# 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 V C C 55.90 13.64 14.03 27.60 111.91 -163.37 -93.76 116.61 99.85 0.06 0.08 99.79 0.07 0.04 0.06 0.00 0.00 0.02 0.01 1 T H H 77.99 4.34 16.58 21.53 102.29 136.65 -77.90 -32.21 48.74 0.46 50.81 44.61 0.87 3.01 50.43 0.73 0.00 0.16 0.19 2 A H H 47.31 8.14 15.75 24.94 94.86 50.66 -64.94 -38.65 11.14 0.10 88.75 6.03 1.46 3.50 88.10 0.83 0.00 0.04 0.04 3 I H H 29.59 18.70 14.19 32.34 92.93 52.14 -65.90 -40.42 3.25 0.04 96.71 1.56 0.41 1.28 96.06 0.66 0.00 0.02 0.01 4 Q H H 80.42 9.03 17.84 27.46 91.82 52.07 -63.86 -40.57 1.07 0.01 98.92 0.47 0.13 0.44 98.57 0.38 0.00 0.00 0.00 5 K H H 114.00 2.67 21.69 23.64 91.83 50.19 -64.79 -41.12 0.85 0.01 99.14 0.30 0.09 0.40 98.99 0.22 0.00 0.00 0.00 6 V H H 26.91 15.06 18.50 33.84 91.97 49.94 -64.83 -43.03 0.66 0.01 99.33 0.19 0.06 0.35 99.26 0.14 0.00 0.00 0.00 7 I H H 22.28 20.23 17.69 37.56 91.68 49.36 -64.76 -41.72 0.62 0.01 99.37 0.17 0.05 0.32 99.32 0.14 0.00 0.00 0.00 8 K H H 110.02 4.88 22.28 27.59 91.46 51.25 -63.60 -41.22 1.17 0.01 98.82 0.23 0.08 0.70 98.69 0.29 0.00 0.00 0.00 9 N H H 71.78 5.70 21.51 27.64 92.19 48.97 -66.17 -39.47 2.50 0.02 97.48 0.36 0.20 1.75 96.94 0.73 0.01 0.01 0.01 10 A H H 12.68 19.23 14.46 34.01 92.17 53.03 -65.93 -38.28 5.59 0.04 94.37 0.70 0.48 4.15 92.92 1.69 0.02 0.02 0.01 11 H H H 84.93 12.27 17.50 29.53 92.92 53.70 -68.90 -31.88 15.30 0.14 84.56 1.73 1.33 12.06 81.96 2.72 0.06 0.07 0.07 12 V H H 97.43 3.87 19.02 23.23 94.87 50.79 -77.17 -26.32 25.27 0.38 74.34 2.90 3.28 19.69 71.44 2.18 0.15 0.17 0.21 13 H C T 87.44 9.10 14.68 24.82 108.56 67.92 -96.69 100.73 67.49 1.06 31.45 7.20 18.54 40.85 29.26 2.90 0.10 0.38 0.76 14 D C T 101.57 5.16 19.18 25.21 101.26 -101.17 -67.05 51.04 92.12 0.76 7.12 8.52 19.86 64.29 3.98 2.55 0.00 0.46 0.33 15 G C C 19.54 14.50 18.59 32.82 100.54 -9.47 84.07 5.04 87.67 10.41 1.92 48.27 14.86 24.47 0.39 1.44 0.00 9.93 0.63 16 L E E 23.19 21.44 17.62 38.56 116.08 138.72 -83.92 133.45 33.38 66.26 0.36 29.48 3.18 0.36 0.21 0.20 0.00 62.54 4.01 17 K E E 49.40 15.53 22.78 37.91 126.32 -164.89 -118.39 140.77 14.85 84.99 0.15 14.31 0.58 0.08 0.11 0.06 0.00 80.74 4.12 18 I E E 63.52 15.13 22.09 36.30 124.33 -158.58 -118.34 135.36 31.95 67.96 0.09 29.17 2.36 