A0A087XPK3_POEFO Loading...

DDB1- and CUL4-associated factor 10

May function as a substrate receptor for CUL4-DDB1 E3 ubiquitin-protein ligase complex.

AlphaFold DB , UniProt , Accession A0A087XPK3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 527 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	34.1	Very low	249 Å²	249	162.9 Å²	162.9	100%	1.227	88%	0.881	S	S	*	*				0	136.8	0	-77.2	172.4	161.6	0	0	106.8
2	S	30.2	Very low	33.9	Very low	126 Å²	126	157.9 Å²	157.9	88%	0.881	88%	0.878	S	S	*	*			trans	-94.3	157.7	-160.3	-53.3	0	0	0	0	113.2
3	S	34.6	Very low	33.8	Very low	109 Å²	109	158.9 Å²	158.9	76%	0.762	88%	0.881	S	S	*	*			trans	-70.2	157.6	165.3	50.6	0	0	0	0	112.2
4	E	37.4	Very low	33.7	Very low	194 Å²	194	159.8 Å²	159.8	91%	0.907	88%	0.875	S	S	*	*			trans	-152.2	156.6	139.5	-127.9	154.2	-152.9	0	0	111.6
5	H	36	Very low	33.6	Very low	185 Å²	185	156.5 Å²	156.5	86%	0.856	87%	0.868	S	S	*	*			trans	-90.5	157.5	177.6	-77.6	-86.4	0	0	0	110.8
6	Q	36.7	Very low	33.5	Very low	200 Å²	200	159.2 Å²	159.2	94%	0.935	87%	0.872	S	S	*	*			trans	-127.3	150.3	148.8	-83.5	-177.1	-29.9	0	0	109.3
7	S	30.3	Very low	33.5	Very low	111 Å²	111	157.4 Å²	157.4	78%	0.776	86%	0.861	S	S	*	*			trans	-120.1	159	-165.6	52.6	0	0	0	0	111.7
8	D	34.7	Very low	33.6	Very low	164 Å²	164	160.3 Å²	160.3	88%	0.877	86%	0.857	S	S	*	*			trans	-62.8	152.5	164.6	-54.7	-74.6	0	0	0	111.4
9	S	31.7	Very low	34.1	Very low	103 Å²	103	158.9 Å²	158.9	72%	0.72	86%	0.858	S	S	*	*			trans	-145	121.1	163.5	57	0	0	0	0	109.3
10	E	34.4	Very low	34.2	Very low	195 Å²	195	157.1 Å²	157.1	91%	0.911	86%	0.858	S	S	*	*			trans	-79.7	134	166.8	-61.1	170.2	111.7	0	0	108.4
11	D	31.9	Very low	33.9	Very low	156 Å²	156	154.5 Å²	154.5	83%	0.834	85%	0.852	S	S	*	*			trans	-119	122.1	165.7	-82.5	-51.4	0	0	0	109.1
12	A	31.8	Very low	33.7	Very low	103 Å²	103	149.7 Å²	149.7	85%	0.851	84%	0.836	S	S	*	*			trans	-92.9	151.7	159.8	0	0	0	0	0	108.3
13	D	31.8	Very low	33.7	Very low	171 Å²	171	146.9 Å²	146.9	91%	0.914	83%	0.827	S	S	*	*			trans	-125.9	147.1	171.5	-158.9	1.4	0	0	0	110.1
14	E	32.2	Very low	33.6	Very low	171 Å²	171	151.6 Å²	151.6	80%	0.799	83%	0.834	S	S	*	*			trans	-120.9	159.9	-157.3	-165.7	171.2	-154.8	0	0	112.1
15	S	33.6	Very low	33.2	Very low	111 Å²	111	149.5 Å²	149.5	78%	0.776	82%	0.822	S	S	*	*			trans	-63.9	137.4	-178.8	54.8	0	0	0	0	113.5
16	Q	31.6	Very low	33	Very low	199 Å²	199	147.5 Å²	147.5	93%	0.93	81%	0.813	S	S	*	*			trans	-131.1	146.4	159.7	-66.5	-163.8	6.3	0	0	111.8
17	D	33.7	Very low	32.9	Very low	128 Å²	128	144.8 Å²	144.8	68%	0.684	81%	0.805	S	S	*	*			trans	-135.2	150	-176.4	-179.9	31	0	0	0	110.3
18	R	34.7	Very low	34	Very low	210 Å²	210	144 Å²	144	79%	0.792	80%	0.798	S	S	*	*			trans	67.3	155.8	171.9	-39.7	-169.1	179.3	-163.6	-7.5	119.4
19	P	43.4	Very low	33.9	Very low	134 Å²	134	143.2 Å²	143.2	87%	0.87	80%	0.798	S	S	*	*				-123.5	166.9	126.1	37.1	-32.3	0	0	0	112.7
20	S	35.2	Very low	33.7	Very low	122 Å²	122	142 Å²	142	85%	0.853	80%	0.801	S	S	*	*			trans	-139.1	164.6	177.1	66.3	0	0	0	0	111.6
21	S	29.3	Very low	33.5	Very low	104 Å²	104	144.4 Å²	144.4	73%	0.727	80%	0.802	S	S	*	*			trans	-144.3	119.6	-176.9	50.7	0	0	0	0	115.1
22	T	31.9	Very low	34.2	Very low	148 Å²	148	141.7 Å²	141.7	91%	0.908	79%	0.793	S	S	*	*			trans	58.6	137.7	150.7	59.4	0	0	0	0	120.6
23	G	31.1	Very low	34.1	Very low	67 Å²	67	141.7 Å²	141.7	69%	0.691	78%	0.782	S	S	*	*			cis	144.6	147.6	-8.5	0	0	0	0	0	114.3
24	K	31.6	Very low	34.1	Very low	207 Å²	207	142.2 Å²	142.2	90%	0.9	78%	0.779	S	S	*	*			trans	83.4	142.5	-178.7	-53.7	171.4	-177.5	173.7	0	115.3
25	K	29.8	Very low	33.9	Very low	151 Å²	151	138.4 Å²	138.4	66%	0.657	77%	0.772	S	S	*	*			cis	-161.5	141.7	-10	-119.3	-176.8	175.1	-80.3	0	110.7
26	E	32.3	Very low	33.8	Very low	142 Å²	142	141.4 Å²	141.4	66%	0.664	77%	0.773	S	S	*	*				27	141.6	122.7	-70.1	161.5	-138.4	0	0	119.8
27	D	33.2	Very low	33.8	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	76%	0.761	S	S	*	*			cis	-174.7	-165.8	0.2	-126.3	15.9	0	0	0	109.7
28	P	54.8	Low	33.6	Very low	96 Å²	96	138.8 Å²	138.8	62%	0.623	76%	0.764	S	S	*	*				-135.4	-163	-74	35.8	-12.6	0	0	0	115
29	V	32.6	Very low	33.4	Very low	147 Å²	147	137.5 Å²	137.5	89%	0.891	77%	0.767	S	S	*	*			trans	84.5	129	159.4	-174	0	0	0	0	119.2
30	G	27.7	Very low	32.7	Very low	76 Å²	76	138.9 Å²	138.9	78%	0.784	77%	0.768	S	S	*	*			trans	158.2	90.9	162.4	0	0	0	0	0	117.5
31	R	29.5	Very low	32.5	Very low	247 Å²	247	136.7 Å²	136.7	93%	0.932	76%	0.757	S	S	*	*			trans	-144.1	163.4	167.2	-122	-167.1	-179.7	-167	1.9	107.1
32	P	46.9	Very low	33.5	Very low	99 Å²	99	137.1 Å²	137.1	64%	0.643	76%	0.757	S	S	*	*			cis	-144.7	-157.7	10.8	39.2	-15.3	0	0	0	116.2
33	T	30.4	Very low	33.4	Very low	102 Å²	102	137.1 Å²	137.1	63%	0.626	75%	0.747	S	S	*	*			trans	81	122.4	145.7	38.1	0	0	0	0	123.9
34	Q	30	Very low	33.3	Very low	182 Å²	182	144.3 Å²	144.3	85%	0.85	75%	0.753	S	S	*	*			trans	68.4	156.3	140.6	-67.9	161.2	-26.7	0	0	117.9
35	S	29.8	Very low	33.1	Very low	91 Å²	91	140.3 Å²	140.3	64%	0.636	75%	0.746	S	S	*	*			cis	-137.7	160.5	7.7	62.8	0	0	0	0	110.9
36	E	30.8	Very low	32.9	Very low	174 Å²	174	139 Å²	139	81%	0.813	76%	0.755	S	S	*	*				53.4	140.3	97.8	-48	178.5	158.4	0	0	115.2
37	V	30.7	Very low	32.8	Very low	112 Å²	112	136.7 Å²	136.7	68%	0.679	76%	0.759	S	S	*	*			cis	-164.4	167	12.1	93.5	0	0	0	0	112.7
38	E	29.3	Very low	32.8	Very low	160 Å²	160	135.2 Å²	135.2	75%	0.748	76%	0.76	S	S	*	*			trans	56.7	136.6	161.7	-73.2	155.9	-172.7	0	0	120.2
39	E	30.7	Very low	32.7	Very low	183 Å²	183	136.5 Å²	136.5	86%	0.855	77%	0.769	S	S	*	*				56.7	134.2	77.6	-59.4	-164.7	155	0	0	113.5
40	D	28.7	Very low	33.5	Very low	164 Å²	164	135.4 Å²	135.4	88%	0.877	76%	0.764	S	S	*	*			cis	-150.7	-167.2	26.7	-172.7	11.7	0	0	0	111.5
41	A	30.7	Very low	33.7	Very low	76 Å²	76	135.2 Å²	135.2	63%	0.628	76%	0.763	S	S	*	*			trans	-110.2	-150.1	-173.8	0	0	0	0	0	113.5
42	P	50.3	Low	33.7	Very low	113 Å²	113	128.7 Å²	128.7	73%	0.734	76%	0.755	S	S	*	*				-123.7	-176.3	-69.8	27.5	-9	0	0	0	115.5
43	Q	30.7	Very low	33.1	Very low	148 Å²	148	129.1 Å²	129.1	69%	0.692	76%	0.76	S	S	*	*			trans	99.3	143.9	152.9	-60.2	-162.9	18.7	0	0	122.1
44	R	29.6	Very low	33.3	Very low	218 Å²	218	128.3 Å²	128.3	82%	0.823	76%	0.759	S	S	*	*			trans	72.1	154.8	151	-74.8	162	-167	-123.5	2	119.1
45	V	27.3	Very low	33.5	Very low	123 Å²	123	127.5 Å²	127.5	75%	0.745	76%	0.755	S	S	*	*			cis	-172	160.1	-34.6	116.8	0	0	0	0	109
46	C	26	Very low	33.5	Very low	124 Å²	124	130.2 Å²	130.2	84%	0.838	76%	0.762	S	S	*	*			trans	70.8	161.3	178.7	-67.9	0	0	0	0	115.8
47	A	28.4	Very low	33.4	Very low	92 Å²	92	130.1 Å²	130.1	76%	0.76	76%	0.762	S	S	*	*			cis	-146.9	174.7	13	0	0	0	0	0	115.4
48	S	33.5	Very low	34.5	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	76%	0.76	S	S	*	*			trans	-154.1	-171.7	168.2	-51.3	0	0	0	0	107.5
49	P	53.1	Low	34.6	Very low	123 Å²	123	131.2 Å²	131.2	80%	0.799	77%	0.768	S	S	*	*			cis	-105.8	-119	-16.7	42	-25.8	0	0	0	108.7
50	P	50.4	Low	34.5	Very low	123 Å²	123	125.9 Å²	125.9	80%	0.799	76%	0.762	S	S	*	*			cis	-109.7	-172.3	-11.4	43.3	-31.3	0	0	0	113
51	G	31.1	Very low	34.6	Very low	73 Å²	73	123.8 Å²	123.8	75%	0.753	76%	0.76	S	S	*	*			cis	142	127	-16.3	0	0	0	0	0	116.3
52	S	30.5	Very low	34.5	Very low	110 Å²	110	125.4 Å²	125.4	77%	0.769	77%	0.774	S	S	*	*			trans	-176.8	129.8	153.2	47.7	0	0	0	0	108
53	S	34.4	Very low	33.4	Very low	107 Å²	107	123.4 Å²	123.4	75%	0.748	77%	0.774	S	S	*	*			cis	81.2	128.7	44.6	75.6	0	0	0	0	113.9
54	S	34.1	Very low	33.3	Very low	85 Å²	85	122.3 Å²	122.3	59%	0.594	78%	0.783	S	S	*	*			cis	-172.4	173.6	-2.1	42.1	0	0	0	0	112.5
55	E	34.2	Very low	33.2	Very low	165 Å²	165	117.2 Å²	117.2	77%	0.771	78%	0.78	S	S	*	*			trans	66.5	154.4	155.7	-71.6	128.9	178.2	0	0	119.5
56	D	29.5	Very low	34.3	Very low	148 Å²	148	117.1 Å²	117.1	79%	0.791	78%	0.782	S	S	*	*			cis	-148.5	-179.7	3.8	-141.9	-27.6	0	0	0	113.8
57	Q	28.8	Very low	35.1	Very low	172 Å²	172	117.1 Å²	117.1	80%	0.804	78%	0.78	S	S	*	*			trans	-111.4	-155.8	174	-45.3	-174.2	-1.8	0	0	111.6
58	P	53.2	Low	35.1	Very low	100 Å²	100	122.2 Å²	122.2	65%	0.649	78%	0.78	S	S	*	*			cis	-137.1	-167.4	-21.5	26.4	-0.5	0	0	0	115.4
59	E	31.4	Very low	35	Very low	196 Å²	196	125.2 Å²	125.2	92%	0.916	79%	0.786	S	S	*	*			trans	80	158.2	157.9	-48.6	-154.2	149	0	0	121.3
60	G	29.4	Very low	33.8	Very low	71 Å²	71	125.9 Å²	125.9	73%	0.732	78%	0.779	S	S	*	*			trans	164.5	-14.9	170.8	0	0	0	0	0	124.1
61	S	29.6	Very low	32.8	Very low	119 Å²	119	127.4 Å²	127.4	83%	0.832	78%	0.78	S	S	*	*			trans	44.5	123.1	167.1	64.9	0	0	0	0	123.8
62	A	29.5	Very low	32.7	Very low	111 Å²	111	132.6 Å²	132.6	92%	0.917	79%	0.785	S	S	*	*			trans	61.6	140.7	137	0	0	0	0	0	124.1
63	G	27.4	Very low	32.7	Very low	70 Å²	70	133.3 Å²	133.3	72%	0.722	78%	0.776	S	S	*	*			trans	167.7	98.9	161.1	0	0	0	0	0	119.7
64	S	28.9	Very low	32.6	Very low	126 Å²	126	134.4 Å²	134.4	88%	0.881	78%	0.781	S	S	*	*			trans	59.6	162.7	146.5	70	0	0	0	0	124.6
65	S	27.9	Very low	32.3	Very low	111 Å²	111	140 Å²	140	78%	0.776	79%	0.789	S	S	*	*			trans	-160.4	178.5	171.7	-45	0	0	0	0	107.2
66	P	48.8	Very low	32	Very low	120 Å²	120	138 Å²	138	78%	0.779	79%	0.793	S	S	*	*			cis	-109.7	-147.5	-38.6	29.9	-7.9	0	0	0	109.3
67	P	44.2	Very low	32.1	Very low	124 Å²	124	136.4 Å²	136.4	81%	0.805	79%	0.793	S	S	*	*				-149.3	-175.4	81.2	40.6	-21.3	0	0	0	115.9
68	R	27.8	Very low	32.4	Very low	200 Å²	200	134.7 Å²	134.7	76%	0.755	80%	0.797	S	S	*	*			trans	-85.7	165.9	168.3	-67.5	-179.7	175.7	179.9	1	112.4	E70	R68-E70 IonicContact CZ-OE1 2.81Å; R68-E70 IonicContact NH1-OE1 3.69Å; R68-E70 PolarHBondContact NH1-OE1 3.05Å
69	L	31	Very low	31.1	Very low	176 Å²	176	133.6 Å²	133.6	92%	0.921	80%	0.804	S	S	*	*			trans	-134.4	161	145.3	-75	175.6	0	0	0	109.7
70	E	28.2	Very low	31	Very low	136 Å²	136	129.1 Å²	129.1	64%	0.636	80%	0.8	S	S	*	*			trans	-128.2	-167.4	-173.2	-65	177.9	159.5	0	0	110.2	R68	R68-E70 IonicContact CZ-OE1 2.81Å; R68-E70 IonicContact NH1-OE1 3.69Å; R68-E70 PolarHBondContact NH1-OE1 3.05Å
71	D	28.7	Very low	30.9	Very low	156 Å²	156	130.3 Å²	130.3	83%	0.834	80%	0.803	S	S	*	*			trans	73.2	144.2	174.4	-51.1	-34.6	0	0	0	118
72	E	28.5	Very low	31	Very low	181 Å²	181	130.7 Å²	130.7	85%	0.846	80%	0.803	S	S	*	*			cis	-148.9	160.7	-3.1	-140.9	-174.9	172.3	0	0	112.2
73	E	30.3	Very low	30.8	Very low	125 Å²	125	134.3 Å²	134.3	58%	0.584	80%	0.801	S	S	*	*			trans	-78.5	165.4	162.7	-80.6	-168.5	141.6	0	0	110.7	R75	E73-R75 IonicContact OE1-NE 3.83Å; E73-R75 IonicContact OE1-NH2 3.86Å; E73-R75 IonicContact OE2-CZ 3.31Å; E73-R75 VanDerWaalsContact OE2-CZ 3.31Å; E73-R75 IonicContact OE2-NE 2.71Å; E73-R75 PolarHBondContact OE2-NE 2.71Å; E73-R75 IonicContact OE2-NH2 3.05Å; E73-R75 PolarHBondContact OE2-NH2 2.84Å
74	P	34.2	Very low	30.9	Very low	131 Å²	131	135.2 Å²	135.2	85%	0.851	80%	0.802	S	S	*	*				-132.4	137.7	121.6	36.2	-29.9	0	0	0	114.3
75	R	26.2	Very low	30.8	Very low	203 Å²	203	134 Å²	134	77%	0.766	80%	0.799	S	S	*	*			trans	-91.4	151.9	171.6	-58.8	177.6	-174.7	-174.2	-1.2	111.1	E73	E73-R75 IonicContact OE1-NE 3.83Å; E73-R75 IonicContact OE1-NH2 3.86Å; E73-R75 IonicContact OE2-CZ 3.31Å; E73-R75 VanDerWaalsContact OE2-CZ 3.31Å; E73-R75 IonicContact OE2-NE 2.71Å; E73-R75 PolarHBondContact OE2-NE 2.71Å; E73-R75 IonicContact OE2-NH2 3.05Å; E73-R75 PolarHBondContact OE2-NH2 2.84Å
