# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 A C C 56.84 8.91 13.45 23.41 117.67 -122.41 -85.31 142.80 99.96 0.03 0.00 99.85 0.11 0.02 0.00 0.00 0.00 0.01 0.00 1 P C C 75.21 7.81 11.79 20.91 112.57 -103.95 -67.87 149.89 86.89 0.76 12.34 79.68 1.29 7.11 1.97 9.20 0.00 0.42 0.33 2 D C C 105.38 3.55 12.71 17.87 110.45 -126.07 -86.82 122.58 79.70 3.51 16.79 46.54 14.58 18.10 2.25 15.11 0.00 1.93 1.48 3 V C C 77.67 10.48 10.14 21.04 107.64 -165.45 -93.58 81.17 74.55 7.34 18.11 45.25 15.93 13.05 2.72 15.82 0.01 3.95 3.28 4 Q C C 116.50 4.71 13.56 19.76 108.26 132.11 -87.34 98.39 82.94 6.24 10.82 45.68 14.88 22.66 1.71 8.97 0.00 3.50 2.61 5 D C C 105.41 4.00 15.08 20.20 101.43 18.26 49.13 21.73 90.42 4.18 5.40 42.80 23.87 23.74 0.65 4.97 0.00 2.05 1.92 6 C C C 28.16 15.77 9.07 24.67 110.99 127.43 -100.56 107.06 97.00 2.64 0.36 81.97 14.14 0.73 0.11 0.23 0.00 0.98 1.84 7 P C G 92.44 3.55 17.92 22.33 94.67 -150.82 -67.65 -24.20 61.92 1.44 36.64 14.00 12.89 31.32 0.89 39.62 0.00 0.84 0.44 8 E C T 102.62 8.39 17.57 26.44 95.66 55.78 -75.96 -15.71 63.05 2.66 34.28 5.18 12.79 42.77 0.79 36.05 0.00 1.87 0.56 9 C C G 19.91 19.90 13.29 32.60 105.11 52.00 -100.39 62.76 48.78 11.71 39.51 18.02 10.64 20.58 1.31 38.84 0.01 8.88 1.72 10 T C C 61.22 7.57 23.08 31.31 123.83 137.55 -112.03 144.06 52.32 46.37 1.32 40.76 9.69 0.88 0.69 0.76 0.01 32.71 14.50 11 L C E 29.77 21.88 12.69 33.89 115.40 -115.89 -81.50 137.92 50.65 49.05 0.29 46.49 3.00 0.43 0.11 0.19 0.00 47.31 2.47 12 Q E E 102.65 4.48 22.28 27.37 124.21 -161.10 -112.64 146.07 32.05 67.67 0.27 27.20 4.14 0.59 0.08 0.20 0.00 64.21 3.58 13 E E E 108.79 9.44 16.08 26.45 113.37 -104.64 -69.93 137.73 34.27 65.40 0.33 30.18 2.04 0.24 0.25 0.15 0.00 53.82 13.33 14 N C C 29.68 15.92 10.51 26.83 111.23 -142.04 -93.88 116.63 91.51 8.38 0.11 89.92 1.98 0.19 0.04 0.06 0.00 6.35 1.47 15 P C T 106.77 2.11 16.93 19.61 92.43 -154.73 -66.98 -24.15 70.66 1.89 27.44 9.44 13.37 48.27 2.87 24.07 0.01 1.21 0.76 16 F C T 113.54 6.25 15.58 22.95 92.96 62.57 -71.04 -26.76 73.30 1.25 25.45 2.70 11.63 59.49 2.32 22.45 0.02 0.79 0.60 17 F C T 47.30 15.90 11.41 27.15 100.72 37.39 -103.73 1.22 68.50 4.30 27.20 10.15 15.12 43.25 2.49 24.35 0.08 2.48 2.07 18 S C C 51.02 