0.13 0.05 0.05 0.00 66.36 1.87 19 G C S 15.74 10.01 24.76 35.92 125.68 15.53 96.89 167.92 93.34 2.11 4.55 16.24 73.34 2.82 5.65 0.30 0.00 0.92 0.72 20 I H H 31.17 21.52 16.23 37.04 91.83 -88.31 -60.93 -38.93 2.39 0.01 97.61 0.16 0.43 1.70 97.38 0.31 0.00 0.00 0.00 21 R H H 147.63 3.47 23.30 27.35 91.38 52.87 -62.99 -41.05 1.25 0.00 98.74 0.08 0.11 0.99 98.47 0.34 0.00 0.00 0.00 22 E H H 77.97 7.70 22.68 30.73 91.79 48.34 -66.18 -40.11 0.47 0.00 99.53 0.06 0.04 0.31 99.24 0.35 0.00 0.00 0.00 23 V H H 2.06 26.36 16.12 43.08 91.35 50.92 -63.77 -43.61 0.38 0.00 99.62 0.06 0.03 0.22 99.57 0.12 0.00 0.00 0.00 24 I H H 34.80 15.91 21.63 37.17 91.56 50.08 -62.90 -42.92 0.18 0.00 99.82 0.03 0.01 0.09 99.84 0.03 0.00 0.00 0.00 25 K H H 112.14 2.26 25.83 26.52 91.64 49.93 -63.81 -41.85 0.14 0.00 99.86 0.01 0.01 0.09 99.86 0.03 0.00 0.00 0.00 26 S H H 11.99 14.03 18.38 33.84 91.64 50.05 -64.32 -41.90 0.25 0.00 99.75 0.02 0.01 0.16 99.72 0.08 0.00 0.00 0.00 27 I H H 8.07 23.77 14.35 37.94 92.10 49.99 -64.97 -42.59 0.66 0.00 99.34 0.05 0.03 0.49 99.23 0.19 0.00 0.00 0.00 28 E H H 117.18 5.30 19.01 25.50 91.59 49.93 -65.55 -33.90 3.69 0.00 96.30 0.08 0.13 3.39 96.22 0.17 0.00 0.00 0.00 29 S C T 70.89 2.77 18.03 20.75 93.68 51.33 -86.50 -3.15 77.89 0.02 22.09 0.43 1.94 73.59 23.51 0.50 0.00 0.00 0.02 30 Q C T 109.43 10.18 15.28 26.11 94.05 -119.90 65.16 24.93 98.20 0.01 1.79 0.91 4.88 92.66 1.31 0.22 0.00 0.00 0.01 31 E C C 104.62 5.95 21.50 28.11 95.64 124.87 -86.03 -12.82 99.31 0.35 0.34 49.05 42.96 7.32 0.08 0.26 0.00 0.16 0.17 32 A C C 5.54 24.57 13.43 37.84 121.19 68.66 -107.08 139.22 93.17 6.54 0.28 85.72 6.49 0.83 0.03 0.32 0.00 6.07 0.53 33 K C S 78.81 11.50 26.52 38.67 100.30 -175.82 -98.01 -27.36 90.60 9.34 0.06 24.28 65.17 0.56 0.00 0.06 0.00 9.74 0.19 34 V E E 8.11 21.72 26.43 47.54 134.34 19.09 -142.84 143.78 4.24 95.72 0.04 3.39 0.68 0.06 0.00 0.02 0.00 95.66 0.18 35 C E E 1.08 27.24 26.53 53.65 123.61 -165.00 -121.23 132.90 0.24 99.76 0.00 0.23 0.01 0.00 0.00 0.00 0.00 99.76 0.01 36 F E E 6.22 24.19 29.38 52.64 119.27 -162.47 -110.67 128.15 0.08 99.92 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.92 0.00 37 L E E 3.56 25.28 25.75 50.30 128.54 -172.85 -119.47 144.44 0.90 99.10 0.00 0.87 0.01 0.00 0.00 0.00 