76	S	27.9	Very low	30.8	Very low	123 Å²	123	134.3 Å²	134.3	86%	0.86	80%	0.802	S	S	*	*			trans	-141.7	154.1	155.7	60	0	0	0	0	111.1
77	S	31.4	Very low	29.7	Very low	113 Å²	113	132.7 Å²	132.7	79%	0.79	81%	0.806	S	S	*	*			trans	-107.8	159.5	-156.2	-50.7	0	0	0	0	113.4
78	P	36.1	Very low	28.8	Very low	136 Å²	136	129.9 Å²	129.9	88%	0.883	80%	0.8	S	S	*	*			trans	-86.7	153.2	-174.2	34.5	-36.3	0	0	0	114.6
79	G	25.8	Very low	28.8	Very low	77 Å²	77	126.4 Å²	126.4	79%	0.794	81%	0.806	S	S	*	*			trans	178.8	153.8	166.9	0	0	0	0	0	110.5
80	A	28	Very low	28.6	Very low	102 Å²	102	123.2 Å²	123.2	84%	0.843	80%	0.799	S	S	*	*			cis	-153.9	162.2	-8.9	0	0	0	0	0	109.6
81	A	27.3	Very low	28.6	Very low	96 Å²	96	121.5 Å²	121.5	79%	0.793	80%	0.802	S	S	*	*			trans	-97.2	151.7	171	0	0	0	0	0	111.3
82	P	32.6	Very low	28.5	Very low	127 Å²	127	118.7 Å²	118.7	83%	0.825	79%	0.794	S	S	*	*			trans	-110.5	158.5	153.4	35.6	-28.2	0	0	0	111.9
83	Q	26.2	Very low	28.4	Very low	187 Å²	187	119.1 Å²	119.1	87%	0.874	80%	0.797	S	S	*	*			trans	-117.7	158.6	179.6	-65.9	-174.4	-6.3	0	0	112.8
84	A	28.1	Very low	28.4	Very low	89 Å²	89	116.9 Å²	116.9	74%	0.736	81%	0.807	S	S	*	*			trans	73.3	129.4	139.2	0	0	0	0	0	122.8
85	A	28	Very low	28	Very low	100 Å²	100	120.5 Å²	120.5	83%	0.826	81%	0.805	S	S	*	*			trans	71	151.4	141.9	0	0	0	0	0	118.5
86	S	28	Very low	28.2	Very low	119 Å²	119	120.4 Å²	120.4	83%	0.832	81%	0.81	S	S	*	*			cis	-161	164.2	21.7	55.8	0	0	0	0	113.6
87	G	25.6	Very low	28.3	Very low	85 Å²	85	118 Å²	118	88%	0.876	81%	0.805	S	S	*	*			trans	85.2	143.5	161.5	0	0	0	0	0	117.7
88	G	24.8	Very low	28.3	Very low	66 Å²	66	120.3 Å²	120.3	68%	0.68	81%	0.808	S	S	*	*			cis	159.5	131.3	-14.1	0	0	0	0	0	114.8
89	S	27.9	Very low	28.2	Very low	126 Å²	126	117.5 Å²	117.5	88%	0.881	79%	0.792	S	S	*	*			trans	61.6	157.2	171.7	68.1	0	0	0	0	117.3
90	S	26.1	Very low	28.8	Very low	109 Å²	109	120.4 Å²	120.4	76%	0.762	79%	0.789	S	S	*	*			cis	-161.3	161.7	-23.2	52	0	0	0	0	106.5
91	S	27.8	Very low	29	Very low	100 Å²	100	121.3 Å²	121.3	70%	0.699	77%	0.774	S	S	*	*				-178.6	167.5	52.3	48.2	0	0	0	0	111.9
92	S	27.3	Very low	29.4	Very low	97 Å²	97	120.3 Å²	120.3	68%	0.678	76%	0.761	S	S	*	*			trans	39.8	102.2	161.8	58	0	0	0	0	119.1
93	E	27.2	Very low	29.6	Very low	191 Å²	191	121.8 Å²	121.8	89%	0.893	75%	0.751	S	S	*	*				88.3	128.3	70.4	-80.9	-161.4	130.2	0	0	115.2
94	G	28.9	Very low	29.8	Very low	78 Å²	78	117.7 Å²	117.7	80%	0.804	73%	0.734	S	S	*	*			trans	172	47.9	-174.6	0	0	0	0	0	115
95	Y	27.1	Very low	30.2	Very low	206 Å²	206	121.2 Å²	121.2	81%	0.808	74%	0.735	S	S	*	*			trans	-60.4	150.9	169.5	-81.5	-80	0	0	0	110.6
96	K	30.7	Very low	30.4	Very low	201 Å²	201	120.3 Å²	120.3	87%	0.874	72%	0.723	S	S	*	*			cis	-158.7	137	30.9	-128.4	153.7	-169.5	171.9	0	109.1
97	G	28.7	Very low	30.8	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	73%	0.725	S	S	*	*			trans	-175.4	15.7	179.2	0	0	0	0	0	118.3	S99	G97-S99 PolarHBondContact O-N 2.95Å
98	N	31.2	Very low	31	Very low	161 Å²	161	127.9 Å²	127.9	86%	0.861	72%	0.721	S	S	*	*			trans	-69.5	99.7	-176.3	-75.8	7.6	0	0	0	112.1	L100	N98-L100 PolarHBondContact O-N 3.3Å
99	S	35.1	Very low	31.3	Very low	78 Å²	78	131.9 Å²	131.9	55%	0.545	73%	0.732	S	S	.	*			trans	-58.9	121.2	151.2	174.9	0	0	0	0	108.1	G97 F101 S102	G97-S99 PolarHBondContact O-N 2.95Å; S99-F101 PolarHBondContact O-N 2.92Å; S99-S102 PolarHBondContact O-N 2.93Å
100	L	37.7	Very low	31.4	Very low	138 Å²	138	133.7 Å²	133.7	72%	0.723	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-3.6	-174.5	-134.8	116.7	0	0	0	113.9	N98 W103	N98-L100 PolarHBondContact O-N 3.3Å; L100-W103 PolarHBondContact O-NE1 3.38Å; L100-W103 VanDerWaalsContact O-NE1 3.1Å
101	F	33.3	Very low	32	Very low	120 Å²	120	140.2 Å²	140.2	53%	0.526	73%	0.728	S	S	.	*	T	Hydrogen-bonded Turn	trans	-135.8	17.6	-170.3	-61.1	-63.7	0	0	0	113.7	S99 W103 L104	S99-F101 PolarHBondContact O-N 2.92Å; F101-W103 PolarHBondContact O-N 3.1Å; F101-L104 HydrophobicContact CB-CD1 4.06Å; F101-L104 HydrophobicContact CB-CG 4.43Å; F101-L104 HydrophobicContact CD1-CD1 3.61Å; F101-L104 HydrophobicContact CD1-CG 4.32Å; F101-L104 HydrophobicContact CE1-CD1 4.44Å; F101-L104 HydrophobicContact CG-CD1 4.13Å; F101-L104 WeakPolarHBondContact O-CB 2.94Å; F101-L104 PolarHBondContact O-N 3.22Å
102	S	34.5	Very low	31.9	Very low	76 Å²	76	138.4 Å²	138.4	53%	0.531	73%	0.725	S	S	.	*	G	3₁₀ helix	trans	-56.7	-33.1	173.7	54.1	0	0	0	0	112.6	S99 L104 Q105	S99-S102 PolarHBondContact O-N 2.93Å; S102-L104 PolarHBondContact O-N 3.09Å; S102-Q105 PolarHBondContact O-N 3.3Å; S102-Q105 VanDerWaalsContact O-N 3.09Å
103	W	36.5	Very low	32.2	Very low	158 Å²	158	142.6 Å²	142.6	60%	0.598	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-67.2	-14.9	173.7	68.2	-87.7	0	0	0	114.5	L100 F101 Q105 S106	L100-W103 PolarHBondContact O-NE1 3.38Å; L100-W103 VanDerWaalsContact O-NE1 3.1Å; F101-W103 PolarHBondContact O-N 3.1Å; W103-Q105 VanDerWaalsContact C-N 3.31Å; W103-S106 PolarHBondContact O-OG 3.43Å
104	L	32.4	Very low	32.5	Very low	101 Å²	101	141.1 Å²	141.1	53%	0.529	73%	0.73	S	S	.	*	G	3₁₀ helix	trans	-79.5	-11.7	170.6	-70.9	179.5	0	0	0	112.8	F101 S102	F101-L104 HydrophobicContact CB-CD1 4.06Å; F101-L104 HydrophobicContact CB-CG 4.43Å; F101-L104 HydrophobicContact CD1-CD1 3.61Å; F101-L104 HydrophobicContact CD1-CG 4.32Å; F101-L104 HydrophobicContact CE1-CD1 4.44Å; F101-L104 HydrophobicContact CG-CD1 4.13Å; F101-L104 WeakPolarHBondContact O-CB 2.94Å; F101-L104 PolarHBondContact O-N 3.22Å; S102-L104 PolarHBondContact O-N 3.09Å
105	Q	34.8	Very low	32.5	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.762	72%	0.722	S	S	*	*	S	Bend	trans	-80.7	-17.9	171	-76.3	-176.9	-43.2	0	0	113.2	S102 W103 R107	S102-Q105 PolarHBondContact O-N 3.3Å; S102-Q105 VanDerWaalsContact O-N 3.09Å; W103-Q105 VanDerWaalsContact C-N 3.31Å; Q105-R107 VanDerWaalsContact C-N 3.25Å; Q105-R107 PolarHBondContact O-N 2.88Å
106	S	32	Very low	33.1	Very low	81 Å²	81	135.3 Å²	135.3	57%	0.566	70%	0.698	S	S	*	*	S	Bend	trans	-73.6	81.2	163.2	29.9	0	0	0	0	110.1	W103 T108	W103-S106 PolarHBondContact O-OG 3.43Å; S106-T108 PolarHBondContact O-N 2.72Å; S106-T108 PolarHBondContact O-OG1 2.82Å
107	R	38	Very low	33.5	Very low	233 Å²	233	129.4 Å²	129.4	88%	0.879	68%	0.68	S	S	*	*			trans	-53.3	81.3	-172.9	-66	168.8	175.4	-175.9	-5.1	114.9	Q105	Q105-R107 VanDerWaalsContact C-N 3.25Å; Q105-R107 PolarHBondContact O-N 2.88Å
108	T	29.6	Very low	34.4	Very low	129 Å²	129	126.5 Å²	126.5	79%	0.791	65%	0.649	S	S	*	*			trans	-104.7	71.3	163.7	40.7	0	0	0	0	110.9	S106 R110	S106-T108 PolarHBondContact O-N 2.72Å; S106-T108 PolarHBondContact O-OG1 2.82Å; T108-R110 PolarHBondContact O-N 3.28Å
109	V	31.3	Very low	35.2	Very low	151 Å²	151	124.9 Å²	124.9	92%	0.915	63%	0.631	S	S	*	*			trans	-72.7	82.3	163.5	-176.8	0	0	0	0	107.9
110	R	30.2	Very low	35.9	Very low	163 Å²	163	128.4 Å²	128.4	62%	0.615	64%	0.643	S	S	*	*			trans	-115.3	103.3	178.8	-157	-169.5	-152.5	166.6	18.2	110.5	T108	T108-R110 PolarHBondContact O-N 3.28Å
111	R	37.9	Very low	36.9	Very low	246 Å²	246	126.1 Å²	126.1	93%	0.928	63%	0.632	S	S	*	*			trans	-159.5	137.3	157.8	-96	168.8	-166	-141.2	0.4	105.8
112	G	26.1	Very low	38.5	Very low	63 Å²	63	122.4 Å²	122.4	65%	0.649	62%	0.616	S	S	*	*	S	Bend	cis	-86.4	-150.9	2	0	0	0	0	0	116.1	F114	G112-F114 PolarHBondContact O-N 2.68Å
113	L	32.2	Very low	40.2	Very low	184 Å²	184	127.1 Å²	127.1	96%	0.963	62%	0.622	S	S	*	*	S	Bend	trans	-84	87.5	-177.2	-82.4	160.7	0	0	0	111.6
114	F	33.5	Very low	42	Very low	161 Å²	161	123.5 Å²	123.5	71%	0.706	62%	0.617	S	S	*	*			trans	-142.6	136.2	154.5	-135.3	-107.1	0	0	0	109.9	G112 P117	G112-F114 PolarHBondContact O-N 2.68Å; F114-P117 HydrophobicContact CE1-CG 3.89Å
115	V	30	Very low	44	Very low	104 Å²	104	121.1 Å²	121.1	63%	0.63	60%	0.604	S	S	*	*			trans	-93.5	112.5	163.1	-177.7	0	0	0	0	104.9	P117	V115-P117 WeakPolarHBondContact O-CD 3.3Å; V115-P117 WeakPolarHBondContact O-CG 3.4Å
116	D	40	Very low	45.9	Very low	57 Å²	57	114.1 Å²	114.1	31%	0.305	57%	0.572	S	S	.	*			trans	-55	104.6	179.9	178.9	-5	0	0	0	109.9	A118 K388	D116-A118 PolarHBondContact O-N 3.26Å; D116-A118 VanDerWaalsContact OD1-CB 3.29Å; D116-A118 WeakPolarHBondContact OD1-CB 3.27Å; D116-A118 PolarHBondContact OD1-N 2.73Å; D116-K388 IonicContact OD2-NZ 3.77Å; D116-K388 PolarHBondContact OD2-NZ 3.29Å
117	P	37.7	Very low	48.2	Very low	77 Å²	77	113.9 Å²	113.9	50%	0.5	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74	-15.5	-175.8	-13.1	30.4	0	0	0	111.8	F114 V115 N121	F114-P117 HydrophobicContact CE1-CG 3.89Å; V115-P117 WeakPolarHBondContact O-CD 3.3Å; V115-P117 WeakPolarHBondContact O-CG 3.4Å; P117-N121 PolarHBondContact O-N 2.99Å
118	A	47.8	Very low	50.3	Low	13 Å²	13	104.5 Å²	104.5	11%	0.107	54%	0.538	C	S	.	.	H	α-helix	trans	-77.6	-28.7	-175.1	0	0	0	0	0	112.1	D116 D120 N121 F122 D451	D116-A118 PolarHBondContact O-N 3.26Å; D116-A118 VanDerWaalsContact OD1-CB 3.29Å; D116-A118 WeakPolarHBondContact OD1-CB 3.27Å; D116-A118 PolarHBondContact OD1-N 2.73Å; A118-D120 VanDerWaalsContact C-N 3.33Å; A118-D120 PolarHBondContact O-N 3.3Å; A118-N121 PolarHBondContact O-N 3.47Å; A118-F122 VanDerWaalsContact O-CA 3.31Å; A118-F122 WeakPolarHBondContact O-CA 3Å; A118-F122 WeakPolarHBondContact O-CB 3.2Å; A118-F122 PolarHBondContact O-N 2.59Å; A118-D451 HydrophobicContact CB-CB 3.57Å
119	R	49.7	Very low	52.9	Low	127 Å²	127	98.7 Å²	98.7	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-32.9	-175.3	-89.6	-169.2	164	-138.9	-11.3	114.6	F122 E474	R119-F122 WeakPolarHBondContact O-CD1 3.3Å; R119-E474 IonicContact CZ-OE2 3.17Å; R119-E474 IonicContact NE-OE2 2.68Å; R119-E474 PolarHBondContact NE-OE2 2.8Å; R119-E474 VanDerWaalsContact NE-OE2 3.14Å; R119-E474 IonicContact NH2-OE2 2.8Å; R119-E474 PolarHBondContact NH2-OE2 2.74Å
120	D	48.6	Very low	55.2	Low	151 Å²	151	93.1 Å²	93.1	81%	0.807	47%	0.469	S	S	*	.	H	α-helix	trans	-91.8	-29.9	175	-61.9	-33.5	0	0	0	112.9	A118	A118-D120 VanDerWaalsContact C-N 3.33Å; A118-D120 PolarHBondContact O-N 3.3Å
121	N	58.3	Low	57.7	Low	90 Å²	90	87 Å²	87	48%	0.481	45%	0.451	S	S	.	.	H	α-helix	trans	-104.8	6.1	-175.1	-69.4	-56.4	0	0	0	115.7	P117 A118 R123 T124 M125	P117-N121 PolarHBondContact O-N 2.99Å; A118-N121 PolarHBondContact O-N 3.47Å; N121-R123 VanDerWaalsContact C-N 3.26Å; N121-R123 PolarHBondContact O-N 3.03Å; N121-R123 VanDerWaalsContact O-N 3.13Å; N121-T124 WeakPolarHBondContact O-CA 3.43Å; N121-T124 WeakPolarHBondContact O-CB 3.38Å; N121-T124 PolarHBondContact O-N 3.16Å; N121-M125 PolarHBondContact O-N 3.38Å
122	F	67.6	Low	60	Low	42 Å²	42	75.2 Å²	75.2	18%	0.184	41%	0.407	C	S	.	.	H	α-helix	trans	-57.5	-34.8	-171.7	70.2	-80.5	0	0	0	114.1	A118 R119 T124 M125 T126 R453	A118-F122 VanDerWaalsContact O-CA 3.31Å; A118-F122 WeakPolarHBondContact O-CA 3Å; A118-F122 WeakPolarHBondContact O-CB 3.2Å; A118-F122 PolarHBondContact O-N 2.59Å; R119-F122 WeakPolarHBondContact O-CD1 3.3Å; F122-T124 VanDerWaalsContact C-N 3.29Å; F122-T124 PolarHBondContact O-N 2.78Å; F122-M125 PolarHBondContact O-N 3.24Å; F122-T126 WeakPolarHBondContact O-CB 3.43Å; F122-T126 PolarHBondContact O-N 3.46Å; F122-T126 PolarHBondContact O-OG1 3.37Å; F122-R453 VanDerWaalsContact CB-NE 3.26Å; F122-R453 VanDerWaalsContact CD2-NH1 3.26Å
