#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jd4 s ALA 2687N -1.45 1.81 -0.23 0.00 0.00 -0.69 -5.01 121.76 116.19 2jd4 s ALA 2687Ca 0.67 0.42 0.00 0.00 0.00 0.00 0.00 51.96 53.05 2jd4 s ALA 2687Cb -0.33 -3.36 0.06 0.00 0.00 0.00 0.00 23.12 19.49 2jd4 s ALA 2687CO 0.40 -2.32 -0.03 0.08 0.00 0.00 0.00 175.76 173.90 2jd4 s VAL 2688N -2.77 1.33 0.15 0.00 1.01 -1.26 -4.88 120.40 113.97 2jd4 s VAL 2688Ca 0.64 -1.12 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 2jd4 s VAL 2688Cb -0.20 -1.66 -0.06 0.00 0.00 0.00 0.00 36.38 34.46 2jd4 s VAL 2688CO 0.57 -0.15 0.39 -1.81 0.00 0.00 0.00 175.10 174.09 2jd4 s ASP 2689N 1.48 6.50 0.17 3.32 1.01 -1.26 -5.07 116.67 122.83 2jd4 s ASP 2689Ca -0.04 0.61 -0.30 0.00 0.71 0.00 0.00 52.55 53.53 2jd4 s ASP 2689Cb -0.18 -2.10 -0.07 0.00 1.01 0.00 0.00 42.92 41.57 2jd4 s ASP 2689CO -0.07 0.04 1.02 0.42 0.21 0.00 0.00 175.17 176.79 2jd4 s THR 2690N -1.67 4.10 0.17 -1.27 -4.23 -1.26 -4.96 115.64 106.51 2jd4 s THR 2690Ca 0.41 1.86 -0.34 0.00 -1.18 0.00 0.00 61.69 62.44 2jd4 s THR 2690Cb -0.12 -4.18 -0.15 0.00 1.34 0.00 0.00 72.50 69.39 2jd4 s THR 2690CO 0.24 0.34 1.37 0.00 -0.54 0.00 0.00 174.62 176.04 2jd4 n ALA 2691N 2.26 0.19 -1.74 3.99 0.00 -1.26 -4.92 120.51 119.03 2jd4 n ALA 2691Ca 0.01 0.46 -0.37 0.00 0.00 0.00 0.00 53.44 53.54 2jd4 n ALA 2691Cb 0.47 -2.18 0.05 0.00 0.00 0.00 0.00 19.45 17.79 2jd4 n ALA 2691CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2jd4 s PRO 2692N 0.15 2.80 0.23 0.00 0.02 -1.26 -5.04 135.00 131.89 2jd4 s PRO 2692Ca 0.76 2.05 0.07 0.00 0.02 0.00 0.00 61.00 63.90 2jd4 s PRO 2692Cb -0.78 -1.97 -0.04 0.00 0.02 0.00 0.00 34.50 31.73 2jd4 s PRO 2692CO 0.47 -1.40 0.16 0.20 -0.33 0.00 0.00 177.00 176.09 2jd4 s GLY 2693N -1.33 1.50 0.08 0.52 0.00 -1.26 -5.02 107.32 101.81 2jd4 s GLY 2693Ca 0.79 -1.39 0.09 0.00 0.00 0.00 0.00 44.72 44.21 2jd4 s GLY 2693CO 0.40 -1.42 -0.23 -0.19 0.00 0.00 0.00 173.10 171.66 2jd4 s TYR 2694N -2.05 2.43 -0.42 1.90 1.51 -1.26 -0.37 117.35 119.09 2jd4 s TYR 2694Ca 0.32 -0.33 -0.28 0.00 -1.01 0.00 0.00 57.07 55.77 2jd4 s TYR 2694Cb -0.08 -1.37 -0.00 0.00 -0.11 0.00 0.00 41.96 40.39 2jd4 s TYR 2694CO 0.24 0.26 1.57 0.08 -1.11 0.00 0.00 175.55 176.59 2jd4 s VAL 2695N -0.96 3.71 0.22 0.71 1.01 -0.62 -4.72 120.40 119.75 2jd4 s VAL 2695Ca 0.14 0.70 -0.32 0.00 0.00 0.00 0.00 61.98 62.50 2jd4 s VAL 2695Cb -0.10 -4.03 -0.13 0.00 0.00 0.00 0.00 36.38 32.12 2jd4 s VAL 2695CO 0.05 -0.71 1.63 0.00 0.00 0.00 0.00 175.10 176.07 2jd4 n ALA 2696N 9.65 2.25 0.00 5.51 0.00 -1.26 -2.50 120.51 134.15 2jd4 n ALA 2696Ca 0.18 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.03 2jd4 n ALA 2696Cb 0.48 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.49 2jd4 n ALA 2696CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jd4 n GLY 2697N 3.25 2.90 3.90 0.00 0.00 -1.26 -5.04 105.19 108.94 2jd4 n GLY 2697Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2jd4 n GLY 2697CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jd4 s ALA 2698N -1.82 3.30 -0.02 4.61 0.00 -1.04 -4.88 121.76 121.91 2jd4 s ALA 2698Ca 0.00 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 51.61 2jd4 s ALA 2698Cb 0.00 -2.74 -0.01 0.00 0.00 0.00 0.00 23.12 20.37 2jd4 s ALA 2698CO 0.00 -0.49 -0.16 -1.01 0.00 0.00 0.00 175.76 174.10 2jd4 s HIS 2699N -2.90 1.49 -0.24 0.00 0.09 -0.78 -4.43 115.29 108.52 2jd4 s HIS 2699Ca 0.50 -0.35 -0.10 0.00 -0.00 0.00 0.00 55.06 55.12 2jd4 s HIS 2699Cb -0.11 -0.99 -0.05 0.00 -0.00 0.00 0.00 32.58 31.44 2jd4 s HIS 2699CO 0.48 -0.08 0.14 -1.14 -0.00 0.00 0.00 174.74 174.14 2jd4 s GLN 2700N -0.17 4.00 0.51 1.40 2.00 0.37 -0.75 119.66 127.03 2jd4 s GLN 2700Ca 0.02 -0.31 0.06 0.00 -2.00 0.00 0.00 55.36 53.13 2jd4 s GLN 2700Cb -0.08 -3.49 0.02 0.00 0.80 0.00 0.00 33.01 30.25 2jd4 s GLN 2700CO 0.00 0.03 0.37 -0.06 -0.50 0.00 0.00 175.29 175.14 2jd4 s PHE 2701N 1.12 1.91 0.00 1.67 0.40 0.35 -2.72 117.98 120.71 2jd4 s PHE 2701Ca 0.07 -0.76 0.00 0.00 -0.60 0.00 0.00 56.93 55.64 2jd4 s PHE 2701Cb -0.14 -1.96 0.00 0.00 0.51 0.00 0.00 43.02 41.43 2jd4 s PHE 2701CO 0.05 -0.34 0.00 0.41 0.70 0.00 0.00 175.22 176.04 2jd4 n GLY 2702N -1.67 0.75 0.20 4.36 0.00 -1.19 -3.19 105.19 104.45 2jd4 n GLY 2702Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.06 2jd4 n GLY 2702CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jd4 h LEU 2703N 0.00 0.00 -8.43 0.99 3.38 -1.76 -3.44 115.31 106.05 2jd4 h LEU 2703Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 2jd4 h LEU 2703Cb 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.60 2jd4 h LEU 2703CO 0.00 0.30 -0.66 -0.94 0.09 0.00 0.00 178.44 177.23 2jd4 s SER 2704N -6.75 0.61 0.61 -0.43 1.04 -1.26 -4.44 113.70 103.07 2jd4 s SER 2704Ca -0.03 -1.13 0.36 0.00 0.48 0.00 0.00 55.95 55.63 2jd4 s SER 2704Cb 0.14 0.22 1.97 0.00 0.10 0.00 0.00 66.02 68.44 2jd4 s SER 2704CO 0.69 -0.64 2.25 1.56 0.98 0.00 0.00 173.24 178.08 2jd4 h GLN 2705N 2.91 0.00 -0.34 4.02 1.08 -1.85 -2.85 115.11 118.09 2jd4 h GLN 2705Ca -0.35 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 56.64 2jd4 h GLN 2705Cb 1.18 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 28.48 2jd4 h GLN 2705CO 0.62 0.02 -0.25 0.09 -0.95 0.00 0.00 178.83 178.37 2jd4 n ASN 2706N -3.45 2.78 -4.71 1.46 4.13 -1.26 -1.64 115.26 112.57 2jd4 n ASN 2706Ca -0.03 -3.82 -0.42 0.00 1.68 0.00 0.00 54.58 51.99 2jd4 n ASN 2706Cb 0.12 -0.59 -0.03 0.00 -1.54 0.00 0.00 39.78 37.74 2jd4 n ASN 2706CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2jd4 s SER 2707N -2.83 6.69 0.13 6.41 0.01 -1.08 -4.65 113.70 118.39 2jd4 s SER 2707Ca 0.45 2.44 -0.25 0.00 1.31 0.00 0.00 55.95 59.90 2jd4 s SER 2707Cb 0.40 -2.58 0.07 0.00 0.21 0.00 0.00 66.02 64.12 2jd4 s SER 2707CO -0.02 -0.78 0.93 -1.38 0.41 0.00 0.00 173.24 172.40 2jd4 s HIS 2708N 1.63 -0.18 -0.01 2.43 -3.43 -0.84 -3.17 115.29 111.72 2jd4 s HIS 2708Ca 0.69 -0.10 0.01 0.00 -0.80 0.00 0.00 55.06 54.86 2jd4 s HIS 2708Cb -0.39 0.62 0.00 0.00 -1.43 0.00 0.00 32.58 31.38 2jd4 s HIS 2708CO 0.31 -0.80 -0.04 -0.51 -2.00 0.00 0.00 174.74 171.69 2jd4 s LEU 2709N -2.86 1.90 -0.24 5.38 1.43 -0.95 -2.05 118.68 121.29 2jd4 s LEU 2709Ca 0.11 -0.08 -0.05 0.00 -1.03 0.00 0.00 54.13 53.08 2jd4 s LEU 2709Cb -0.02 -0.25 -0.01 0.00 0.03 0.00 0.00 46.19 45.95 2jd4 s LEU 2709CO 0.00 0.04 -0.01 -0.69 0.23 0.00 0.00 176.35 175.91 2jd4 s VAL 2710N 0.05 3.53 -0.14 -1.59 1.01 -0.29 -0.79 120.40 122.19 2jd4 s VAL 2710Ca -0.00 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2jd4 s VAL 2710Cb -0.04 -2.66 0.01 0.00 0.00 0.00 0.00 36.38 33.70 2jd4 s VAL 2710CO -0.00 0.35 -0.21 -0.76 0.00 0.00 0.00 175.10 174.48 2jd4 s LEU 2711N 1.49 2.05 0.53 3.92 1.43 0.02 -0.82 118.68 127.30 2jd4 s LEU 2711Ca 0.05 -0.58 -0.21 0.00 -1.03 0.00 0.00 54.13 52.36 2jd4 s LEU 2711Cb -0.15 -1.40 -0.06 0.00 0.03 0.00 0.00 46.19 44.62 2jd4 s LEU 2711CO -0.02 0.07 1.19 -2.84 0.23 0.00 0.00 176.35 174.98 2jd4 s PRO 2712N 0.87 3.36 -0.85 1.29 0.02 -1.26 -0.20 135.00 138.22 2jd4 s PRO 2712Ca -0.06 1.79 0.01 0.00 0.02 0.00 0.00 61.00 62.75 2jd4 s PRO 2712Cb -0.15 -2.14 0.27 0.00 0.02 0.00 0.00 34.50 32.50 2jd4 s PRO 2712CO -0.02 -0.89 1.04 1.28 -0.33 0.00 0.00 177.00 178.08 2jd4 n LEU 2713N -1.09 4.88 -0.20 -5.54 4.77 -0.05 -4.85 117.00 114.93 2jd4 n LEU 2713Ca 0.11 -5.31 0.00 0.00 -0.03 0.00 0.00 56.01 50.78 2jd4 n LEU 2713Cb 0.49 -0.97 0.11 0.00 -2.33 0.00 0.00 43.42 40.72 2jd4 n LEU 2713CO 0.46 1.84 0.98 1.56 -1.33 0.00 0.00 177.39 180.90 2jd4 h GLN 2714N 4.93 0.39 -0.99 3.23 4.20 -1.94 -3.24 115.11 121.69 2jd4 h GLN 2714Ca 0.19 -0.02 -0.60 0.00 0.06 0.00 0.00 58.65 58.28 2jd4 h GLN 2714Cb 0.66 -0.09 -0.39 0.00 0.30 0.00 0.00 27.48 27.97 2jd4 h GLN 2714CO 1.04 0.26 -0.33 1.04 -0.67 0.00 0.00 178.83 180.16 2jd4 n GLN 2715N -5.00 3.34 -4.76 1.46 6.02 -1.26 -5.03 117.38 112.14 2jd4 n GLN 2715Ca 0.09 -4.00 -0.24 0.00 -0.01 0.00 0.00 57.00 52.84 2jd4 n GLN 2715Cb 0.28 -2.28 -0.15 0.00 1.02 0.00 0.00 30.24 29.11 2jd4 n GLN 2715CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2jd4 s SER 2716N -3.07 1.91 -0.30 1.08 0.01 -1.23 -5.00 113.70 107.11 2jd4 s SER 2716Ca 0.54 -0.30 0.01 0.00 1.31 0.00 0.00 55.95 57.51 2jd4 s SER 2716Cb 0.43 -0.26 0.07 0.00 0.21 0.00 0.00 66.02 66.47 2jd4 s SER 2716CO -0.03 0.19 -0.02 -0.62 0.41 0.00 0.00 173.24 173.16 2jd4 s ASP 2717N -0.32 4.71 0.00 2.44 2.15 -1.26 -4.98 116.67 119.41 2jd4 s ASP 2717Ca 0.05 -1.53 0.13 0.00 0.43 0.00 0.00 52.55 51.64 2jd4 s ASP 2717Cb -0.07 -1.64 0.29 0.00 -0.30 0.00 0.00 42.92 41.21 2jd4 s ASP 2717CO -0.00 -0.27 1.20 1.33 -0.17 0.00 0.00 175.17 177.25 2jd4 n VAL 2718N 4.48 0.68 -0.29 1.11 0.24 -1.26 -4.59 118.33 118.70 2jd4 n VAL 2718Ca -0.10 -0.84 0.07 0.00 -2.04 0.00 0.00 64.34 61.44 2jd4 n VAL 2718Cb 0.42 0.76 0.23 0.00 -1.47 0.00 0.00 33.84 33.78 2jd4 n VAL 2718CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2jd4 h ARG 2719N 2.59 0.57 0.00 7.34 3.08 -1.94 -2.97 114.38 123.05 2jd4 h ARG 2719Ca 0.00 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 2jd4 h ARG 2719Cb 0.72 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.59 2jd4 h ARG 2719CO 0.00 0.37 -0.45 1.63 -1.07 0.00 0.00 179.97 180.46 2jd4 n LYS 2720N -4.90 1.18 0.00 0.04 5.02 -1.26 -0.69 118.16 117.55 2jd4 n LYS 2720Ca 0.17 -2.79 0.00 0.00 -2.02 0.00 0.00 58.31 53.67 2jd4 n LYS 2720Cb 0.45 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 2jd4 n LYS 2720CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2jd4 n ARG 2721N -0.90 0.00 -3.72 1.97 0.00 -1.12 -2.94 116.66 109.95 2jd4 n ARG 2721Ca 0.15 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.70 2jd4 n ARG 2721Cb 0.74 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 33.05 2jd4 n ARG 2721CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2jd4 s LEU 2722N 0.00 2.16 -0.27 6.15 2.96 0.56 -4.13 118.68 126.11 2jd4 s LEU 2722Ca 0.00 -1.62 0.00 0.00 -0.22 0.00 0.00 54.13 52.29 2jd4 s LEU 2722Cb 0.00 -0.84 0.05 0.00 0.50 0.00 0.00 46.19 45.90 2jd4 s LEU 2722CO 0.00 -0.42 -0.06 0.00 -1.32 0.00 0.00 176.35 174.55 2jd4 s GLN 2723N 1.64 2.43 -0.10 1.98 -2.07 -1.26 -1.29 119.66 121.00 2jd4 s GLN 2723Ca 0.10 -1.24 -0.00 0.00 -1.82 0.00 0.00 55.36 52.39 2jd4 s GLN 2723Cb -0.17 -3.01 -0.03 0.00 -1.09 0.00 0.00 33.01 28.72 2jd4 s GLN 2723CO -0.26 -0.55 -0.07 0.08 -1.32 0.00 0.00 175.29 173.18 2jd4 s VAL 2724N 1.20 3.69 -0.04 3.63 1.01 -0.22 -1.10 120.40 128.57 2jd4 s VAL 2724Ca -0.06 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.48 2jd4 s VAL 2724Cb -0.19 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.66 2jd4 s VAL 2724CO -0.04 0.56 -0.09 -1.58 0.00 0.00 0.00 175.10 173.96 2jd4 s GLN 2725N -0.39 1.18 0.15 2.72 0.74 -0.80 -0.83 119.66 122.43 2jd4 s GLN 2725Ca 0.06 -0.29 -0.14 0.00 0.05 0.00 0.00 55.36 55.03 2jd4 s GLN 2725Cb -0.12 -1.06 0.02 0.00 1.10 0.00 0.00 33.01 32.95 2jd4 s GLN 2725CO 0.02 0.04 0.39 -0.48 -0.55 0.00 0.00 175.29 174.71 2jd4 s LEU 2726N 0.52 0.54 -0.07 3.68 0.05 0.24 -0.78 118.68 122.86 2jd4 s LEU 2726Ca -0.09 -0.52 0.00 0.00 0.05 0.00 0.00 54.13 53.57 2jd4 s LEU 2726Cb -0.13 1.70 -0.03 0.00 -2.05 0.00 0.00 46.19 45.69 2jd4 s LEU 2726CO 0.01 -0.91 -0.05 -0.44 -0.55 0.00 0.00 176.35 174.42 2jd4 s SER 2727N -2.87 4.84 -0.01 1.48 0.01 -1.01 -0.24 113.70 115.91 2jd4 s SER 2727Ca 0.08 0.03 -0.14 0.00 1.31 0.00 0.00 55.95 57.24 2jd4 s SER 2727Cb 0.02 -1.27 0.02 0.00 0.21 0.00 0.00 66.02 65.00 2jd4 s SER 2727CO -0.07 0.37 0.28 -0.51 0.41 0.00 0.00 173.24 173.72 2jd4 s ILE 2728N -0.84 0.06 -0.05 1.44 2.07 -0.52 -1.09 121.20 122.27 2jd4 s ILE 2728Ca 0.13 -0.52 -0.02 0.00 -1.41 0.00 0.00 60.65 58.83 2jd4 s ILE 2728Cb -0.11 -0.60 0.03 0.00 0.13 0.00 0.00 42.46 41.91 2jd4 s ILE 2728CO 0.02 -0.29 0.08 -0.60 -1.91 0.00 0.00 174.94 172.24 2jd4 s ARG 2729N -1.41 -0.03 0.07 3.50 3.52 -0.38 -1.47 118.95 122.76 2jd4 s ARG 2729Ca -0.13 0.37 -0.20 0.00 -0.13 0.00 0.00 55.73 55.63 2jd4 s ARG 2729Cb -0.05 -0.36 0.05 0.00 -1.56 0.00 0.00 34.95 33.02 2jd4 s ARG 2729CO 0.03 -0.27 0.48 -0.08 -0.81 0.00 0.00 175.30 174.65 2jd4 s THR 2730N 1.81 0.04 -0.52 4.11 -1.32 -1.26 -1.04 115.64 117.46 2jd4 s THR 2730Ca -0.00 -0.34 0.10 0.00 -1.21 0.00 0.00 61.69 60.24 2jd4 s THR 2730Cb -0.12 -1.01 -0.10 0.00 -1.51 0.00 0.00 72.50 69.76 2jd4 s THR 2730CO -0.04 -0.19 0.45 0.49 -2.21 0.00 0.00 174.62 173.12 2jd4 n PHE 2731N 0.26 0.00 -1.53 9.09 3.01 -1.26 -1.63 117.46 125.39 2jd4 n PHE 2731Ca -0.18 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 57.99 2jd4 n PHE 2731Cb 0.61 0.00 0.11 0.00 -0.01 0.00 0.00 39.48 40.19 2jd4 n PHE 2731CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jd4 s ALA 2732N -1.90 2.05 -0.41 4.37 0.00 -1.26 -4.90 121.76 119.71 2jd4 s ALA 2732Ca 0.04 -0.31 0.13 0.00 0.00 0.00 0.00 51.96 51.83 2jd4 s