0.00 99.09 0.03 38 S E E 7.17 20.46 21.87 42.51 115.79 -113.56 -74.66 146.59 25.55 74.35 0.10 24.02 1.08 0.11 0.02 0.06 0.00 74.27 0.44 39 D C T 66.63 12.19 21.96 34.34 92.59 -123.76 -67.75 -22.17 91.14 6.01 2.85 3.74 25.30 62.16 0.13 3.01 0.00 5.11 0.55 40 V C T 74.63 7.32 22.80 30.89 95.08 63.21 -87.81 -0.53 94.43 2.43 3.14 13.29 18.63 61.89 0.20 3.80 0.00 1.69 0.49 41 C C C 9.96 23.53 9.77 32.45 109.59 119.36 -75.49 123.28 94.64 2.56 2.81 78.91 10.21 5.04 0.59 2.55 0.00 1.24 1.48 42 S C C 82.24 3.17 19.91 23.73 99.32 169.57 -97.77 -9.74 99.18 0.30 0.52 80.71 15.72 2.69 0.15 0.34 0.00 0.11 0.28 43 E C S 84.10 7.45 13.92 23.14 114.14 92.61 -81.79 130.80 99.00 0.16 0.83 48.05 50.31 0.57 0.77 0.09 0.00 0.03 0.18 44 P H H 92.90 3.43 15.27 20.17 92.64 -132.18 -58.90 -38.05 5.97 0.00 94.02 0.54 0.69 4.59 91.56 2.62 0.01 0.00 0.00 45 A H H 56.65 4.65 17.71 23.21 91.49 54.19 -63.93 -37.93 4.28 0.00 95.71 0.33 0.34 3.45 92.66 3.21 0.01 0.00 0.00 46 Y H H 26.57 19.41 14.87 33.95 92.51 48.36 -67.13 -40.49 2.48 0.01 97.51 0.39 0.24 1.64 93.83 3.89 0.00 0.00 0.00 47 K H H 68.59 15.21 17.57 32.19 91.35 53.63 -61.78 -42.15 0.95 0.00 99.04 0.23 0.09 0.51 98.76 0.41 0.00 0.00 0.00 48 K H H 126.04 2.03 24.44 25.19 91.69 50.58 -64.37 -40.94 0.76 0.00 99.24 0.08 0.04 0.54 99.21 0.13 0.00 0.00 0.00 49 L H H 38.63 12.52 21.68 34.59 91.78 49.59 -64.56 -42.69 0.27 0.00 99.73 0.02 0.01 0.18 99.74 0.05 0.00 0.00 0.00 50 I H H 1.54 27.27 17.53 45.59 91.23 48.94 -63.85 -43.65 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 51 T H H 54.94 11.43 22.64 33.78 91.53 50.35 -62.99 -42.35 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 52 T H H 65.15 2.82 24.76 26.49 91.45 49.88 -63.69 -42.56 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 53 L H H 15.18 16.30 19.26 36.32 91.75 49.11 -64.41 -42.68 0.11 0.00 99.89 0.00 0.00 0.08 99.89 0.02 0.00 0.00 0.00 54 C H H 7.15 21.27 14.37 35.89 91.72 50.24 -63.72 -42.27 0.39 0.00 99.61 0.03 0.02 0.26 99.61 0.08 0.00 0.00 0.00 55 A H H 76.00 2.79 19.26 22.44 92.16 49.67 -65.04 -40.44 1.13 0.00 98.87 0.04 0.03 0.96 98.63 0.34 0.00 0.00 0.00 56 E H H 128.59 2.43 18.05 20.69 92.08 49.18 -66.71 -34.32 5.27 0.00 94.72 0.09 0.16 4.98 94.41 0.36 0.00 0.00 0.00 57 K C T 72.23 12.11 13.54 26.36 