123	R	70.1	Confident	62.8	Low	175 Å²	175	73.9 Å²	73.9	66%	0.66	39%	0.385	S	S	*	.	H	α-helix	trans	-63.9	-38.7	178.2	-68.4	-170.6	175.8	-144.6	0.7	111.5	N121 S127	N121-R123 VanDerWaalsContact C-N 3.26Å; N121-R123 PolarHBondContact O-N 3.03Å; N121-R123 VanDerWaalsContact O-N 3.13Å; R123-S127 WeakPolarHBondContact O-CB 3.31Å; R123-S127 PolarHBondContact O-N 2.85Å
124	T	75.2	Confident	65.2	Low	82 Å²	82	67.3 Å²	67.3	50%	0.503	35%	0.353	S	S	.	.	H	α-helix	trans	-66.1	-50.2	173.8	-45.4	0	0	0	0	110.3	N121 F122 T126 S127 L128	N121-T124 WeakPolarHBondContact O-CA 3.43Å; N121-T124 WeakPolarHBondContact O-CB 3.38Å; N121-T124 PolarHBondContact O-N 3.16Å; F122-T124 VanDerWaalsContact C-N 3.29Å; F122-T124 PolarHBondContact O-N 2.78Å; T124-T126 PolarHBondContact O-N 3.37Å; T124-S127 WeakPolarHBondContact O-CB 3.16Å; T124-S127 PolarHBondContact O-N 3.4Å; T124-S127 VanDerWaalsContact O-N 3.17Å; T124-L128 HydrophobicContact CG2-CD1 4.31Å; T124-L128 VanDerWaalsContact O-CG 3.3Å; T124-L128 WeakPolarHBondContact O-CG 3.37Å; T124-L128 PolarHBondContact O-N 3.22Å
125	M	74.1	Confident	67.3	Low	52 Å²	52	60 Å²	60	26%	0.256	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-45.7	178.1	-71.8	-60.4	-62.6	0	0	112.5	N121 F122 S127 L128 Y129 C509	N121-M125 PolarHBondContact O-N 3.38Å; F122-M125 PolarHBondContact O-N 3.24Å; M125-S127 PolarHBondContact O-N 2.84Å; M125-L128 PolarHBondContact O-N 2.96Å; M125-L128 VanDerWaalsContact O-N 3.17Å; M125-L128 HydrophobicContact SD-CD1 4.43Å; M125-Y129 HydrophobicContact CB-CE2 4.32Å; M125-Y129 HydrophobicContact CE-CE2 3.73Å; M125-Y129 WeakPolarHBondContact O-CD2 2.98Å; M125-Y129 PolarHBondContact O-N 2.94Å; M125-C509 HydrophobicContact CE-CB 3.9Å
126	T	74.4	Confident	68.8	Low	15 Å²	15	62.2 Å²	62.2	9%	0.092	34%	0.336	C	S	.	.	H	α-helix	trans	-55.5	-50.3	172.6	-61.8	0	0	0	0	110.4	F122 T124 L128 Y129 C130 C472	F122-T126 WeakPolarHBondContact O-CB 3.43Å; F122-T126 PolarHBondContact O-N 3.46Å; F122-T126 PolarHBondContact O-OG1 3.37Å; T124-T126 PolarHBondContact O-N 3.37Å; T126-L128 VanDerWaalsContact C-N 3.27Å; T126-L128 PolarHBondContact O-N 3.45Å; T126-Y129 PolarHBondContact O-N 2.77Å; T126-C130 WeakPolarHBondContact O-CB 3.48Å; T126-C130 PolarHBondContact O-N 2.81Å; T126-C130 PolarHBondContact O-SG 3.1Å; T126-C472 HydrophobicContact CG2-CB 3.53Å; T126-C472 WeakPolarHBondContact CG2-SG 3.05Å
127	S	79.7	Confident	69.6	Low	77 Å²	77	65.5 Å²	65.5	54%	0.538	35%	0.349	S	S	.	.	H	α-helix	trans	-60.8	-36.5	178.5	-166.9	0	0	0	0	112.2	R123 T124 M125 C130 S131	R123-S127 WeakPolarHBondContact O-CB 3.31Å; R123-S127 PolarHBondContact O-N 2.85Å; T124-S127 WeakPolarHBondContact O-CB 3.16Å; T124-S127 PolarHBondContact O-N 3.4Å; T124-S127 VanDerWaalsContact O-N 3.17Å; M125-S127 PolarHBondContact O-N 2.84Å; S127-C130 CarbonylContact O-C 3.48Å; S127-C130 PolarHBondContact O-N 3.18Å; S127-S131 WeakPolarHBondContact O-CB 3.36Å; S127-S131 PolarHBondContact O-N 2.91Å
128	L	83.4	Confident	70.4	Confident	36 Å²	36	63 Å²	63	19%	0.188	33%	0.333	C	S	.	.	H	α-helix	trans	-68.9	-47.2	177.2	-70.2	171.5	0	0	0	111.5	T124 M125 T126 C130 S131 M132 C509 P525 F527	T124-L128 HydrophobicContact CG2-CD1 4.31Å; T124-L128 VanDerWaalsContact O-CG 3.3Å; T124-L128 WeakPolarHBondContact O-CG 3.37Å; T124-L128 PolarHBondContact O-N 3.22Å; M125-L128 PolarHBondContact O-N 2.96Å; M125-L128 VanDerWaalsContact O-N 3.17Å; M125-L128 HydrophobicContact SD-CD1 4.43Å; T126-L128 VanDerWaalsContact C-N 3.27Å; T126-L128 PolarHBondContact O-N 3.45Å; L128-C130 VanDerWaalsContact C-N 3.29Å; L128-C130 PolarHBondContact O-N 2.8Å; L128-S131 WeakPolarHBondContact CA-OG 3.34Å; L128-S131 CarbonylContact O-C 3.57Å; L128-S131 WeakPolarHBondContact O-CA 3.49Å; L128-S131 PolarHBondContact O-N 3.31Å; L128-S131 PolarHBondContact O-OG 2.75Å; L128-M132 PolarHBondContact O-N 3.23Å; L128-C509 VanDerWaalsContact CB-SG 3.52Å; L128-P525 HydrophobicContact CB-CB 4.36Å; L128-P525 HydrophobicContact CB-CG 3.84Å; L128-P525 HydrophobicContact CD2-CB 3.84Å; L128-P525 HydrophobicContact CD2-CG 4.1Å; L128-F527 HydrophobicContact CD2-CD1 4.39Å; L128-F527 HydrophobicContact CD2-CE1 3.52Å; L128-F527 HydrophobicContact CD2-CZ 3.82Å
129	Y	82.5	Confident	70.7	Confident	6 Å²	6	63.3 Å²	63.3	2%	0.024	33%	0.334	C	S	.	.	H	α-helix	trans	-57	-42.8	170.8	-70.9	-58.6	0	0	0	111.3	M125 T126 S131 M132 L454 L465 F504	M125-Y129 HydrophobicContact CB-CE2 4.32Å; M125-Y129 HydrophobicContact CE-CE2 3.73Å; M125-Y129 WeakPolarHBondContact O-CD2 2.98Å; M125-Y129 PolarHBondContact O-N 2.94Å; T126-Y129 PolarHBondContact O-N 2.77Å; Y129-S131 VanDerWaalsContact C-N 3.25Å; Y129-S131 PolarHBondContact O-N 2.97Å; Y129-M132 HydrophobicContact CD1-CE 3.35Å; Y129-M132 HydrophobicContact CD1-SD 3.82Å; Y129-M132 HydrophobicContact CE1-CE 3.65Å; Y129-M132 HydrophobicContact CG-CE 4.49Å; Y129-M132 VanDerWaalsContact O-CB 3.31Å; Y129-M132 WeakPolarHBondContact O-CB 3.28Å; Y129-M132 WeakPolarHBondContact O-CG 3.49Å; Y129-M132 PolarHBondContact O-N 2.68Å; Y129-L454 HydrophobicContact CD2-CD1 3.79Å; Y129-L454 HydrophobicContact CG-CD1 3.88Å; Y129-L465 WeakPolarHBondContact O-CD1 3.47Å; Y129-F504 AromaticContact CD1-CD1 4Å; Y129-F504 HydrophobicContact CD1-CD1 4Å; Y129-F504 AromaticContact CD1-CE1 3.59Å; Y129-F504 HydrophobicContact CD1-CE1 3.59Å; Y129-F504 AromaticContact CE1-CD1 3.51Å; Y129-F504 HydrophobicContact CE1-CD1 3.51Å; Y129-F504 AromaticContact CE1-CE1 3.6Å; Y129-F504 HydrophobicContact CE1-CE1 3.6Å; Y129-F504 HydrophobicContact CG-CE1 4.38Å
130	C	79.4	Confident	70.9	Confident	35 Å²	35	61.7 Å²	61.7	24%	0.236	34%	0.335	C	S	.	.	H	α-helix	trans	-67	-22.2	175.3	-64.3	0	0	0	0	113.6	T126 S127 L128 I489 R490	T126-C130 WeakPolarHBondContact O-CB 3.48Å; T126-C130 PolarHBondContact O-N 2.81Å; T126-C130 PolarHBondContact O-SG 3.1Å; S127-C130 CarbonylContact O-C 3.48Å; S127-C130 PolarHBondContact O-N 3.18Å; L128-C130 VanDerWaalsContact C-N 3.29Å; L128-C130 PolarHBondContact O-N 2.8Å; C130-I489 WeakPolarHBondContact SG-CG2 3.32Å; C130-R490 VanDerWaalsContact O-CD 3.25Å; C130-R490 WeakPolarHBondContact O-CD 3.36Å; C130-R490 PolarHBondContact O-NH1 3.12Å
131	S	84.4	Confident	71.1	Confident	33 Å²	33	56 Å²	56	23%	0.231	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-1.7	175.2	78.8	0	0	0	0	114	S127 L128 Y129 N133 R490 P525	S127-S131 WeakPolarHBondContact O-CB 3.36Å; S127-S131 PolarHBondContact O-N 2.91Å; L128-S131 WeakPolarHBondContact CA-OG 3.34Å; L128-S131 CarbonylContact O-C 3.57Å; L128-S131 WeakPolarHBondContact O-CA 3.49Å; L128-S131 PolarHBondContact O-N 3.31Å; L128-S131 PolarHBondContact O-OG 2.75Å; Y129-S131 VanDerWaalsContact C-N 3.25Å; Y129-S131 PolarHBondContact O-N 2.97Å; S131-N133 PolarHBondContact O-ND2 3.37Å; S131-R490 VanDerWaalsContact C-NH1 3.29Å; S131-P525 WeakPolarHBondContact OG-CB 3.38Å
132	M	85.3	Confident	70.5	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	141.4	-176.6	-81.6	-175.6	167	0	0	113.7	L128 Y129 R490 I492 C509 L511 Q524	L128-M132 PolarHBondContact O-N 3.23Å; Y129-M132 HydrophobicContact CD1-CE 3.35Å; Y129-M132 HydrophobicContact CD1-SD 3.82Å; Y129-M132 HydrophobicContact CE1-CE 3.65Å; Y129-M132 HydrophobicContact CG-CE 4.49Å; Y129-M132 VanDerWaalsContact O-CB 3.31Å; Y129-M132 WeakPolarHBondContact O-CB 3.28Å; Y129-M132 WeakPolarHBondContact O-CG 3.49Å; Y129-M132 PolarHBondContact O-N 2.68Å; M132-R490 PolarHBondContact O-NH1 3.01Å; M132-R490 PolarHBondContact O-NH2 3.3Å; M132-I492 HydrophobicContact CB-CD1 4.22Å; M132-I492 WeakPolarHBondContact O-CD1 2.96Å; M132-C509 VanDerWaalsContact CE-O 3.24Å; M132-C509 WeakPolarHBondContact CE-O 3.46Å; M132-L511 HydrophobicContact CE-CB 4.32Å; M132-L511 HydrophobicContact SD-CB 3.81Å; M132-Q524 CarbonylContact C-O 3.58Å; M132-Q524 WeakPolarHBondContact CA-O 3.37Å
133	N	84.3	Confident	69.3	Low	35 Å²	35	60.1 Å²	60.1	19%	0.187	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	152.7	173.6	-80.1	-112.2	0	0	0	107.8	S131 A135 Y523 Q524 K526	S131-N133 PolarHBondContact O-ND2 3.37Å; N133-A135 PolarHBondContact O-N 2.88Å; N133-Y523 CarbonylContact O-C 3.52Å; N133-Y523 WeakPolarHBondContact O-CA 3.17Å; N133-Q524 PolarHBondContact N-O 2.98Å; N133-Q524 PolarHBondContact O-N 2.68Å; N133-K526 HydrophobicContact CB-CD 4Å; N133-K526 HydrophobicContact CB-CG 4.04Å; N133-K526 VanDerWaalsContact CG-CE 3.41Å; N133-K526 WeakPolarHBondContact OD1-CE 3.27Å; N133-K526 PolarHBondContact OD1-NZ 2.93Å
134	P	82.4	Confident	68.6	Low	46 Å²	46	57.5 Å²	57.5	30%	0.299	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	140.6	169.8	25.6	-33.5	0	0	0	109	L522 Y523	P134-L522 CarbonylContact C-O 3.56Å; P134-L522 WeakPolarHBondContact CA-O 3.37Å; P134-Y523 HydrophobicContact CB-CD1 4Å; P134-Y523 HydrophobicContact CB-CE1 4.1Å
135	A	78.2	Confident	68.3	Low	7 Å²	7	60 Å²	60	6%	0.058	36%	0.356	C	S	.	.			trans	-55.7	146.3	170.6	0	0	0	0	0	109.7	N133 E137 S138 L522	N133-A135 PolarHBondContact O-N 2.88Å; A135-E137 CarbonylContact O-C 3.57Å; A135-E137 PolarHBondContact O-N 3.24Å; A135-S138 PolarHBondContact O-N 3.36Å; A135-S138 VanDerWaalsContact O-N 3.12Å; A135-L522 PolarHBondContact N-O 3.03Å
136	V	61.2	Low	68.8	Low	151 Å²	151	57.8 Å²	57.8	92%	0.915	35%	0.345	S	S	*	.	S	Bend	trans	-60.9	-37.9	-178.7	-177.9	0	0	0	0	110.2	S138	V136-S138 PolarHBondContact O-N 2.76Å
137	E	57	Low	69.5	Low	125 Å²	125	57.7 Å²	57.7	58%	0.584	35%	0.347	S	S	*	.	S	Bend	trans	-88.6	74.4	163.5	-66.6	178.9	-172	0	0	109.7	A135 V139	A135-E137 CarbonylContact O-C 3.57Å; A135-E137 PolarHBondContact O-N 3.24Å; E137-V139 PolarHBondContact O-N 2.75Å
138	S	54.4	Low	70.2	Confident	24 Å²	24	54 Å²	54	17%	0.168	32%	0.321	C	S	.	.			trans	-64.4	125.8	162	67.9	0	0	0	0	108	A135 V136 N140 R519	A135-S138 PolarHBondContact O-N 3.36Å; A135-S138 VanDerWaalsContact O-N 3.12Å; V136-S138 PolarHBondContact O-N 2.76Å; S138-N140 PolarHBondContact O-N 3.25Å; S138-R519 PolarHBondContact OG-NH2 3.09Å
139	V	55.6	Low	70.8	Confident	20 Å²	20	52.3 Å²	52.3	12%	0.121	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-75.2	94.9	-168.1	-167.6	0	0	0	0	111.6	E137 L141 F173 S178 V520	E137-V139 PolarHBondContact O-N 2.75Å; V139-L141 HydrophobicContact CG1-CG 4.16Å; V139-F173 HydrophobicContact CB-CE1 3.99Å; V139-F173 HydrophobicContact CB-CZ 4.49Å; V139-F173 HydrophobicContact CG1-CD1 4.38Å; V139-F173 HydrophobicContact CG1-CE1 3.39Å; V139-F173 HydrophobicContact CG1-CZ 3.89Å; V139-F173 HydrophobicContact CG2-CD1 4.12Å; V139-F173 HydrophobicContact CG2-CE1 3.91Å; V139-S178 VanDerWaalsContact CG2-O 3.24Å; V139-S178 WeakPolarHBondContact CG2-O 3.46Å; V139-V520 PolarHBondContact N-O 3.45Å; V139-V520 VanDerWaalsContact N-O 3.13Å
140	N	52.2	Low	71.5	Confident	94 Å²	94	54 Å²	54	50%	0.503	32%	0.32	S	S	.	.			trans	-80.1	109.3	160.1	-63	-23.3	0	0	0	108	S138 S142 R519	S138-N140 PolarHBondContact O-N 3.25Å; N140-S142 PolarHBondContact O-N 2.9Å; N140-R519 WeakPolarHBondContact OD1-CD 3.13Å; N140-R519 PolarHBondContact OD1-NE 3.14Å
141	L	53.8	Low	72.4	Confident	31 Å²	31	52.7 Å²	52.7	16%	0.162	31%	0.31	C	S	.	.			trans	-76	64.9	168.5	-66.9	125	0	0	0	109.6	V139 S143 L171 F173	V139-L141 HydrophobicContact CG1-CG 4.16Å; L141-S143 PolarHBondContact O-N 3.3Å; L141-L171 HydrophobicContact CD1-CD1 3.51Å; L141-L171 HydrophobicContact CD2-CD1 3.86Å; L141-L171 HydrophobicContact CG-CD1 4.3Å; L141-F173 HydrophobicContact CD1-CZ 4.09Å; L141-F173 HydrophobicContact CD2-CZ 4.09Å; L141-F173 HydrophobicContact CG-CZ 4.35Å
