.00 0.00 175.26 173.32 1k25 s LEU 718 N 5.39 3.48 -0.25 2.70 1.43 -1.26 -2.53 118.68 127.64 1k25 s LEU 718 Ca 0.48 1.04 -0.09 0.00 -1.03 0.00 0.00 54.13 54.53 1k25 s LEU 718 Cb -0.09 -4.01 0.10 0.00 0.03 0.00 0.00 46.19 42.22 1k25 s LEU 718 CO 0.26 -0.71 0.54 -0.70 0.23 0.00 0.00 176.35 175.98 1k25 s GLU 719 N -4.89 0.48 -0.19 1.70 2.12 -1.21 -4.95 118.70 111.76 1k25 s GLU 719 Ca 0.50 1.22 -0.13 0.00 0.36 0.00 0.00 54.97 56.92 1k25 s GLU 719 Cb -0.10 0.53 -0.05 0.00 0.26 0.00 0.00 34.13 34.77 1k25 s GLU 719 CO 0.47 -0.21 0.28 -0.06 -0.54 0.00 0.00 175.26 175.21 1k25 s PHE 720 N 2.56 3.41 -0.05 5.30 0.08 -1.26 -1.97 117.98 126.05 1k25 s PHE 720 Ca -0.05 0.52 0.05 0.00 0.12 0.00 0.00 56.93 57.57 1k25 s PHE 720 Cb -0.11 -2.36 -0.02 0.00 -0.57 0.00 0.00 43.02 39.96 1k25 s PHE 720 CO -0.16 0.16 -0.19 -1.83 -0.10 0.00 0.00 175.22 173.09 1k25 s GLU 721 N 0.75 2.46 0.78 0.44 -1.05 -1.10 -4.97 118.70 116.01 1k25 s GLU 721 Ca 0.15 -0.79 0.00 0.00 -0.15 0.00 0.00 54.97 54.18 1k25 s GLU 721 Cb -0.13 -2.27 0.00 0.00 -0.44 0.00 0.00 34.13 31.29 1k25 s GLU 721 CO 0.04 0.55 0.00 0.41 0.95 0.00 0.00 175.26 177.21 1k25 n GLY 722 N 2.51 -1.76 3.18 -3.83 0.00 -1.26 -1.35 105.19 102.68 1k25 n GLY 722 Ca -0.17 -1.72 -0.11 0.00 0.00 0.00 0.00 46.02 44.02 1k25 n GLY 722 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k25 s SER 723 N -4.00 -0.23 0.00 1.61 1.04 -1.25 -4.77 113.70 106.10 1k25 s SER 723 Ca 0.00 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.23 1k25 s SER 723 Cb 0.00 0.87 0.00 0.00 0.10 0.00 0.00 66.02 66.99 1k25 s SER 723 CO 0.00 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1k25 n GLY 724 N 4.80 0.92 0.00 7.32 0.00 -1.26 -3.93 105.19 113.04 1k25 n GLY 724 Ca -0.16 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1k25 n GLY 724 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k25 n SER 725 N 0.00 0.12 -4.15 1.61 3.41 -1.08 -4.83 113.62 108.71 1k25 n SER 725 Ca 0.00 -0.60 -0.15 0.00 -0.26 0.00 0.00 58.87 57.86 1k25 n SER 725 Cb 0.00 0.10 -0.11 0.00 -0.26 0.00 0.00 64.21 63.94 1k25 n SER 725 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1k25 s VAL 726 N -0.10 0.86 -0.15 -3.33 -7.23 -1.25 0.14 120.40 109.35 1k25 s VAL 726 Ca 0.00 -1.44 -0.27 0.00 -1.81 0.00 0.00 61.98 58.47 1k25 s VAL 726 Cb 0.00 -1.12 -0.01 0.00 0.56 0.00 0.00 36.38 35.81 1k25 s VAL 726 CO 0.00 -0.45 0.89 -0.69 -0.31 0.00 0.00 175.10 174.54 1k25 s VAL 727 N -1.96 4.85 -0.27 1.32 1.01 0.15 -1.18 120.40 124.31 1k25 s VAL 727 Ca 0.00 1.77 0.02 0.00 0.00 0.00 0.00 61.98 63.78 1k25 s VAL 727 Cb -0.06 -4.20 0.03 0.00 0.00 0.00 0.00 36.38 32.15 1k25 s VAL 727 CO 0.00 0.02 0.68 0.00 0.00 0.00 0.00 175.10 175.81 1k25 n GLN 728 N 5.14 0.16 -3.54 2.72 6.02 0.31 0.34 117.38 128.53 1k25 n GLN 728 Ca 0.06 -0.86 -0.01 0.00 -0.01 0.00 0.00 57.00 56.18 1k25 n GLN 728 Cb 0.49 -1.05 -0.05 0.00 1.02 0.00 0.00 30.24 30.65 1k25 n GLN 728 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1k25 