97.72 37.28 -102.23 5.38 57.38 0.04 42.58 0.95 2.65 52.01 43.37 0.96 0.01 0.01 0.04 58 N C T 130.26 1.58 20.46 21.75 93.60 -121.81 56.88 41.31 99.89 0.01 0.10 4.98 1.43 93.53 0.03 0.02 0.00 0.01 0.00 59 I C C 10.55 23.44 12.03 35.56 116.68 155.93 -101.98 127.28 99.53 0.47 0.00 98.64 0.98 0.01 0.00 0.00 0.00 0.33 0.04 60 P C C 46.77 8.77 25.74 35.66 112.53 -117.04 -69.15 138.93 95.47 4.53 0.00 95.05 0.56 0.02 0.00 0.00 0.00 4.27 0.09 61 L E E 24.82 23.69 16.76 39.81 124.91 -163.01 -120.77 135.14 5.01 94.98 0.01 4.91 0.23 0.01 0.00 0.00 0.00 94.23 0.62 62 F E E 35.34 16.17 23.78 39.77 121.56 -165.70 -117.25 130.15 0.47 99.53 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.51 0.03 63 M E E 73.51 13.81 23.78 36.82 117.08 -148.52 -101.90 127.92 1.42 98.58 0.00 1.38 0.03 0.00 0.00 0.00 0.00 98.51 0.08 64 V E E 12.35 21.86 14.01 35.92 118.49 -161.56 -107.58 129.40 33.64 66.28 0.09 32.63 0.75 0.10 0.02 0.05 0.00 65.93 0.52 65 Q C S 116.64 4.07 21.83 26.25 107.70 -134.96 -82.03 106.62 82.02 17.24 0.74 33.36 37.13 10.90 0.09 0.64 0.00 17.35 0.52 66 N C S 86.76 9.12 17.93 27.21 108.63 12.93 -61.40 58.30 93.99 4.58 1.44 16.24 64.05 13.94 0.23 1.06 0.00 3.78 0.70 67 D C C 64.87 8.18 20.04 28.71 111.57 109.11 -103.87 106.83 94.70 2.30 2.99 86.27 6.32 2.33 1.65 1.11 0.00 1.35 0.97 68 S H H 26.22 20.42 14.54 34.01 94.36 -154.41 -65.29 -32.33 18.51 0.23 81.26 5.52 4.92 9.15 75.57 4.59 0.04 0.09 0.12 69 K H H 115.83 7.09 21.34 29.03 92.82 56.58 -65.36 -40.21 11.03 0.11 88.85 1.91 1.83 7.58 84.24 4.30 0.04 0.06 0.04 70 D H H 66.78 6.41 23.51 30.02 92.41 48.86 -66.57 -40.20 6.44 0.16 93.39 2.17 1.03 3.59 88.51 4.54 0.02 0.11 0.04 71 L H H 5.18 23.62 17.92 41.65 91.57 52.31 -63.77 -43.36 2.47 0.06 97.47 0.65 0.36 1.45 95.33 2.15 0.01 0.04 0.01 72 G H H 5.30 20.33 18.36 38.76 91.80 51.97 -62.57 -42.21 2.90 0.06 97.04 0.61 0.28 1.88 93.27 3.90 0.01 0.05 0.01 73 H H H 116.86 4.22 24.43 29.12 92.02 50.14 -65.15 -40.56 3.14 0.07 96.79 0.45 0.26 2.30 92.15 4.77 0.01 0.05 0.01 74 W H H 79.58 13.77 21.68 35.02 92.38 50.00 -66.38 -36.89 6.34 0.09 93.57 0.59 0.52 5.19 89.78 3.82 0.03 0.05 0.03 75 A H H 7.29 22.54 17.72 40.36 92.64 48.17 -82.05 -13.24 49.72 0.30 49.98 1.54 2.53 44.67 48.21 2.69 0.06 0.12 0.18 76 G C T 32.33 8.07 24.00 