142	S	44.8	Very low	73	Confident	112 Å²	112	51.1 Å²	51.1	78%	0.783	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	64.6	-169.7	62.7	0	0	0	0	112.9	N140	N140-S142 PolarHBondContact O-N 2.9Å
143	S	42.3	Very low	73.6	Confident	107 Å²	107	51.6 Å²	51.6	75%	0.748	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.1	-30.2	166	56	0	0	0	0	114.3	L141	L141-S143 PolarHBondContact O-N 3.3Å
144	Q	55.5	Low	74.2	Confident	119 Å²	119	50.3 Å²	50.3	56%	0.556	29%	0.294	S	S	*	.	S	Bend	trans	-136.6	135	178.8	-74	168.3	-75.9	0	0	109.9	H146	Q144-H146 PolarHBondContact O-CD2 3.3Å; Q144-H146 PolarHBondContact O-N 2.9Å; Q144-H146 VanDerWaalsContact O-N 3.13Å
145	T	69.5	Low	74.9	Confident	135 Å²	135	48.1 Å²	48.1	83%	0.828	28%	0.28	S	S	*	.			trans	-84.5	85.7	179.3	50.1	0	0	0	0	109.9	G147	T145-G147 PolarHBondContact O-N 2.58Å
146	H	83.3	Confident	75.6	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.028	30%	0.296	C	S	.	.			trans	-61.5	3.3	177	-53.2	-62.7	0	0	0	114.6	Q144 C165 Q167 E169	Q144-H146 PolarHBondContact O-CD2 3.3Å; Q144-H146 PolarHBondContact O-N 2.9Å; Q144-H146 VanDerWaalsContact O-N 3.13Å; H146-C165 HydrophobicContact CB-CB 4.36Å; H146-C165 WeakPolarHBondContact O-CB 3.47Å; H146-Q167 VanDerWaalsContact C-CG 3.44Å; H146-Q167 WeakPolarHBondContact O-CB 3.47Å; H146-Q167 WeakPolarHBondContact O-CG 3.23Å; H146-Q167 PolarHBondContact O-N 2.96Å; H146-Q167 VanDerWaalsContact O-N 3.14Å; H146-E169 IonicContact CE1-OE1 3.35Å; H146-E169 PolarHBondContact CE1-OE1 3.18Å; H146-E169 IonicContact CE1-OE2 3.2Å; H146-E169 IonicContact CG-OE2 3.46Å; H146-E169 IonicContact ND1-OE1 3.11Å; H146-E169 PolarHBondContact ND1-OE1 2.81Å; H146-E169 IonicContact ND1-OE2 2.84Å; H146-E169 PolarHBondContact ND1-OE2 2.62Å
147	G	90.9	Very high	77	Confident	12 Å²	12	46.2 Å²	46.2	12%	0.124	27%	0.267	C	S	.	.			trans	67.7	-171.7	-176.4	0	0	0	0	0	113.1	T145 E166 G518	T145-G147 PolarHBondContact O-N 2.58Å; G147-E166 WeakPolarHBondContact CA-OE2 3.45Å; G147-G518 WeakPolarHBondContact O-CA 3.24Å; G147-G518 PolarHBondContact O-N 3.1Å
148	A	94	Very high	78.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.239	C	C	.	.			trans	-57	145.5	-178.3	0	0	0	0	0	113.7	F150 C165 E166 L500 L516	A148-F150 HydrophobicContact CB-CD1 4.19Å; A148-F150 HydrophobicContact CB-CE1 3.65Å; A148-F150 HydrophobicContact CB-CZ 4.22Å; A148-F150 PolarHBondContact O-N 3.18Å; A148-C165 CarbonylContact O-C 3.58Å; A148-C165 WeakPolarHBondContact O-CA 3.4Å; A148-E166 HydrophobicContact CB-CB 4.07Å; A148-E166 VanDerWaalsContact N-CB 3.34Å; A148-E166 PolarHBondContact N-OE2 3.38Å; A148-E166 PolarHBondContact O-N 2.8Å; A148-L500 HydrophobicContact CB-CD1 4.07Å; A148-L516 WeakPolarHBondContact CA-O 3.21Å; A148-L516 HydrophobicContact CB-CD2 3.99Å; A148-L516 PolarHBondContact N-O 2.97Å
149	V	95.8	Very high	80.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	107.1	174	-173.9	0	0	0	0	110.1	L152 V163 T501 C515 V520	V149-L152 HydrophobicContact CG1-CD2 4.19Å; V149-L152 HydrophobicContact CG1-CG 4.34Å; V149-V163 HydrophobicContact CB-CG1 4.49Å; V149-V163 HydrophobicContact CG1-CG1 3.46Å; V149-V163 VanDerWaalsContact CG1-CG1 3.46Å; V149-V163 HydrophobicContact CG2-CG1 4.29Å; V149-T501 HydrophobicContact CB-CG2 4.32Å; V149-T501 HydrophobicContact CG1-CG2 3.71Å; V149-T501 WeakPolarHBondContact O-CG2 3.16Å; V149-C515 PolarHBondContact N-O 3.27Å; V149-V520 HydrophobicContact CG2-CG2 4.15Å
150	F	96.7	Very high	82.4	Confident	43 Å²	43	41.8 Å²	41.8	19%	0.189	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-25.6	-179.7	-63.4	-31.4	0	0	0	113.8	A148 A164 E166 C191 Y442 L500	A148-F150 HydrophobicContact CB-CD1 4.19Å; A148-F150 HydrophobicContact CB-CE1 3.65Å; A148-F150 HydrophobicContact CB-CZ 4.22Å; A148-F150 PolarHBondContact O-N 3.18Å; F150-A164 PolarHBondContact N-O 2.84Å; F150-E166 HydrophobicContact CD2-CB 4.42Å; F150-E166 HydrophobicContact CE1-CB 4.45Å; F150-E166 HydrophobicContact CE2-CB 3.67Å; F150-E166 HydrophobicContact CE2-CG 4.09Å; F150-E166 HydrophobicContact CZ-CB 3.68Å; F150-E166 HydrophobicContact CZ-CG 3.86Å; F150-C191 HydrophobicContact CE2-CB 4.16Å; F150-Y442 HydrophobicContact CE1-CD1 4.3Å; F150-Y442 HydrophobicContact CE1-CE1 4.4Å; F150-L500 HydrophobicContact CD1-CD1 3.91Å; F150-L500 HydrophobicContact CE1-CD1 4.04Å
151	N	98.1	Very high	84.5	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.032	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	155.6	179	-136.5	-111	0	0	0	115.9	V163 A164 N194	N151-V163 WeakPolarHBondContact O-CA 3.48Å; N151-A164 HydrophobicContact CB-CB 3.56Å; N151-A164 PolarHBondContact N-O 3.3Å; N151-A164 PolarHBondContact O-N 2.85Å; N151-N194 PolarHBondContact ND2-ND2 3.09Å; N151-N194 PolarHBondContact OD1-ND2 3.29Å
152	L	98.1	Very high	86.6	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	122.8	176.5	-68.3	173.9	0	0	0	109	V149 L161 T162 V163 T501 K503 A512 S513	V149-L152 HydrophobicContact CG1-CD2 4.19Å; V149-L152 HydrophobicContact CG1-CG 4.34Å; L152-L161 HydrophobicContact CB-CD1 4.24Å; L152-L161 HydrophobicContact CD2-CD1 4.2Å; L152-L161 HydrophobicContact CD2-CD2 4.35Å; L152-T162 WeakPolarHBondContact CA-O 3.28Å; L152-V163 HydrophobicContact CD2-CB 4.2Å; L152-V163 HydrophobicContact CD2-CG1 3.94Å; L152-V163 HydrophobicContact CD2-CG2 3.76Å; L152-T501 HydrophobicContact CD1-CG2 3.81Å; L152-T501 HydrophobicContact CG-CG2 3.74Å; L152-K503 HydrophobicContact CB-CB 3.75Å; L152-K503 HydrophobicContact CB-CG 4.48Å; L152-K503 WeakPolarHBondContact O-CD 3.47Å; L152-K503 WeakPolarHBondContact O-CG 3.16Å; L152-K503 PolarHBondContact O-NZ 3.28Å; L152-A512 HydrophobicContact CD1-CB 3.91Å; L152-S513 VanDerWaalsContact CD1-CA 3.48Å
153	E	98.1	Very high	89.1	Confident	9 Å²	9	30.5 Å²	30.5	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	122.5	177.7	-178	79.7	149.8	0	0	109.7	T162 I195 R196 F197 K503	E153-T162 PolarHBondContact N-O 3.28Å; E153-T162 VanDerWaalsContact N-O 3.11Å; E153-T162 PolarHBondContact O-N 2.56Å; E153-T162 PolarHBondContact O-OG1 2.59Å; E153-I195 HydrophobicContact CB-CB 4.15Å; E153-I195 HydrophobicContact CB-CG2 4.41Å; E153-I195 WeakPolarHBondContact CB-O 3.46Å; E153-R196 WeakPolarHBondContact OE1-CD 3.39Å; E153-R196 IonicContact OE1-CZ 2.85Å; E153-R196 IonicContact OE1-NE 3.81Å; E153-R196 IonicContact OE1-NH1 3.18Å; E153-R196 PolarHBondContact OE1-NH1 2.99Å; E153-F197 HydrophobicContact CG-CD2 3.72Å; E153-F197 HydrophobicContact CG-CE2 4.28Å; E153-K503 WeakPolarHBondContact OE2-CE 3.47Å; E153-K503 IonicContact OE2-NZ 2.93Å; E153-K503 PolarHBondContact OE2-NZ 2.82Å
154	Y	96.8	Very high	91.7	Very high	9 Å²	9	25.4 Å²	25.4	4%	0.035	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	148.1	170.8	-76.7	-97.5	0	0	0	110.1	V160 L161 P175 F197 K503 F504 P506 A512	Y154-V160 CarbonylContact C-O 3.47Å; Y154-V160 WeakPolarHBondContact CA-O 3.37Å; Y154-L161 HydrophobicContact CD1-CB 4.23Å; Y154-L161 HydrophobicContact CD2-CD1 3.88Å; Y154-L161 HydrophobicContact CE1-CB 4.22Å; Y154-L161 HydrophobicContact CE2-CD1 3.94Å; Y154-L161 HydrophobicContact CG-CD1 4.19Å; Y154-P175 HydrophobicContact CD1-CG 3.95Å; Y154-P175 HydrophobicContact CE1-CB 3.74Å; Y154-P175 HydrophobicContact CE1-CG 3.6Å; Y154-F197 VanDerWaalsContact O-CD2 3.29Å; Y154-F197 WeakPolarHBondContact O-CD2 3.39Å; Y154-K503 HydrophobicContact CD2-CB 4.36Å; Y154-K503 HydrophobicContact CD2-CG 3.84Å; Y154-K503 HydrophobicContact CE2-CB 4.24Å; Y154-K503 HydrophobicContact CE2-CG 4.2Å; Y154-F504 WeakPolarHBondContact CD2-O 3.46Å; Y154-P506 VanDerWaalsContact CB-CD 3.49Å; Y154-A512 HydrophobicContact CE2-CB 4.05Å
155	S	96.5	Very high	93.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.119	C	C	.	.			trans	-57.8	155.3	161.8	62.9	0	0	0	0	110.3	D157 G158 S159 V160 P506	S155-D157 WeakPolarHBondContact CB-OD1 3.41Å; S155-D157 PolarHBondContact O-N 3.14Å; S155-D157 PolarHBondContact OG-OD1 2.85Å; S155-G158 WeakPolarHBondContact O-CA 3.42Å; S155-G158 PolarHBondContact O-N 3.14Å; S155-G158 PolarHBondContact OG-N 3.31Å; S155-S159 PolarHBondContact OG-N 2.97Å; S155-S159 VanDerWaalsContact OG-N 3.09Å; S155-S159 PolarHBondContact OG-OG 3.02Å; S155-V160 PolarHBondContact N-O 3.23Å; S155-V160 PolarHBondContact OG-N 2.87Å; S155-V160 VanDerWaalsContact OG-N 3.1Å; S155-V160 PolarHBondContact OG-O 2.8Å; S155-P506 WeakPolarHBondContact O-CG 3.21Å
156	P	93.4	Very high	94.8	Very high	62 Å²	62	16 Å²	16	40%	0.403	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-21.9	-175.6	-21.5	33.7	0	0	0	114.2	F197 N200	P156-F197 HydrophobicContact CG-CB 4.11Å; P156-N200 WeakPolarHBondContact CB-OD1 3.23Å
157	D	90.4	Very high	95.3	Very high	56 Å²	56	20 Å²	20	30%	0.299	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-7	168.4	51.9	30.1	0	0	0	114.2	S155 S159 N200 T507	S155-D157 WeakPolarHBondContact CB-OD1 3.41Å; S155-D157 PolarHBondContact O-N 3.14Å; S155-D157 PolarHBondContact OG-OD1 2.85Å; D157-S159 PolarHBondContact O-N 3.34Å; D157-S159 VanDerWaalsContact OD1-CB 3.31Å; D157-S159 WeakPolarHBondContact OD1-CB 3.46Å; D157-S159 PolarHBondContact OD1-N 2.86Å; D157-S159 PolarHBondContact OD1-OG 2.75Å; D157-N200 WeakPolarHBondContact CB-ND2 3.48Å; D157-N200 VanDerWaalsContact CG-ND2 3.28Å; D157-N200 PolarHBondContact OD2-ND2 2.83Å; D157-T507 VanDerWaalsContact C-OG1 3.31Å; D157-T507 WeakPolarHBondContact O-CB 3.17Å; D157-T507 VanDerWaalsContact O-CG2 3.31Å; D157-T507 WeakPolarHBondContact O-CG2 3.32Å; D157-T507 PolarHBondContact O-OG1 3.28Å
158	G	90.9	Very high	95.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	66	16.8	-176.8	0	0	0	0	0	115	S155 V160 T507	S155-G158 WeakPolarHBondContact O-CA 3.42Å; S155-G158 PolarHBondContact O-N 3.14Å; S155-G158 PolarHBondContact OG-N 3.31Å; G158-V160 VanDerWaalsContact C-N 3.33Å; G158-T507 WeakPolarHBondContact CA-OG1 3.37Å
159	S	92.9	Very high	95.5	Very high	58 Å²	58	22.4 Å²	22.4	41%	0.406	12%	0.122	S	C	.	.	S	Bend	trans	-71.7	-24.7	175.4	63.5	0	0	0	0	113.7	S155 D157 P175	S155-S159 PolarHBondContact OG-N 2.97Å; S155-S159 VanDerWaalsContact OG-N 3.09Å; S155-S159 PolarHBondContact OG-OG 3.02Å; D157-S159 PolarHBondContact O-N 3.34Å; D157-S159 VanDerWaalsContact OD1-CB 3.31Å; D157-S159 WeakPolarHBondContact OD1-CB 3.46Å; D157-S159 PolarHBondContact OD1-N 2.86Å; D157-S159 PolarHBondContact OD1-OG 2.75Å; S159-P175 WeakPolarHBondContact O-CD 3.42Å
160	V	95.7	Very high	95.6	Very high	17 Å²	17	22.4 Å²	22.4	10%	0.103	12%	0.122	C	C	.	.			trans	-132.2	136.6	178.5	179.2	0	0	0	0	109.5	Y154 S155 G158 T162 L172 F173 I181 L217	Y154-V160 CarbonylContact C-O 3.47Å; Y154-V160 WeakPolarHBondContact CA-O 3.37Å; S155-V160 PolarHBondContact N-O 3.23Å; S155-V160 PolarHBondContact OG-N 2.87Å; S155-V160 VanDerWaalsContact OG-N 3.1Å; S155-V160 PolarHBondContact OG-O 2.8Å; G158-V160 VanDerWaalsContact C-N 3.33Å; V160-T162 HydrophobicContact CG1-CG2 4.24Å; V160-L172 HydrophobicContact CG1-CB 4.28Å; V160-L172 HydrophobicContact CG1-CD2 4.06Å; V160-L172 HydrophobicContact CG1-CG 4.18Å; V160-F173 WeakPolarHBondContact CA-O 3.31Å; V160-I181 HydrophobicContact CG2-CD1 4.36Å; V160-L217 HydrophobicContact CG1-CD2 4.36Å; V160-L217 HydrophobicContact CG2-CD1 4.41Å; V160-L217 HydrophobicContact CG2-CD2 4.41Å