9.95 12.46 23.33 105.55 90.63 -85.01 49.99 86.62 7.71 5.67 57.76 17.84 10.48 1.69 4.05 0.00 3.75 4.42 19 Q C C 97.19 4.70 12.26 18.73 120.07 134.83 -106.48 137.53 88.52 10.89 0.60 44.41 40.66 2.34 0.25 0.32 0.00 3.07 8.94 20 P C T 116.69 1.72 11.92 14.79 109.10 -98.60 -62.09 135.72 98.43 0.90 0.66 2.92 9.40 86.14 0.06 0.62 0.00 0.55 0.30 21 G C T 64.97 0.79 13.56 13.46 97.79 17.13 82.96 -3.16 99.30 0.36 0.34 3.10 12.59 83.56 0.02 0.39 0.00 0.27 0.08 22 A C S 49.61 7.53 11.38 20.64 119.43 100.99 -105.83 134.07 91.51 8.27 0.21 45.80 46.03 0.78 0.06 0.16 0.00 4.11 3.07 23 P C C 73.08 6.57 16.09 23.81 113.89 -122.54 -72.31 142.06 89.93 9.94 0.13 86.16 3.62 0.40 0.03 0.08 0.00 7.96 1.75 24 I C C 38.77 17.13 14.45 31.68 122.29 -150.44 -109.96 135.78 53.84 45.90 0.26 48.03 4.50 0.46 0.09 0.19 0.00 42.34 4.39 25 L E E 58.20 11.88 21.69 33.85 121.24 -158.94 -108.41 135.88 24.24 75.48 0.28 20.53 3.27 0.50 0.10 0.21 0.00 72.48 2.92 26 Q E E 45.46 16.50 20.55 36.59 124.09 -160.43 -115.31 141.23 23.60 75.55 0.85 16.94 6.44 1.54 0.26 0.63 0.00 72.10 2.08 27 C E E 17.90 19.92 16.96 37.10 112.72 -115.04 -78.65 132.06 28.28 71.14 0.58 24.36 3.10 0.82 0.22 0.41 0.00 68.57 2.53 28 M E E 81.85 9.93 22.80 32.99 102.69 -162.67 -100.28 -6.56 37.27 61.72 1.01 19.94 14.97 5.18 0.22 0.83 0.01 56.88 1.98 29 G E E 19.29 10.54 21.99 33.04 140.99 -24.90 166.73 -170.99 43.84 55.57 0.59 10.25 26.91 7.05 0.05 0.51 0.00 54.43 0.80 30 C E E 41.75 13.14 21.88 35.06 133.13 -77.94 -131.44 153.30 33.43 65.78 0.80 22.83 9.30 2.51 0.17 0.65 0.00 63.19 1.34 31 C E E 21.14 19.39 17.70 36.80 127.40 -160.12 -123.84 142.60 19.21 80.43 0.36 15.33 3.69 0.77 0.11 0.26 0.00 78.41 1.44 32 F E E 74.46 11.37 22.92 34.42 125.79 -161.46 -118.65 142.25 13.98 85.70 0.31 11.27 2.56 0.55 0.09 0.19 0.00 84.26 1.07 33 S E E 31.55 18.21 16.21 33.59 128.35 -160.91 -121.89 145.71 20.97 78.50 0.53 15.03 5.41 1.13 0.12 0.33 0.00 77.34 0.63 34 R E E 104.42 8.99 20.79 30.39 128.69 -167.88 -129.50 143.37 26.40 72.76 0.85 16.58 8.70 2.38 0.20 0.57 0.00 70.57 1.00 35 A E E 48.84 13.21 15.68 28.95 118.04 -135.84 -96.58 136.38 38.15 61.11 0.75 27.28 9.79 1.94 0.23 0.54 0.00 58.21 2.00 36 Y C E 81.55 10.46 16.31 27.96 127.78 -172.95 -127.30 144.49 53.65 