ALA 2732Cb 0.08 -3.08 -0.17 0.00 0.00 0.00 0.00 23.12 19.94 2jd4 s ALA 2732CO 0.40 -1.95 0.47 -1.13 0.00 0.00 0.00 175.76 173.55 2jd4 n SER 2733N -3.57 1.06 -3.53 0.00 3.41 -1.26 -4.49 113.62 105.25 2jd4 n SER 2733Ca 0.07 -0.53 -0.11 0.00 -0.26 0.00 0.00 58.87 58.04 2jd4 n SER 2733Cb 0.57 1.22 -0.03 0.00 -0.26 0.00 0.00 64.21 65.71 2jd4 n SER 2733CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2jd4 s SER 2734N -2.73 -0.41 0.00 4.04 1.04 -1.26 -0.59 113.70 113.80 2jd4 s SER 2734Ca 0.01 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2jd4 s SER 2734Cb 0.10 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.75 2jd4 s SER 2734CO 0.56 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 174.48 2jd4 n GLY 2735N -0.28 3.70 3.71 7.32 0.00 -0.80 -4.54 105.19 114.31 2jd4 n GLY 2735Ca -0.17 -1.17 -0.39 0.00 0.00 0.00 0.00 46.02 44.29 2jd4 n GLY 2735CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jd4 s LEU 2736N 0.00 4.27 -0.20 0.99 2.96 -0.27 -1.16 118.68 125.28 2jd4 s LEU 2736Ca 0.00 1.02 -0.17 0.00 -0.22 0.00 0.00 54.13 54.76 2jd4 s LEU 2736Cb 0.00 -2.95 -0.14 0.00 0.50 0.00 0.00 46.19 43.61 2jd4 s LEU 2736CO 0.00 -0.12 0.03 -0.38 -1.32 0.00 0.00 176.35 174.56 2jd4 n ILE 2737N 3.96 1.50 -3.72 6.68 2.08 -0.28 -3.70 119.36 125.88 2jd4 n ILE 2737Ca -0.03 0.01 -0.12 0.00 0.56 0.00 0.00 62.75 63.18 2jd4 n ILE 2737Cb 0.51 -2.14 -0.07 0.00 -0.75 0.00 0.00 39.64 37.19 2jd4 n ILE 2737CO 0.00 0.00 0.00 -0.72 0.56 0.00 0.00 176.55 176.39 2jd4 s TYR 2738N -2.36 -0.16 -0.16 1.39 -0.85 -1.10 -0.53 117.35 113.58 2jd4 s TYR 2738Ca -0.26 0.07 -0.12 0.00 -0.52 0.00 0.00 57.07 56.24 2jd4 s TYR 2738Cb 0.06 0.14 0.05 0.00 0.38 0.00 0.00 41.96 42.58 2jd4 s TYR 2738CO 0.47 -0.52 0.41 -0.47 -1.52 0.00 0.00 175.55 173.92 2jd4 s TYR 2739N -2.46 -0.51 0.00 -3.49 5.04 -0.57 -1.84 117.35 113.53 2jd4 s TYR 2739Ca -0.05 1.17 0.00 0.00 -2.44 0.00 0.00 57.07 55.75 2jd4 s TYR 2739Cb -0.01 0.20 -0.00 0.00 0.35 0.00 0.00 41.96 42.49 2jd4 s TYR 2739CO -0.03 -0.26 -0.01 0.08 -1.34 0.00 0.00 175.55 173.99 2jd4 s VAL 2740N 0.66 0.05 0.16 3.14 1.01 -0.68 -0.91 120.40 123.83 2jd4 s VAL 2740Ca -0.04 -0.19 -0.23 0.00 0.00 0.00 0.00 61.98 61.52 2jd4 s VAL 2740Cb -0.05 -0.08 0.06 0.00 0.00 0.00 0.00 36.38 36.31 2jd4 s VAL 2740CO -0.04 -0.09 0.66 0.00 0.00 0.00 0.00 175.10 175.63 2jd4 s ALA 2741N -0.29 -1.55 0.69 5.51 0.00 -1.26 -1.85 121.76 123.01 2jd4 s ALA 2741Ca -0.03 0.39 -0.14 0.00 0.00 0.00 0.00 51.96 52.18 2jd4 s ALA 2741Cb -0.02 0.82 0.02 0.00 0.00 0.00 0.00 23.12 23.94 2jd4 s ALA 2741CO -0.00 -0.82 1.12 -1.58 0.00 0.00 0.00 175.76 174.47 2jd4 s HIS 2742N -3.70 2.54 0.27 0.00 5.65 -0.74 -1.18 115.29 118.13 2jd4 s HIS 2742Ca 0.04 1.56 -0.05 0.00 0.25 0.00 0.00 55.06 56.86 2jd4 s HIS 2742Cb -0.02 -3.17 0.52 0.00 -1.18 0.00 0.00 32.58 28.73 2jd4 s HIS 2742CO -0.08 -1.81 1.60 0.37 -0.65 0.00 0.00 174.74 174.17 2jd4 h GLN 2743N -0.27 0.05 -0.45 2.88 5.75 -1.92 0.31 115.11 121.46 2jd4 h GLN 2743Ca -0.46 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.04 2jd4 h GLN 2743Cb 1.25 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.79 2jd4 h GLN 2743CO 0.53 0.03 0.00 0.27 -2.65 0.00 0.00 178.83 177.01 2jd4 n ASN 2744N -5.44 3.58 -0.18 -0.69 2.04 -1.26 -4.98 115.26 108.33 2jd4 n ASN 2744Ca 0.16 -2.00 -0.02 0.00 -0.44 0.00 0.00 54.58 52.28 2jd4 n ASN 2744Cb 0.55 -0.29 -0.01 0.00 -2.53 0.00 0.00 39.78 37.50 2jd4 n ASN 2744CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2jd4 n GLN 2745N 1.55 -0.51 0.25 -3.83 6.02 0.10 -4.91 117.38 116.04 2jd4 n GLN 2745Ca 0.20 0.36 0.12 0.00 -0.01 0.00 0.00 57.00 57.68 2jd4 n GLN 2745Cb 0.62 -3.91 0.62 0.00 1.02 0.00 0.00 30.24 28.59 2jd4 n GLN 2745CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jd4 h MET 2746N 0.44 0.00 -5.76 -1.09 -0.00 -1.92 -3.42 114.93 103.17 2jd4 h MET 2746Ca -0.05 0.00 -0.51 0.00 -0.00 0.00 0.00 59.70 59.15 2jd4 h MET 2746Cb 0.33 0.00 -0.24 0.00 -0.00 0.00 0.00 31.60 31.69 2jd4 h MET 2746CO 0.07 0.15 -0.81 -0.51 -0.00 0.00 0.00 176.91 175.81 2jd4 s ASP 2747N -6.08 2.13 0.13 -0.10 -0.00 -1.26 -3.81 116.67 107.68 2jd4 s ASP 2747Ca -0.01 -0.56 -0.26 0.00 -0.00 0.00 0.00 52.55 51.72 2jd4 s ASP 2747Cb 0.11 -0.13 0.07 0.00 -0.00 0.00 0.00 42.92 42.97 2jd4 s ASP 2747CO 0.60 0.06 1.01 -0.72 -0.00 0.00 0.00 175.17 176.11 2jd4 s TYR 2748N -0.99 -0.11 -0.21 4.23 -0.85 -0.84 -1.79 117.35 116.79 2jd4 s TYR 2748Ca 0.04 -0.18 -0.15 0.00 -0.52 0.00 0.00 57.07 56.26 2jd4 s TYR 2748Cb -0.09 0.63 0.06 0.00 0.38 0.00 0.00 41.96 42.94 2jd4 s TYR 2748CO 0.02 -0.76 0.53 0.00 -1.52 0.00 0.00 175.55 173.83 2jd4 s ALA 2749N -3.11 -1.36 0.04 9.51 0.00 -0.77 -1.10 121.76 124.98 2jd4 s ALA 2749Ca 0.13 1.73 -0.18 0.00 0.00 0.00 0.00 51.96 53.64 2jd4 s ALA 2749Cb -0.01 -1.02 0.04 0.00 0.00 0.00 0.00 23.12 22.13 2jd4 s ALA 2749CO 0.02 -0.29 0.42 -0.08 0.00 0.00 0.00 175.76 175.82 2jd4 s THR 2750N 0.99 0.05 -0.14 0.00 -1.32 0.04 -1.69 115.64 113.58 2jd4 s THR 2750Ca -0.06 -0.45 0.00 0.00 -1.21 0.00 0.00 61.69 59.98 2jd4 s THR 2750Cb -0.06 -0.95 0.02 0.00 -1.51 0.00 0.00 72.50 70.01 2jd4 s THR 2750CO -0.09 -0.25 -0.12 -0.22 -2.21 0.00 0.00 174.62 171.73 2jd4 s LEU 2751N -1.99 1.53 0.07 9.08 2.96 -0.76 -1.78 118.68 127.79 2jd4 s LEU 2751Ca -0.05 -0.43 0.05 0.00 -0.22 0.00 0.00 54.13 53.47 2jd4 s LEU 2751Cb -0.01 -1.07 -0.03 0.00 0.50 0.00 0.00 46.19 45.58 2jd4 s LEU 2751CO -0.02 -0.08 -0.13 -1.10 -1.32 0.00 0.00 176.35 173.70 2jd4 s GLN 2752N 1.56 0.81 -0.18 1.98 -0.21 -0.70 -1.13 119.66 121.79 2jd4 s GLN 2752Ca 0.05 -0.97 -0.07 0.00 0.02 0.00 0.00 55.36 54.38 2jd4 s GLN 2752Cb -0.13 -0.77 -0.04 0.00 1.00 0.00 0.00 33.01 33.07 2jd4 s GLN 2752CO -0.10 0.16 0.06 -1.17 -2.12 0.00 0.00 175.29 172.13 2jd4 s LEU 2753N -1.82 3.81 -0.04 2.90 2.96 -0.31 -1.22 118.68 124.97 2jd4 s LEU 2753Ca -0.01 0.08 -0.01 0.00 -0.22 0.00 0.00 54.13 53.97 2jd4 s LEU 2753Cb -0.09 -1.97 0.03 0.00 0.50 0.00 0.00 46.19 44.66 2jd4 s LEU 2753CO 0.02 0.17 0.03 -1.58 -1.32 0.00 0.00 176.35 173.67 2jd4 s GLN 2754N 0.40 0.09 -1.38 1.98 0.74 0.37 -1.90 119.66 119.95 2jd4 s GLN 2754Ca 0.03 0.23 -0.04 0.00 0.05 0.00 0.00 55.36 55.64 2jd4 s GLN 2754Cb -0.12 -0.48 0.02 0.00 1.10 0.00 0.00 33.01 33.53 2jd4 s GLN 2754CO 0.00 -0.24 0.73 0.39 -0.55 0.00 0.00 175.29 175.62 2jd4 n GLU 2755N 4.72 -4.84 -0.80 1.67 1.02 0.25 -1.59 120.64 121.06 2jd4 n GLU 2755Ca -0.16 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.57 2jd4 n GLU 2755Cb 0.50 -5.17 0.00 0.00 -0.02 0.00 0.00 31.44 26.75 2jd4 n GLU 2755CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jd4 n GLY 2756N -1.65 0.39 3.33 0.62 0.00 0.10 -4.99 105.19 102.99 2jd4 n GLY 2756Ca -0.22 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 2jd4 n GLY 2756CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jd4 s ARG 2757N -0.70 1.25 0.15 1.61 0.52 -0.62 -1.67 118.95 119.50 2jd4 s ARG 2757Ca 0.00 -1.34 -0.18 0.00 -0.52 0.00 0.00 55.73 53.68 2jd4 s ARG 2757Cb 0.00 -1.39 -0.07 0.00 0.52 0.00 0.00 34.95 34.00 2jd4 s ARG 2757CO 0.00 0.30 0.63 -0.51 0.02 0.00 0.00 175.30 175.73 2jd4 s LEU 2758N -2.44 4.41 -0.06 2.53 1.43 -1.26 -0.48 118.68 122.81 2jd4 s LEU 2758Ca 0.13 1.28 -0.01 0.00 -1.03 0.00 0.00 54.13 54.51 2jd4 s LEU 2758Cb -0.07 -3.27 0.03 0.00 0.03 0.00 0.00 46.19 42.90 2jd4 s LEU 2758CO 0.06 0.14 -0.01 -1.00 0.23 0.00 0.00 176.35 175.77 2jd4 s HIS 2759N -1.36 0.62 -0.20 0.29 3.76 -0.36 -2.78 115.29 115.25 2jd4 s HIS 2759Ca 0.37 -0.14 -0.03 0.00 -0.15 0.00 0.00 55.06 55.11 2jd4 s HIS 2759Cb -0.17 -0.71 -0.01 0.00 1.11 0.00 0.00 32.58 32.80 2jd4 s HIS 2759CO 0.20 -0.27 -0.07 0.12 -0.85 0.00 0.00 174.74 173.87 2jd4 s PHE 2760N 1.64 2.92 0.03 1.40 5.36 0.16 -1.71 117.98 127.78 2jd4 s PHE 2760Ca -0.00 -0.94 -0.00 0.00 -0.96 0.00 0.00 56.93 55.03 2jd4 s PHE 2760Cb -0.13 -2.04 -0.03 0.00 -0.34 0.00 0.00 43.02 40.48 2jd4 s PHE 2760CO -0.04 -0.50 -0.03 0.00 -1.46 0.00 0.00 175.22 173.19 2jd4 s MET 2761N 1.25 0.45 0.14 10.12 0.23 -0.74 -0.43 119.30 130.33 2jd4 s MET 2761Ca 0.03 -0.88 -0.18 0.00 -1.03 0.00 0.00 55.69 53.63 2jd4 s MET 2761Cb -0.14 0.13 0.05 0.00 -1.53 0.00 0.00 34.83 33.33 2jd4 s MET 2761CO -0.03 -0.07 0.47 -0.59 -2.03 0.00 0.00 175.02 172.77 2jd4 s PHE 2762N -2.50 -0.32 -0.07 3.16 -0.12 -0.60 -0.78 117.98 116.76 2jd4 s PHE 2762Ca -0.06 0.04 -0.01 0.00 -0.05 0.00 0.00 56.93 56.86 2jd4 s PHE 2762Cb -0.02 0.36 0.03 0.00 -0.63 0.00 0.00 43.02 42.76 2jd4 s PHE 2762CO -0.05 -0.75 -0.02 0.34 -0.05 0.00 0.00 175.22 174.69 2jd4 s ASP 2763N -2.79 1.49 0.00 1.98 -1.08 -0.25 -0.63 116.67 115.39 2jd4 s ASP 2763Ca 0.02 -0.12 0.27 0.00 -0.52 0.00 0.00 52.55 52.20 2jd4 s ASP 2763Cb 0.01 -0.49 1.18 0.00 -1.46 0.00 0.00 42.92 42.15 2jd4 s ASP 2763CO -0.12 -0.15 1.81 0.18 0.52 0.00 0.00 175.17 177.41 2jd4 n LEU 2764N 4.83 1.11 0.00 -1.34 7.99 -1.25 -1.99 117.00 126.34 2jd4 n LEU 2764Ca -0.13 -0.40 0.00 0.00 -0.01 0.00 0.00 56.01 55.48 2jd4 n LEU 2764Cb 0.50 -0.02 0.00 0.00 -0.11 0.00 0.00 43.42 43.79 2jd4 n LEU 2764CO 0.15 0.20 0.00 0.61 -1.51 0.00 0.00 177.39 176.84 2jd4 n GLY 2765N 1.10 1.56 2.69 -0.72 0.00 -1.25 -4.55 105.19 104.03 2jd4 n GLY 2765Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 2jd4 n GLY 2765CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jd4 n LYS 2766N 0.00 1.24 0.00 1.61 5.02 -1.26 -5.00 118.16 119.77 2jd4 n LYS 2766Ca 0.00 -3.14 0.00 0.00 -2.02 0.00 0.00 58.31 53.15 2jd4 n LYS 2766Cb 0.00 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 2jd4 n LYS 2766CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jd4 n GLY 2767N -0.21 3.94 3.76 0.72 0.00 -1.26 -4.47 105.19 107.68 2jd4 n GLY 2767Ca 0.07 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 2jd4 n GLY 2767CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jd4 s ARG 2768N -4.42 4.31 -0.12 1.61 3.52 -1.26 -3.90 118.95 118.69 2jd4 s ARG 2768Ca 0.00 0.73 -0.01 0.00 -0.13 0.00 0.00 55.73 56.31 2jd4 s ARG 2768Cb 0.00 -3.34 -0.02 0.00 -1.56 0.00 0.00 34.95 30.02 2jd4 s ARG 2768CO 0.00 0.37 -0.07 0.99 -0.81 0.00 0.00 175.30 175.77 2jd4 s THR 2769N -0.18 3.60 0.10 4.11 2.01 0.20 -4.74 115.64 120.74 2jd4 s THR 2769Ca 0.31 -0.48 0.07 0.00 0.31 0.00 0.00 61.69 61.91 2jd4 s THR 2769Cb -0.18 -2.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 2jd4 s THR 2769CO 0.17 0.53 -0.19 -0.75 -0.69 0.00 0.00 174.62 173.69 2jd4 s LYS 2770N 0.03 1.05 -0.06 4.92 2.20 -1.26 -1.55 119.74 125.07 2jd4 s LYS 2770Ca -0.01 -1.13 -0.03 0.00 -0.36 0.00 0.00 55.97 54.44 2jd4 s LYS 2770Cb -0.14 -1.23 0.03 0.00 -1.51 0.00 0.00 37.83 34.99 2jd4 s LYS 2770CO 0.03 0.28 0.14 0.08 -0.36 0.00 0.00 175.35 175.52 2jd4 s VAL 2771N -1.28 -0.04 -0.08 4.02 1.01 0.43 -4.97 120.40 119.48 2jd4 s VAL 2771Ca 0.05 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.21 2jd4 s VAL 2771Cb -0.10 -0.23 0.01 0.00 0.00 0.00 0.00 36.38 36.07 2jd4 s VAL 2771CO 0.04 0.06 -0.14 -0.44 0.00 0.00 0.00 175.10 174.62 2jd4 s SER 2772N 1.01 2.12 -0.14 3.32 0.01 -1.26 -0.67 113.70 118.09 2jd4 s SER 2772Ca -0.08 -0.36 -0.09 0.00 1.31 0.00 0.00 55.95 56.73 2jd4 s SER 2772Cb -0.10 -0.96 -0.05 0.00 0.21 0.00 0.00 66.02 65.12 2jd4 s SER 2772CO -0.05 0.04 0.17 -2.28 0.41 0.00 0.00 173.24 171.53 2jd4 s HIS 2773N 0.76 3.53 -1.57 2.43 2.46 -1.12 -4.99 115.29 116.79 2jd4 s HIS 2773Ca -0.12 0.51 0.17 0.00 0.47 0.00 0.00 55.06 56.09 2jd4 s HIS 2773Cb -0.16 -2.08 0.91 0.00 -0.13 0.00 0.00 32.58 31.12 2jd4 s HIS 2773CO 0.02 0.54 1.49 -0.35 -2.47 0.00 0.00 174.74 173.97 2jd4 n PRO 2774N 2.63 0.32 -2.36 2.88 -0.04 -1.26 -4.19 135.00 132.97 2jd4 n PRO 2774Ca -0.17 0.09 -0.41 0.00 -0.04 0.00 0.00 63.50 62.97 2jd4 n PRO 2774Cb 0.54 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.46 2jd4 n PRO 2774CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jd4 s ALA 2775N -2.43 3.44 -0.18 0.55 0.00 -1.26 -5.01 121.76 116.87 2jd4 s ALA 2775Ca 0.19 1.00 -0.18 0.00 0.00 0.00 0.00 51.96 52.97 2jd4 s ALA 2775Cb 0.12 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2jd4 s ALA 2775CO 0.24 -0.32 0.50 -1.17 0.00 0.00 0.00 175.76 175.02 2jd4 s LEU 2776N -1.34 4.17 -0.01 0.00 2.96 -1.26 -4.43 118.68 118.77 2jd4 s LEU 2776Ca 0.47 0.69 0.16 0.00 -0.22 0.00 0.00 54.13 55.23 2jd4 s LEU 2776Cb -0.34 -2.69 -0.22 0.00 0.50 0.00 0.00 46.19 43.44 2jd4 s LEU 2776CO 0.43 -0.14 0.46 0.18 -1.32 0.00 0.00 176.35 175.96 2jd4 n LEU 2777N 4.55 0.26 -1.40 -0.68 4.32 -0.67 -4.66 117.00 118.71 2jd4 n LEU 2777Ca -0.05 -0.18 0.00 0.00 -0.02 0.00 0.00 56.01 55.75 2jd4 n LEU 2777Cb 0.51 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.31 2jd4 n LEU 2777CO 0.42 0.07 0.48 -1.54 -1.22 0.00 0.00 177.39 175.60 2jd4 n SER 2778N -1.80 2.65 -1.21 -1.43 3.41 -1.26 -4.14 113.62 109.84 2jd4 n SER 2778Ca -0.01 -1.59 0.09 0.00 -0.26 0.00 0.00 58.87 57.10 2jd4 n SER 2778Cb 