161	L	96.9	Very high	95.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.7	161	170	66.1	0	0	0	109	L152 Y154 V163 L172 F173 P175 A512 L522	L152-L161 HydrophobicContact CB-CD1 4.24Å; L152-L161 HydrophobicContact CD2-CD1 4.2Å; L152-L161 HydrophobicContact CD2-CD2 4.35Å; Y154-L161 HydrophobicContact CD1-CB 4.23Å; Y154-L161 HydrophobicContact CD2-CD1 3.88Å; Y154-L161 HydrophobicContact CE1-CB 4.22Å; Y154-L161 HydrophobicContact CE2-CD1 3.94Å; Y154-L161 HydrophobicContact CG-CD1 4.19Å; L161-V163 HydrophobicContact CG-CG2 4.45Å; L161-L172 WeakPolarHBondContact O-CA 3.17Å; L161-F173 HydrophobicContact CB-CB 4.25Å; L161-F173 PolarHBondContact N-O 2.87Å; L161-F173 PolarHBondContact O-N 3.04Å; L161-P175 HydrophobicContact CB-CG 3.93Å; L161-A512 HydrophobicContact CD1-CB 4.41Å; L161-A512 HydrophobicContact CD2-CB 3.63Å; L161-L522 HydrophobicContact CD2-CD2 3.72Å
162	T	97.9	Very high	95.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	147	171.7	61.1	0	0	0	0	110.8	L152 E153 V160 L171 L172 I195 F197	L152-T162 WeakPolarHBondContact CA-O 3.28Å; E153-T162 PolarHBondContact N-O 3.28Å; E153-T162 VanDerWaalsContact N-O 3.11Å; E153-T162 PolarHBondContact O-N 2.56Å; E153-T162 PolarHBondContact O-OG1 2.59Å; V160-T162 HydrophobicContact CG1-CG2 4.24Å; T162-L171 CarbonylContact C-O 3.57Å; T162-L171 WeakPolarHBondContact CA-O 3.45Å; T162-L172 HydrophobicContact CG2-CG 4.32Å; T162-I195 WeakPolarHBondContact OG1-CG2 3.31Å; T162-F197 HydrophobicContact CG2-CE2 3.7Å; T162-F197 HydrophobicContact CG2-CZ 3.61Å
163	V	97.6	Very high	95.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	126.6	-174.5	-171.2	0	0	0	0	109.4	V149 N151 L152 L161 V170 L171 F173 V520	V149-V163 HydrophobicContact CB-CG1 4.49Å; V149-V163 HydrophobicContact CG1-CG1 3.46Å; V149-V163 VanDerWaalsContact CG1-CG1 3.46Å; V149-V163 HydrophobicContact CG2-CG1 4.29Å; N151-V163 WeakPolarHBondContact O-CA 3.48Å; L152-V163 HydrophobicContact CD2-CB 4.2Å; L152-V163 HydrophobicContact CD2-CG1 3.94Å; L152-V163 HydrophobicContact CD2-CG2 3.76Å; L161-V163 HydrophobicContact CG-CG2 4.45Å; V163-V170 WeakPolarHBondContact O-CA 3.33Å; V163-L171 HydrophobicContact CB-CB 4.04Å; V163-L171 HydrophobicContact CG2-CB 4.35Å; V163-L171 PolarHBondContact N-O 3.4Å; V163-L171 PolarHBondContact O-N 3.25Å; V163-L171 VanDerWaalsContact O-N 3.12Å; V163-F173 HydrophobicContact CG2-CD2 3.62Å; V163-F173 HydrophobicContact CG2-CE2 3.66Å; V163-V520 HydrophobicContact CG1-CG2 3.92Å; V163-V520 HydrophobicContact CG2-CG2 4.22Å
164	A	97.4	Very high	94.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132	174.5	0	0	0	0	0	110	F150 N151 V192 I195	F150-A164 PolarHBondContact N-O 2.84Å; N151-A164 HydrophobicContact CB-CB 3.56Å; N151-A164 PolarHBondContact N-O 3.3Å; N151-A164 PolarHBondContact O-N 2.85Å; A164-V192 HydrophobicContact CB-CB 4.25Å; A164-V192 HydrophobicContact CB-CG1 4.06Å; A164-V192 VanDerWaalsContact CB-O 3.25Å; A164-V192 WeakPolarHBondContact CB-O 3.33Å; A164-I195 HydrophobicContact CB-CD1 3.94Å; A164-I195 HydrophobicContact CB-CG1 3.9Å
165	C	95.3	Very high	94.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	156.3	-171.1	-73.4	0	0	0	0	111.8	H146 A148 Q167 E169 V192	H146-C165 HydrophobicContact CB-CB 4.36Å; H146-C165 WeakPolarHBondContact O-CB 3.47Å; A148-C165 CarbonylContact O-C 3.58Å; A148-C165 WeakPolarHBondContact O-CA 3.4Å; C165-Q167 VanDerWaalsContact C-N 3.29Å; C165-Q167 CarbonylContact C-O 3.59Å; C165-E169 WeakPolarHBondContact CB-O 3.29Å; C165-V192 WeakPolarHBondContact O-CA 3.36Å; C165-V192 PolarHBondContact O-N 2.79Å
166	E	95	Very high	93.9	Very high	57 Å²	57	25.9 Å²	25.9	27%	0.266	14%	0.143	S	C	.	.	S	Bend	trans	-67.8	-27.4	171.8	175.6	-176.9	-128.7	0	0	112.4	G147 A148 F150 C191	G147-E166 WeakPolarHBondContact CA-OE2 3.45Å; A148-E166 HydrophobicContact CB-CB 4.07Å; A148-E166 VanDerWaalsContact N-CB 3.34Å; A148-E166 PolarHBondContact N-OE2 3.38Å; A148-E166 PolarHBondContact O-N 2.8Å; F150-E166 HydrophobicContact CD2-CB 4.42Å; F150-E166 HydrophobicContact CE1-CB 4.45Å; F150-E166 HydrophobicContact CE2-CB 3.67Å; F150-E166 HydrophobicContact CE2-CG 4.09Å; F150-E166 HydrophobicContact CZ-CB 3.68Å; F150-E166 HydrophobicContact CZ-CG 3.86Å; E166-C191 WeakPolarHBondContact O-CA 3.2Å; E166-C191 PolarHBondContact O-SG 3.25Å
167	Q	93.6	Very high	93.6	Very high	89 Å²	89	25.2 Å²	25.2	42%	0.416	14%	0.139	S	C	.	.	S	Bend	trans	-81.8	174.4	166.1	-60.5	-57.4	-43.7	0	0	111.4	H146 C165 E169	H146-Q167 VanDerWaalsContact C-CG 3.44Å; H146-Q167 WeakPolarHBondContact O-CB 3.47Å; H146-Q167 WeakPolarHBondContact O-CG 3.23Å; H146-Q167 PolarHBondContact O-N 2.96Å; H146-Q167 VanDerWaalsContact O-N 3.14Å; C165-Q167 VanDerWaalsContact C-N 3.29Å; C165-Q167 CarbonylContact C-O 3.59Å; Q167-E169 PolarHBondContact O-N 3.32Å
168	T	94.7	Very high	93.3	Very high	46 Å²	46	23 Å²	23	28%	0.282	13%	0.128	S	C	.	.	S	Bend	trans	-67.2	21.4	-174.6	53.7	0	0	0	0	115.7	A187 H188	T168-A187 WeakPolarHBondContact O-CB 3.27Å; T168-A187 PolarHBondContact O-N 3.4Å; T168-H188 VanDerWaalsContact CB-O 3.24Å; T168-H188 WeakPolarHBondContact CB-O 3.16Å; T168-H188 WeakPolarHBondContact CG2-O 3.31Å; T168-H188 PolarHBondContact O-N 3.33Å
169	E	94.1	Very high	93.1	Very high	18 Å²	18	28.9 Å²	28.9	8%	0.084	15%	0.154	C	C	.	.			trans	-121.5	152	-160.8	-62.8	176.3	97	0	0	112.7	H146 C165 Q167 T183 L184	H146-E169 IonicContact CE1-OE1 3.35Å; H146-E169 PolarHBondContact CE1-OE1 3.18Å; H146-E169 IonicContact CE1-OE2 3.2Å; H146-E169 IonicContact CG-OE2 3.46Å; H146-E169 IonicContact ND1-OE1 3.11Å; H146-E169 PolarHBondContact ND1-OE1 2.81Å; H146-E169 IonicContact ND1-OE2 2.84Å; H146-E169 PolarHBondContact ND1-OE2 2.62Å; C165-E169 WeakPolarHBondContact CB-O 3.29Å; Q167-E169 PolarHBondContact O-N 3.32Å; E169-T183 HydrophobicContact CB-CG2 4.4Å; E169-T183 HydrophobicContact CG-CG2 4.38Å; E169-T183 VanDerWaalsContact OE1-CG2 3.29Å; E169-T183 WeakPolarHBondContact OE1-CG2 3.31Å; E169-L184 WeakPolarHBondContact CA-O 3.49Å
170	V	96.9	Very high	92.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.2	168.5	168.4	0	0	0	0	109.3	V163 L172 L184 A187 V192 I195 T205	V163-V170 WeakPolarHBondContact O-CA 3.33Å; V170-L172 HydrophobicContact CG1-CD1 4.22Å; V170-L184 HydrophobicContact CB-CB 4.22Å; V170-L184 HydrophobicContact CB-CD1 4.19Å; V170-L184 HydrophobicContact CB-CG 4.42Å; V170-L184 HydrophobicContact CG1-CD1 4.16Å; V170-L184 PolarHBondContact N-O 2.65Å; V170-L184 WeakPolarHBondContact O-CB 3.32Å; V170-L184 PolarHBondContact O-N 3.02Å; V170-A187 HydrophobicContact CB-CB 4.19Å; V170-A187 HydrophobicContact CG2-CB 3.92Å; V170-V192 HydrophobicContact CG2-CB 4.34Å; V170-V192 HydrophobicContact CG2-CG1 3.82Å; V170-V192 HydrophobicContact CG2-CG2 4.15Å; V170-I195 HydrophobicContact CG1-CD1 3.68Å; V170-I195 HydrophobicContact CG2-CD1 4.16Å; V170-T205 HydrophobicContact CG2-CG2 4.03Å
171	L	95.4	Very high	92.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.9	-176.6	-45.7	173.8	0	0	0	110.6	L141 T162 V163 F173 T183	L141-L171 HydrophobicContact CD1-CD1 3.51Å; L141-L171 HydrophobicContact CD2-CD1 3.86Å; L141-L171 HydrophobicContact CG-CD1 4.3Å; T162-L171 CarbonylContact C-O 3.57Å; T162-L171 WeakPolarHBondContact CA-O 3.45Å; V163-L171 HydrophobicContact CB-CB 4.04Å; V163-L171 HydrophobicContact CG2-CB 4.35Å; V163-L171 PolarHBondContact N-O 3.4Å; V163-L171 PolarHBondContact O-N 3.25Å; V163-L171 VanDerWaalsContact O-N 3.12Å; L171-F173 HydrophobicContact CB-CD2 4.47Å; L171-F173 HydrophobicContact CB-CE2 3.67Å; L171-F173 HydrophobicContact CB-CZ 4.34Å; L171-F173 HydrophobicContact CD1-CE2 4.37Å; L171-T183 HydrophobicContact CD2-CG2 3.78Å
172	L	95.9	Very high	92.5	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135.5	177.6	-75.4	77.7	0	0	0	110.8	V160 L161 T162 V170 H180 I181 K182 L184 L217 L220	V160-L172 HydrophobicContact CG1-CB 4.28Å; V160-L172 HydrophobicContact CG1-CD2 4.06Å; V160-L172 HydrophobicContact CG1-CG 4.18Å; L161-L172 WeakPolarHBondContact O-CA 3.17Å; T162-L172 HydrophobicContact CG2-CG 4.32Å; V170-L172 HydrophobicContact CG1-CD1 4.22Å; L172-H180 PolarHBondContact O-CD2 3.1Å; L172-H180 VanDerWaalsContact O-CD2 3.29Å; L172-I181 HydrophobicContact CB-CB 4.23Å; L172-I181 PolarHBondContact O-N 3.37Å; L172-K182 PolarHBondContact N-O 3.37Å; L172-K182 PolarHBondContact O-N 3.06Å; L172-L184 HydrophobicContact CD1-CD1 3.98Å; L172-L184 HydrophobicContact CD1-CD2 4.26Å; L172-L184 HydrophobicContact CD1-CG 3.79Å; L172-L217 HydrophobicContact CD2-CD2 3.75Å; L172-L220 HydrophobicContact CD2-CD1 3.44Å; L172-L220 VanDerWaalsContact CD2-CD1 3.44Å
173	F	93	Very high	92.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146.3	-179.2	-69.9	-83.2	0	0	0	112.1	V139 L141 V160 L161 V163 L171 P175 K179 H180 I181	V139-F173 HydrophobicContact CB-CE1 3.99Å; V139-F173 HydrophobicContact CB-CZ 4.49Å; V139-F173 HydrophobicContact CG1-CD1 4.38Å; V139-F173 HydrophobicContact CG1-CE1 3.39Å; V139-F173 HydrophobicContact CG1-CZ 3.89Å; V139-F173 HydrophobicContact CG2-CD1 4.12Å; V139-F173 HydrophobicContact CG2-CE1 3.91Å; L141-F173 HydrophobicContact CD1-CZ 4.09Å; L141-F173 HydrophobicContact CD2-CZ 4.09Å; L141-F173 HydrophobicContact CG-CZ 4.35Å; V160-F173 WeakPolarHBondContact CA-O 3.31Å; L161-F173 HydrophobicContact CB-CB 4.25Å; L161-F173 PolarHBondContact N-O 2.87Å; L161-F173 PolarHBondContact O-N 3.04Å; V163-F173 HydrophobicContact CG2-CD2 3.62Å; V163-F173 HydrophobicContact CG2-CE2 3.66Å; L171-F173 HydrophobicContact CB-CD2 4.47Å; L171-F173 HydrophobicContact CB-CE2 3.67Å; L171-F173 HydrophobicContact CB-CZ 4.34Å; L171-F173 HydrophobicContact CD1-CE2 4.37Å; F173-P175 WeakPolarHBondContact O-CD 3.33Å; F173-K179 WeakPolarHBondContact CA-O 3.44Å; F173-K179 WeakPolarHBondContact CD1-O 3.39Å; F173-H180 HydrophobicContact CD1-CB 4.17Å; F173-H180 HydrophobicContact CE1-CB 3.63Å; F173-H180 AromaticContact CE1-CD2 3.81Å; F173-H180 HydrophobicContact CZ-CB 4.35Å; F173-H180 AromaticContact CZ-CD2 3.73Å; F173-I181 VanDerWaalsContact C-CD1 3.43Å
174	D	91.4	Very high	92.2	Very high	47 Å²	47	38.7 Å²	38.7	25%	0.251	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	112.3	161.3	168.8	1.9	0	0	0	107.3	I176 S177 S178 K179 I181	D174-I176 PolarHBondContact O-N 3.3Å; D174-I176 WeakPolarHBondContact OD1-CA 3.4Å; D174-I176 WeakPolarHBondContact OD1-CB 3.18Å; D174-I176 PolarHBondContact OD1-N 2.7Å; D174-S177 PolarHBondContact OD1-N 3.33Å; D174-S177 WeakPolarHBondContact OD2-CB 3.44Å; D174-S177 PolarHBondContact OD2-N 2.71Å; D174-S177 PolarHBondContact OD2-OG 3.49Å; D174-S178 CarbonylContact O-C 3.55Å; D174-S178 WeakPolarHBondContact O-CA 3.42Å; D174-S178 PolarHBondContact O-N 2.54Å; D174-K179 PolarHBondContact N-O 3.24Å; D174-K179 PolarHBondContact O-N 3.09Å; D174-I181 HydrophobicContact CB-CD1 4.04Å; D174-I181 HydrophobicContact CB-CG1 4.1Å
175	P	88.4	Confident	91.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-22.4	-178.3	-20.4	35.5	0	0	0	113.7	Y154 S159 L161 F173 Q510	Y154-P175 HydrophobicContact CD1-CG 3.95Å; Y154-P175 HydrophobicContact CE1-CB 3.74Å; Y154-P175 HydrophobicContact CE1-CG 3.6Å; S159-P175 WeakPolarHBondContact O-CD 3.42Å; L161-P175 HydrophobicContact CB-CG 3.93Å; F173-P175 WeakPolarHBondContact O-CD 3.33Å; P175-Q510 PolarHBondContact O-NE2 2.9Å; P175-Q510 PolarHBondContact O-OE1 3.15Å