46.09 0.26 41.92 10.69 0.95 0.08 0.23 0.00 43.16 2.97 37 P C C 81.84 6.02 17.22 24.04 112.70 -103.46 -68.96 144.91 74.67 25.02 0.32 50.43 22.77 1.75 0.08 0.28 0.00 23.02 1.68 38 T C C 43.76 13.21 10.86 24.56 119.27 -145.62 -104.62 142.15 90.70 8.05 1.25 72.77 16.71 1.35 0.81 0.49 0.00 5.66 2.22 39 P C C 74.99 4.12 15.16 20.24 107.32 -108.13 -67.44 149.50 69.91 3.86 26.24 45.85 11.45 11.88 20.74 6.32 0.01 2.64 1.11 40 L H H 103.32 5.47 11.64 18.59 95.23 -114.37 -65.03 -31.59 47.48 3.64 48.88 20.91 11.04 16.68 36.28 11.42 0.14 2.45 1.08 41 R H H 147.69 2.37 13.66 16.58 94.49 58.72 -67.71 -33.43 39.77 8.60 51.63 21.37 8.60 11.27 37.22 13.11 0.18 6.44 1.81 42 S H H 44.25 6.94 11.49 20.19 95.06 55.30 -69.19 -33.72 37.57 9.18 53.25 24.62 6.69 7.53 40.25 12.01 0.08 6.98 1.84 43 K H H 93.30 8.78 10.70 20.47 94.00 60.11 -69.92 -29.10 37.56 7.32 55.12 18.79 7.50 12.71 41.24 12.25 0.24 5.44 1.82 44 K C H 148.37 1.94 13.55 16.09 94.41 59.61 -71.76 -25.08 49.51 3.87 46.62 13.16 10.19 26.51 34.70 11.13 0.39 2.62 1.31 45 T C T 91.22 2.79 12.34 16.00 99.18 47.33 -90.38 -11.01 59.60 4.12 36.28 14.91 12.76 32.13 26.60 9.19 0.33 2.43 1.66 46 M C C 77.69 10.09 7.71 18.36 115.45 89.48 -93.10 131.00 73.21 9.67 17.13 34.38 22.25 17.63 11.73 5.00 0.14 5.32 3.55 47 L C C 138.25 1.32 13.40 14.76 97.89 -155.22 -81.54 -11.52 83.30 8.10 8.60 32.51 31.46 20.27 4.62 3.67 0.04 5.50 1.93 48 V C S 84.03 5.17 10.32 17.42 118.52 79.40 -104.04 133.65 82.74 12.21 5.05 34.13 42.01 7.44 2.76 2.32 0.03 7.86 3.45 49 Q C C 123.10 3.96 13.15 18.90 112.91 -126.36 -78.80 133.44 82.60 12.81 4.60 66.52 10.72 4.82 2.59 2.19 0.00 9.48 3.67 50 K C C 110.45 8.58 10.89 20.57 114.88 -137.69 -94.55 139.48 83.07 13.15 3.79 58.56 19.38 4.77 2.22 1.77 0.01 8.09 5.20 51 N C C 83.08 6.24 14.14 21.53 109.60 -118.19 -84.11 113.76 89.71 7.05 3.24 73.93 11.03 4.51 1.69 1.65 0.00 4.86 2.34 52 V C C 84.34 8.47 13.24 22.75 95.69 -159.17 -74.79 -18.63 72.02 6.81 21.16 31.33 14.04 28.17 4.93 15.13 0.02 4.60 1.78 53 T C T 79.50 6.20 16.20 23.21 96.82 62.72 -85.57 -8.91 66.72 11.13 22.16 18.48 16.70 33.52 4.88 15.76 0.06 8.60 2.00 54 S C C 40.87 11.04 15.46 27.35 106.12 69.00 -91.17 36.21 53.66 24.71 21.63 24.05 15.57 17.85 4.52 15.03 0.12 20.28 2.59 55 