0.35 -0.53 0.28 0.00 -0.26 0.00 0.00 64.21 64.05 2jd4 n SER 2778CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2jd4 n ASP 2779N 1.28 3.53 -0.61 4.04 5.68 -1.22 -4.59 116.55 124.65 2jd4 n ASP 2779Ca 0.00 -2.16 -0.08 0.00 -0.50 0.00 0.00 54.79 52.05 2jd4 n ASP 2779Cb 0.30 -0.45 -0.03 0.00 -1.14 0.00 0.00 41.12 39.80 2jd4 n ASP 2779CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jd4 n GLY 2780N 1.25 0.87 3.46 6.12 0.00 -0.65 -4.99 105.19 111.25 2jd4 n GLY 2780Ca 0.20 -0.14 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2jd4 n GLY 2780CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jd4 s LYS 2781N -2.43 1.66 0.30 1.61 1.02 -1.26 -4.77 119.74 115.87 2jd4 s LYS 2781Ca 0.00 -1.75 -0.29 0.00 0.02 0.00 0.00 55.97 53.95 2jd4 s LYS 2781Cb 0.00 -1.77 -0.10 0.00 -0.52 0.00 0.00 37.83 35.44 2jd4 s LYS 2781CO 0.00 0.34 1.26 -1.58 -0.92 0.00 0.00 175.35 174.45 2jd4 s TRP 2782N -2.43 3.19 0.04 3.18 0.52 -1.26 -4.50 118.94 117.68 2jd4 s TRP 2782Ca 0.29 1.45 0.03 0.00 0.02 0.00 0.00 56.10 57.88 2jd4 s TRP 2782Cb -0.05 -3.59 -0.02 0.00 -1.15 0.00 0.00 33.47 28.66 2jd4 s TRP 2782CO 0.14 -1.59 -0.08 -1.01 0.02 0.00 0.00 176.95 174.43 2jd4 s HIS 2783N -0.98 0.73 -0.22 -1.98 3.76 -0.54 -4.98 115.29 111.08 2jd4 s HIS 2783Ca 0.49 -0.49 -0.06 0.00 -0.15 0.00 0.00 55.06 54.85 2jd4 s HIS 2783Cb -0.38 -0.43 -0.03 0.00 1.11 0.00 0.00 32.58 32.85 2jd4 s HIS 2783CO 0.48 -0.07 0.04 0.99 -0.85 0.00 0.00 174.74 175.34 2jd4 s THR 2784N -1.35 4.27 0.03 1.30 2.01 -1.26 -1.44 115.64 119.20 2jd4 s THR 2784Ca -0.09 -0.20 0.07 0.00 0.31 0.00 0.00 61.69 61.79 2jd4 s THR 2784Cb -0.10 -2.96 -0.02 0.00 0.01 0.00 0.00 72.50 69.43 2jd4 s THR 2784CO 0.01 0.40 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.42 2jd4 s VAL 2785N 1.12 1.75 -0.04 3.82 1.01 0.67 -0.99 120.40 127.74 2jd4 s VAL 2785Ca 0.04 -1.16 -0.03 0.00 0.00 0.00 0.00 61.98 60.83 2jd4 s VAL 2785Cb -0.14 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.75 2jd4 s VAL 2785CO 0.03 0.30 0.10 -1.59 0.00 0.00 0.00 175.10 173.94 2jd4 s LYS 2786N -1.02 0.10 -0.08 2.72 -2.85 -0.70 -0.59 119.74 117.32 2jd4 s LYS 2786Ca 0.08 0.17 0.04 0.00 -1.00 0.00 0.00 55.97 55.27 2jd4 s LYS 2786Cb -0.09 0.00 -0.00 0.00 -2.06 0.00 0.00 37.83 35.68 2jd4 s LYS 2786CO 0.01 -0.04 -0.22 0.95 0.10 0.00 0.00 175.35 176.15 2jd4 s THR 2787N 0.26 1.89 -0.06 3.79 -4.23 -0.01 -1.56 115.64 115.73 2jd4 s THR 2787Ca -0.02 -0.94 -0.00 0.00 -1.18 0.00 0.00 61.69 59.55 2jd4 s THR 2787Cb -0.03 -1.63 0.03 0.00 1.34 0.00 0.00 72.50 72.21 2jd4 s THR 2787CO -0.01 0.52 -0.01 -1.61 -0.54 0.00 0.00 174.62 172.98 2jd4 s GLU 2788N 0.22 0.59 -0.16 3.99 2.02 -0.65 -1.05 118.70 123.67 2jd4 s GLU 2788Ca -0.13 0.06 -0.01 0.00 0.02 0.00 0.00 54.97 54.91 2jd4 s GLU 2788Cb -0.16 -0.85 -0.01 0.00 0.10 0.00 0.00 34.13 33.21 2jd4 s GLU 2788CO 0.06 -0.22 -0.11 -0.47 0.02 0.00 0.00 175.26 174.54 2jd4 s TYR 2789N 1.56 2.85 -0.23 1.61 5.04 -0.41 -1.60 117.35 126.18 2jd4 s TYR 2789Ca -0.01 -0.80 -0.12 0.00 -2.44 0.00 0.00 57.07 53.69 2jd4 s TYR 2789Cb -0.13 -1.92 0.08 0.00 0.35 0.00 0.00 41.96 40.33 2jd4 s TYR 2789CO -0.03 -0.35 0.56 -1.50 -1.34 0.00 0.00 175.55 172.88 2jd4 s ILE 2790N 0.74 -0.13 0.00 3.14 2.07 -0.08 -0.33 121.20 126.61 2jd4 s ILE 2790Ca -0.05 0.05 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 2jd4 s ILE 2790Cb -0.15 -0.82 0.00 0.00 0.13 0.00 0.00 42.46 41.62 2jd4 s ILE 2790CO 0.02 0.02 0.00 0.29 -1.91 0.00 0.00 174.94 173.36 2jd4 n LYS 2791N 4.46 0.00 -0.73 3.50 4.76 -1.15 -1.39 118.16 127.60 2jd4 n LYS 2791Ca -0.20 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.24 2jd4 n LYS 2791Cb 0.56 0.00 0.26 0.00 -1.84 0.00 0.00 35.03 34.01 2jd4 n LYS 2791CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2jd4 n ARG 2792N 9.45 2.86 -3.99 1.97 5.12 -1.26 -4.97 116.66 125.86 2jd4 n ARG 2792Ca 0.00 -3.01 -0.10 0.00 -1.93 0.00 0.00 57.85 52.81 2jd4 n ARG 2792Cb 0.00 -1.96 -0.07 0.00 -1.16 0.00 0.00 32.46 29.27 2jd4 n ARG 2792CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2jd4 s LYS 2793N -3.00 1.29 0.02 5.56 1.02 -0.49 -1.73 119.74 122.41 2jd4 s LYS 2793Ca 0.47 -1.23 -0.10 0.00 0.02 0.00 0.00 55.97 55.13 2jd4 s LYS 2793Cb 0.39 0.40 0.01 0.00 -0.52 0.00 0.00 37.83 38.11 2jd4 s LYS 2793CO 0.08 -0.49 0.20 0.00 -0.92 0.00 0.00 175.35 174.22 2jd4 s ALA 2794N -4.00 -0.41 -0.07 5.17 0.00 -0.52 -0.90 121.76 121.03 2jd4 s ALA 2794Ca 0.21 -0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.71 2jd4 s ALA 2794Cb 0.02 0.22 0.11 0.00 0.00 0.00 0.00 23.12 23.47 2jd4 s ALA 2794CO 0.04 -0.32 0.89 -0.59 0.00 0.00 0.00 175.76 175.78 2jd4 s PHE 2795N -2.15 -0.41 0.29 0.00 -0.12 -0.62 -1.02 117.98 113.94 2jd4 s PHE 2795Ca -0.08 0.52 0.09 0.00 -0.05 0.00 0.00 56.93 57.41 2jd4 s PHE 2795Cb -0.03 0.49 -0.05 0.00 -0.63 0.00 0.00 43.02 42.80 2jd4 s PHE 2795CO -0.02 -0.48 0.00 -1.64 -0.05 0.00 0.00 175.22 173.03 2jd4 s MET 2796N -2.06 2.22 -0.09 1.99 -1.94 -1.26 -1.63 119.30 116.53 2jd4 s MET 2796Ca -0.00 -1.52 -0.08 0.00 -1.71 0.00 0.00 55.69 52.37 2jd4 s MET 2796Cb -0.01 -2.09 0.02 0.00 2.01 0.00 0.00 34.83 34.77 2jd4 s MET 2796CO -0.02 0.28 0.24 0.99 -0.01 0.00 0.00 175.02 176.51 2jd4 s THR 2797N -2.39 -0.00 -0.06 2.05 2.01 -0.60 0.00 115.64 116.66 2jd4 s THR 2797Ca 0.33 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 2jd4 s THR 2797Cb -0.05 -0.35 0.03 0.00 0.01 0.00 0.00 72.50 72.14 2jd4 s THR 2797CO 0.20 0.00 0.00 -0.69 -0.69 0.00 0.00 174.62 173.44 2jd4 s VAL 2798N 0.17 0.30 -1.59 3.82 1.01 -0.84 -1.73 120.40 121.54 2jd4 s VAL 2798Ca -0.00 0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.94 2jd4 s VAL 2798Cb -0.02 -0.44 0.12 0.00 0.00 0.00 0.00 36.38 36.05 2jd4 s VAL 2798CO 0.00 0.22 0.82 0.47 0.00 0.00 0.00 175.10 176.61 2jd4 n ASP 2799N 4.81 -3.91 0.00 3.32 8.00 -0.16 -0.38 116.55 128.23 2jd4 n ASP 2799Ca -0.13 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.53 2jd4 n ASP 2799Cb 0.50 -3.17 0.00 0.00 -0.02 0.00 0.00 41.12 38.43 2jd4 n ASP 2799CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jd4 n GLY 2800N -1.45 1.84 3.48 0.44 0.00 -1.26 -5.00 105.19 103.24 2jd4 n GLY 2800Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2jd4 n GLY 2800CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jd4 s GLN 2801N -0.34 3.15 0.04 1.61 -0.21 0.49 -5.02 119.66 119.38 2jd4 s GLN 2801Ca 0.00 -0.65 -0.28 0.00 0.02 0.00 0.00 55.36 54.45 2jd4 s GLN 2801Cb 0.00 -4.20 -0.05 0.00 1.00 0.00 0.00 33.01 29.76 2jd4 s GLN 2801CO 0.00 -1.86 0.88 -2.00 -2.12 0.00 0.00 175.29 170.19 2jd4 s GLU 2802N 4.43 4.58 0.71 2.91 2.12 -1.26 -1.98 118.70 130.20 2jd4 s GLU 2802Ca 0.26 1.27 -0.10 0.00 0.36 0.00 0.00 54.97 56.76 2jd4 s GLU 2802Cb -0.15 -3.40 0.04 0.00 0.26 0.00 0.00 34.13 30.88 2jd4 s GLU 2802CO 0.12 0.15 1.06 -1.54 -0.54 0.00 0.00 175.26 174.51 2jd4 s SER 2803N 0.34 5.16 0.39 -1.70 1.04 0.10 -4.99 113.70 114.05 2jd4 s SER 2803Ca 0.45 0.86 -0.26 0.00 0.48 0.00 0.00 55.95 57.48 2jd4 s SER 2803Cb -0.21 -1.61 -0.09 0.00 0.10 0.00 0.00 66.02 64.21 2jd4 s SER 2803CO 0.26 -1.45 1.23 -2.84 0.98 0.00 0.00 173.24 171.42 2jd4 s PRO 2804N -5.32 4.09 0.49 4.02 0.02 -1.26 -4.66 135.00 132.39 2jd4 s PRO 2804Ca 0.58 2.00 -0.21 0.00 0.02 0.00 0.00 61.00 63.39 2jd4 s PRO 2804Cb -0.11 -2.78 -0.07 0.00 0.02 0.00 0.00 34.50 31.56 2jd4 s PRO 2804CO 0.49 -0.33 1.11 -1.12 -0.33 0.00 0.00 177.00 176.81 2jd4 s SER 2805N -0.90 6.10 0.02 2.53 0.01 -1.26 -4.78 113.70 115.41 2jd4 s SER 2805Ca 0.55 2.14 0.08 0.00 1.31 0.00 0.00 55.95 60.04 2jd4 s SER 2805Cb -0.34 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.28 2jd4 s SER 2805CO 0.44 -0.96 -0.25 -0.69 0.41 0.00 0.00 173.24 172.19 2jd4 s VAL 2806N -1.74 2.03 0.20 3.43 1.01 -0.19 -4.97 120.40 120.16 2jd4 s VAL 2806Ca 0.67 -1.23 -0.27 0.00 0.00 0.00 0.00 61.98 61.15 2jd4 s VAL 2806Cb -0.23 -1.71 -0.08 0.00 0.00 0.00 0.00 36.38 34.35 2jd4 s VAL 2806CO 0.27 0.44 0.84 -0.89 0.00 0.00 0.00 175.10 175.76 2jd4 s THR 2807N -0.71 4.26 0.15 3.92 2.01 -1.26 -1.44 115.64 122.57 2jd4 s THR 2807Ca 0.10 1.84 -0.33 0.00 0.31 0.00 0.00 61.69 63.61 2jd4 s THR 2807Cb -0.10 -4.20 -0.12 0.00 0.01 0.00 0.00 72.50 68.09 2jd4 s THR 2807CO 0.01 0.50 1.71 0.52 -0.69 0.00 0.00 174.62 176.66 2jd4 n VAL 2808N 1.52 0.13 -2.87 3.82 0.31 -0.70 -4.92 118.33 115.61 2jd4 n VAL 2808Ca -0.04 -0.02 -0.41 0.00 -0.01 0.00 0.00 64.34 63.85 2jd4 n VAL 2808Cb 0.48 -1.84 -0.04 0.00 -0.91 0.00 0.00 33.84 31.54 2jd4 n VAL 2808CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2jd4 s VAL 2809N 1.64 4.90 0.00 2.52 1.01 -1.26 -4.91 120.40 124.30 2jd4 s VAL 2809Ca 0.79 1.72 0.00 0.00 0.00 0.00 0.00 61.98 64.50 2jd4 s VAL 2809Cb -0.58 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 31.63 2jd4 s VAL 2809CO 0.37 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.18 2jd4 n GLY 2810N 3.22 2.04 0.08 4.51 0.00 -1.26 -4.64 105.19 109.14 2jd4 n GLY 2810Ca 0.04 -1.91 0.12 0.00 0.00 0.00 0.00 46.02 44.27 2jd4 n GLY 2810CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jd4 h LYS 2811N 0.00 0.00 -6.98 1.61 1.57 -1.91 -3.47 116.57 107.40 2jd4 h LYS 2811Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2jd4 h LYS 2811Cb 0.00 0.00 0.11 0.00 0.08 0.00 0.00 32.23 32.42 2jd4 h LYS 2811CO 0.00 0.00 0.72 0.00 -0.57 0.00 0.00 179.45 179.60 2jd4 s ALA 2812N -3.18 3.32 -1.02 3.86 0.00 -1.26 -4.94 121.76 118.54 2jd4 s ALA 2812Ca 0.06 1.48 0.08 0.00 0.00 0.00 0.00 51.96 53.59 2jd4 s ALA 2812Cb 0.13 -3.59 0.09 0.00 0.00 0.00 0.00 23.12 19.75 2jd4 s ALA 2812CO 0.71 -1.14 0.82 0.25 0.00 0.00 0.00 175.76 176.40 2jd4 n THR 2813N -0.02 0.12 -4.16 0.00 -2.24 -1.26 -4.94 114.28 101.78 2jd4 n THR 2813Ca 0.04 -0.56 -0.16 0.00 -2.27 0.00 0.00 64.05 61.10 2jd4 n THR 2813Cb 0.41 1.10 -0.15 0.00 -2.10 0.00 0.00 70.33 69.59 2jd4 n THR 2813CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2jd4 s THR 2814N -0.74 0.42 -0.48 4.28 -4.23 -1.26 -4.66 115.64 108.96 2jd4 s THR 2814Ca 0.11 -0.21 -0.23 0.00 -1.18 0.00 0.00 61.69 60.18 2jd4 s THR 2814Cb 0.07 -0.37 0.03 0.00 1.34 0.00 0.00 72.50 73.58 2jd4 s THR 2814CO 0.11 0.13 0.82 -0.22 -0.54 0.00 0.00 174.62 174.92 2jd4 s LEU 2815N -0.02 4.26 -0.44 4.79 2.96 0.13 -4.64 118.68 125.72 2jd4 s LEU 2815Ca 0.01 -0.23 -0.07 0.00 -0.22 0.00 0.00 54.13 53.61 2jd4 s LEU 2815Cb -0.03 -2.89 0.11 0.00 0.50 0.00 0.00 46.19 43.87 2jd4 s LEU 2815CO -0.00 -1.01 0.29 -1.81 -1.32 0.00 0.00 176.35 172.50 2jd4 s ASP 2816N 2.38 5.56 0.12 3.68 1.01 -1.26 -3.70 116.67 124.46 2jd4 s ASP 2816Ca 0.29 -1.86 0.00 0.00 0.71 0.00 0.00 52.55 51.70 2jd4 s ASP 2816Cb -0.13 -1.96 -0.04 0.00 1.01 0.00 0.00 42.92 41.81 2jd4 s ASP 2816CO 0.21 -0.62 0.00 0.68 0.21 0.00 0.00 175.17 175.65 2jd4 s VAL 2817N 1.32 0.35 0.14 -1.27 -7.23 -1.26 -3.84 120.40 108.60 2jd4 s VAL 2817Ca 0.06 -1.90 -0.31 0.00 -1.81 0.00 0.00 61.98 58.02 2jd4 s VAL 2817Cb -0.25 -1.88 -0.08 0.00 0.56 0.00 0.00 36.38 34.74 2jd4 s VAL 2817CO -0.01 -0.66 1.30 -1.61 -0.31 0.00 0.00 175.10 173.80 2jd4 s GLU 2818N -3.95 4.39 -1.05 4.82 2.02 -0.33 -4.83 118.70 119.77 2jd4 s GLU 2818Ca 0.18 1.98 -0.08 0.00 0.02 0.00 0.00 54.97 57.06 2jd4 s GLU 2818Cb 0.07 -3.25 -0.06 0.00 0.10 0.00 0.00 34.13 30.98 2jd4 s GLU 2818CO -0.02 -0.30 2.25 0.54 0.02 0.00 0.00 175.26 177.76 2jd4 n ARG 2819N 3.37 2.35 -3.74 1.61 1.74 -1.26 -4.47 116.66 116.26 2jd4 n ARG 2819Ca 0.08 -1.65 -0.13 0.00 -0.77 0.00 0.00 57.85 55.38 2jd4 n ARG 2819Cb 0.44 -2.57 -0.14 0.00 -1.02 0.00 0.00 32.46 29.16 2jd4 n ARG 2819CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2jd4 s LYS 2820N 3.31 0.13 -0.13 5.56 -2.85 -1.26 -0.87 119.74 123.63 2jd4 s LYS 2820Ca 0.47 0.44 -0.04 0.00 -1.00 0.00 0.00 55.97 55.83 2jd4 s LYS 2820Cb 0.12 -0.16 -0.03 0.00 -2.06 0.00 0.00 37.83 35.70 2jd4 s LYS 2820CO -0.03 -0.17 0.01 -1.17 0.10 0.00 0.00 175.35 174.09 2jd4 s LEU 2821N 1.25 3.56 -0.25 2.77 0.20 0.72 -4.59 118.68 122.34 2jd4 s LEU 2821Ca -0.09 0.06 -0.15 0.00 0.69 0.00 0.00 54.13 54.64 2jd4 s LEU 2821Cb -0.11 -1.85 -0.04 0.00 -0.43 0.00 0.00 46.19 43.76 2jd4 s LEU 2821CO -0.07 0.27 0.39 -0.31 -0.29 0.00 0.00 176.35 176.35 2jd4 s TYR 2822N -0.26 3.27 -0.10 5.38 1.51 -0.09 -0.80 117.35 126.28 2jd4 s TYR 2822Ca 0.06 0.47 -0.00 0.00 -1.01 0.00 0.00 57.07 56.59 2jd4 s TYR 2822Cb -0.12 -2.57 -0.03 0.00 -0.11 0.00 0.00 41.96 39.13 2jd4 s TYR 2822CO 0.02 -0.19 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.02 2jd4 s LEU 2823N 1.93 3.05 0.00 -1.29 2.96 0.03 -1.51 118.68 123.85 2jd4 s LEU 2823Ca 0.16 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.95 2jd4 s LEU 2823Cb -0.15 -1.68 0.00 0.00 0.50 0.00 0.00 46.19 44.86 2jd4 s LEU 2823CO 0.09 0.28 0.00 0.61 -1.32 0.00 0.00 176.35 176.01 2jd4 n GLY 2824N 2.76 1.43 0.00 7.98 0.00 0.31 -2.25 105.19 115.42 2jd4 n GLY 