176	I	85.8	Confident	91.6	Very high	92 Å²	92	50.4 Å²	50.4	47%	0.472	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-50.2	-176.3	-56.1	-55	0	0	0	110.6	D174 S178	D174-I176 PolarHBondContact O-N 3.3Å; D174-I176 WeakPolarHBondContact OD1-CA 3.4Å; D174-I176 WeakPolarHBondContact OD1-CB 3.18Å; D174-I176 PolarHBondContact OD1-N 2.7Å; I176-S178 VanDerWaalsContact C-N 3.29Å
177	S	85.8	Confident	91.7	Very high	47 Å²	47	47.7 Å²	47.7	33%	0.329	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-8	174	73.3	0	0	0	0	113.9	D174 K179	D174-S177 PolarHBondContact OD1-N 3.33Å; D174-S177 WeakPolarHBondContact OD2-CB 3.44Å; D174-S177 PolarHBondContact OD2-N 2.71Å; D174-S177 PolarHBondContact OD2-OG 3.49Å; S177-K179 PolarHBondContact O-N 3.37Å; S177-K179 WeakPolarHBondContact OG-CB 3.5Å; S177-K179 WeakPolarHBondContact OG-CG 3.19Å
178	S	85	Confident	91.9	Very high	10 Å²	10	43.7 Å²	43.7	7%	0.07	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	19.1	-172.3	-58.4	0	0	0	0	114.6	V139 D174 I176	V139-S178 VanDerWaalsContact CG2-O 3.24Å; V139-S178 WeakPolarHBondContact CG2-O 3.46Å; D174-S178 CarbonylContact O-C 3.55Å; D174-S178 WeakPolarHBondContact O-CA 3.42Å; D174-S178 PolarHBondContact O-N 2.54Å; I176-S178 VanDerWaalsContact C-N 3.29Å
179	K	85.2	Confident	92	Very high	124 Å²	124	50 Å²	50	54%	0.539	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	145.4	-173.1	-67.3	179.5	-177.1	-176.8	0	113	F173 D174 S177 I181	F173-K179 WeakPolarHBondContact CA-O 3.44Å; F173-K179 WeakPolarHBondContact CD1-O 3.39Å; D174-K179 PolarHBondContact N-O 3.24Å; D174-K179 PolarHBondContact O-N 3.09Å; S177-K179 PolarHBondContact O-N 3.37Å; S177-K179 WeakPolarHBondContact OG-CB 3.5Å; S177-K179 WeakPolarHBondContact OG-CG 3.19Å; K179-I181 PolarHBondContact O-N 3.25Å
180	H	89	Confident	92.2	Very high	76 Å²	76	52.4 Å²	52.4	35%	0.352	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	124.6	166.9	-175.3	-127.5	0	0	0	110.1	L172 F173 K182 T183	L172-H180 PolarHBondContact O-CD2 3.1Å; L172-H180 VanDerWaalsContact O-CD2 3.29Å; F173-H180 HydrophobicContact CD1-CB 4.17Å; F173-H180 HydrophobicContact CE1-CB 3.63Å; F173-H180 AromaticContact CE1-CD2 3.81Å; F173-H180 HydrophobicContact CZ-CB 4.35Å; F173-H180 AromaticContact CZ-CD2 3.73Å; H180-K182 PolarHBondContact NE2-O 3.15Å; H180-T183 PolarHBondContact CE1-N 3.48Å; H180-T183 VanDerWaalsContact CE1-N 3.33Å; H180-T183 PolarHBondContact CE1-OG1 2.76Å; H180-T183 PolarHBondContact NE2-N 3.41Å; H180-T183 PolarHBondContact NE2-OG1 3.33Å
181	I	91.4	Very high	92.2	Very high	93 Å²	93	53.4 Å²	53.4	48%	0.477	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-53.6	174.8	-58.8	172.6	0	0	0	109.4	V160 L172 F173 D174 K179	V160-I181 HydrophobicContact CG2-CD1 4.36Å; L172-I181 HydrophobicContact CB-CB 4.23Å; L172-I181 PolarHBondContact O-N 3.37Å; F173-I181 VanDerWaalsContact C-CD1 3.43Å; D174-I181 HydrophobicContact CB-CD1 4.04Å; D174-I181 HydrophobicContact CB-CG1 4.1Å; K179-I181 PolarHBondContact O-N 3.25Å
182	K	92.7	Very high	92.3	Very high	75 Å²	75	53.4 Å²	53.4	33%	0.326	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	136.9	-170.7	-179	165	-171	-178.7	0	113.9	L172 H180 L184 L220	L172-K182 PolarHBondContact N-O 3.37Å; L172-K182 PolarHBondContact O-N 3.06Å; H180-K182 PolarHBondContact NE2-O 3.15Å; K182-L184 HydrophobicContact CD-CD2 3.99Å; K182-L184 HydrophobicContact CG-CD2 4.17Å; K182-L220 HydrophobicContact CD-CB 4.23Å; K182-L220 PolarHBondContact NZ-O 3.29Å
183	T	93.9	Very high	92.4	Very high	32 Å²	32	53.9 Å²	53.9	20%	0.196	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.1	159.6	-53.9	0	0	0	0	110	E169 L171 H180 T185	E169-T183 HydrophobicContact CB-CG2 4.4Å; E169-T183 HydrophobicContact CG-CG2 4.38Å; E169-T183 VanDerWaalsContact OE1-CG2 3.29Å; E169-T183 WeakPolarHBondContact OE1-CG2 3.31Å; L171-T183 HydrophobicContact CD2-CG2 3.78Å; H180-T183 PolarHBondContact CE1-N 3.48Å; H180-T183 VanDerWaalsContact CE1-N 3.33Å; H180-T183 PolarHBondContact CE1-OG1 2.76Å; H180-T183 PolarHBondContact NE2-N 3.41Å; H180-T183 PolarHBondContact NE2-OG1 3.33Å; T183-T185 HydrophobicContact CG2-CG2 3.83Å
184	L	95.5	Very high	92.7	Very high	5 Å²	5	54 Å²	54	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	91.7	161.2	-51	-175.2	0	0	0	107.3	E169 V170 L172 K182 A187 F203 W215 L220	E169-L184 WeakPolarHBondContact CA-O 3.49Å; V170-L184 HydrophobicContact CB-CB 4.22Å; V170-L184 HydrophobicContact CB-CD1 4.19Å; V170-L184 HydrophobicContact CB-CG 4.42Å; V170-L184 HydrophobicContact CG1-CD1 4.16Å; V170-L184 PolarHBondContact N-O 2.65Å; V170-L184 WeakPolarHBondContact O-CB 3.32Å; V170-L184 PolarHBondContact O-N 3.02Å; L172-L184 HydrophobicContact CD1-CD1 3.98Å; L172-L184 HydrophobicContact CD1-CD2 4.26Å; L172-L184 HydrophobicContact CD1-CG 3.79Å; K182-L184 HydrophobicContact CD-CD2 3.99Å; K182-L184 HydrophobicContact CG-CD2 4.17Å; L184-A187 HydrophobicContact CB-CB 4.15Å; L184-F203 HydrophobicContact CD1-CE2 4.43Å; L184-F203 HydrophobicContact CD1-CZ 4.05Å; L184-W215 HydrophobicContact CB-CH2 4.49Å; L184-W215 HydrophobicContact CD1-CD2 3.99Å; L184-W215 HydrophobicContact CD1-CE3 3.93Å; L184-W215 HydrophobicContact CD1-CH2 4.31Å; L184-W215 HydrophobicContact CD1-CZ2 4.37Å; L184-W215 HydrophobicContact CD1-CZ3 4.1Å; L184-L220 HydrophobicContact CD1-CD2 4.28Å; L184-L220 HydrophobicContact CD2-CB 3.97Å; L184-L220 HydrophobicContact CD2-CD2 4.25Å
185	T	91.6	Very high	93	Very high	91 Å²	91	51.8 Å²	51.8	56%	0.558	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	143.4	170.4	51.6	0	0	0	0	109.4	T183 A187	T183-T185 HydrophobicContact CG2-CG2 3.83Å; T185-A187 PolarHBondContact O-N 2.8Å
186	E	89.9	Confident	93.5	Very high	155 Å²	155	55.2 Å²	55.2	72%	0.724	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	37	-179.2	-54.8	172	164.9	0	0	111.6	H188 K223	E186-H188 PolarHBondContact O-N 3.34Å; E186-K223 PolarHBondContact O-NZ 2.8Å
187	A	95.8	Very high	94.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-61.2	-33.3	173.1	0	0	0	0	0	110.7	T168 V170 L184 T185 W215 K223	T168-A187 WeakPolarHBondContact O-CB 3.27Å; T168-A187 PolarHBondContact O-N 3.4Å; V170-A187 HydrophobicContact CB-CB 4.19Å; V170-A187 HydrophobicContact CG2-CB 3.92Å; L184-A187 HydrophobicContact CB-CB 4.15Å; T185-A187 PolarHBondContact O-N 2.8Å; A187-W215 HydrophobicContact CB-CH2 4.39Å; A187-W215 HydrophobicContact CB-CZ2 3.9Å; A187-K223 WeakPolarHBondContact O-CE 3.19Å; A187-K223 PolarHBondContact O-NZ 2.92Å
188	H	97.8	Very high	94.5	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.019	25%	0.245	C	C	.	.			trans	-145.8	176.6	174.7	-83.5	-77.3	0	0	0	110.3	T168 E186 D190 V192 T205 S207 D209 T211	T168-H188 VanDerWaalsContact CB-O 3.24Å; T168-H188 WeakPolarHBondContact CB-O 3.16Å; T168-H188 WeakPolarHBondContact CG2-O 3.31Å; T168-H188 PolarHBondContact O-N 3.33Å; E186-H188 PolarHBondContact O-N 3.34Å; H188-D190 WeakPolarHBondContact CB-O 3.28Å; H188-V192 HydrophobicContact CB-CG2 4.13Å; H188-T205 PolarHBondContact CD2-OG1 3.32Å; H188-T205 VanDerWaalsContact NE2-C 3.35Å; H188-T205 PolarHBondContact NE2-O 3.31Å; H188-T205 PolarHBondContact NE2-OG1 3.49Å; H188-S207 WeakPolarHBondContact CB-OG 3.35Å; H188-S207 WeakPolarHBondContact ND1-CB 3.48Å; H188-D209 WeakPolarHBondContact CA-OD2 3.39Å; H188-D209 WeakPolarHBondContact CB-OD2 3.25Å; H188-D209 IonicContact CG-OD2 3.37Å; H188-D209 IonicContact ND1-OD1 2.73Å; H188-D209 PolarHBondContact ND1-OD1 3.35Å; H188-D209 IonicContact ND1-OD2 3.67Å; H188-D209 PolarHBondContact ND1-OD2 2.74Å; H188-T211 PolarHBondContact CE1-OG1 2.85Å; H188-T211 PolarHBondContact ND1-OG1 2.97Å
189	E	97.6	Very high	94.9	Very high	180 Å²	180	53 Å²	53	84%	0.841	26%	0.259	S	S	*	.	S	Bend	trans	-92.6	-12.7	173.7	-65.2	-177.4	-170.9	0	0	113	D209	E189-D209 HydrophobicContact CB-CB 3.93Å; E189-D209 PolarHBondContact N-OD2 2.88Å
190	D	97.6	Very high	95.2	Very high	67 Å²	67	51 Å²	51	36%	0.358	26%	0.255	S	S	.	.	S	Bend	trans	-145.5	-179.2	176.7	-155.3	-18.9	0	0	0	110.6	H188 V192 S207 D208 D209	H188-D190 WeakPolarHBondContact CB-O 3.28Å; D190-V192 PolarHBondContact O-N 3.01Å; D190-S207 PolarHBondContact O-OG 2.86Å; D190-D208 HydrophobicContact CB-CB 4.05Å; D190-D209 HydrophobicContact CB-CB 4.17Å
191	C	97.1	Very high	95.4	Very high	22 Å²	22	52 Å²	52	15%	0.149	26%	0.255	C	S	.	.			trans	-33.6	126.3	178.6	-60.2	0	0	0	0	114.7	F150 E166 S207 D208	F150-C191 HydrophobicContact CE2-CB 4.16Å; E166-C191 WeakPolarHBondContact O-CA 3.2Å; E166-C191 PolarHBondContact O-SG 3.25Å; C191-S207 WeakPolarHBondContact O-CA 3.31Å; C191-S207 VanDerWaalsContact O-CB 3.24Å; C191-S207 WeakPolarHBondContact O-CB 3.5Å; C191-S207 PolarHBondContact O-OG 3.04Å; C191-D208 HydrophobicContact CB-CB 4.17Å; C191-D208 PolarHBondContact O-N 2.9Å; C191-D208 VanDerWaalsContact O-N 3.1Å
192	V	98.4	Very high	95.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	112.2	176.3	-165	0	0	0	0	110.7	A164 C165 V170 H188 D190	A164-V192 HydrophobicContact CB-CB 4.25Å; A164-V192 HydrophobicContact CB-CG1 4.06Å; A164-V192 VanDerWaalsContact CB-O 3.25Å; A164-V192 WeakPolarHBondContact CB-O 3.33Å; C165-V192 WeakPolarHBondContact O-CA 3.36Å; C165-V192 PolarHBondContact O-N 2.79Å; V170-V192 HydrophobicContact CG2-CB 4.34Å; V170-V192 HydrophobicContact CG2-CG1 3.82Å; V170-V192 HydrophobicContact CG2-CG2 4.15Å; H188-V192 HydrophobicContact CB-CG2 4.13Å; D190-V192 PolarHBondContact O-N 3.01Å
193	N	98	Very high	95.9	Very high	11 Å²	11	46 Å²	46	6%	0.059	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-32.6	-170.9	-64	-71	0	0	0	114.7	C206 S207 D208 V234 K235	N193-C206 PolarHBondContact N-O 2.98Å; N193-S207 VanDerWaalsContact ND2-C 3.34Å; N193-D208 PolarHBondContact ND2-N 2.87Å; N193-D208 PolarHBondContact ND2-OD1 2.82Å; N193-V234 WeakPolarHBondContact CB-O 3.34Å; N193-V234 PolarHBondContact ND2-O 3.17Å; N193-K235 HydrophobicContact CB-CD 4.02Å; N193-K235 WeakPolarHBondContact OD1-CD 3.48Å; N193-K235 PolarHBondContact OD1-NZ 2.81Å
194	N	98.3	Very high	96.2	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.011	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	147.9	-166.5	-141.2	-125.2	0	0	0	112.3	N151 T205 C206 I237	N151-N194 PolarHBondContact ND2-ND2 3.09Å; N151-N194 PolarHBondContact OD1-ND2 3.29Å; N194-T205 WeakPolarHBondContact O-CA 3.4Å; N194-C206 VanDerWaalsContact CB-SG 3.53Å; N194-C206 PolarHBondContact O-N 3.09Å; N194-C206 VanDerWaalsContact O-N 3.17Å; N194-I237 PolarHBondContact OD1-N 2.91Å
195	I	98.7	Very high	96.3	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139	173.6	-49.3	-179.1	0	0	0	108.6	E153 T162 A164 V170 F203 A204 T205	E153-I195 HydrophobicContact CB-CB 4.15Å; E153-I195 HydrophobicContact CB-CG2 4.41Å; E153-I195 WeakPolarHBondContact CB-O 3.46Å; T162-I195 WeakPolarHBondContact OG1-CG2 3.31Å; A164-I195 HydrophobicContact CB-CD1 3.94Å; A164-I195 HydrophobicContact CB-CG1 3.9Å; V170-I195 HydrophobicContact CG1-CD1 3.68Å; V170-I195 HydrophobicContact CG2-CD1 4.16Å; I195-F203 HydrophobicContact CG2-CB 4.4Å; I195-F203 HydrophobicContact CG2-CD2 3.76Å; I195-F203 HydrophobicContact CG2-CE2 4.5Å; I195-F203 HydrophobicContact CG2-CG 4.43Å; I195-A204 VanDerWaalsContact CA-O 3.31Å; I195-A204 WeakPolarHBondContact CA-O 3.42Å; I195-A204 WeakPolarHBondContact CG2-O 3.38Å; I195-T205 HydrophobicContact CD1-CG2 4.45Å; I195-T205 HydrophobicContact CG1-CG2 4.11Å; I195-T205 HydrophobicContact CG2-CG2 4.24Å