E E E 82.05 10.76 19.02 30.01 118.51 91.00 -100.65 131.56 45.35 48.23 6.42 30.83 10.10 5.82 2.67 3.70 0.07 43.06 3.76 56 S E E 19.10 17.92 17.24 34.94 133.69 129.90 -132.17 154.46 33.18 66.27 0.55 26.66 5.26 1.28 0.15 0.37 0.00 65.12 1.14 57 T E E 44.12 12.52 24.11 36.72 125.20 -139.89 -119.15 141.76 12.75 87.12 0.13 10.60 1.79 0.32 0.03 0.09 0.00 86.73 0.44 58 C E E 12.50 21.58 19.82 41.07 129.86 -166.99 -125.34 146.21 5.40 94.56 0.04 4.31 0.76 0.07 0.01 0.02 0.00 94.69 0.13 59 C E E 16.86 17.38 23.30 40.83 120.80 -149.27 -110.49 134.03 2.63 97.35 0.02 2.03 0.33 0.02 0.01 0.01 0.00 97.54 0.06 60 V E E 21.40 17.52 22.83 40.31 121.99 -159.73 -113.68 133.93 3.03 96.91 0.05 2.44 0.37 0.04 0.02 0.02 0.00 96.91 0.19 61 A E E 15.24 18.71 16.87 35.83 112.99 -120.22 -76.99 133.16 15.00 83.84 1.16 12.27 2.30 0.66 0.37 0.67 0.00 83.07 0.66 62 K C E 109.14 7.14 20.03 27.94 99.20 -162.97 -84.92 -29.31 53.59 43.35 3.06 11.11 23.67 19.76 0.19 2.79 0.00 41.87 0.61 63 S C E 62.17 3.52 21.86 25.50 134.02 6.01 -143.64 152.19 65.72 30.05 4.23 15.95 28.18 21.12 0.25 4.04 0.00 29.81 0.65 64 Y C C 76.81 18.75 10.61 27.81 128.46 -163.23 -131.98 146.55 61.00 34.88 4.12 49.59 8.45 2.43 0.57 3.65 0.00 34.17 1.13 65 N E E 90.04 4.53 18.16 23.63 123.39 -165.45 -119.55 146.62 46.41 52.47 1.12 29.18 16.09 2.10 0.21 0.84 0.00 50.73 0.86 66 R E E 138.46 6.45 14.99 22.96 118.44 -113.47 -96.42 133.51 18.12 81.25 0.63 14.71 2.86 0.61 0.16 0.40 0.00 80.75 0.50 67 V E E 46.47 11.65 11.33 24.31 125.57 -170.34 -121.75 143.43 8.90 90.96 0.14 8.11 0.59 0.10 0.05 0.06 0.00 90.73 0.36 68 T E E 87.12 3.82 14.65 19.93 115.04 -133.10 -99.93 125.63 9.23 90.64 0.14 8.48 0.56 0.12 0.04 0.06 0.00 90.22 0.51 69 V E E 58.75 10.26 8.94 20.16 118.12 -166.97 -109.34 143.67 34.06 65.38 0.56 29.02 3.37 1.00 0.12 0.39 0.00 65.51 0.60 70 M C E 122.02 3.85 10.09 15.47 109.59 -50.87 -90.99 117.19 49.62 45.98 4.40 7.02 9.77 36.88 0.40 3.84 0.01 40.37 1.71 71 G C T 67.50 0.51 11.40 10.83 95.03 -1.98 65.30 18.68 95.89 1.13 2.97 2.85 8.53 84.13 0.16 3.28 0.00 0.86 0.17 72 G C T 62.25 1.30 11.05 12.81 97.44 -53.35 82.16 4.50 95.41 1.64 2.95 7.92 22.46 64.61 0.15 3.27 0.00 1.33 0.27 73 F E E 97.76 6.42 9.16 17.70 117.53 129.62 -94.24 134.78 33.61 