2824Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2jd4 n GLY 2824CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jd4 n GLY 2825N -2.00 -1.67 3.26 -0.02 0.00 -1.19 -2.48 105.19 101.09 2jd4 n GLY 2825Ca 0.00 -1.14 -0.23 0.00 0.00 0.00 0.00 46.02 44.65 2jd4 n GLY 2825CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jd4 s LEU 2826N 0.00 2.26 0.66 0.99 1.43 -1.26 -4.71 118.68 118.05 2jd4 s LEU 2826Ca 0.00 -0.63 -0.17 0.00 -1.03 0.00 0.00 54.13 52.30 2jd4 s LEU 2826Cb 0.00 -0.84 0.00 0.00 0.03 0.00 0.00 46.19 45.38 2jd4 s LEU 2826CO 0.00 0.06 1.20 -2.84 0.23 0.00 0.00 176.35 175.00 2jd4 s PRO 2827N -1.71 2.59 0.56 1.29 0.02 -1.26 -4.64 135.00 131.85 2jd4 s PRO 2827Ca 0.05 1.75 0.23 0.00 0.02 0.00 0.00 61.00 63.05 2jd4 s PRO 2827Cb -0.10 -1.89 1.55 0.00 0.02 0.00 0.00 34.50 34.08 2jd4 s PRO 2827CO 0.03 -1.48 2.20 0.66 -0.33 0.00 0.00 177.00 178.08 2jd4 h SER 2828N 0.27 0.00 0.38 2.53 4.64 -1.98 -2.63 113.55 116.76 2jd4 h SER 2828Ca -0.49 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.65 2jd4 h SER 2828Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 2jd4 h SER 2828CO 0.53 0.00 -0.76 1.12 -0.87 0.00 0.00 176.83 176.84 2jd4 h HIS 2829N 0.00 0.43 -3.91 4.77 2.07 -2.01 -3.45 115.15 113.04 2jd4 h HIS 2829Ca 0.00 -0.20 -0.53 0.00 -2.85 0.00 0.00 60.37 56.80 2jd4 h HIS 2829Cb 0.01 -0.06 0.08 0.00 2.57 0.00 0.00 27.41 30.01 2jd4 h HIS 2829CO 0.00 0.96 0.66 -0.47 -3.07 0.00 0.00 177.93 176.00 2jd4 s TYR 2830N -3.50 2.89 -0.34 6.12 5.04 -0.99 -5.00 117.35 121.56 2jd4 s TYR 2830Ca -0.04 1.37 0.01 0.00 -2.44 0.00 0.00 57.07 55.97 2jd4 s TYR 2830Cb 0.11 -3.74 0.10 0.00 0.35 0.00 0.00 41.96 38.78 2jd4 s TYR 2830CO 0.83 -2.15 0.10 1.03 -1.34 0.00 0.00 175.55 174.02 2jd4 s ARG 2831N -1.99 1.08 -0.09 4.97 1.81 -1.26 -4.89 118.95 118.59 2jd4 s ARG 2831Ca 0.52 -1.50 -0.30 0.00 -1.72 0.00 0.00 55.73 52.73 2jd4 s ARG 2831Cb -0.41 -2.49 -0.02 0.00 -0.45 0.00 0.00 34.95 31.58 2jd4 s ARG 2831CO 0.54 -0.99 1.17 0.00 -0.68 0.00 0.00 175.30 175.33 2jd4 s ALA 2832N 1.17 3.51 -0.03 2.13 0.00 -1.26 -4.94 121.76 122.35 2jd4 s ALA 2832Ca 0.11 0.54 0.16 0.00 0.00 0.00 0.00 51.96 52.77 2jd4 s ALA 2832Cb -0.19 -3.52 -0.24 0.00 0.00 0.00 0.00 23.12 19.17 2jd4 s ALA 2832CO -0.16 -0.80 0.33 0.54 0.00 0.00 0.00 175.76 175.67 2jd4 n ARG 2833N 5.40 0.52 -0.31 0.00 1.74 -1.26 -4.72 116.66 118.03 2jd4 n ARG 2833Ca 0.11 -0.14 0.09 0.00 -0.77 0.00 0.00 57.85 57.14 2jd4 n ARG 2833Cb 0.46 -1.37 0.22 0.00 -1.02 0.00 0.00 32.46 30.75 2jd4 n ARG 2833CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2jd4 n ASN 2834N -2.07 3.31 -0.34 0.55 3.02 -1.26 -4.67 115.26 113.81 2jd4 n ASN 2834Ca -0.04 -3.04 0.07 0.00 -0.03 0.00 0.00 54.58 51.55 2jd4 n ASN 2834Cb 0.43 -0.50 0.13 0.00 -0.61 0.00 0.00 39.78 39.23 2jd4 n ASN 2834CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2jd4 n ILE 2835N -0.85 1.56 -3.80 2.41 -5.35 -1.26 -5.11 119.36 106.96 2jd4 n ILE 2835Ca 0.19 -2.07 0.00 0.00 -0.27 0.00 0.00 62.75 60.60 2jd4 n ILE 2835Cb 0.80 -0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 2jd4 n ILE 2835CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jd4 n GLY 2836N -1.03 -1.60 0.12 3.28 0.00 -1.26 -4.41 105.19 100.29 2jd4 n GLY 2836Ca 0.14 -1.36 0.12 0.00 0.00 0.00 0.00 46.02 44.91 2jd4 n GLY 2836CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2jd4 h THR 2837N 0.00 0.00 -0.74 2.61 2.02 -1.99 -3.43 112.91 111.39 2jd4 h THR 2837Ca 0.00 -0.90 -0.55 0.00 0.77 0.00 0.00 66.41 65.73 2jd4 h THR 2837Cb 0.00 1.51 -0.07 0.00 -1.74 0.00 0.00 68.15 67.86 2jd4 h THR 2837CO 0.00 0.00 1.76 -0.63 0.37 0.00 0.00 175.52 177.02 2jd4 s ILE 2838N -3.30 3.90 0.00 3.11 1.01 -1.26 -4.50 121.20 120.17 2jd4 s ILE 2838Ca 0.02 -1.50 0.00 0.00 0.00 0.00 0.00 60.65 59.18 2jd4 s ILE 2838Cb 0.09 -4.96 0.00 0.00 0.01 0.00 0.00 42.46 37.61 2jd4 s ILE 2838CO 0.75 -1.66 0.45 0.35 0.00 0.00 0.00 174.94 174.84 2jd4 n THR 2839N 6.92 0.00 -2.05 2.92 -2.24 -1.26 -4.46 114.28 114.12 2jd4 n THR 2839Ca 0.47 -0.47 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 2jd4 n THR 2839Cb 0.46 1.06 0.01 0.00 -2.10 0.00 0.00 70.33 69.76 2jd4 n THR 2839CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2jd4 s HIS 2840N -0.04 3.55 0.33 4.78 -3.43 -1.26 -4.44 115.29 114.78 2jd4 s HIS 2840Ca 0.00 1.13 -0.28 0.00 -0.80 0.00 0.00 55.06 55.10 2jd4 s HIS 2840Cb 0.00 -2.69 -0.10 0.00 -1.43 0.00 0.00 32.58 28.36 2jd4 s HIS 2840CO 0.00 -0.69 1.20 0.45 -2.00 0.00 0.00 174.74 173.70 2jd4 s SER 2841N -4.20 6.89 -0.16 7.38 0.15 -0.65 -1.11 113.70 122.00 2jd4 s SER 2841Ca 0.54 2.46 -0.29 0.00 0.70 0.00 0.00 55.95 59.37 2jd4 s SER 2841Cb -0.11 -2.63 -0.01 0.00 -1.71 0.00 0.00 66.02 61.56 2jd4 s SER 2841CO 0.51 -0.43 0.98 -0.51 1.20 0.00 0.00 173.24 175.00 2jd4 s ILE 2842N -1.21 4.77 -0.99 6.45 1.10 -1.03 -4.59 121.20 125.69 2jd4 s ILE 2842Ca 0.49 1.96 -0.24 0.00 -0.51 0.00 0.00 60.65 62.36 2jd4 s ILE 2842Cb -0.35 -4.28 -0.02 0.00 0.15 0.00 0.00 42.46 37.96 2jd4 s ILE 2842CO 0.45 -0.05 1.82 -2.84 -2.11 0.00 0.00 174.94 172.21 2jd4 s PRO 2843N 2.43 2.86 0.25 3.50 0.02 -1.26 -3.15 135.00 139.65 2jd4 s PRO 2843Ca 0.45 -0.70 -0.20 0.00 0.02 0.00 0.00 61.00 60.56 2jd4 s PRO 2843Cb -0.17 -5.18 0.03 0.00 0.02 0.00 0.00 34.50 29.19 2jd4 s PRO 2843CO 0.13 -3.14 0.66 0.00 -0.33 0.00 0.00 177.00 174.31 2jd4 s ALA 2844N 8.75 -1.16 -0.17 -1.55 0.00 -1.19 -4.26 121.76 122.18 2jd4 s ALA 2844Ca 0.64 -0.23 -0.07 0.00 0.00 0.00 0.00 51.96 52.30 2jd4 s ALA 2844Cb -0.04 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.92 2jd4 s ALA 2844CO -0.00 -0.95 0.05 0.00 0.00 0.00 0.00 175.76 174.85 2jd4 s ILE 2846N 0.19 2.23 0.00 0.00 1.01 0.07 -1.25 121.20 123.46 2jd4 s ILE 2846Ca 0.04 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.76 2jd4 s ILE 2846Cb -0.12 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.45 2jd4 s ILE 2846CO 0.01 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.10 2jd4 n GLY 2847N 3.96 1.04 3.82 6.18 0.00 -0.25 -1.87 105.19 118.06 2jd4 n GLY 2847Ca -0.20 -1.22 -0.31 0.00 0.00 0.00 0.00 46.02 44.30 2jd4 n GLY 2847CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2jd4 s GLU 2848N 0.91 2.82 -0.06 1.61 -1.05 -1.26 -4.73 118.70 116.94 2jd4 s GLU 2848Ca 0.00 0.92 -0.03 0.00 -0.15 0.00 0.00 54.97 55.71 2jd4 s GLU 2848Cb 0.00 -1.98 0.03 0.00 -0.44 0.00 0.00 34.13 31.74 2jd4 s GLU 2848CO 0.00 -1.18 0.13 -1.50 0.95 0.00 0.00 175.26 173.66 2jd4 s ILE 2849N -3.06 -0.03 0.04 1.83 2.07 -1.26 -2.41 121.20 118.38 2jd4 s ILE 2849Ca 0.58 0.11 0.05 0.00 -1.41 0.00 0.00 60.65 59.99 2jd4 s ILE 2849Cb -0.14 -0.21 -0.02 0.00 0.13 0.00 0.00 42.46 42.22 2jd4 s ILE 2849CO 0.55 0.05 -0.15 0.00 -1.91 0.00 0.00 174.94 173.48 2jd4 s MET 2850N 0.74 0.99 -0.12 3.50 0.23 0.04 -1.43 119.30 123.25 2jd4 s MET 2850Ca -0.06 -0.78 0.02 0.00 -1.03 0.00 0.00 55.69 53.85 2jd4 s MET 2850Cb -0.07 -1.01 0.01 0.00 -1.53 0.00 0.00 34.83 32.23 2jd4 s MET 2850CO -0.03 0.25 -0.19 0.08 -2.03 0.00 0.00 175.02 173.09 2jd4 s VAL 2851N -0.85 1.79 -1.57 5.16 1.01 -0.19 -1.91 120.40 123.83 2jd4 s VAL 2851Ca 0.02 -0.83 -0.10 0.00 0.00 0.00 0.00 61.98 61.08 2jd4 s VAL 2851Cb -0.08 -1.59 0.08 0.00 0.00 0.00 0.00 36.38 34.79 2jd4 s VAL 2851CO 0.01 0.50 0.59 0.59 0.00 0.00 0.00 175.10 176.79 2jd4 n ASN 2852N 4.01 -1.85 0.00 3.32 4.13 -0.26 -1.01 115.26 123.61 2jd4 n ASN 2852Ca -0.20 -1.02 0.00 0.00 1.68 0.00 0.00 54.58 55.04 2jd4 n ASN 2852Cb 0.52 -2.82 0.00 0.00 -1.54 0.00 0.00 39.78 35.94 2jd4 n ASN 2852CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jd4 n GLY 2853N -1.72 2.30 3.63 7.41 0.00 -1.26 -5.03 105.19 110.52 2jd4 n GLY 2853Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 2jd4 n GLY 2853CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jd4 s GLN 2854N -0.24 3.99 0.17 1.61 -1.52 -0.18 -5.07 119.66 118.43 2jd4 s GLN 2854Ca 0.00 -0.32 -0.30 0.00 -1.95 0.00 0.00 55.36 52.79 2jd4 s GLN 2854Cb 0.00 -3.39 -0.08 0.00 -0.22 0.00 0.00 33.01 29.32 2jd4 s GLN 2854CO 0.00 0.12 1.27 -1.14 -0.25 0.00 0.00 175.29 175.28 2jd4 s GLN 2855N 0.85 4.42 0.08 2.91 2.00 -1.26 -1.02 119.66 127.64 2jd4 s GLN 2855Ca 0.06 1.96 -0.17 0.00 -2.00 0.00 0.00 55.36 55.21 2jd4 s GLN 2855Cb -0.13 -3.23 -0.06 0.00 0.80 0.00 0.00 33.01 30.38 2jd4 s GLN 2855CO 0.03 -0.22 0.52 -0.51 -0.50 0.00 0.00 175.29 174.61 2jd4 s LEU 2856N 0.12 4.46 -0.96 3.68 1.02 -0.52 -4.95 118.68 121.53 2jd4 s LEU 2856Ca 0.56 1.13 -0.20 0.00 0.02 0.00 0.00 54.13 55.65 2jd4 s LEU 2856Cb -0.34 -2.93 0.11 0.00 0.02 0.00 0.00 46.19 43.05 2jd4 s LEU 2856CO 0.36 0.24 1.22 -0.62 0.02 0.00 0.00 176.35 177.56 2jd4 s ASP 2857N -1.30 6.61 0.57 2.29 -1.08 -1.26 -4.75 116.67 117.76 2jd4 s ASP 2857Ca 0.30 -1.94 0.34 0.00 -0.52 0.00 0.00 52.55 50.74 2jd4 s ASP 2857Cb -0.17 -2.44 1.73 0.00 -1.46 0.00 0.00 42.92 40.57 2jd4 s ASP 2857CO 0.18 -1.16 2.14 0.11 0.52 0.00 0.00 175.17 176.96 2jd4 h LYS 2858N 9.00 0.00 0.00 4.34 1.57 -1.96 -2.66 116.57 126.86 2jd4 h LYS 2858Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2jd4 h LYS 2858Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2jd4 h LYS 2858CO 1.19 0.05 0.00 -0.25 -0.57 0.00 0.00 179.45 179.87 2jd4 n ASP 2859N -3.34 0.18 -3.26 0.86 8.00 -1.26 -4.14 116.55 113.60 2jd4 n ASP 2859Ca -0.02 0.52 -0.25 0.00 0.71 0.00 0.00 54.79 55.76 2jd4 n ASP 2859Cb 0.20 -0.57 -0.07 0.00 -0.02 0.00 0.00 41.12 40.67 2jd4 n ASP 2859CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jd4 n ARG 2860N -1.68 1.67 -1.86 -1.24 1.74 -1.00 -5.11 116.66 109.19 2jd4 n ARG 2860Ca 0.06 -3.95 -0.32 0.00 -0.77 0.00 0.00 57.85 52.88 2jd4 n ARG 2860Cb 0.33 -1.76 0.02 0.00 -1.02 0.00 0.00 32.46 30.04 2jd4 n ARG 2860CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2jd4 s PRO 2861N -2.01 3.29 0.15 5.56 0.04 -1.26 -4.91 135.00 135.85 2jd4 s PRO 2861Ca 0.39 0.98 0.13 0.00 0.04 0.00 0.00 61.00 62.54 2jd4 s PRO 2861Cb 0.19 -2.04 -0.10 0.00 0.04 0.00 0.00 34.50 32.60 2jd4 s PRO 2861CO -0.07 -0.82 1.18 -0.07 0.04 0.00 0.00 177.00 177.26 2jd4 h LEU 2862N -0.13 0.00 -7.28 -3.56 3.38 -1.38 -3.47 115.31 102.88 2jd4 h LEU 2862Ca -0.45 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.43 2jd4 h LEU 2862Cb 1.21 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.76 2jd4 h LEU 2862CO 0.58 0.73 -0.07 -0.55 0.09 0.00 0.00 178.44 179.22 2jd4 s SER 2863N -6.36 -0.41 0.15 -0.43 0.15 -1.25 -4.99 113.70 100.55 2jd4 s SER 2863Ca 0.01 0.43 -0.23 0.00 0.70 0.00 0.00 55.95 56.86 2jd4 s SER 2863Cb 0.09 0.48 0.07 0.00 -1.71 0.00 0.00 66.02 64.94 2jd4 s SER 2863CO 0.79 -0.48 0.58 0.00 1.20 0.00 0.00 173.24 175.33 2jd4 s ALA 2864N -1.11 -1.54 -0.29 5.45 0.00 -1.26 -1.13 121.76 121.88 2jd4 s ALA 2864Ca -0.11 0.48 -0.17 0.00 0.00 0.00 0.00 51.96 52.16 2jd4 s ALA 2864Cb -0.03 0.82 0.12 0.00 0.00 0.00 0.00 23.12 24.04 2jd4 s ALA 2864CO 0.06 -0.74 0.89 0.45 0.00 0.00 0.00 175.76 176.42 2jd4 s SER 2865N -2.67 -0.64 -1.36 0.00 0.15 -0.87 -4.97 113.70 103.33 2jd4 s SER 2865Ca 0.01 1.04 -0.02 0.00 0.70 0.00 0.00 55.95 57.68 2jd4 s SER 2865Cb -0.01 1.25 -0.00 0.00 -1.71 0.00 0.00 66.02 65.55 2jd4 s SER 2865CO -0.12 -0.17 0.49 0.00 1.20 0.00 0.00 173.24 174.65 2jd4 n ALA 2866N 3.77 -2.07 -2.46 5.45 0.00 -1.26 -1.98 120.51 121.96 2jd4 n ALA 2866Ca -0.19 -0.26 -0.32 0.00 0.00 0.00 0.00 53.44 52.67 2jd4 n ALA 2866Cb 0.58 -1.79 -0.13 0.00 0.00 0.00 0.00 19.45 18.10 2jd4 n ALA 2866CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jd4 s VAL 2867N -3.87 2.93 0.00 0.00 1.01 -1.26 -4.32 120.40 114.88 2jd4 s VAL 2867Ca 0.05 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.24 2jd4 s VAL 2867Cb -0.02 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.22 2jd4 s VAL 2867CO 0.88 0.58 0.00 -0.67 0.00 0.00 0.00 175.10 175.88 2jd4 n ASP 2868N 2.28 0.00 -4.96 3.32 4.64 -1.10 -4.96 116.55 115.77 2jd4 n ASP 2868Ca -0.17 -0.39 -0.23 0.00 -1.38 0.00 0.00 54.79 52.62 2jd4 n ASP 2868Cb 0.52 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.60 2jd4 n ASP 2868CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 2jd4 s ARG 2869N -0.17 3.21 0.03 -0.67 0.52 -1.26 -0.47 118.95 120.14 2jd4 s ARG 2869Ca 0.00 -0.52 0.02 0.00 -0.52 0.00 0.00 55.73 54.71 2jd4 s ARG 2869Cb 0.00 -2.64 -0.04 0.00 0.52 0.00 0.00 34.95 32.79 2jd4 s ARG 2869CO 0.00 -0.07 0.04 0.00 0.02 0.00 0.00 175.30 175.29 2jd4 s TYR 2871N -1.23 3.64 0.31 0.00 1.51 -1.26 -1.59 117.35 118.73 2jd4 s TYR 2871Ca 0.24 1.75 0.04 0.00 -1.01 0.00 0.00 57.07 58.09 2jd4 s TYR 2871Cb -0.12 -2.90 0.64 0.00 -0.11 0.00 0.00 41.96 39.47 2jd4 s TYR 2871CO 0.16 0.18 1.87 0.28 -1.11 0.00 0.00 175.55 176.92 2jd4 h VAL 2872N 2.53 0.92 -3.24 0.71 2.07 -0.99 -3.38 116.25 114.87 2jd4 h VAL 2872Ca -0.47 -0.31 -0.46 0.00 0.82 0.00 0.00 66.70 66.28 2jd4 h VAL 2872Cb 1.19 -0.05 -0.38 0.00 -1.52 0.00 0.00 31.29 30.53 2jd4 h VAL 2872CO 0.64 