33.08 95.08 -119.25 74.77 22.60 98.14 0.34 1.51 6.91 4.86 86.74 0.83 0.36 0.00 0.18 0.12 77 L C C 21.92 18.51 17.83 36.50 97.50 125.29 -87.02 -15.07 91.62 7.71 0.67 49.49 35.19 7.15 0.14 0.56 0.00 6.56 0.91 78 F E E 34.45 18.75 15.30 33.63 130.42 46.06 -127.11 148.54 36.78 62.88 0.34 25.74 10.89 1.43 0.08 0.31 0.00 59.96 1.58 79 K E E 104.68 6.21 19.97 27.18 127.03 -157.08 -120.88 146.67 11.38 88.57 0.05 10.26 0.93 0.10 0.01 0.03 0.00 88.25 0.41 80 L E E 78.02 10.48 11.70 23.24 119.22 -131.35 -102.71 136.48 4.50 95.48 0.02 4.16 0.21 0.02 0.02 0.01 0.00 82.47 13.11 81 D C C 55.38 6.07 10.09 18.25 123.49 -132.80 -82.91 173.49 96.95 3.03 0.02 97.16 0.31 0.04 0.00 0.00 0.00 2.11 0.38 82 N C T 147.42 0.46 9.74 9.83 90.29 -88.28 -64.29 -20.91 99.52 0.17 0.31 0.60 4.93 94.02 0.01 0.29 0.00 0.13 0.02 83 E C T 156.41 0.57 10.43 10.08 93.98 54.08 -88.34 0.79 99.61 0.05 0.34 0.31 4.43 94.90 0.01 0.31 0.00 0.03 0.01 84 G C S 45.61 4.40 9.58 15.91 96.25 -105.20 83.34 6.06 99.48 0.28 0.24 12.02 86.66 0.94 0.02 0.15 0.00 0.11 0.10 85 N C C 94.90 2.33 13.30 16.74 118.11 135.54 -85.16 142.21 98.54 1.42 0.05 91.48 6.97 0.24 0.01 0.03 0.00 0.84 0.43 86 A E E 54.22 9.83 10.72 21.69 112.92 -107.44 -68.40 139.87 7.67 92.21 0.13 6.52 0.56 0.08 0.10 0.05 0.00 66.62 26.08 87 R E E 111.35 7.95 14.47 23.65 121.36 -173.05 -111.92 146.86 32.35 67.46 0.20 25.20 6.18 0.67 0.03 0.18 0.00 67.25 0.50 88 K E E 119.77 5.71 18.05 25.00 120.40 -88.51 -103.00 135.72 27.43 72.23 0.34 20.96 6.32 0.84 0.07 0.28 0.00 70.46 1.07 89 I E E 52.10 16.51 14.96 31.10 115.02 -140.44 -94.94 126.88 32.83 66.79 0.39 29.48 2.11 0.40 0.17 0.23 0.00 62.83 4.78 90 I C C 51.30 13.30 19.98 33.46 117.36 -167.67 -107.24 130.91 56.06 43.25 0.69 44.73 8.59 2.22 0.19 0.55 0.00 41.09 2.61 91 G C C 20.33 13.40 23.87 36.89 115.08 -96.29 98.61 131.82 67.52 31.67 0.80 42.32 21.30 4.63 0.13 0.75 0.00 28.85 2.01 92 A C C 6.54 24.14 19.60 43.31 123.26 -119.66 -105.50 139.42 58.81 40.43 0.76 50.26 5.97 1.22 0.18 0.63 0.00 38.74 3.01 93 S E E 19.61 17.59 27.01 44.03 103.59 -165.64 -101.00 -23.27 47.30 51.97 0.73 27.76 19.52 1.81 0.16 0.55 0.00 49.11 1.08 94 S E E 3.35 24.15 26.83 50.06 139.53 2.66 -151.72 152.74 12.36 86.83 0.81 9.44 2.68 0.61 0.23 0.41 0.00 86.31 0.33 95 V E E 