196	R	98.4	Very high	96.7	Very high	72 Å²	72	39.9 Å²	39.9	27%	0.272	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	128.2	176.4	-156.6	73.4	170.7	108.1	-0.2	110.6	E153 F203 A204 I237 E238	E153-R196 WeakPolarHBondContact OE1-CD 3.39Å; E153-R196 IonicContact OE1-CZ 2.85Å; E153-R196 IonicContact OE1-NE 3.81Å; E153-R196 IonicContact OE1-NH1 3.18Å; E153-R196 PolarHBondContact OE1-NH1 2.99Å; R196-F203 CarbonylContact O-C 3.57Å; R196-F203 VanDerWaalsContact O-CA 3.25Å; R196-F203 WeakPolarHBondContact O-CA 3.41Å; R196-F203 WeakPolarHBondContact O-CB 3.39Å; R196-A204 PolarHBondContact N-O 3.08Å; R196-A204 PolarHBondContact O-N 2.77Å; R196-I237 HydrophobicContact CB-CB 3.87Å; R196-I237 HydrophobicContact CB-CG2 3.68Å; R196-I237 WeakPolarHBondContact CD-O 3.37Å; R196-I237 HydrophobicContact CG-CG2 4.33Å; R196-E238 IonicContact CZ-OE2 3.92Å; R196-E238 IonicContact NE-OE1 3.7Å; R196-E238 IonicContact NE-OE2 3.31Å; R196-E238 PolarHBondContact NE-OE2 3.33Å; R196-E238 IonicContact NH2-OE1 2.83Å; R196-E238 IonicContact NH2-OE2 3.86Å; R196-E238 PolarHBondContact NH2-OE2 2.71Å
197	F	97.8	Very high	97.1	Very high	13 Å²	13	32.5 Å²	32.5	6%	0.057	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137.7	169.5	-80.5	-88.2	0	0	0	111	E153 Y154 P156 T162 D199 F203 L217	E153-F197 HydrophobicContact CG-CD2 3.72Å; E153-F197 HydrophobicContact CG-CE2 4.28Å; Y154-F197 VanDerWaalsContact O-CD2 3.29Å; Y154-F197 WeakPolarHBondContact O-CD2 3.39Å; P156-F197 HydrophobicContact CG-CB 4.11Å; T162-F197 HydrophobicContact CG2-CE2 3.7Å; T162-F197 HydrophobicContact CG2-CZ 3.61Å; F197-D199 WeakPolarHBondContact CD1-O 3.29Å; F197-F203 HydrophobicContact CD1-CB 3.71Å; F197-F203 HydrophobicContact CD1-CD1 4.37Å; F197-F203 HydrophobicContact CD1-CG 4.45Å; F197-F203 HydrophobicContact CD2-CB 4.35Å; F197-F203 HydrophobicContact CE1-CB 3.84Å; F197-F203 AromaticContact CE1-CD1 3.71Å; F197-F203 HydrophobicContact CE1-CD1 3.71Å; F197-F203 HydrophobicContact CE1-CG 4.09Å; F197-F203 HydrophobicContact CE2-CB 4.47Å; F197-F203 HydrophobicContact CG-CB 3.98Å; F197-F203 HydrophobicContact CZ-CB 4.23Å; F197-F203 HydrophobicContact CZ-CD1 4.07Å; F197-F203 HydrophobicContact CZ-CG 4.29Å; F197-L217 HydrophobicContact CE1-CD1 3.76Å; F197-L217 HydrophobicContact CE1-CG 4.21Å; F197-L217 HydrophobicContact CZ-CD1 4.38Å
198	L	95.6	Very high	97.2	Very high	19 Å²	19	33.1 Å²	33.1	10%	0.099	16%	0.159	C	C	.	.	S	Bend	trans	-93.5	-35	173.2	-70.7	71.3	0	0	0	110.3	L202 A204 Y239 L246	L198-L202 HydrophobicContact CB-CB 4.27Å; L198-L202 PolarHBondContact N-O 3.02Å; L198-A204 HydrophobicContact CD1-CB 3.96Å; L198-Y239 HydrophobicContact CB-CD1 4.16Å; L198-Y239 HydrophobicContact CB-CD2 4.42Å; L198-Y239 HydrophobicContact CB-CE1 4Å; L198-Y239 HydrophobicContact CB-CE2 4.29Å; L198-Y239 HydrophobicContact CB-CG 4.36Å; L198-Y239 HydrophobicContact CD2-CD2 4.19Å; L198-Y239 HydrophobicContact CD2-CE2 3.96Å; L198-Y239 HydrophobicContact CG-CD1 4.37Å; L198-Y239 HydrophobicContact CG-CD2 3.86Å; L198-Y239 HydrophobicContact CG-CE1 4.47Å; L198-Y239 HydrophobicContact CG-CE2 3.99Å; L198-Y239 HydrophobicContact CG-CG 4.06Å; L198-Y239 WeakPolarHBondContact O-CE1 3.42Å; L198-L246 HydrophobicContact CD1-CD1 3.97Å; L198-L246 HydrophobicContact CD2-CD1 4.3Å; L198-L246 HydrophobicContact CG-CD1 4.14Å
199	D	92.8	Very high	97.2	Very high	70 Å²	70	34.3 Å²	34.3	37%	0.374	17%	0.166	S	C	.	.	S	Bend	trans	-155.8	-167.7	171.3	61.9	29.7	0	0	0	109.3	F197 R201 L202	F197-D199 WeakPolarHBondContact CD1-O 3.29Å; D199-R201 PolarHBondContact O-N 2.87Å; D199-R201 VanDerWaalsContact O-N 3.1Å; D199-R201 WeakPolarHBondContact OD1-CA 3.47Å; D199-R201 VanDerWaalsContact OD1-CB 3.31Å; D199-R201 WeakPolarHBondContact OD1-CB 3.5Å; D199-R201 PolarHBondContact OD1-N 3.28Å; D199-L202 PolarHBondContact N-O 2.83Å; D199-L202 PolarHBondContact OD1-N 2.79Å
200	N	91.8	Very high	97.3	Very high	83 Å²	83	28 Å²	28	44%	0.444	14%	0.139	S	C	.	.	S	Bend	trans	-74.2	8.8	179.7	-59.8	28.9	0	0	0	114.3	P156 D157	P156-N200 WeakPolarHBondContact CB-OD1 3.23Å; D157-N200 WeakPolarHBondContact CB-ND2 3.48Å; D157-N200 VanDerWaalsContact CG-ND2 3.28Å; D157-N200 PolarHBondContact OD2-ND2 2.83Å
201	R	93.7	Very high	97.3	Very high	96 Å²	96	25.6 Å²	25.6	36%	0.362	13%	0.127	S	C	.	.	S	Bend	trans	-128.9	-46.7	-177.4	172	-158.2	171.9	-154.1	-4.9	111.3	D199 D216 L217 R218	D199-R201 PolarHBondContact O-N 2.87Å; D199-R201 VanDerWaalsContact O-N 3.1Å; D199-R201 WeakPolarHBondContact OD1-CA 3.47Å; D199-R201 VanDerWaalsContact OD1-CB 3.31Å; D199-R201 WeakPolarHBondContact OD1-CB 3.5Å; D199-R201 PolarHBondContact OD1-N 3.28Å; R201-D216 WeakPolarHBondContact CG-OD1 3.24Å; R201-D216 IonicContact CZ-OD2 3.89Å; R201-D216 IonicContact NE-OD1 3.66Å; R201-D216 PolarHBondContact NE-OD1 2.82Å; R201-D216 IonicContact NE-OD2 3.73Å; R201-D216 PolarHBondContact NE-OD2 3.37Å; R201-D216 IonicContact NH2-OD2 2.84Å; R201-D216 PolarHBondContact NH2-OD2 2.73Å; R201-L217 PolarHBondContact O-N 3.15Å; R201-R218 VanDerWaalsContact CZ-NH2 3.28Å
202	L	96.4	Very high	97.4	Very high	43 Å²	43	24.6 Å²	24.6	23%	0.225	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135	-172.7	-61.3	-178.8	0	0	0	111.4	L198 D199 W215 D216	L198-L202 HydrophobicContact CB-CB 4.27Å; L198-L202 PolarHBondContact N-O 3.02Å; D199-L202 PolarHBondContact N-O 2.83Å; D199-L202 PolarHBondContact OD1-N 2.79Å; L202-W215 WeakPolarHBondContact CA-O 3.39Å; L202-W215 WeakPolarHBondContact CD2-O 3.38Å; L202-D216 HydrophobicContact CD2-CB 3.96Å
203	F	98.4	Very high	97.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	157.5	168.9	63.3	-84.7	0	0	0	111.2	L184 I195 R196 F197 T205 W215 L217 L220	L184-F203 HydrophobicContact CD1-CE2 4.43Å; L184-F203 HydrophobicContact CD1-CZ 4.05Å; I195-F203 HydrophobicContact CG2-CB 4.4Å; I195-F203 HydrophobicContact CG2-CD2 3.76Å; I195-F203 HydrophobicContact CG2-CE2 4.5Å; I195-F203 HydrophobicContact CG2-CG 4.43Å; R196-F203 CarbonylContact O-C 3.57Å; R196-F203 VanDerWaalsContact O-CA 3.25Å; R196-F203 WeakPolarHBondContact O-CA 3.41Å; R196-F203 WeakPolarHBondContact O-CB 3.39Å; F197-F203 HydrophobicContact CD1-CB 3.71Å; F197-F203 HydrophobicContact CD1-CD1 4.37Å; F197-F203 HydrophobicContact CD1-CG 4.45Å; F197-F203 HydrophobicContact CD2-CB 4.35Å; F197-F203 HydrophobicContact CE1-CB 3.84Å; F197-F203 AromaticContact CE1-CD1 3.71Å; F197-F203 HydrophobicContact CE1-CD1 3.71Å; F197-F203 HydrophobicContact CE1-CG 4.09Å; F197-F203 HydrophobicContact CE2-CB 4.47Å; F197-F203 HydrophobicContact CG-CB 3.98Å; F197-F203 HydrophobicContact CZ-CB 4.23Å; F197-F203 HydrophobicContact CZ-CD1 4.07Å; F197-F203 HydrophobicContact CZ-CG 4.29Å; F203-T205 HydrophobicContact CD2-CG2 3.84Å; F203-T205 HydrophobicContact CE2-CG2 3.77Å; F203-W215 HydrophobicContact CD1-CB 4.01Å; F203-W215 HydrophobicContact CD2-CB 4.03Å; F203-W215 AromaticContact CD2-CD1 3.9Å; F203-W215 HydrophobicContact CD2-CG 4.24Å; F203-W215 HydrophobicContact CE1-CB 3.6Å; F203-W215 HydrophobicContact CE1-CG 4.45Å; F203-W215 HydrophobicContact CE2-CB 3.64Å; F203-W215 AromaticContact CE2-CD1 3.53Å; F203-W215 AromaticContact CE2-CG 3.65Å; F203-W215 HydrophobicContact CE2-CG 3.65Å; F203-W215 HydrophobicContact CG-CB 4.22Å; F203-W215 HydrophobicContact CZ-CB 3.41Å; F203-W215 VanDerWaalsContact CZ-CB 3.41Å; F203-W215 AromaticContact CZ-CG 3.77Å; F203-W215 HydrophobicContact CZ-CG 3.77Å; F203-W215 PolarHBondContact N-O 2.79Å; F203-W215 PolarHBondContact O-N 2.77Å; F203-L217 HydrophobicContact CD1-CD2 4.3Å; F203-L217 HydrophobicContact CD1-CG 4.22Å; F203-L217 HydrophobicContact CE1-CD2 3.77Å; F203-L217 HydrophobicContact CE1-CG 4.06Å; F203-L220 HydrophobicContact CE1-CD2 3.9Å; F203-L220 HydrophobicContact CZ-CD2 3.93Å
204	A	98.6	Very high	97.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	144.2	174.7	0	0	0	0	0	110.1	I195 R196 L198 I212 A213 L214 I237 L246	I195-A204 VanDerWaalsContact CA-O 3.31Å; I195-A204 WeakPolarHBondContact CA-O 3.42Å; I195-A204 WeakPolarHBondContact CG2-O 3.38Å; R196-A204 PolarHBondContact N-O 3.08Å; R196-A204 PolarHBondContact O-N 2.77Å; L198-A204 HydrophobicContact CD1-CB 3.96Å; A204-I212 HydrophobicContact CB-CG2 4.11Å; A204-A213 CarbonylContact C-O 3.52Å; A204-A213 VanDerWaalsContact CA-O 3.31Å; A204-A213 WeakPolarHBondContact CA-O 3.22Å; A204-L214 HydrophobicContact CB-CD2 3.73Å; A204-I237 HydrophobicContact CB-CD1 3.86Å; A204-I237 HydrophobicContact CB-CG2 4.13Å; A204-I237 WeakPolarHBondContact O-CD1 3.42Å; A204-L246 HydrophobicContact CB-CD1 4.07Å; A204-L246 HydrophobicContact CB-CD2 4Å
205	T	98.8	Very high	97.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.6	173.5	62.2	0	0	0	0	108.8	V170 H188 N194 I195 F203 I212 A213 W215	V170-T205 HydrophobicContact CG2-CG2 4.03Å; H188-T205 PolarHBondContact CD2-OG1 3.32Å; H188-T205 VanDerWaalsContact NE2-C 3.35Å; H188-T205 PolarHBondContact NE2-O 3.31Å; H188-T205 PolarHBondContact NE2-OG1 3.49Å; N194-T205 WeakPolarHBondContact O-CA 3.4Å; I195-T205 HydrophobicContact CD1-CG2 4.45Å; I195-T205 HydrophobicContact CG1-CG2 4.11Å; I195-T205 HydrophobicContact CG2-CG2 4.24Å; F203-T205 HydrophobicContact CD2-CG2 3.84Å; F203-T205 HydrophobicContact CE2-CG2 3.77Å; T205-I212 CarbonylContact O-C 3.6Å; T205-I212 WeakPolarHBondContact O-CA 3.29Å; T205-I212 VanDerWaalsContact O-CG2 3.24Å; T205-I212 WeakPolarHBondContact O-CG2 3.1Å; T205-A213 PolarHBondContact N-O 3.33Å; T205-A213 PolarHBondContact O-N 3.13Å; T205-W215 PolarHBondContact OG1-NE1 2.8Å
206	C	98.6	Very high	97.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	152.7	177.9	72.9	0	0	0	0	112.7	N193 N194 I212 V234 I237	N193-C206 PolarHBondContact N-O 2.98Å; N194-C206 VanDerWaalsContact CB-SG 3.53Å; N194-C206 PolarHBondContact O-N 3.09Å; N194-C206 VanDerWaalsContact O-N 3.17Å; C206-I212 HydrophobicContact CB-CB 4.33Å; C206-I212 HydrophobicContact CB-CG1 3.68Å; C206-I212 HydrophobicContact CB-CG2 4.35Å; C206-V234 HydrophobicContact CB-CB 3.86Å; C206-V234 HydrophobicContact CB-CG1 3.66Å; C206-V234 PolarHBondContact SG-O 2.73Å; C206-I237 HydrophobicContact CB-CD1 3.8Å; C206-I237 HydrophobicContact CB-CG1 3.91Å
207	S	98.7	Very high	97.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	170.5	-164.3	167.6	0	0	0	0	114.1	H188 D190 C191 N193 D209 T210 T211 V234	H188-S207 WeakPolarHBondContact CB-OG 3.35Å; H188-S207 WeakPolarHBondContact ND1-CB 3.48Å; D190-S207 PolarHBondContact O-OG 2.86Å; C191-S207 WeakPolarHBondContact O-CA 3.31Å; C191-S207 VanDerWaalsContact O-CB 3.24Å; C191-S207 WeakPolarHBondContact O-CB 3.5Å; C191-S207 PolarHBondContact O-OG 3.04Å; N193-S207 VanDerWaalsContact ND2-C 3.34Å; S207-D209 WeakPolarHBondContact CB-OD1 3.31Å; S207-D209 VanDerWaalsContact OG-CG 3.31Å; S207-D209 PolarHBondContact OG-N 2.75Å; S207-T210 PolarHBondContact O-N 3Å; S207-T211 PolarHBondContact N-O 2.58Å; S207-V234 PolarHBondContact O-N 2.93Å
208	D	98.5	Very high	96.9	Very high	13 Å²	13	32.3 Å²	32.3	7%	0.07	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.1	167.8	-72.5	-0.1	0	0	0	112.8	D190 C191 N193 T210 W233 K235	D190-D208 HydrophobicContact CB-CB 4.05Å; C191-D208 HydrophobicContact CB-CB 4.17Å; C191-D208 PolarHBondContact O-N 2.9Å; C191-D208 VanDerWaalsContact O-N 3.1Å; N193-D208 PolarHBondContact ND2-N 2.87Å; N193-D208 PolarHBondContact ND2-OD1 2.82Å; D208-T210 PolarHBondContact O-N 3.49Å; D208-W233 HydrophobicContact CB-CB 4.43Å; D208-W233 VanDerWaalsContact CB-CD1 3.45Å; D208-W233 HydrophobicContact CB-CD2 4.12Å; D208-W233 HydrophobicContact CB-CG 3.79Å; D208-W233 WeakPolarHBondContact OD1-CB 3.19Å; D208-W233 VanDerWaalsContact OD1-CG 3.26Å; D208-K235 WeakPolarHBondContact OD1-CE 3.49Å; D208-K235 IonicContact OD1-NZ 2.73Å; D208-K235 PolarHBondContact OD1-NZ 3.33Å; D208-K235 IonicContact OD2-NZ 3.2Å; D208-K235 PolarHBondContact OD2-NZ 3.34Å