0.16 -0.78 -0.69 0.02 0.00 0.00 177.57 176.93 2jd4 s VAL 2873N -5.85 0.55 0.33 2.57 1.01 -1.26 -4.96 120.40 112.80 2jd4 s VAL 2873Ca -0.11 0.01 0.10 0.00 0.00 0.00 0.00 61.98 61.98 2jd4 s VAL 2873Cb 0.22 -0.67 -0.06 0.00 0.00 0.00 0.00 36.38 35.86 2jd4 s VAL 2873CO 0.80 0.29 -0.10 0.00 0.00 0.00 0.00 175.10 176.09 2jd4 s ALA 2874N 1.88 2.96 0.10 5.51 0.00 -1.26 0.38 121.76 131.33 2jd4 s ALA 2874Ca 0.05 -2.03 -0.02 0.00 0.00 0.00 0.00 51.96 49.96 2jd4 s ALA 2874Cb -0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 2jd4 s ALA 2874CO -0.06 0.12 0.05 1.14 0.00 0.00 0.00 175.76 177.01 2jd4 s GLN 2875N -3.61 0.83 0.22 0.00 -2.07 -0.21 -4.54 119.66 110.28 2jd4 s GLN 2875Ca 0.32 -1.31 -0.31 0.00 -1.82 0.00 0.00 55.36 52.25 2jd4 s GLN 2875Cb 0.01 0.25 -0.10 0.00 -1.09 0.00 0.00 33.01 32.07 2jd4 s GLN 2875CO 0.17 -0.22 1.54 -2.00 -1.32 0.00 0.00 175.29 173.46 2jd4 s GLU 2876N -3.98 4.21 0.00 9.60 2.12 -1.26 -3.80 118.70 125.59 2jd4 s GLU 2876Ca 0.16 2.40 0.00 0.00 0.36 0.00 0.00 54.97 57.89 2jd4 s GLU 2876Cb 0.07 -3.11 0.00 0.00 0.26 0.00 0.00 34.13 31.35 2jd4 s GLU 2876CO -0.03 -0.56 0.00 0.41 -0.54 0.00 0.00 175.26 174.54 2jd4 n GLY 2877N 2.95 0.52 3.09 -1.50 0.00 -1.26 -4.88 105.19 104.11 2jd4 n GLY 2877Ca 0.11 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.97 2jd4 n GLY 2877CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jd4 s THR 2878N -1.33 1.68 0.06 2.61 2.01 -0.24 -1.70 115.64 118.73 2jd4 s THR 2878Ca 0.00 -0.75 -0.22 0.00 0.31 0.00 0.00 61.69 61.03 2jd4 s THR 2878Cb 0.00 -1.51 -0.06 0.00 0.01 0.00 0.00 72.50 70.93 2jd4 s THR 2878CO 0.00 0.48 0.64 0.12 -0.69 0.00 0.00 174.62 175.17 2jd4 s PHE 2879N 0.93 3.77 -0.18 4.92 5.36 -0.65 -1.63 117.98 130.50 2jd4 s PHE 2879Ca -0.07 1.34 -0.00 0.00 -0.96 0.00 0.00 56.93 57.24 2jd4 s PHE 2879Cb -0.15 -2.63 0.01 0.00 -0.34 0.00 0.00 43.02 39.91 2jd4 s PHE 2879CO -0.02 0.45 -0.16 -0.06 -1.46 0.00 0.00 175.22 173.98 2jd4 s PHE 2880N -0.67 2.81 -0.92 10.12 0.40 0.12 -1.19 117.98 128.66 2jd4 s PHE 2880Ca 0.32 -1.40 0.27 0.00 -0.60 0.00 0.00 56.93 55.53 2jd4 s PHE 2880Cb -0.20 -1.95 0.94 0.00 0.51 0.00 0.00 43.02 42.32 2jd4 s PHE 2880CO 0.20 -0.70 1.75 -0.85 0.70 0.00 0.00 175.22 176.32 2jd4 n GLU 2881N 4.56 0.07 -0.26 0.44 0.28 -0.81 -1.29 120.64 123.63 2jd4 n GLU 2881Ca -0.20 0.04 0.00 0.00 -0.16 0.00 0.00 57.16 56.84 2jd4 n GLU 2881Cb 0.50 -1.57 0.00 0.00 1.43 0.00 0.00 31.44 31.81 2jd4 n GLU 2881CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jd4 n GLY 2882N 1.45 0.85 0.01 -1.84 0.00 -1.05 -4.84 105.19 99.77 2jd4 n GLY 2882Ca 0.06 -0.15 0.03 0.00 0.00 0.00 0.00 46.02 45.96 2jd4 n GLY 2882CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jd4 n SER 2883N 0.28 2.86 0.00 1.61 3.41 -1.26 -4.62 113.62 115.90 2jd4 n SER 2883Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2jd4 n SER 2883Cb 0.00 1.31 0.00 0.00 -0.26 0.00 0.00 64.21 65.26 2jd4 n SER 2883CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jd4 n GLY 2884N 2.05 4.48 3.67 5.00 0.00 -1.18 -4.89 105.19 114.32 2jd4 n GLY 2884Ca -0.04 -0.56 0.03 0.00 0.00 0.00 0.00 46.02 45.45 2jd4 n GLY 2884CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2jd4 n TYR 2885N 0.00 -0.29 -4.09 1.61 0.18 0.61 -4.14 117.16 111.04 2jd4 n TYR 2885Ca 0.00 -0.62 -0.16 0.00 1.88 0.00 0.00 57.90 59.00 2jd4 n TYR 2885Cb 0.00 0.28 -0.15 0.00 -0.38 0.00 0.00 39.34 39.09 2jd4 n TYR 2885CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2jd4 s ALA 2886N -1.92 0.41 -0.07 -3.48 0.00 -0.63 -0.90 121.76 115.16 2jd4 s ALA 2886Ca 0.28 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 52.19 2jd4 s ALA 2886Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 2jd4 s ALA 2886CO -0.01 0.05 -0.19 0.00 0.00 0.00 0.00 175.76 175.61 2jd4 s ALA 2887N 0.28 2.44 0.22 0.00 0.00 -0.54 -0.53 121.76 123.63 2jd4 s ALA 2887Ca -0.03 -0.99 0.06 0.00 0.00 0.00 0.00 51.96 51.00 2jd4 s ALA 2887Cb -0.06 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 2jd4 s ALA 2887CO -0.00 0.43 -0.07 -0.51 0.00 0.00 0.00 175.76 175.60 2jd4 s LEU 2888N -0.24 2.43 -0.80 0.00 1.43 0.23 -1.13 118.68 120.60 2jd4 s LEU 2888Ca -0.00 -1.13 -0.01 0.00 -1.03 0.00 0.00 54.13 51.96 2jd4 s LEU 2888Cb -0.13 -0.49 -0.01 0.00 0.03 0.00 0.00 46.19 45.59 2jd4 s LEU 2888CO 0.03 -0.35 0.73 0.52 0.23 0.00 0.00 176.35 177.51 2jd4 n VAL 2889N -0.42 -9.60 0.21 -1.59 0.31 -1.26 -0.44 118.33 105.53 2jd4 n VAL 2889Ca -0.07 -0.40 0.07 0.00 -0.01 0.00 0.00 64.34 63.93 2jd4 n VAL 2889Cb 0.62 -6.62 0.58 0.00 -0.91 0.00 0.00 33.84 27.52 2jd4 n VAL 2889CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2jd4 h LYS 2890N 0.16 0.10 0.00 5.55 3.64 -1.94 -1.40 116.57 122.68 2jd4 h LYS 2890Ca -0.13 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2jd4 h LYS 2890Cb 1.07 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2jd4 h LYS 2890CO 0.33 0.09 0.00 -0.85 -2.27 0.00 0.00 179.45 176.75 2jd4 n GLU 2891N -4.50 0.05 0.00 1.90 0.00 -1.26 -4.77 120.64 112.06 2jd4 n GLU 2891Ca -0.02 0.16 0.00 0.00 0.00 0.00 0.00 57.16 57.30 2jd4 n GLU 2891Cb 0.10 -1.57 0.00 0.00 0.00 0.00 0.00 31.44 29.97 2jd4 n GLU 2891CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2jd4 n GLY 2892N 0.80 2.41 3.45 -1.84 0.00 -0.53 -4.85 105.19 104.62 2jd4 n GLY 2892Ca 0.05 -1.53 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 2jd4 n GLY 2892CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2jd4 s TYR 2893N -0.83 2.81 -0.44 1.61 5.04 0.83 -4.68 117.35 121.69 2jd4 s TYR 2893Ca 0.00 -0.36 -0.07 0.00 -2.44 0.00 0.00 57.07 54.21 2jd4 s TYR 2893Cb 0.00 -1.77 0.11 0.00 0.35 0.00 0.00 41.96 40.65 2jd4 s TYR 2893CO 0.00 0.01 0.28 0.15 -1.34 0.00 0.00 175.55 174.65 2jd4 s LYS 2894N -0.17 2.32 0.12 4.97 1.02 -1.26 -2.50 119.74 124.24 2jd4 s LYS 2894Ca 0.00 -1.74 -0.27 0.00 0.02 0.00 0.00 55.97 53.98 2jd4 s LYS 2894Cb -0.13 -3.78 -0.07 0.00 -0.52 0.00 0.00 37.83 33.33 2jd4 s LYS 2894CO 0.03 -1.12 1.63 0.28 -0.92 0.00 0.00 175.35 175.26 2jd4 h VAL 2895N 6.22 0.41 0.00 3.17 2.07 -1.78 -3.47 116.25 122.87 2jd4 h VAL 2895Ca -0.18 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2jd4 h VAL 2895Cb 1.06 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2jd4 h VAL 2895CO 0.79 0.00 0.00 0.54 0.02 0.00 0.00 177.57 178.92 2jd4 n ARG 2896N -5.38 0.00 -0.06 1.57 1.74 0.70 -4.00 116.66 111.22 2jd4 n ARG 2896Ca -0.06 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.81 2jd4 n ARG 2896Cb 0.29 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.61 2jd4 n ARG 2896CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2jd4 h LEU 2897N 0.00 0.13 -8.22 0.55 3.38 -1.87 0.24 115.31 109.52 2jd4 h LEU 2897Ca 0.00 -0.70 -0.58 0.00 0.09 0.00 0.00 57.88 56.69 2jd4 h LEU 2897Cb 0.00 -0.04 -0.32 0.00 0.09 0.00 0.00 40.66 40.39 2jd4 h LEU 2897CO 0.00 1.50 -0.84 -0.62 0.09 0.00 0.00 178.44 178.57 2jd4 s ASP 2898N -6.84 2.30 -0.14 -0.43 -1.08 -1.26 -1.50 116.67 107.73 2jd4 s ASP 2898Ca -0.25 -0.39 -0.11 0.00 -0.52 0.00 0.00 52.55 51.29 2jd4 s ASP 2898Cb 0.04 -0.77 0.04 0.00 -1.46 0.00 0.00 42.92 40.77 2jd4 s ASP 2898CO 0.66 0.14 0.36 -0.22 0.52 0.00 0.00 175.17 176.63 2jd4 s LEU 2899N 0.18 0.42 -0.05 -1.34 2.96 -0.75 -4.37 118.68 115.72 2jd4 s LEU 2899Ca -0.08 0.74 0.02 0.00 -0.22 0.00 0.00 54.13 54.59 2jd4 s LEU 2899Cb -0.13 1.21 0.02 0.00 0.50 0.00 0.00 46.19 47.78 2jd4 s LEU 2899CO 0.04 -0.15 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.26 2jd4 s GLN 2900N 0.62 1.16 -0.11 1.98 0.74 -0.07 -0.50 119.66 123.47 2jd4 s GLN 2900Ca -0.04 -0.22 0.02 0.00 0.05 0.00 0.00 55.36 55.17 2jd4 s GLN 2900Cb -0.05 -1.05 -0.01 0.00 1.10 0.00 0.00 33.01 33.01 2jd4 s GLN 2900CO -0.04 -0.04 -0.19 0.42 -0.55 0.00 0.00 175.29 174.89 2jd4 s ILE 2901N 0.81 2.46 0.01 -2.34 1.01 -0.14 -0.97 121.20 122.05 2jd4 s ILE 2901Ca -0.13 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.68 2jd4 s ILE 2901Cb -0.15 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 2jd4 s ILE 2901CO 0.02 0.54 -0.09 0.42 0.00 0.00 0.00 174.94 175.83 2jd4 s THR 2902N 0.36 0.68 0.06 2.92 -4.23 -0.69 -0.64 115.64 114.10 2jd4 s THR 2902Ca -0.15 -0.60 -0.28 0.00 -1.18 0.00 0.00 61.69 59.48 2jd4 s THR 2902Cb -0.17 -0.62 0.10 0.00 1.34 0.00 0.00 72.50 73.15 2jd4 s THR 2902CO 0.07 0.03 1.15 -1.48 -0.54 0.00 0.00 174.62 173.86 2jd4 s LEU 2903N -0.64 -0.09 0.03 4.79 0.05 -0.69 -1.00 118.68 121.14 2jd4 s LEU 2903Ca 0.00 -0.28 0.06 0.00 0.05 0.00 0.00 54.13 53.97 2jd4 s LEU 2903Cb -0.05 1.71 -0.02 0.00 -2.05 0.00 0.00 46.19 45.77 2jd4 s LEU 2903CO 0.00 -0.56 -0.18 -1.61 -0.55 0.00 0.00 176.35 173.45 2jd4 s GLU 2904N -2.69 1.22 0.05 1.48 2.02 -0.85 -0.83 118.70 119.11 2jd4 s GLU 2904Ca 0.15 -0.80 -0.10 0.00 0.02 0.00 0.00 54.97 54.24 2jd4 s GLU 2904Cb 0.02 -1.27 0.01 0.00 0.10 0.00 0.00 34.13 32.98 2jd4 s GLU 2904CO -0.01 0.33 0.21 -0.59 0.02 0.00 0.00 175.26 175.22 2jd4 s PHE 2905N -0.73 0.04 0.01 1.61 -0.12 -0.24 -1.79 117.98 116.78 2jd4 s PHE 2905Ca 0.05 -0.29 0.01 0.00 -0.05 0.00 0.00 56.93 56.65 2jd4 s PHE 2905Cb -0.08 -0.01 -0.01 0.00 -0.63 0.00 0.00 43.02 42.29 2jd4 s PHE 2905CO 0.01 -0.47 -0.04 -0.98 -0.05 0.00 0.00 175.22 173.70 2jd4 s ARG 2906N -2.83 0.30 -0.05 1.99 1.70 -0.99 -0.30 118.95 118.77 2jd4 s ARG 2906Ca -0.03 -0.38 -0.29 0.00 -0.47 0.00 0.00 55.73 54.55 2jd4 s ARG 2906Cb 0.00 -0.12 0.11 0.00 -0.57 0.00 0.00 34.95 34.37 2jd4 s ARG 2906CO -0.05 0.02 0.92 -0.08 -1.08 0.00 0.00 175.30 175.02 2jd4 s THR 2907N -0.75 0.00 -0.13 4.99 -1.32 -1.26 -2.13 115.64 115.04 2jd4 s THR 2907Ca -0.06 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.51 2jd4 s THR 2907Cb -0.06 -1.00 0.17 0.00 -1.51 0.00 0.00 72.50 70.10 2jd4 s THR 2907CO -0.00 0.00 1.10 0.35 -2.21 0.00 0.00 174.62 173.86 2jd4 n THR 2908N 0.06 1.42 -4.32 5.08 -2.24 -1.26 -2.17 114.28 110.85 2jd4 n THR 2908Ca -0.09 -1.54 -0.32 0.00 -2.27 0.00 0.00 64.05 59.83 2jd4 n THR 2908Cb 0.60 0.17 -0.09 0.00 -2.10 0.00 0.00 70.33 68.91 2jd4 n THR 2908CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jd4 s SER 2909N -1.78 4.83 0.00 3.42 0.15 -1.26 -4.70 113.70 114.36 2jd4 s SER 2909Ca 0.17 -0.13 0.27 0.00 0.70 0.00 0.00 55.95 56.95 2jd4 s SER 2909Cb 0.14 -1.16 0.82 0.00 -1.71 0.00 0.00 66.02 64.11 2jd4 s SER 2909CO 0.03 0.25 1.61 2.29 1.20 0.00 0.00 173.24 178.61 2jd4 n LYS 2910N 1.23 0.88 -4.14 5.44 2.85 -1.26 -4.69 118.16 118.46 2jd4 n LYS 2910Ca -0.14 -0.50 -0.17 0.00 -1.05 0.00 0.00 58.31 56.45 2jd4 n LYS 2910Cb 0.52 -1.49 -0.15 0.00 -0.65 0.00 0.00 35.03 33.26 2jd4 n LYS 2910CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2jd4 s ASN 2911N -2.47 0.70 0.00 -5.58 -0.87 -1.26 -1.52 114.94 103.94 2jd4 s ASN 2911Ca 0.26 -0.10 0.00 0.00 -1.57 0.00 0.00 52.86 51.45 2jd4 s ASN 2911Cb 0.19 -0.21 0.00 0.00 -0.02 0.00 0.00 41.25 41.21 2jd4 s ASN 2911CO 0.50 0.00 0.00 0.61 -2.57 0.00 0.00 177.10 175.65 2jd4 n GLY 2912N 3.47 1.42 3.73 0.66 0.00 0.04 -4.67 105.19 109.83 2jd4 n GLY 2912Ca -0.19 0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2jd4 n GLY 2912CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jd4 s VAL 2913N 0.00 3.65 -0.27 1.61 1.01 0.01 -0.43 120.40 125.99 2jd4 s VAL 2913Ca 0.00 1.33 -0.15 0.00 0.00 0.00 0.00 61.98 63.16 2jd4 s VAL 2913Cb 0.00 -3.85 -0.13 0.00 0.00 0.00 0.00 36.38 32.40 2jd4 s VAL 2913CO 0.00 0.19 -0.29 0.18 0.00 0.00 0.00 175.10 175.18 2jd4 n LEU 2914N 2.85 1.95 -3.64 3.92 4.77 0.22 -3.63 117.00 123.44 2jd4 n LEU 2914Ca 0.06 0.35 -0.15 0.00 -0.03 0.00 0.00 56.01 56.24 2jd4 n LEU 2914Cb 0.45 -0.83 -0.08 0.00 -2.33 0.00 0.00 43.42 40.63 2jd4 n LEU 2914CO 0.56 0.49 0.31 -0.22 -1.33 0.00 0.00 177.39 177.20 2jd4 s LEU 2915N -7.58 -0.28 -0.10 2.23 0.20 -0.68 -1.24 118.68 111.23 2jd4 s LEU 2915Ca -0.37 0.95 -0.07 0.00 0.69 0.00 0.00 54.13 55.33 2jd4 s LEU 2915Cb 0.13 2.12 0.03 0.00 -0.43 0.00 0.00 46.19 48.04 2jd4 s LEU 2915CO 0.50 -0.35 0.24 -0.83 -0.29 0.00 0.00 176.35 175.62 2jd4 s GLY 2916N -0.29 -0.17 -0.12 7.98 0.00 -0.27 -0.48 107.32 113.97 2jd4 s GLY 2916Ca -0.05 0.80 -0.03 0.00 0.00 0.00 0.00 44.72 45.45 2jd4 s GLY 2916CO 0.04 0.84 0.05 -0.42 0.00 0.00 0.00 173.10 173.60 2jd4 s ILE 2917N 0.55 0.14 -0.04 0.90 1.01 -0.96 -1.37 121.20 121.41 2jd4 s ILE 2917Ca -0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 60.65 60.52 2jd4 s ILE 2917Cb -0.05 -0.54 0.01 0.00 0.01 0.00 0.00 42.46 41.90 2jd4 s ILE 2917CO -0.03 -0.01 0.20 -0.55 0.00 0.00 0.00 174.94 174.55 2jd4 s SER 2918N 2.05 -0.13 0.85 3.58 0.15 -1.26 -0.84 113.70 118.11 2jd4 s SER 2918Ca 0.03 0.15 -0.12 0.00 0.70 0.00 0.00 55.95 56.70 2jd4 s SER 2918Cb -0.14 0.33 0.12 0.00 -1.71 0.00 0.00 66.02 64.63 2jd4 s SER 2918CO -0.06 -0.23 1.21 -0.94 1.20 0.00 0.00 173.24 174.41 2jd4 s SER 2919N -0.64 4.02 0.00 5.45 1.04 -0.51 -4.73 113.70 118.34 2jd4 s SER 2919Ca -0.07 0.51 