66.27 0.13 28.82 3.09 0.76 0.04 0.10 0.00 66.06 1.13 74 K E E 124.46 4.38 15.04 21.12 116.63 -142.39 -98.64 129.15 9.63 90.34 0.03 9.06 0.41 0.04 0.01 0.02 0.00 89.94 0.52 75 V E E 37.10 14.98 12.25 28.02 121.04 -165.11 -112.29 132.43 8.06 91.84 0.10 7.55 0.42 0.08 0.04 0.05 0.00 91.36 0.49 76 E E E 91.88 7.65 19.88 28.16 119.22 -151.27 -101.49 134.70 18.47 80.96 0.57 16.08 1.80 0.46 0.24 0.32 0.00 79.81 1.28 77 N C C 41.11 15.61 15.61 31.33 115.75 -152.65 -100.30 129.63 62.57 31.79 5.64 51.72 7.39 2.87 1.53 4.01 0.00 31.18 1.29 78 H C G 64.11 14.15 16.64 30.75 98.03 -143.85 -79.09 1.69 53.23 9.40 37.37 19.84 12.25 22.50 3.36 33.15 0.01 7.97 0.93 79 T C T 74.92 8.27 19.39 28.23 97.94 79.59 -84.84 -15.43 56.90 9.53 33.57 13.15 14.15 31.32 2.92 29.37 0.03 7.89 1.17 80 A C G 52.61 8.21 20.15 28.88 118.65 52.19 -112.77 129.29 51.28 16.49 32.23 20.99 13.30 19.70 3.38 27.38 0.04 13.39 1.81 81 C C C 19.02 20.83 13.23 33.54 122.35 101.77 -113.11 137.30 64.48 34.09 1.43 49.31 13.20 2.02 0.60 0.97 0.00 28.62 5.27 82 H E E 92.50 8.11 22.50 30.89 118.80 -158.15 -104.08 136.19 41.78 56.93 1.29 34.35 4.28 1.25 0.85 0.62 0.01 42.12 16.51 83 C C C 36.12 17.37 14.69 31.40 118.04 -157.27 -109.45 140.52 59.93 34.16 5.91 47.16 8.92 3.16 4.09 2.35 0.01 29.37 4.94 84 S C C 54.82 7.83 18.94 27.10 100.11 -141.33 -76.57 -16.76 59.04 12.95 28.02 33.13 13.68 12.43 18.19 9.85 0.12 10.38 2.21 85 T C H 55.61 10.74 16.40 27.59 100.47 53.85 -77.16 -17.69 51.70 9.08 39.22 23.49 12.86 16.07 25.36 13.45 0.25 6.48 2.04 86 C H H 45.98 11.94 13.32 25.87 101.48 70.34 -77.02 -3.74 43.03 9.83 47.14 22.29 9.55 12.25 28.90 17.59 0.23 6.95 2.26 87 Y H H 128.74 6.05 14.82 21.96 97.35 87.99 -74.26 -24.93 41.75 10.86 47.40 23.42 8.65 10.70 30.64 15.97 0.20 7.95 2.45 88 Y C H 124.77 6.50 12.73 20.51 97.69 64.07 -80.30 -16.25 47.33 10.33 42.34 25.57 9.15 13.60 27.72 13.87 0.18 7.52 2.40 89 H C C 105.54 7.20 10.37 18.84 104.30 66.01 -87.87 17.76 56.97 8.73 34.31 30.87 10.89 16.39 23.34 9.99 0.11 5.97 2.45 90 K C C 134.10 3.97 9.54 15.28 107.73 93.00 -87.90 80.21 77.75 4.43 17.82 63.00 2.09 12.95 13.92 3.40 0.00 2.72 1.92 91 S C C 79.41 3.73 11.40 16.82 108.39 130.11 -89.10 99.11 99.88 0.08 0.05 99.76 0.09 0.07 0.03 0.00 0.00 0.04 0.01