3.14 25.44 27.74 52.39 125.08 -159.58 -125.67 135.76 1.62 97.71 0.67 1.41 0.13 0.06 0.56 0.10 0.00 97.66 0.08 96 A E E 4.87 23.16 27.92 49.98 120.67 -159.87 -112.08 131.45 0.88 98.26 0.86 0.74 0.05 0.04 0.93 0.07 0.00 98.11 0.04 97 V E E 8.26 23.16 24.24 46.63 120.13 -163.98 -112.98 126.95 2.47 96.21 1.32 2.18 0.14 0.09 1.37 0.17 0.00 95.90 0.14 98 V E E 37.06 15.53 23.09 38.16 119.10 -166.04 -110.57 135.63 22.37 75.30 2.33 17.16 4.36 0.95 1.76 0.65 0.00 74.62 0.49 99 D C C 71.04 10.72 21.86 32.30 107.87 -120.29 -84.39 107.42 69.05 28.63 2.33 49.50 14.96 3.21 0.96 1.23 0.00 29.35 0.78 100 F C C 53.43 16.23 15.26 31.35 100.18 171.33 -93.28 -2.74 83.96 10.59 5.45 68.44 8.90 6.43 1.98 3.28 0.00 9.18 1.80 101 G C C 28.79 7.68 17.50 26.34 118.33 -134.72 82.68 -167.79 82.97 4.49 12.54 50.22 18.08 14.87 4.07 8.33 0.01 2.42 2.01 102 E C T 130.74 4.89 15.61 21.55 96.96 -41.95 -74.42 -20.09 74.24 1.37 24.39 15.07 20.99 39.05 8.81 14.46 0.03 0.66 0.93 103 D C T 101.55 3.77 14.90 19.76 99.04 55.55 -88.75 4.97 74.97 1.09 23.94 23.97 16.15 35.80 9.80 13.06 0.01 0.48 0.73 104 S C C 33.88 10.75 10.75 22.78 117.39 123.52 -82.88 148.91 63.38 0.81 35.81 38.64 19.34 5.84 30.96 4.51 0.00 0.28 0.43 105 A H H 73.17 2.87 16.67 19.98 93.66 -126.47 -62.94 -34.83 19.36 0.40 80.24 8.08 4.41 8.23 73.19 5.67 0.04 0.22 0.16 106 E H H 78.92 8.79 15.49 25.38 92.26 53.92 -65.47 -39.48 12.52 0.39 87.09 5.74 2.07 5.41 80.63 5.75 0.02 0.27 0.11 107 K H H 64.76 12.44 13.91 26.96 91.98 51.79 -64.69 -39.86 8.01 0.34 91.65 4.32 1.33 2.89 85.11 6.01 0.01 0.26 0.07 108 D H H 78.84 3.70 17.17 21.42 92.25 51.77 -65.19 -38.86 9.43 0.53 90.04 5.18 1.49 3.46 84.23 5.10 0.01 0.41 0.11 109 F H H 98.51 4.07 15.93 21.02 92.81 51.71 -65.17 -40.80 9.58 0.87 89.55 4.48 1.56 4.18 83.93 4.93 0.03 0.74 0.16 110 L H H 54.01 11.19 12.64 24.82 92.69 51.22 -66.57 -38.62 12.73 1.04 86.23 5.27 1.98 5.97 81.57 4.12 0.04 0.83 0.22 111 L H H 85.26 7.61 12.10 20.98 93.86 52.56 -71.23 -27.71 27.49 1.10 71.41 8.22 3.77 15.71 68.08 3.12 0.06 0.65 0.40 112 S C H 85.55 1.74 12.53 14.79 97.78 56.89 -82.45 -5.32 56.83 0.55 42.63 24.85 1.90 27.55 43.40 1.77 0.00 0.24 0.28 113 Q C C 110.77 5.81 11.22 18.56 107.02 90.70 -83.88 91.25 99.88 0.03 0.10 99.61 0.10 0.18 0.08 0.00 0.00 0.01 0.01