0.07 0.00 0.48 0.00 0.00 55.95 56.94 2jd4 s SER 2919Cb -0.04 -0.85 0.23 0.00 0.10 0.00 0.00 66.02 65.45 2jd4 s SER 2919CO 0.01 -2.18 1.18 0.00 0.98 0.00 0.00 173.24 173.24 2jd4 n ALA 2920N -3.42 2.48 -2.00 5.32 0.00 -1.26 -4.68 120.51 116.95 2jd4 n ALA 2920Ca 0.11 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2jd4 n ALA 2920Cb 0.60 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.05 2jd4 n ALA 2920CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jd4 n LYS 2921N 0.01 0.00 -0.10 0.00 5.02 -1.26 -5.04 118.16 116.79 2jd4 n LYS 2921Ca 0.07 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.21 2jd4 n LYS 2921Cb 0.16 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.12 2jd4 n LYS 2921CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2jd4 n VAL 2922N 0.00 1.51 -1.70 -0.18 0.31 -1.26 -4.81 118.33 112.20 2jd4 n VAL 2922Ca 0.00 -0.02 -0.44 0.00 -0.01 0.00 0.00 64.34 63.88 2jd4 n VAL 2922Cb 0.00 -2.21 -0.03 0.00 -0.91 0.00 0.00 33.84 30.69 2jd4 n VAL 2922CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2jd4 n ASP 2923N -4.40 3.30 0.00 4.52 9.92 -1.26 -4.82 116.55 123.81 2jd4 n ASP 2923Ca -0.26 1.12 0.00 0.00 -0.53 0.00 0.00 54.79 55.12 2jd4 n ASP 2923Cb 0.63 -1.49 0.00 0.00 -0.64 0.00 0.00 41.12 39.62 2jd4 n ASP 2923CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jd4 n ALA 2924N 2.64 0.00 -2.44 2.24 0.00 -0.91 -1.42 120.51 120.62 2jd4 n ALA 2924Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.43 2jd4 n ALA 2924Cb 0.33 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.67 2jd4 n ALA 2924CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2jd4 s ILE 2925N -2.00 0.94 -0.07 0.00 -5.25 -0.02 -0.89 121.20 113.92 2jd4 s ILE 2925Ca 0.00 -1.70 -0.29 0.00 -0.99 0.00 0.00 60.65 57.67 2jd4 s ILE 2925Cb 0.00 -1.43 0.07 0.00 2.95 0.00 0.00 42.46 44.05 2jd4 s ILE 2925CO 0.00 -0.60 0.66 -0.83 -1.79 0.00 0.00 174.94 172.38 2jd4 s GLY 2926N -2.56 -0.55 -0.07 6.27 0.00 -0.08 -2.27 107.32 108.07 2jd4 s GLY 2926Ca 0.07 1.32 0.01 0.00 0.00 0.00 0.00 44.72 46.12 2jd4 s GLY 2926CO -0.00 0.98 -0.06 -2.27 0.00 0.00 0.00 173.10 171.74 2jd4 s LEU 2927N -1.04 1.25 0.08 0.66 2.96 0.37 -0.80 118.68 122.15 2jd4 s LEU 2927Ca -0.10 -0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 53.42 2jd4 s LEU 2927Cb -0.01 -0.63 0.04 0.00 0.50 0.00 0.00 46.19 46.09 2jd4 s LEU 2927CO 0.09 -0.07 0.45 -1.83 -1.32 0.00 0.00 176.35 173.67 2jd4 s GLU 2928N 1.22 1.02 -0.22 1.98 -1.05 -0.71 -0.61 118.70 120.33 2jd4 s GLU 2928Ca -0.06 -0.44 -0.07 0.00 -0.15 0.00 0.00 54.97 54.26 2jd4 s GLU 2928Cb -0.14 0.46 -0.03 0.00 -0.44 0.00 0.00 34.13 33.98 2jd4 s GLU 2928CO -0.02 -0.38 0.06 0.42 0.95 0.00 0.00 175.26 176.30 2jd4 s ILE 2929N -2.96 4.49 -0.14 1.83 1.01 0.42 -0.85 121.20 125.01 2jd4 s ILE 2929Ca -0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 2jd4 s ILE 2929Cb 0.00 -3.06 0.04 0.00 0.01 0.00 0.00 42.46 39.45 2jd4 s ILE 2929CO -0.06 0.39 0.00 -0.69 0.00 0.00 0.00 174.94 174.59 2jd4 s VAL 2930N 1.08 0.57 -1.44 2.92 1.01 0.03 -0.78 120.40 123.80 2jd4 s VAL 2930Ca 0.04 -0.30 -0.09 0.00 0.00 0.00 0.00 61.98 61.63 2jd4 s VAL 2930Cb -0.14 -0.88 0.05 0.00 0.00 0.00 0.00 36.38 35.41 2jd4 s VAL 2930CO 0.03 0.04 0.95 -0.67 0.00 0.00 0.00 175.10 175.46 2jd4 n ASP 2931N 5.06 -4.07 0.00 3.32 2.03 -0.69 -1.80 116.55 120.40 2jd4 n ASP 2931Ca -0.09 -0.74 0.00 0.00 0.52 0.00 0.00 54.79 54.48 2jd4 n ASP 2931Cb 0.48 -4.18 0.00 0.00 -0.72 0.00 0.00 41.12 36.71 2jd4 n ASP 2931CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jd4 n GLY 2932N -1.69 1.42 3.70 0.27 0.00 -0.58 -5.03 105.19 103.28 2jd4 n GLY 2932Ca -0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 2jd4 n GLY 2932CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jd4 s LYS 2933N -0.09 2.56 -0.21 1.61 3.01 -0.74 -4.66 119.74 121.21 2jd4 s LYS 2933Ca 0.00 -1.01 -0.08 0.00 -1.01 0.00 0.00 55.97 53.87 2jd4 s LYS 2933Cb 0.00 -2.46 -0.04 0.00 -1.01 0.00 0.00 37.83 34.32 2jd4 s LYS 2933CO 0.00 0.47 0.10 0.08 0.51 0.00 0.00 175.35 176.51 2jd4 s VAL 2934N -1.68 4.90 -0.05 3.17 1.01 -0.36 -0.79 120.40 126.61 2jd4 s VAL 2934Ca 0.28 0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.33 2jd4 s VAL 2934Cb -0.10 -3.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 2jd4 s VAL 2934CO 0.20 0.40 -0.23 -0.76 0.00 0.00 0.00 175.10 174.71 2jd4 s LEU 2935N 0.80 2.20 -0.20 3.92 1.43 -0.03 -0.71 118.68 126.10 2jd4 s LEU 2935Ca 0.05 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 2jd4 s LEU 2935Cb -0.13 -1.40 0.03 0.00 0.03 0.00 0.00 46.19 44.72 2jd4 s LEU 2935CO 0.02 0.28 -0.15 0.12 0.23 0.00 0.00 176.35 176.85 2jd4 s PHE 2936N -0.38 2.73 -0.07 0.29 5.36 -0.75 -1.73 117.98 123.44 2jd4 s PHE 2936Ca 0.03 -1.72 0.03 0.00 -0.96 0.00 0.00 56.93 54.30 2jd4 s PHE 2936Cb -0.12 -1.82 -0.02 0.00 -0.34 0.00 0.00 43.02 40.71 2jd4 s PHE 2936CO 0.02 -0.79 -0.13 -1.01 -1.46 0.00 0.00 175.22 171.84 2jd4 s HIS 2937N 1.30 2.74 -0.02 10.12 3.76 0.02 -1.54 115.29 131.67 2jd4 s HIS 2937Ca 0.01 -0.22 -0.00 0.00 -0.15 0.00 0.00 55.06 54.69 2jd4 s HIS 2937Cb -0.15 -1.67 0.03 0.00 1.11 0.00 0.00 32.58 31.90 2jd4 s HIS 2937CO -0.10 0.13 0.04 0.08 -0.85 0.00 0.00 174.74 174.04 2jd4 s VAL 2938N -0.55 -0.06 -0.19 -0.90 1.01 -0.01 -0.90 120.40 118.80 2jd4 s VAL 2938Ca 0.08 0.22 -0.00 0.00 0.00 0.00 0.00 61.98 62.27 2jd4 s VAL 2938Cb -0.12 -0.09 0.05 0.00 0.00 0.00 0.00 36.38 36.22 2jd4 s VAL 2938CO 0.01 0.09 -0.05 0.21 0.00 0.00 0.00 175.10 175.36 2jd4 s ASN 2939N 1.09 3.15 0.00 3.32 3.84 -0.07 -0.46 114.94 125.81 2jd4 s ASN 2939Ca -0.09 -0.83 0.27 0.00 0.21 0.00 0.00 52.86 52.42 2jd4 s ASN 2939Cb -0.13 -0.98 0.83 0.00 -0.55 0.00 0.00 41.25 40.42 2jd4 s ASN 2939CO -0.03 -0.20 1.62 0.59 -2.79 0.00 0.00 177.10 176.28 2jd4 n ASN 2940N 4.82 1.80 0.00 -4.21 3.02 -1.26 -2.13 115.26 117.30 2jd4 n ASN 2940Ca -0.12 -1.57 0.00 0.00 -0.03 0.00 0.00 54.58 52.86 2jd4 n ASN 2940Cb 0.47 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 2jd4 n ASN 2940CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jd4 n GLY 2941N 1.23 1.56 0.62 7.41 0.00 -1.26 -4.55 105.19 110.20 2jd4 n GLY 2941Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.28 2jd4 n GLY 2941CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jd4 n ALA 2942N 0.00 2.57 0.00 4.61 0.00 -1.26 -4.98 120.51 121.46 2jd4 n ALA 2942Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.82 2jd4 n ALA 2942Cb 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2jd4 n ALA 2942CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jd4 n GLY 2943N 0.97 4.42 3.74 0.00 0.00 -1.26 -5.01 105.19 108.05 2jd4 n GLY 2943Ca 0.09 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 2jd4 n GLY 2943CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jd4 s ARG 2944N -3.38 4.42 -0.15 1.61 3.52 -1.26 -4.39 118.95 119.32 2jd4 s ARG 2944Ca 0.00 2.01 -0.02 0.00 -0.13 0.00 0.00 55.73 57.59 2jd4 s ARG 2944Cb 0.00 -3.20 -0.02 0.00 -1.56 0.00 0.00 34.95 30.17 2jd4 s ARG 2944CO 0.00 -0.20 -0.09 0.42 -0.81 0.00 0.00 175.30 174.62 2jd4 s ILE 2945N 0.01 3.37 -0.04 4.11 1.01 0.39 -4.95 121.20 125.09 2jd4 s ILE 2945Ca 0.55 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 60.68 2jd4 s ILE 2945Cb -0.35 -2.45 0.02 0.00 0.01 0.00 0.00 42.46 39.68 2jd4 s ILE 2945CO 0.38 0.50 -0.06 -0.89 0.00 0.00 0.00 174.94 174.87 2jd4 s THR 2946N 0.53 0.66 -0.13 2.92 2.01 -1.26 -0.83 115.64 119.53 2jd4 s THR 2946Ca -0.06 -0.22 -0.01 0.00 0.31 0.00 0.00 61.69 61.70 2jd4 s THR 2946Cb -0.15 -0.64 -0.02 0.00 0.01 0.00 0.00 72.50 71.70 2jd4 s THR 2946CO 0.03 0.24 -0.09 0.00 -0.69 0.00 0.00 174.62 174.11 2jd4 s ALA 2947N 0.69 2.79 -0.16 7.40 0.00 -0.59 -4.79 121.76 127.10 2jd4 s ALA 2947Ca -0.10 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.00 2jd4 s ALA 2947Cb -0.13 -1.34 0.01 0.00 0.00 0.00 0.00 23.12 21.66 2jd4 s ALA 2947CO 0.01 0.27 -0.19 0.99 0.00 0.00 0.00 175.76 176.84 2jd4 s THR 2948N 0.25 2.25 -0.24 0.00 2.01 -1.26 -1.80 115.64 116.84 2jd4 s THR 2948Ca -0.06 -0.90 -0.05 0.00 0.31 0.00 0.00 61.69 60.99 2jd4 s THR 2948Cb -0.15 -1.93 -0.00 0.00 0.01 0.00 0.00 72.50 70.42 2jd4 s THR 2948CO 0.04 0.53 -0.00 -0.47 -0.69 0.00 0.00 174.62 174.03 2jd4 s TYR 2949N 1.04 3.03 -0.20 4.92 5.04 0.11 -4.95 117.35 126.34 2jd4 s TYR 2949Ca -0.01 -0.93 0.01 0.00 -2.44 0.00 0.00 57.07 53.70 2jd4 s TYR 2949Cb -0.14 -2.15 0.03 0.00 0.35 0.00 0.00 41.96 40.04 2jd4 s TYR 2949CO -0.06 -0.54 -0.17 -1.14 -1.34 0.00 0.00 175.55 172.30 2jd4 s GLN 2950N 1.49 2.74 0.68 4.97 0.74 -1.26 -1.22 119.66 127.80 2jd4 s GLN 2950Ca 0.05 -0.92 -0.16 0.00 0.05 0.00 0.00 55.36 54.38 2jd4 s GLN 2950Cb -0.15 -2.60 0.01 0.00 1.10 0.00 0.00 33.01 31.37 2jd4 s GLN 2950CO -0.01 -0.30 1.19 -1.25 -0.55 0.00 0.00 175.29 174.37 2jd4 s PRO 2951N 1.27 2.48 0.32 1.67 0.04 -1.26 -4.91 135.00 134.61 2jd4 s PRO 2951Ca 0.02 1.71 0.06 0.00 0.04 0.00 0.00 61.00 62.82 2jd4 s PRO 2951Cb -0.15 -1.88 0.71 0.00 0.04 0.00 0.00 34.50 33.22 2jd4 s PRO 2951CO -0.11 -1.56 1.86 0.07 0.04 0.00 0.00 177.00 177.29 2jd4 h ARG 2952N 0.08 0.80 -4.54 4.56 0.11 -2.01 -3.34 114.38 110.04 2jd4 h ARG 2952Ca -0.48 -0.05 -0.72 0.00 0.10 0.00 0.00 59.98 58.83 2jd4 h ARG 2952Cb 1.29 -0.18 -0.21 0.00 1.11 0.00 0.00 29.97 31.98 2jd4 h ARG 2952CO 0.52 0.53 -0.40 0.00 0.10 0.00 0.00 179.97 180.72 2jd4 s ALA 2953N -5.80 3.48 0.13 0.08 0.00 -1.26 -4.98 121.76 113.40 2jd4 s ALA 2953Ca -0.11 -1.71 -0.07 0.00 0.00 0.00 0.00 51.96 50.08 2jd4 s ALA 2953Cb 0.22 -2.92 0.17 0.00 0.00 0.00 0.00 23.12 20.59 2jd4 s ALA 2953CO 0.80 -1.48 0.78 0.00 0.00 0.00 0.00 175.76 175.85 2jd4 n ALA 2954N 5.21 0.02 -1.60 0.00 0.00 -1.26 0.10 120.51 122.98 2jd4 n ALA 2954Ca -0.11 0.52 -0.19 0.00 0.00 0.00 0.00 53.44 53.66 2jd4 n ALA 2954Cb 0.47 -0.27 0.11 0.00 0.00 0.00 0.00 19.45 19.76 2jd4 n ALA 2954CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jd4 n ARG 2955N -4.77 2.65 0.13 0.00 5.12 -1.26 -4.70 116.66 113.83 2jd4 n ARG 2955Ca 0.06 -3.53 -0.01 0.00 -1.93 0.00 0.00 57.85 52.44 2jd4 n ARG 2955Cb 0.22 -2.11 0.25 0.00 -1.16 0.00 0.00 32.46 29.66 2jd4 n ARG 2955CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2jd4 h ALA 2956N 1.64 1.15 0.00 7.54 0.00 -0.70 -3.18 119.26 125.71 2jd4 h ALA 2956Ca 0.39 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 2jd4 h ALA 2956Cb 1.47 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 2jd4 h ALA 2956CO 0.85 0.60 -0.76 -0.07 0.00 0.00 0.00 179.25 179.87 2jd4 h LEU 2957N 0.09 0.00 -3.61 0.00 3.38 -1.84 -3.24 115.31 110.10 2jd4 h LEU 2957Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 2jd4 h LEU 2957Cb 0.85 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.38 2jd4 h LEU 2957CO 0.06 0.76 0.57 0.00 0.09 0.00 0.00 178.44 179.93 2jd4 n ASP 2959N -0.46 1.44 0.00 0.00 5.75 -1.22 -1.70 116.55 120.36 2jd4 n ASP 2959Ca 0.45 -1.51 0.00 0.00 -0.01 0.00 0.00 54.79 53.72 2jd4 n ASP 2959Cb 0.95 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 41.02 2jd4 n ASP 2959CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jd4 n GLY 2960N 1.15 1.67 3.97 6.12 0.00 -0.92 -4.65 105.19 112.53 2jd4 n GLY 2960Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2jd4 n GLY 2960CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jd4 s LYS 2961N -0.11 2.69 0.24 1.61 1.02 -1.26 -4.59 119.74 119.34 2jd4 s LYS 2961Ca 0.00 -0.73 -0.28 0.00 0.02 0.00 0.00 55.97 54.98 2jd4 s LYS 2961Cb 0.00 -2.52 -0.09 0.00 -0.52 0.00 0.00 37.83 34.70 2jd4 s LYS 2961CO 0.00 -0.58 0.91 -1.58 -0.92 0.00 0.00 175.35 173.18 2jd4 s TRP 2962N -2.69 3.90 0.06 3.18 0.52 -1.26 -4.24 118.94 118.42 2jd4 s TRP 2962Ca 0.55 1.83 0.06 0.00 0.02 0.00 0.00 56.10 58.55 2jd4 s TRP 2962Cb -0.10 -2.92 -0.03 0.00 -1.15 0.00 0.00 33.47 29.27 2jd4 s TRP 2962CO 0.38 0.41 -0.17 -1.01 0.02 0.00 0.00 176.95 176.59 2jd4 s HIS 2963N -1.28 1.43 0.01 -1.98 3.76 0.59 -4.94 115.29 112.88 2jd4 s HIS 2963Ca 0.42 -0.40 -0.04 0.00 -0.15 0.00 0.00 55.06 54.89 2jd4 s HIS 2963Cb -0.24 -0.82 -0.04 0.00 1.11 0.00 0.00 32.58 32.59 2jd4 s HIS 2963CO 0.29 0.09 0.24 0.95 -0.85 0.00 0.00 174.74 175.45 2jd4 s THR 2964N -1.02 5.35 -0.06 1.30 -4.23 -1.26 -1.08 115.64 114.65 2jd4 s THR 2964Ca 0.02 -0.02 -0.05 0.00 -1.18 0.00 0.00 61.69 60.47 2jd4 s THR 2964Cb -0.09 -3.56 0.02 0.00 1.34 0.00 0.00 72.50 70.20 2jd4 s THR 2964CO 0.02 0.31 0.14 -0.22 -0.54 0.00 0.00 174.62 174.33 2jd4 s LEU 2965N -1.96 1.34 -0.04 4.79 0.20 -0.01 -1.20 118.68 121.81 2jd4 s LEU 2965Ca 0.29 0.29 -0.01 0.00 0.69 0.00 0.00 54.13 55.39 2jd4 s LEU 2965Cb -0.13 0.47 0.03 0.00 -0.43 0.00 0.00 46.19 46.14 2jd4 s LEU 2965CO 0.19 -0.06 0.06 -1.10 -0.29 0.00 0.00 176.35 175.14 2jd4 s GLN 2966N 0.24 -0.04 -0.14 1.98 -0.21 0.00 -1.71 119.66 119.79 2jd4 s GLN 2966Ca -0.01 0.31 0.01 0.00 0.02 0.00 0.00 55.36 55.69 2jd4 s GLN 