s LYS 729 N -0.38 0.42 0.06 -1.09 2.20 -0.77 -4.94 119.74 115.24 1k25 s LYS 729 Ca 0.03 0.91 0.09 0.00 -0.36 0.00 0.00 55.97 56.64 1k25 s LYS 729 Cb 0.02 0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 36.71 1k25 s LYS 729 CO 0.03 -0.12 -0.23 1.14 -0.36 0.00 0.00 175.35 175.81 1k25 s GLN 730 N 2.15 1.83 0.20 4.03 -2.07 -1.26 0.13 119.66 124.66 1k25 s GLN 730 Ca -0.06 -1.11 0.22 0.00 -1.82 0.00 0.00 55.36 52.60 1k25 s GLN 730 Cb -0.06 -2.04 -0.01 0.00 -1.09 0.00 0.00 33.01 29.80 1k25 s GLN 730 CO -0.17 0.51 1.03 -0.40 -1.32 0.00 0.00 175.29 174.94 1k25 n ASP 731 N 1.50 0.83 -4.32 12.60 5.68 -1.08 -4.58 116.55 127.19 1k25 n ASP 731 Ca -0.17 0.32 -0.42 0.00 -0.50 0.00 0.00 54.79 54.03 1k25 n ASP 731 Cb 0.52 0.48 -0.09 0.00 -1.14 0.00 0.00 41.12 40.89 1k25 n ASP 731 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1k25 s VAL 732 N -3.37 4.60 0.64 2.12 1.01 -1.26 -5.01 120.40 119.13 1k25 s VAL 732 Ca -0.01 -1.21 -0.15 0.00 0.00 0.00 0.00 61.98 60.61 1k25 s VAL 732 Cb 0.10 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 1k25 s VAL 732 CO 0.79 -0.48 1.10 0.00 0.00 0.00 0.00 175.10 176.51 1k25 s ARG 733 N 1.51 2.94 0.23 2.72 1.70 -1.26 -4.94 118.95 121.85 1k25 s ARG 733 Ca 0.03 1.35 -0.27 0.00 -0.47 0.00 0.00 55.73 56.37 1k25 s ARG 733 Cb -0.23 -1.97 -0.16 0.00 -0.57 0.00 0.00 34.95 32.02 1k25 s ARG 733 CO 0.04 -1.13 0.56 2.41 -1.08 0.00 0.00 175.30 176.10 1k25 n THR 734 N -2.30 1.91 -2.18 4.99 -1.04 -1.26 -2.52 114.28 111.89 1k25 n THR 734 Ca 0.10 -0.50 -0.17 0.00 -2.04 0.00 0.00 64.05 61.44 1k25 n THR 734 Cb 0.52 -0.15 -0.02 0.00 -1.82 0.00 0.00 70.33 68.87 1k25 n THR 734 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1k25 n ASN 735 N 1.90 -4.96 -4.91 8.00 3.02 -0.59 -4.96 115.26 112.75 1k25 n ASN 735 Ca 0.16 0.06 -0.27 0.00 -0.03 0.00 0.00 54.58 54.50 1k25 n ASN 735 Cb 0.27 -4.04 -0.01 0.00 -0.61 0.00 0.00 39.78 35.39 1k25 n ASN 735 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1k25 s THR 736 N -2.80 4.94 -0.69 3.41 2.01 -1.05 -4.76 115.64 116.70 1k25 s THR 736 Ca 0.00 0.13 -0.26 0.00 0.31 0.00 0.00 61.69 61.87 1k25 s THR 736 Cb 0.00 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 1k25 s THR 736 CO 0.00 -0.72 1.92 0.00 -0.69 0.00 0.00 174.62 175.14 1k25 s ALA 737 N -2.57 1.97 0.64 7.40 0.00 -1.26 -1.29 121.76 126.65 1k25 s ALA 737 Ca 0.46 -0.85 0.30 0.00 0.00 0.00 0.00 51.96 51.87 1k25 s ALA 737 Cb -0.10 -4.38 1.61 0.00 0.00 0.00 0.00 23.12 20.24 1k25 s ALA 737 CO 0.40 -4.22 1.94 0.97 0.00 0.00 0.00 175.76 174.85 1k25 h ILE 738 N 7.05 0.15 -0.78 0.00 2.10 -1.89 -3.27 117.51 120.87 1k25 h ILE 738 Ca -0.16 0.00 0.07 0.00 1.08 0.00 0.00 64.86 65.85 1k25 h ILE 738 Cb 1.12 0.68 -0.09 0.00 -1.09 0.00 0.00 36.82 37.44 1k25 h ILE 738 CO 1.21 0.00 -0.46 1.17 -1.08 0.00 0.00 178.15 178.99 1k25 n LYS 739 N -3.22 -0.34 -2.00 2.19 4.81 -1.26 -3.03 118.16 115.31 1k25 n LYS 739 Ca 0.01 1.23 -0.27 0.00 -0.87 0.00 0.00 58.31 58.42 1k25 n LYS 739 Cb 0.45 -1.82 0.03 0.00 0.02 0.00 0.00 35.03 33.71 1k25 n LYS 739 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1k25 n ASN 740 N -4.89 5.45 -4.72 3.14 3.02 -1.23 -5.00 115.26 111.02 1k25 n ASN 740 Ca 0.02 -3.75 -0.35 0.00 -0.03 0.00 0.00 54.58 50.46 1k25 n ASN 740 Cb 0.20 -0.50 -0.09 0.00 -0.61 0.00 0.00 39.78 38.79 1k25 n ASN 740 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1k25 s ILE 741 N -4.84 4.53 -0.02 2.41 1.09 -1.17 -5.00 121.20 118.19 1k25 s ILE 741 Ca 0.53 -0.22 0.04 0.00 -1.10 0.00 0.00 60.65 59.90 1k25 s ILE 741 Cb 0.43 -2.94 -0.06 0.00 -1.06 0.00 0.00 42.46 38.83 1k25 s ILE 741 CO -0.04 0.57 0.05 0.29 -0.10 0.00 0.00 174.94 175.71 1k25 n LYS 742 N 1.97 1.88 -3.48 2.79 4.76 -1.26 -4.92 118.16 119.90 1k25 n LYS 742 Ca -0.18 -0.02 -0.13 0.00 -2.87 0.00 0.00 58.31 55.11 1k25 n LYS 742 Cb 0.54 -1.10 -0.11 0.00 -1.84 0.00 0.00 35.03 32.52 1k25 n LYS 742 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1k25 s LYS 743 N -2.19 0.25 -0.24 1.97 2.20 -1.26 0.90 119.74 121.38 1k25 s LYS 743 Ca -0.02 0.48 -0.09 0.00 -0.36 0.00 0.00 55.97 55.98 1k25 s LYS 743 Cb 0.02 -0.63 -0.04 0.00 -1.51 0.00 0.00 37.83 35.67 1k25 s LYS 743 CO 0.17 -0.56 0.12 0.42 -0.36 0.00 0.00 175.35 175.13 1k25 s ILE 744 N 2.44 4.90 -0.16 5.43 1.01 -1.05 -4.94 121.20 128.83 1k25 s ILE 744 Ca 0.08 0.02 -0.18 0.00 0.00 0.00 0.00 60.65 60.57 1k25 s ILE 744 Cb -0.15 -3.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 1k25 s ILE 744 CO -0.13 0.35 0.48 -1.59 0.00 0.00 0.00 174.94 174.05 1k25 s LYS 745 N 1.22 4.26 -0.34 2.79 0.00 -1.26 -3.35 119.74 123.06 1k25 s LYS 745 Ca 0.06 0.40 -0.05 0.00 0.00 0.00 0.00 55.97 56.38 1k25 s LYS 745 Cb -0.14 -3.50 0.05 0.00 0.00 0.00 0.00 37.83 34.24 1k25 s LYS 745 CO 0.05 0.02 0.10 -0.51 0.00 0.00 0.00 175.35 175.00 1k25 s LEU 746 N 1.10 4.37 -0.15 2.77 1.43 -0.83 -2.63 118.68 124.74 1k25 s LEU 746 Ca 0.24 -1.31 -0.29 0.00 -1.03 0.00 0.00 54.13 51.73 1k25 s LEU 746 Cb -0.15 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 1k25 s LEU 746 CO 0.10 -0.35 1.51 -0.89 0.23 0.00 0.00 176.35 176.94 1k25 s THR 747 N 1.33 3.85 0.44 5.49 2.01 0.34 -2.72 115.64 126.38 1k25 s THR 747 Ca -0.01 1.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.97 1k25 s THR 747 Cb -0.20 -3.73 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 1k25 s THR 747 CO 0.01 -0.18 0.70 -0.76 -0.69 0.00 0.00 174.62 173.70 1k25 s LEU 748 N 4.24 3.72 -0.28 4.42 1.43 -0.46 -0.53 118.68 131.23 1k25 s LEU 748 Ca 0.66 0.61 -0.20 0.00 -1.03 0.00 0.00 54.13 54.18 1k25 s LEU 748 Cb -0.26 -3.51 0.08 0.00 0.03 0.00 0.00 46.19 42.53 1k25 s LEU 748 CO 0.25 -0.56 0.73 -0.83 0.23 0.00 0.00 176.35 176.16 1k25 s GLY 749 N -4.13 -0.56 0.00 -3.19 0.00 -0.33 -3.87 107.32 95.25 1k25 s GLY 749 Ca 0.46 2.30 0.00 0.00 0.00 0.00 0.00 44.72 47.48 1k25 s GLY 749 CO 0.41 2.12 0.00 1.22 0.00 0.00 0.00 173.10 176.85