2966Cb -0.03 -0.35 0.02 0.00 1.00 0.00 0.00 33.01 33.65 2jd4 s GLN 2966CO -0.01 -0.25 -0.15 0.00 -2.12 0.00 0.00 175.29 172.77 2jd4 s ALA 2967N 1.62 1.84 -0.11 6.09 0.00 0.19 -0.30 121.76 131.09 2jd4 s ALA 2967Ca -0.02 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 51.09 2jd4 s ALA 2967Cb -0.12 -0.98 0.01 0.00 0.00 0.00 0.00 23.12 22.02 2jd4 s ALA 2967CO -0.03 -0.26 -0.19 -1.58 0.00 0.00 0.00 175.76 173.70 2jd4 s HIS 2968N 1.28 2.24 -0.20 0.00 5.04 0.46 -0.96 115.29 123.15 2jd4 s HIS 2968Ca 0.00 -1.04 -0.04 0.00 -1.54 0.00 0.00 55.06 52.45 2jd4 s HIS 2968Cb -0.14 -1.56 -0.01 0.00 0.04 0.00 0.00 32.58 30.91 2jd4 s HIS 2968CO -0.07 -0.49 -0.04 0.21 -2.34 0.00 0.00 174.74 172.01 2jd4 s LYS 2969N 0.78 3.46 -0.32 2.88 2.20 0.34 -1.45 119.74 127.63 2jd4 s LYS 2969Ca -0.10 -0.60 -0.01 0.00 -0.36 0.00 0.00 55.97 54.91 2jd4 s LYS 2969Cb -0.16 -3.00 0.11 0.00 -1.51 0.00 0.00 37.83 33.27 2jd4 s LYS 2969CO 0.01 -0.09 0.12 0.45 -0.36 0.00 0.00 175.35 175.48 2jd4 s SER 2970N 1.20 3.93 1.93 1.43 0.15 -0.48 -1.82 113.70 120.05 2jd4 s SER 2970Ca 0.03 -1.74 0.00 0.00 0.70 0.00 0.00 55.95 54.94 2jd4 s SER 2970Cb -0.14 -0.83 0.00 0.00 -1.71 0.00 0.00 66.02 63.33 2jd4 s SER 2970CO -0.01 -0.40 0.00 0.29 1.20 0.00 0.00 173.24 174.33 2jd4 n LYS 2971N 4.71 0.00 -0.32 5.44 5.02 -0.56 -1.67 118.16 130.78 2jd4 n LYS 2971Ca -0.01 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.38 2jd4 n LYS 2971Cb 0.41 0.00 0.27 0.00 -0.02 0.00 0.00 35.03 35.69 2jd4 n LYS 2971CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 2jd4 n HIS 2972N 13.87 0.84 -4.51 2.13 1.44 -1.26 -4.79 115.22 122.94 2jd4 n HIS 2972Ca 0.00 -0.41 -0.31 0.00 -2.01 0.00 0.00 57.72 54.98 2jd4 n HIS 2972Cb 0.00 -0.01 -0.11 0.00 0.12 0.00 0.00 29.99 29.99 2jd4 n HIS 2972CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2jd4 s ARG 2973N -1.20 2.31 0.04 -1.40 0.52 -0.67 -1.58 118.95 116.98 2jd4 s ARG 2973Ca 0.41 -0.86 -0.00 0.00 -0.52 0.00 0.00 55.73 54.76 2jd4 s ARG 2973Cb 0.22 -2.36 -0.03 0.00 0.52 0.00 0.00 34.95 33.30 2jd4 s ARG 2973CO 0.28 0.57 -0.04 0.96 0.02 0.00 0.00 175.30 177.08 2jd4 s ILE 2974N -1.00 0.26 -0.05 1.52 -4.36 -0.17 -1.38 121.20 116.01 2jd4 s ILE 2974Ca 0.17 -1.43 -0.02 0.00 -0.26 0.00 0.00 60.65 59.10 2jd4 s ILE 2974Cb -0.11 -1.00 0.04 0.00 1.25 0.00 0.00 42.46 42.64 2jd4 s ILE 2974CO 0.07 -0.75 0.12 -0.69 0.24 0.00 0.00 174.94 173.93 2jd4 s VAL 2975N -2.77 -0.05 -0.16 8.37 1.01 -0.52 -2.31 120.40 123.97 2jd4 s VAL 2975Ca -0.02 0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.15 2jd4 s VAL 2975Cb -0.00 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.18 2jd4 s VAL 2975CO -0.05 0.07 -0.20 -0.22 0.00 0.00 0.00 175.10 174.70 2jd4 s LEU 2976N 1.10 2.21 -0.15 3.92 2.96 -0.20 -0.40 118.68 128.11 2jd4 s LEU 2976Ca -0.09 -0.58 0.02 0.00 -0.22 0.00 0.00 54.13 53.26 2jd4 s LEU 2976Cb -0.11 -1.49 0.02 0.00 0.50 0.00 0.00 46.19 45.11 2jd4 s LEU 2976CO -0.05 0.06 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.96 2jd4 s THR 2977N 0.95 1.89 -0.12 3.68 2.01 0.59 -0.76 115.64 123.87 2jd4 s THR 2977Ca -0.03 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.12 2jd4 s THR 2977Cb -0.15 -1.70 0.02 0.00 0.01 0.00 0.00 72.50 70.68 2jd4 s THR 2977CO -0.04 0.51 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.58 2jd4 s VAL 2978N 1.07 1.43 -1.46 3.82 1.01 -0.21 -0.82 120.40 125.24 2jd4 s VAL 2978Ca -0.02 -0.57 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 2jd4 s VAL 2978Cb -0.14 -1.34 0.03 0.00 0.00 0.00 0.00 36.38 34.93 2jd4 s VAL 2978CO -0.06 0.43 0.66 0.47 0.00 0.00 0.00 175.10 176.61 2jd4 n ASP 2979N 4.53 -5.30 0.00 3.32 8.00 -0.34 -1.43 116.55 125.33 2jd4 n ASP 2979Ca -0.17 -0.39 0.00 0.00 0.71 0.00 0.00 54.79 54.94 2jd4 n ASP 2979Cb 0.51 -4.29 0.00 0.00 -0.02 0.00 0.00 41.12 37.32 2jd4 n ASP 2979CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jd4 n GLY 2980N -1.48 1.28 3.61 0.44 0.00 -1.26 -5.02 105.19 102.76 2jd4 n GLY 2980Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2jd4 n GLY 2980CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jd4 s ASN 2981N -3.15 6.07 -0.01 1.61 0.01 -0.51 -5.07 114.94 113.88 2jd4 s ASN 2981Ca 0.00 0.05 -0.01 0.00 -0.71 0.00 0.00 52.86 52.18 2jd4 s ASN 2981Cb 0.00 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.50 2jd4 s ASN 2981CO 0.00 -0.02 0.11 -0.44 -1.51 0.00 0.00 177.10 175.24 2jd4 s SER 2982N 1.53 5.90 0.01 -1.22 0.01 -1.26 -1.05 113.70 117.62 2jd4 s SER 2982Ca 0.08 0.22 0.02 0.00 1.31 0.00 0.00 55.95 57.57 2jd4 s SER 2982Cb -0.15 -1.75 -0.01 0.00 0.21 0.00 0.00 66.02 64.32 2jd4 s SER 2982CO 0.09 0.28 -0.06 -0.69 0.41 0.00 0.00 173.24 173.27 2jd4 s VAL 2983N -1.22 0.41 0.21 3.43 1.01 0.06 -4.99 120.40 119.31 2jd4 s VAL 2983Ca 0.24 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.81 2jd4 s VAL 2983Cb -0.12 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 2jd4 s VAL 2983CO 0.15 -0.02 0.03 0.00 0.00 0.00 0.00 175.10 175.26 2jd4 s ARG 2984N -0.49 1.24 0.14 2.72 1.70 -1.26 -1.04 118.95 121.96 2jd4 s ARG 2984Ca -0.01 -1.63 -0.24 0.00 -0.47 0.00 0.00 55.73 53.38 2jd4 s ARG 2984Cb -0.04 -0.33 0.07 0.00 -0.57 0.00 0.00 34.95 34.09 2jd4 s ARG 2984CO -0.00 -0.18 0.63 0.00 -1.08 0.00 0.00 175.30 174.68 2jd4 s ALA 2985N -3.65 -1.63 -0.09 7.88 0.00 -0.98 -4.91 121.76 118.39 2jd4 s ALA 2985Ca 0.29 0.57 -0.21 0.00 0.00 0.00 0.00 51.96 52.61 2jd4 s ALA 2985Cb 0.07 0.82 0.05 0.00 0.00 0.00 0.00 23.12 24.05 2jd4 s ALA 2985CO 0.08 -0.75 0.50 -1.83 0.00 0.00 0.00 175.76 173.76 2jd4 s GLU 2986N -3.62 0.78 0.34 0.00 -1.05 -1.26 -1.00 118.70 112.88 2jd4 s GLU 2986Ca 0.01 0.27 -0.27 0.00 -0.15 0.00 0.00 54.97 54.83 2jd4 s GLU 2986Cb -0.01 0.36 -0.09 0.00 -0.44 0.00 0.00 34.13 33.95 2jd4 s GLU 2986CO -0.12 -0.19 1.13 0.45 0.95 0.00 0.00 175.26 177.48 2jd4 s SER 2987N -0.74 6.90 0.28 0.83 0.15 -0.62 -4.92 113.70 115.59 2jd4 s SER 2987Ca -0.08 2.29 0.26 0.00 0.70 0.00 0.00 55.95 59.11 2jd4 s SER 2987Cb -0.03 -2.62 0.84 0.00 -1.71 0.00 0.00 66.02 62.50 2jd4 s SER 2987CO 0.05 -0.40 1.75 1.55 1.20 0.00 0.00 173.24 177.39 2jd4 h PRO 2988N 3.17 0.00 -4.25 5.44 0.13 -1.98 -3.37 132.00 131.14 2jd4 h PRO 2988Ca -0.48 0.00 -0.76 0.00 -0.87 0.00 0.00 66.00 63.89 2jd4 h PRO 2988Cb 1.22 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.12 2jd4 h PRO 2988CO 0.65 0.00 0.64 -1.01 -0.23 0.00 0.00 178.00 178.05 2jd4 s HIS 2989N -3.21 3.69 -0.92 1.56 3.76 -1.26 -4.90 115.29 114.00 2jd4 s HIS 2989Ca 0.08 -2.07 0.12 0.00 -0.15 0.00 0.00 55.06 53.05 2jd4 s HIS 2989Cb 0.10 -4.04 0.54 0.00 1.11 0.00 0.00 32.58 30.29 2jd4 s HIS 2989CO 0.55 -1.19 1.39 0.25 -0.85 0.00 0.00 174.74 174.89 2jd4 n THR 2990N 4.14 1.20 0.49 1.30 -2.24 -1.26 -2.78 114.28 115.14 2jd4 n THR 2990Ca 0.24 0.32 0.13 0.00 -2.27 0.00 0.00 64.05 62.47 2jd4 n THR 2990Cb 0.45 -1.15 0.33 0.00 -2.10 0.00 0.00 70.33 67.85 2jd4 n THR 2990CO 0.00 0.00 0.00 1.12 -0.57 0.00 0.00 175.07 175.62 2jd4 h HIS 2991N 0.00 0.00 -3.33 4.78 2.07 -1.96 -3.41 115.15 113.30 2jd4 h HIS 2991Ca 0.00 0.00 -0.76 0.00 -2.85 0.00 0.00 60.37 56.76 2jd4 h HIS 2991Cb 0.20 0.00 -0.26 0.00 2.57 0.00 0.00 27.41 29.92 2jd4 h HIS 2991CO 0.00 0.00 -0.16 0.45 -3.07 0.00 0.00 177.93 175.15 2jd4 s SER 2992N -5.08 6.25 -0.00 3.10 0.15 -1.12 -4.87 113.70 112.13 2jd4 s SER 2992Ca 0.09 -2.08 0.01 0.00 0.70 0.00 0.00 55.95 54.67 2jd4 s SER 2992Cb 0.10 -2.17 -0.01 0.00 -1.71 0.00 0.00 66.02 62.23 2jd4 s SER 2992CO 0.62 -0.75 0.03 0.35 1.20 0.00 0.00 173.24 174.70 2jd4 n THR 2993N 4.81 0.00 -4.46 6.45 -2.24 -1.26 -4.45 114.28 113.13 2jd4 n THR 2993Ca -0.05 -0.48 -0.34 0.00 -2.27 0.00 0.00 64.05 60.91 2jd4 n THR 2993Cb 0.42 1.00 -0.12 0.00 -2.10 0.00 0.00 70.33 69.53 2jd4 n THR 2993CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jd4 s SER 2994N -1.07 4.72 -0.81 3.42 0.15 -1.26 -4.21 113.70 114.65 2jd4 s SER 2994Ca 0.00 -0.13 -0.16 0.00 0.70 0.00 0.00 55.95 56.36 2jd4 s SER 2994Cb 0.01 -1.69 0.17 0.00 -1.71 0.00 0.00 66.02 62.79 2jd4 s SER 2994CO 0.03 0.20 0.84 0.00 1.20 0.00 0.00 173.24 175.51 2jd4 s ALA 2995N 0.19 3.76 -1.23 5.45 0.00 0.85 -4.56 121.76 126.22 2jd4 s ALA 2995Ca -0.03 -2.96 -0.16 0.00 0.00 0.00 0.00 51.96 48.80 2jd4 s ALA 2995Cb -0.14 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.30 2jd4 s ALA 2995CO 0.03 -2.47 2.14 -0.25 0.00 0.00 0.00 175.76 175.21 2jd4 n ASP 2996N 5.11 3.54 -4.96 0.00 8.00 -1.26 -0.22 116.55 126.76 2jd4 n ASP 2996Ca 0.12 -2.77 -0.20 0.00 0.71 0.00 0.00 54.79 52.65 2jd4 n ASP 2996Cb 0.46 -1.47 0.04 0.00 -0.02 0.00 0.00 41.12 40.14 2jd4 n ASP 2996CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jd4 s THR 2997N 3.77 2.58 -0.39 -3.53 -4.23 -1.26 -4.85 115.64 107.73 2jd4 s THR 2997Ca 0.51 -0.87 0.05 0.00 -1.18 0.00 0.00 61.69 60.20 2jd4 s THR 2997Cb 0.14 -2.72 0.32 0.00 1.34 0.00 0.00 72.50 71.59 2jd4 s THR 2997CO -0.02 0.00 1.27 -3.20 -0.54 0.00 0.00 174.62 172.13 2jd4 n ASN 2998N -2.20 -1.74 -4.13 3.99 4.05 -1.13 -4.19 115.26 109.91 2jd4 n ASN 2998Ca 0.11 -2.69 -0.10 0.00 0.45 0.00 0.00 54.58 52.34 2jd4 n ASN 2998Cb 0.60 1.50 -0.09 0.00 1.23 0.00 0.00 39.78 43.02 2jd4 n ASN 2998CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 2jd4 s ASP 2999N -0.69 0.19 0.83 1.20 1.01 -1.04 -4.58 116.67 113.59 2jd4 s ASP 2999Ca 0.21 -1.21 -0.11 0.00 0.71 0.00 0.00 52.55 52.15 2jd4 s ASP 2999Cb 0.29 0.36 0.10 0.00 1.01 0.00 0.00 42.92 44.68 2jd4 s ASP 2999CO -0.13 -0.81 1.13 -2.84 0.21 0.00 0.00 175.17 172.73 2jd4 s PRO 3000N -4.07 1.65 -0.30 8.23 0.02 -1.25 -0.12 135.00 139.15 2jd4 s PRO 3000Ca 0.28 1.44 -0.12 0.00 0.02 0.00 0.00 61.00 62.62 2jd4 s PRO 3000Cb 0.06 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.74 2jd4 s PRO 3000CO 0.06 -2.14 0.21 0.42 -0.33 0.00 0.00 177.00 175.21 2jd4 s ILE 3001N -2.65 5.28 -0.19 2.83 1.01 0.41 -4.57 121.20 123.31 2jd4 s ILE 3001Ca 0.66 0.01 -0.11 0.00 0.00 0.00 0.00 60.65 61.21 2jd4 s ILE 3001Cb -0.21 -3.59 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 2jd4 s ILE 3001CO 0.55 0.15 0.17 -0.31 0.00 0.00 0.00 174.94 175.50 2jd4 s TYR 3002N 1.74 3.41 -0.13 3.97 1.51 -0.47 -0.60 117.35 126.78 2jd4 s TYR 3002Ca 0.07 0.38 0.02 0.00 -1.01 0.00 0.00 57.07 56.53 2jd4 s TYR 3002Cb -0.17 -2.21 0.00 0.00 -0.11 0.00 0.00 41.96 39.47 2jd4 s TYR 3002CO 0.11 0.26 -0.21 0.08 -1.11 0.00 0.00 175.55 174.68 2jd4 s VAL 3003N 0.46 2.26 0.00 0.71 1.01 0.31 -1.12 120.40 124.03 2jd4 s VAL 3003Ca 0.10 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.15 2jd4 s VAL 3003Cb -0.12 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.36 2jd4 s VAL 3003CO -0.00 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2jd4 n GLY 3004N 3.81 1.17 0.00 4.51 0.00 -0.38 -1.60 105.19 112.71 2jd4 n GLY 3004Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2jd4 n GLY 3004CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jd4 n GLY 3005N -2.00 -0.12 3.58 -0.02 0.00 -1.24 -0.25 105.19 105.13 2jd4 n GLY 3005Ca 0.00 -1.50 -0.12 0.00 0.00 0.00 0.00 46.02 44.40 2jd4 n GLY 3005CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jd4 s TYR 3006N -2.74 -0.44 0.41 1.61 -0.85 -1.26 -4.72 117.35 109.36 2jd4 s TYR 3006Ca 0.00 0.80 -0.26 0.00 -0.52 0.00 0.00 57.07 57.09 2jd4 s TYR 3006Cb 0.00 0.43 -0.09 0.00 0.38 0.00 0.00 41.96 42.68 2jd4 s TYR 3006CO 0.00 -0.38 1.31 -1.25 -1.52 0.00 0.00 175.55 173.71 2jd4 s PRO 3007N -0.94 3.95 0.61 -3.49 0.04 -1.26 -4.90 135.00 129.00 2jd4 s PRO 3007Ca -0.03 2.17 0.28 0.00 0.04 0.00 0.00 61.00 63.46 2jd4 s PRO 3007Cb -0.01 -2.75 1.47 0.00 0.04 0.00 0.00 34.50 33.25 2jd4 s PRO 3007CO 0.02 -0.51 1.87 0.00 0.04 0.00 0.00 177.00 178.42 2jd4 h ALA 3008N 2.65 1.98 -0.12 8.56 0.00 -2.01 -0.54 119.26 129.77 2jd4 h ALA 3008Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2jd4 h ALA 3008Cb 1.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2jd4 h ALA 3008CO 0.62 -0.65 0.00 -2.39 0.00 0.00 0.00 179.25 176.83 2jd4 n HIS 3009N -3.47 0.15 -3.98 0.00 1.44 -1.26 -4.83 115.22 103.27 2jd4 n HIS 3009Ca 0.06 -0.08 -0.35 0.00 -2.01 0.00 0.00 57.72 55.34 2jd4 n HIS 3009Cb 0.63 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.62 2jd4 n HIS 3009CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2jd4 s ILE 3010N -1.85 4.37 0.31 0.61 -1.09 -0.21 -5.09 121.20 118.25 2jd4 s ILE 3010Ca 0.34 -0.17 -0.27 0.00 -2.23 0.00 0.00 60.65 58.31 2jd4 s ILE 3010Cb 0.18 -2.99 -0.09 0.00 -1.58 0.00 0.00 42.46 37.98 2jd4 s ILE 3010CO 0.28 0.41 1.01 -0.75 -1.23 0.00 0.00 174.94 174.66 2jd4 s LYS 3011N 0.93 4.57 -0.39 2.79 2.20 -1.26 -4.86 119.74 123.71 2jd4 s LYS 3011Ca 0.03 1.53 0.02 0.00 -0.36 0.00 0.00 55.97 57.19 2jd4 s LYS 3011Cb -0.14 -2.96 0.15 0.00 -1.51 0.00 0.00 37.83 33.38 2jd4 s LYS 3011CO 0.02 0.22 0.27 -0.65 -0.36 0.00 0.00 175.35 174.85 2jd4 s GLN 3012N -1.79 0.81 0.00 4.03 -1.52 -1.26 -4.71 119.66 115.22 2jd4 s GLN 3012Ca 0.48 -1.74 0.08 0.00 -1.95 0.00 0.00 55.36 52.23 2jd4 s GLN 3012Cb -0.25 -1.51 0.33 0.00 -0.22 0.00 0.00 33.01 31.36 2jd4 s GLN 3012CO 0.31 -1.27 1.25 -1.71 -0.25 0.00 0.00 175.29 173.62 2jd4 n ASN 3013N 3.50 0.00 -0.96 5.90 5.15 -1.26 -2.54 115.26 125.04 2jd4 n ASN 3013Ca 0.18 0.50 -0.02 0.00 -0.60 0.00 0.00 54.58 54.64 2jd4 n ASN 3013Cb 0.41 -0.50 0.17 0.00 -0.53 0.00 0.00 39.78 39.33 2jd4 n ASN 3013CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2jd4 n SER 3014N -1.50 2.50 -3.82 1.20 7.64 -1.26 -4.96 113.62 113.42 2jd4 n SER 3014Ca 0.02 -3.87 -0.17 0.00 1.01 0.00 0.00 58.87 55.86 2jd4 n SER 3014Cb 0.09 -0.50 -0.16 0.00 -1.01 0.00 0.00 64.21 62.63 2jd4 n SER 3014CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jd4 s LEU 3015N -3.32 1.18 0.09 -3.43 1.43 -1.05 -3.19 118.68 110.38 2jd4 s LEU 3015Ca 0.42 -0.03 0.23 0.00 -1.03 0.00 0.00 54.13 53.71 2jd4 s LEU 3015Cb 0.38 -0.23 -0.00 0.00 0.03 0.00 0.00 46.19 46.36 2jd4 s LEU 3015CO -0.04 -0.10 0.97 -1.54 0.23 0.00 0.00 176.35 175.87 2jd4 n SER 3016N 4.13 0.60 -4.92 2.29 3.41 -1.26 -4.93 113.62 112.94 2jd4 n SER 3016Ca -0.27 0.01 -0.20 0.00 -0.26 0.00 0.00 58.87 58.15 2jd4 n SER 3016Cb 0.50 0.83 -0.02 0.00 -0.26 0.00 0.00 64.21 65.26 2jd4 n SER 3016CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2jd4 s SER 3017N -4.47 5.64 0.00 4.04 0.15 -1.26 -5.01 113.70 112.78 2jd4 s SER 3017Ca 0.01 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2jd4 s SER 3017Cb 0.13 -1.14 0.00 0.00 -1.71 0.00 0.00 66.02 63.30 2jd4 s SER 3017CO 0.81 -0.36 0.24 -1.14 1.20 0.00 0.00 173.24 173.99 2jd4 n ARG 3018N -1.48 -0.26 -1.93 5.44 0.63 -1.26 -4.98 116.66 112.82 2jd4 n ARG 3018Ca -0.02 -0.24 -0.42 0.00 -0.92 0.00 0.00 57.85 56.25 2jd4 n ARG 3018Cb 0.59 -0.73 -0.03 0.00 0.45 0.00 0.00 32.46 32.74 2jd4 n ARG 3018CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2jd4 s ALA 3019N -0.03 3.72 0.24 5.13 0.00 -1.26 -4.81 121.76 124.74 2jd4 s ALA 3019Ca 0.00 1.26 -0.30 0.00 0.00 0.00 0.00 51.96 52.93 2jd4 s ALA 3019Cb 0.00 -3.67 -0.09 0.00 0.00 0.00 0.00 23.12 19.36 2jd4 s ALA 3019CO 0.00 -0.99 1.08 -1.12 0.00 0.00 0.00 175.76 174.73 2jd4 s SER 3020N 1.98 7.31 0.44 0.00 0.01 -1.26 -0.81 113.70 121.38 2jd4 s SER 3020Ca 0.73 2.18 -0.24 0.00 1.31 0.00 0.00 55.95 59.93 2jd4 s SER 3020Cb -0.41 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.13 2jd4 s SER 3020CO 0.32 -0.14 1.22 0.12 0.41 0.00 0.00 173.24 175.17 2jd4 s PHE 3021N -0.87 2.83 -0.13 2.43 5.36 0.66 -4.64 117.98 123.62 2jd4 s PHE 3021Ca 0.46 1.49 -0.01 0.00 -0.96 0.00 0.00 56.93 57.91 2jd4 s PHE 3021Cb -0.31 -3.50 0.03 0.00 -0.34 0.00 0.00 43.02 38.91 2jd4 s PHE 3021CO 0.38 -1.76 -0.05 0.50 -1.46 0.00 0.00 175.22 172.83 2jd4 s ARG 3022N -2.53 1.34 0.00 10.12 3.52 -1.26 -2.54 118.95 127.60 2jd4 s ARG 3022Ca 0.62 -0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.93 2jd4 s ARG 3022Cb -0.33 -1.64 0.00 0.00 -1.56 0.00 0.00 34.95 31.42 2jd4 s ARG 3022CO 0.40 -0.33 0.00 0.41 -0.81 0.00 0.00 175.30 174.97 2jd4 n GLY 3023N 4.96 0.45 3.34 8.12 0.00 -0.41 -4.34 105.19 117.30 2jd4 n GLY 3023Ca -0.11 -1.47 -0.21 0.00 0.00 0.00 0.00 46.02 44.23 2jd4 n GLY 3023CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jd4 s VAL 3025N -2.32 0.65 0.05 0.00 1.01 -0.65 -2.34 120.40 116.80 2jd4 s VAL 3025Ca 0.18 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 2jd4 s VAL 3025Cb -0.04 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 2jd4 s VAL 3025CO 0.07 0.18 -0.01 0.00 0.00 0.00 0.00 175.10 175.35 2jd4 s ARG 3026N -0.20 0.57 -1.41 2.72 1.70 -0.74 -1.08 118.95 120.52 2jd4 s ARG 3026Ca 0.03 -1.06 -0.04 0.00 -0.47 0.00 0.00 55.73 54.19 2jd4 s ARG 3026Cb -0.03 0.20 0.03 0.00 -0.57 0.00 0.00 34.95 34.58 2jd4 s ARG 3026CO -0.00 -0.11 0.68 0.09 -1.08 0.00 0.00 175.30 174.87 2jd4 n ASN 3027N 0.42 -1.79 -4.66 -2.89 3.02 -1.26 -2.00 115.26 106.10 2jd4 n ASN 3027Ca -0.16 -0.88 -0.43 0.00 -0.03 0.00 0.00 54.58 53.08 2jd4 n ASN 3027Cb 0.60 -3.62 -0.02 0.00 -0.61 0.00 0.00 39.78 36.13 2jd4 n ASN 3027CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2jd4 s LEU 3028N -6.93 4.12 0.04 3.41 2.96 -1.26 -4.07 118.68 116.95 2jd4 s LEU 3028Ca 0.19 1.39 0.03 0.00 -0.22 0.00 0.00 54.13 55.52 2jd4 s LEU 3028Cb -0.10 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.04 2jd4 s LEU 3028CO 0.85 -0.64 -0.09 -0.13 -1.32 0.00 0.00 176.35 175.02 2jd4 s ARG 3029N 3.06 0.60 0.01 1.98 0.52 -0.17 -1.09 118.95 123.87 2jd4 s ARG 3029Ca 0.44 -0.71 0.07 0.00 -0.52 0.00 0.00 55.73 55.01 2jd4 s ARG 3029Cb -0.15 -0.46 -0.02 0.00 0.52 0.00 0.00 34.95 34.84 2jd4 s ARG 3029CO 0.07 0.10 -0.20 -1.17 0.02 0.00 0.00 175.30 174.12 2jd4 s LEU 3030N -1.36 2.10 0.01 2.53 2.96 -0.38 -1.71 118.68 122.83 2jd4 s LEU 3030Ca -0.06 -0.43 -0.00 0.00 -0.22 0.00 0.00 54.13 53.41 2jd4 s LEU 3030Cb -0.09 -0.97 -0.01 0.00 0.50 0.00 0.00 46.19 45.62 2jd4 s LEU 3030CO 0.01 0.20 -0.00 -0.44 -1.32 0.00 0.00 176.35 174.79 2jd4 s SER 3031N -0.81 0.10 -0.39 3.68 0.01 -0.14 -1.55 113.70 114.60 2jd4 s SER 3031Ca 0.07 -0.22 0.03 0.00 1.31 0.00 0.00 55.95 57.14 2jd4 s SER 3031Cb -0.08 0.06 0.11 0.00 0.21 0.00 0.00 66.02 66.32 2jd4 s SER 3031CO 0.00 -0.15 0.14 -0.60 0.41 0.00 0.00 173.24 173.05 2jd4 s ARG 3032N -0.68 1.39 7.88 12.44 3.52 -0.04 -0.89 118.95 142.56 2jd4 s ARG 3032Ca -0.07 -1.89 0.00 0.00 -0.13 0.00 0.00 55.73 53.64 2jd4 s ARG 3032Cb -0.05 -2.81 0.00 0.00 -1.56 0.00 0.00 34.95 30.53 2jd4 s ARG 3032CO -0.00 -1.03 0.00 0.41 -0.81 0.00 0.00 175.30 173.87 2jd4 n GLY 3033N 4.01 3.46 0.15 8.12 0.00 -1.26 -1.99 105.19 117.67 2jd4 n GLY 3033Ca 0.04 -0.10 0.05 0.00 0.00 0.00 0.00 46.02 46.00 2jd4 n GLY 3033CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jd4 h SER 3034N 0.00 0.00 -2.79 1.61 4.64 -2.00 -3.45 113.55 111.56 2jd4 h SER 3034Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 2jd4 h SER 3034Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2jd4 h SER 3034CO 0.00 0.38 0.96 -1.10 -0.87 0.00 0.00 176.83 176.20 2jd4 s GLN 3035N -3.03 4.23 0.03 4.77 -0.21 -0.84 -5.01 119.66 119.60 2jd4 s GLN 3035Ca 0.03 1.96 0.05 0.00 0.02 0.00 0.00 55.36 57.43 2jd4 s GLN 3035Cb 0.07 -3.80 -0.02 0.00 1.00 0.00 0.00 33.01 30.27 2jd4 s GLN 3035CO 0.74 -0.72 -0.15 0.08 -2.12 0.00 0.00 175.29 173.11 2jd4 s VAL 3036N 3.39 1.22 -0.24 1.09 1.01 -1.26 -0.86 120.40 124.74 2jd4 s VAL 3036Ca 0.65 -0.95 -0.22 0.00 0.00 0.00 0.00 61.98 61.46 2jd4 s VAL 3036Cb -0.29 -1.07 0.06 0.00 0.00 0.00 0.00 36.38 35.08 2jd4 s VAL 3036CO 0.24 0.11 0.65 0.00 0.00 0.00 0.00 175.10 176.10 2jd4 s GLN 3037N -0.97 0.75 0.23 2.72 0.00 -0.60 -5.02 119.66 116.77 2jd4 s GLN 3037Ca 0.03 0.92 -0.30 0.00 -0.00 0.00 0.00 55.36 56.02 2jd4 s GLN 3037Cb -0.07 0.34 -0.09 0.00 0.00 0.00 0.00 33.01 33.19 2jd4 s GLN 3037CO 0.01 -0.10 0.96 -1.12 0.00 0.00 0.00 175.29 175.04 2jd4 s SER 3038N 0.46 7.60 -0.45 12.60 0.01 -1.26 -1.25 113.70 131.41 2jd4 s SER 3038Ca -0.01 1.97 -0.22 0.00 1.31 0.00 0.00 55.95 59.00 2jd4 s SER 3038Cb -0.05 -2.61 0.03 0.00 0.21 0.00 0.00 66.02 63.60 2jd4 s SER 3038CO -0.01 0.11 0.70 -0.76 0.41 0.00 0.00 173.24 173.69 2jd4 s LEU 3039N -1.10 4.42 -0.50 2.44 1.43 -0.25 -4.92 118.68 120.20 2jd4 s LEU 3039Ca 0.42 -0.28 -0.25 0.00 -1.03 0.00 0.00 54.13 52.99 2jd4 s LEU 3039Cb -0.26 -2.81 0.03 0.00 0.03 0.00 0.00 46.19 43.18 2jd4 s LEU 3039CO 0.33 -0.85 0.95 -0.62 0.23 0.00 0.00 176.35 176.39 2jd4 s ASP 3040N 2.10 6.45 0.56 2.29 -1.08 -1.26 -4.75 116.67 120.97 2jd4 s ASP 3040Ca 0.25 -0.02 0.37 0.00 -0.52 0.00 0.00 52.55 52.63 2jd4 s ASP 3040Cb -0.13 -2.45 1.83 0.00 -1.46 0.00 0.00 42.92 40.70 2jd4 s ASP 3040CO 0.20 -1.14 2.11 -0.07 0.52 0.00 0.00 175.17 176.80 2jd4 h LEU 3041N 10.79 0.00 0.00 -1.34 3.38 -1.97 -1.78 115.31 124.39 2jd4 h LEU 3041Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2jd4 h LEU 3041Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2jd4 h LEU 3041CO 1.06 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 178.05 2jd4 n SER 3042N -2.91 0.00 -0.96 -0.43 3.41 -1.26 -2.14 113.62 109.33 2jd4 n SER 3042Ca -0.01 0.44 0.12 0.00 -0.26 0.00 0.00 58.87 59.15 2jd4 n SER 3042Cb 0.15 -0.47 0.23 0.00 -0.26 0.00 0.00 64.21 63.86 2jd4 n SER 3042CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jd4 n ARG 3043N -1.47 2.28 -1.68 4.33 1.74 -0.67 -3.60 116.66 117.58 2jd4 n ARG 3043Ca 0.04 -1.90 -0.42 0.00 -0.77 0.00 0.00 57.85 54.80 2jd4 n ARG 3043Cb 0.18 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.14 2jd4 n ARG 3043CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jd4 n ALA 3044N 1.17 1.10 1.32 7.54 0.00 -0.91 -4.88 120.51 125.86 2jd4 n ALA 3044Ca 0.17 0.34 0.14 0.00 0.00 0.00 0.00 53.44 54.09 2jd4 n ALA 3044Cb 0.54 -2.23 0.49 0.00 0.00 0.00 0.00 19.45 18.25 2jd4 n ALA 3044CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2jd4 n PHE 3045N 0.19 0.00 -3.25 0.00 1.16 -0.29 -4.69 117.46 110.57 2jd4 n PHE 3045Ca 0.06 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.61 2jd4 n PHE 3045Cb 0.36 -0.15 -0.05 0.00 -1.61 0.00 0.00 39.48 38.04 2jd4 n PHE 3045CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2jd4 s ASP 3046N -2.48 -0.52 -0.16 5.98 2.15 -1.24 -5.01 116.67 115.39 2jd4 s ASP 3046Ca 0.27 0.43 -0.01 0.00 0.43 0.00 0.00 52.55 53.67 2jd4 s ASP 3046Cb 0.20 1.59 -0.01 0.00 -0.30 0.00 0.00 42.92 44.40 2jd4 s ASP 3046CO 0.50 -0.29 -0.12 -0.76 -0.17 0.00 0.00 175.17 174.33 2jd4 s LEU 3047N 2.69 2.69 -0.18 -1.34 1.43 -1.26 -1.46 118.68 121.24 2jd4 s LEU 3047Ca 0.16 -0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 52.83 2jd4 s LEU 3047Cb -0.15 -1.63 0.06 0.00 0.03 0.00 0.00 46.19 44.50 2jd4 s LEU 3047CO -0.20 0.09 0.06 -1.10 0.23 0.00 0.00 176.35 175.43 2jd4 s GLN 3048N 0.77 0.41 -1.11 1.70 -1.52 -0.08 -4.84 119.66 115.00 2jd4 s GLN 3048Ca -0.05 -0.28 0.00 0.00 -1.95 0.00 0.00 55.36 53.08 2jd4 s GLN 3048Cb -0.15 -2.00 0.00 0.00 -0.22 0.00 0.00 33.01 30.64 2jd4 s GLN 3048CO 0.01 -0.65 0.00 0.41 -0.25 0.00 0.00 175.29 174.81 2jd4 n GLY 3049N 5.14 0.44 3.05 3.09 0.00 -1.26 -0.28 105.19 115.37 2jd4 n GLY 3049Ca -0.08 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 2jd4 n GLY 3049CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jd4 s VAL 3050N -2.53 0.95 -0.56 1.61 1.01 -1.26 -1.92 120.40 117.69 2jd4 s VAL 3050Ca 0.00 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.54 2jd4 s VAL 3050Cb 0.00 -0.81 0.15 0.00 0.00 0.00 0.00 36.38 35.72 2jd4 s VAL 3050CO 0.00 0.28 0.37 -0.36 0.00 0.00 0.00 175.10 175.39 2jd4 s PHE 3051N -0.05 2.70 -0.07 5.22 0.40 -0.33 -5.03 117.98 120.82 2jd4 s PHE 3051Ca 0.00 -2.92 -0.38 0.00 -0.60 0.00 0.00 56.93 53.03 2jd4 s PHE 3051Cb -0.07 -2.22 -0.16 0.00 0.51 0.00 0.00 43.02 41.08 2jd4 s PHE 3051CO 0.00 -0.68 1.53 -0.35 0.70 0.00 0.00 175.22 176.42 2jd4 n PRO 3052N 2.68 1.19 -0.89 0.24 -0.04 -1.26 -1.72 135.00 135.20 2jd4 n PRO 3052Ca 0.16 0.43 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 2jd4 n PRO 3052Cb 0.37 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 2jd4 n PRO 3052CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2jd4 n HIS 3053N 3.84 0.00 -3.95 0.54 8.25 -1.18 -4.37 115.22 118.35 2jd4 n HIS 3053Ca 0.22 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.34 2jd4 n HIS 3053Cb 0.17 -0.57 -0.14 0.00 1.12 0.00 0.00 29.99 30.57 2jd4 n HIS 3053CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2jd4 s SER 3054N -2.44 4.80 -0.06 0.41 0.15 -0.69 -4.50 113.70 111.38 2jd4 s SER 3054Ca 0.00 -1.52 0.01 0.00 0.70 0.00 0.00 55.95 55.14 2jd4 s SER 3054Cb 0.00 -1.67 0.02 0.00 -1.71 0.00 0.00 66.02 62.66 2jd4 s SER 3054CO 0.00 -0.29 -0.08 0.00 1.20 0.00 0.00 173.24 174.07 2jd4 s PRO 3056N 0.94 4.22 0.00 0.00 0.04 -1.26 -1.05 135.00 137.89 2jd4 s PRO 3056Ca -0.10 2.39 0.00 0.00 0.04 0.00 0.00 61.00 63.33 2jd4 s PRO 3056Cb -0.15 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.32 2jd4 s PRO 3056CO 0.01 -0.47 0.00 0.41 0.04 0.00 0.00 177.00 176.98 2jd4 n GLY 3057N 1.97 2.84 3.92 0.56 0.00 0.16 -4.59 105.19 110.06 2jd4 n GLY 3057Ca 0.06 -2.01 -0.28 0.00 0.00 0.00 0.00 46.02 43.80 2jd4 n GLY 3057CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jd4 s PRO 3058N 2.85 1.76 0.00 1.61 0.04 -1.26 -4.87 135.00 135.13 2jd4 s PRO 3058Ca 0.00 -0.22 0.00 0.00 0.04 0.00 0.00 61.00 60.82 2jd4 s PRO 3058Cb 0.00 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2jd4 s PRO 3058CO 0.00 -1.62 0.00 -1.91 0.04 0.00 0.00 177.00 173.51 2jd4 n GLU 3059N -3.22 -1.65 0.00 4.56 4.07 -1.26 -5.02 120.64 118.11 2jd4 n GLU 3059Ca 0.10 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 2jd4 n GLU 3059Cb 0.60 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.98 2jd4 n GLU 3059CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77