209	D	98.4	Very high	96.8	Very high	29 Å²	29	36.8 Å²	36.8	16%	0.155	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	3.1	165.9	74.3	14.2	0	0	0	114.3	H188 E189 D190 S207 T211	H188-D209 WeakPolarHBondContact CA-OD2 3.39Å; H188-D209 WeakPolarHBondContact CB-OD2 3.25Å; H188-D209 IonicContact CG-OD2 3.37Å; H188-D209 IonicContact ND1-OD1 2.73Å; H188-D209 PolarHBondContact ND1-OD1 3.35Å; H188-D209 IonicContact ND1-OD2 3.67Å; H188-D209 PolarHBondContact ND1-OD2 2.74Å; E189-D209 HydrophobicContact CB-CB 3.93Å; E189-D209 PolarHBondContact N-OD2 2.88Å; D190-D209 HydrophobicContact CB-CB 4.17Å; S207-D209 WeakPolarHBondContact CB-OD1 3.31Å; S207-D209 VanDerWaalsContact OG-CG 3.31Å; S207-D209 PolarHBondContact OG-N 2.75Å; D209-T211 VanDerWaalsContact CG-OG1 3.29Å; D209-T211 PolarHBondContact O-N 2.59Å; D209-T211 WeakPolarHBondContact OD1-CA 3.4Å; D209-T211 VanDerWaalsContact OD1-CB 3.25Å; D209-T211 WeakPolarHBondContact OD1-CB 3.48Å; D209-T211 WeakPolarHBondContact OD1-CG2 3.34Å; D209-T211 PolarHBondContact OD1-N 3.38Å; D209-T211 PolarHBondContact OD1-OG1 2.73Å; D209-T211 PolarHBondContact OD2-OG1 2.83Å
210	T	98.6	Very high	96.9	Very high	47 Å²	47	34.6 Å²	34.6	29%	0.288	16%	0.159	S	C	.	.	S	Bend	trans	70.1	1.1	-178.1	78.1	0	0	0	0	115.8	S207 D208 V234	S207-T210 PolarHBondContact O-N 3Å; D208-T210 PolarHBondContact O-N 3.49Å; T210-V234 WeakPolarHBondContact O-CG2 2.86Å
211	T	98.2	Very high	96.9	Very high	17 Å²	17	36.6 Å²	36.6	10%	0.104	17%	0.17	C	C	.	.			trans	-101.6	167.2	-177.1	80.2	0	0	0	0	113.5	H188 S207 D209 L227	H188-T211 PolarHBondContact CE1-OG1 2.85Å; H188-T211 PolarHBondContact ND1-OG1 2.97Å; S207-T211 PolarHBondContact N-O 2.58Å; D209-T211 VanDerWaalsContact CG-OG1 3.29Å; D209-T211 PolarHBondContact O-N 2.59Å; D209-T211 WeakPolarHBondContact OD1-CA 3.4Å; D209-T211 VanDerWaalsContact OD1-CB 3.25Å; D209-T211 WeakPolarHBondContact OD1-CB 3.48Å; D209-T211 WeakPolarHBondContact OD1-CG2 3.34Å; D209-T211 PolarHBondContact OD1-N 3.38Å; D209-T211 PolarHBondContact OD1-OG1 2.73Å; D209-T211 PolarHBondContact OD2-OG1 2.83Å; T211-L227 WeakPolarHBondContact CA-O 3.43Å
212	I	98.6	Very high	96.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126	165.7	-54.9	99.8	0	0	0	108.4	A204 T205 C206 L227 V234 I237 L246 T248 W258	A204-I212 HydrophobicContact CB-CG2 4.11Å; T205-I212 CarbonylContact O-C 3.6Å; T205-I212 WeakPolarHBondContact O-CA 3.29Å; T205-I212 VanDerWaalsContact O-CG2 3.24Å; T205-I212 WeakPolarHBondContact O-CG2 3.1Å; C206-I212 HydrophobicContact CB-CB 4.33Å; C206-I212 HydrophobicContact CB-CG1 3.68Å; C206-I212 HydrophobicContact CB-CG2 4.35Å; I212-L227 HydrophobicContact CB-CB 4.16Å; I212-L227 HydrophobicContact CB-CD1 4.22Å; I212-L227 HydrophobicContact CB-CG 4.39Å; I212-L227 HydrophobicContact CD1-CB 4.46Å; I212-L227 HydrophobicContact CG2-CD1 4.24Å; I212-L227 PolarHBondContact N-O 2.89Å; I212-L227 VanDerWaalsContact N-O 3.08Å; I212-L227 WeakPolarHBondContact O-CG 3.48Å; I212-L227 PolarHBondContact O-N 2.85Å; I212-V234 HydrophobicContact CD1-CG1 4.15Å; I212-V234 HydrophobicContact CD1-CG2 4.27Å; I212-V234 HydrophobicContact CG1-CG1 4Å; I212-I237 HydrophobicContact CG2-CD1 4.26Å; I212-L246 HydrophobicContact CG2-CD2 4.1Å; I212-T248 HydrophobicContact CD1-CG2 3.87Å; I212-T248 HydrophobicContact CG1-CG2 3.83Å; I212-W258 HydrophobicContact CD1-CH2 4.44Å; I212-W258 HydrophobicContact CD1-CZ2 3.73Å
213	A	97.9	Very high	96.8	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.8	176.4	0	0	0	0	0	111.3	A204 T205 W215 K223	A204-A213 CarbonylContact C-O 3.52Å; A204-A213 VanDerWaalsContact CA-O 3.31Å; A204-A213 WeakPolarHBondContact CA-O 3.22Å; T205-A213 PolarHBondContact N-O 3.33Å; T205-A213 PolarHBondContact O-N 3.13Å; A213-W215 HydrophobicContact CB-CZ2 4.3Å; A213-K223 HydrophobicContact CB-CD 3.76Å; A213-K223 HydrophobicContact CB-CG 4.07Å
214	L	97.7	Very high	96.6	Very high	12 Å²	12	38.4 Å²	38.4	6%	0.063	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	141.4	171.3	-64	-179.9	0	0	0	110.4	A204 V224 C225 L227 L246 T260	A204-L214 HydrophobicContact CB-CD2 3.73Å; L214-V224 HydrophobicContact CB-CB 4.1Å; L214-V224 WeakPolarHBondContact O-CB 3.45Å; L214-V224 PolarHBondContact O-N 3.17Å; L214-C225 HydrophobicContact CD1-CB 4.35Å; L214-C225 PolarHBondContact N-O 3.02Å; L214-L227 HydrophobicContact CD1-CD2 4.48Å; L214-L227 HydrophobicContact CG-CD1 4.5Å; L214-L246 HydrophobicContact CD2-CD2 4.27Å; L214-T260 HydrophobicContact CD1-CG2 3.78Å; L214-T260 HydrophobicContact CD2-CG2 4.42Å
215	W	97.8	Very high	96.4	Very high	11 Å²	11	39.7 Å²	39.7	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.8	-176.8	-59.5	91.4	0	0	0	111.8	L184 A187 L202 F203 T205 A213 K223	L184-W215 HydrophobicContact CB-CH2 4.49Å; L184-W215 HydrophobicContact CD1-CD2 3.99Å; L184-W215 HydrophobicContact CD1-CE3 3.93Å; L184-W215 HydrophobicContact CD1-CH2 4.31Å; L184-W215 HydrophobicContact CD1-CZ2 4.37Å; L184-W215 HydrophobicContact CD1-CZ3 4.1Å; A187-W215 HydrophobicContact CB-CH2 4.39Å; A187-W215 HydrophobicContact CB-CZ2 3.9Å; L202-W215 WeakPolarHBondContact CA-O 3.39Å; L202-W215 WeakPolarHBondContact CD2-O 3.38Å; F203-W215 HydrophobicContact CD1-CB 4.01Å; F203-W215 HydrophobicContact CD2-CB 4.03Å; F203-W215 AromaticContact CD2-CD1 3.9Å; F203-W215 HydrophobicContact CD2-CG 4.24Å; F203-W215 HydrophobicContact CE1-CB 3.6Å; F203-W215 HydrophobicContact CE1-CG 4.45Å; F203-W215 HydrophobicContact CE2-CB 3.64Å; F203-W215 AromaticContact CE2-CD1 3.53Å; F203-W215 AromaticContact CE2-CG 3.65Å; F203-W215 HydrophobicContact CE2-CG 3.65Å; F203-W215 HydrophobicContact CG-CB 4.22Å; F203-W215 HydrophobicContact CZ-CB 3.41Å; F203-W215 VanDerWaalsContact CZ-CB 3.41Å; F203-W215 AromaticContact CZ-CG 3.77Å; F203-W215 HydrophobicContact CZ-CG 3.77Å; F203-W215 PolarHBondContact N-O 2.79Å; F203-W215 PolarHBondContact O-N 2.77Å; T205-W215 PolarHBondContact OG1-NE1 2.8Å; A213-W215 HydrophobicContact CB-CZ2 4.3Å; W215-K223 HydrophobicContact CH2-CG 3.61Å; W215-K223 HydrophobicContact CZ2-CD 4.44Å; W215-K223 HydrophobicContact CZ2-CG 3.68Å; W215-K223 HydrophobicContact CZ3-CG 4.05Å
216	D	96.4	Very high	96.2	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.07	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.1	172.2	-176.9	-10.5	0	0	0	108.4	R201 L202 R218 K219 L220 V224	R201-D216 WeakPolarHBondContact CG-OD1 3.24Å; R201-D216 IonicContact CZ-OD2 3.89Å; R201-D216 IonicContact NE-OD1 3.66Å; R201-D216 PolarHBondContact NE-OD1 2.82Å; R201-D216 IonicContact NE-OD2 3.73Å; R201-D216 PolarHBondContact NE-OD2 3.37Å; R201-D216 IonicContact NH2-OD2 2.84Å; R201-D216 PolarHBondContact NH2-OD2 2.73Å; L202-D216 HydrophobicContact CD2-CB 3.96Å; D216-R218 PolarHBondContact O-N 2.75Å; D216-R218 WeakPolarHBondContact OD1-CB 3.42Å; D216-R218 PolarHBondContact OD1-N 2.89Å; D216-R218 IonicContact OD1-NE 2.75Å; D216-K219 HydrophobicContact CB-CB 4.4Å; D216-K219 CarbonylContact O-C 3.55Å; D216-K219 VanDerWaalsContact O-C 3.27Å; D216-K219 PolarHBondContact O-N 3.45Å; D216-L220 WeakPolarHBondContact O-CD2 3.15Å; D216-L220 WeakPolarHBondContact O-CG 3.38Å; D216-L220 PolarHBondContact O-N 2.98Å; D216-V224 HydrophobicContact CB-CG2 3.83Å
217	L	95.9	Very high	96.2	Very high	37 Å²	37	42 Å²	42	19%	0.194	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-27	175.6	-78.3	177.4	0	0	0	112.7	V160 L172 F197 R201 F203 L220	V160-L217 HydrophobicContact CG1-CD2 4.36Å; V160-L217 HydrophobicContact CG2-CD1 4.41Å; V160-L217 HydrophobicContact CG2-CD2 4.41Å; L172-L217 HydrophobicContact CD2-CD2 3.75Å; F197-L217 HydrophobicContact CE1-CD1 3.76Å; F197-L217 HydrophobicContact CE1-CG 4.21Å; F197-L217 HydrophobicContact CZ-CD1 4.38Å; R201-L217 PolarHBondContact O-N 3.15Å; F203-L217 HydrophobicContact CD1-CD2 4.3Å; F203-L217 HydrophobicContact CD1-CG 4.22Å; F203-L217 HydrophobicContact CE1-CD2 3.77Å; F203-L217 HydrophobicContact CE1-CG 4.06Å; L217-L220 HydrophobicContact CD2-CD1 4.26Å
218	R	94.1	Very high	96	Very high	188 Å²	188	47.7 Å²	47.7	71%	0.709	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-10	177.6	-56.1	-174.2	-66.3	145.4	-9.4	113.9	R201 D216	R201-R218 VanDerWaalsContact CZ-NH2 3.28Å; D216-R218 PolarHBondContact O-N 2.75Å; D216-R218 WeakPolarHBondContact OD1-CB 3.42Å; D216-R218 PolarHBondContact OD1-N 2.89Å; D216-R218 IonicContact OD1-NE 2.75Å
219	K	94	Very high	95.9	Very high	113 Å²	113	48.4 Å²	48.4	49%	0.491	25%	0.251	S	S	.	.			trans	-146.1	51.2	-177.1	-156.8	-141.2	174.6	-160.2	0	112.8	D216 N221 S222	D216-K219 HydrophobicContact CB-CB 4.4Å; D216-K219 CarbonylContact O-C 3.55Å; D216-K219 VanDerWaalsContact O-C 3.27Å; D216-K219 PolarHBondContact O-N 3.45Å; K219-N221 VanDerWaalsContact CE-OD1 3.28Å; K219-N221 WeakPolarHBondContact CE-OD1 3.48Å; K219-N221 PolarHBondContact O-N 2.86Å; K219-S222 WeakPolarHBondContact CE-OG 3.39Å; K219-S222 PolarHBondContact NZ-OG 3.35Å
220	L	94.8	Very high	95.8	Very high	24 Å²	24	47.6 Å²	47.6	13%	0.126	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	27.2	-178.7	-65.5	172.8	0	0	0	115.5	L172 K182 L184 F203 D216 L217	L172-L220 HydrophobicContact CD2-CD1 3.44Å; L172-L220 VanDerWaalsContact CD2-CD1 3.44Å; K182-L220 HydrophobicContact CD-CB 4.23Å; K182-L220 PolarHBondContact NZ-O 3.29Å; L184-L220 HydrophobicContact CD1-CD2 4.28Å; L184-L220 HydrophobicContact CD2-CB 3.97Å; L184-L220 HydrophobicContact CD2-CD2 4.25Å; F203-L220 HydrophobicContact CE1-CD2 3.9Å; F203-L220 HydrophobicContact CZ-CD2 3.93Å; D216-L220 WeakPolarHBondContact O-CD2 3.15Å; D216-L220 WeakPolarHBondContact O-CG 3.38Å; D216-L220 PolarHBondContact O-N 2.98Å; L217-L220 HydrophobicContact CD2-CD1 4.26Å
221	N	90.9	Very high	95.8	Very high	125 Å²	125	49.2 Å²	49.2	67%	0.668	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	2.8	175	69.8	-7.3	0	0	0	113.5	K219	K219-N221 VanDerWaalsContact CE-OD1 3.28Å; K219-N221 WeakPolarHBondContact CE-OD1 3.48Å; K219-N221 PolarHBondContact O-N 2.86Å
222	S	93.6	Very high	95.8	Very high	39 Å²	39	50.3 Å²	50.3	27%	0.273	27%	0.272	S	S	.	.	S	Bend	trans	-157.1	144.2	174.7	60.6	0	0	0	0	109.5	K219	K219-S222 WeakPolarHBondContact CE-OG 3.39Å; K219-S222 PolarHBondContact NZ-OG 3.35Å
223	K	95.2	Very high	95.8	Very high	67 Å²	67	55.7 Å²	55.7	29%	0.291	29%	0.293	S	S	.	.			trans	-54.2	141	161.1	-61.7	178.6	166.5	89.6	0	109.3	E186 A187 A213 W215 S226	E186-K223 PolarHBondContact O-NZ 2.8Å; A187-K223 WeakPolarHBondContact O-CE 3.19Å; A187-K223 PolarHBondContact O-NZ 2.92Å; A213-K223 HydrophobicContact CB-CD 3.76Å; A213-K223 HydrophobicContact CB-CG 4.07Å; W215-K223 HydrophobicContact CH2-CG 3.61Å; W215-K223 HydrophobicContact CZ2-CD 4.44Å; W215-K223 HydrophobicContact CZ2-CG 3.68Å; W215-K223 HydrophobicContact CZ3-CG 4.05Å; K223-S226 WeakPolarHBondContact CD-OG 3.4Å
224	V	94.3	Very high	95.8	Very high	72 Å²	72	55.7 Å²	55.7	44%	0.436	29%	0.293	S	S	.	.	S	Bend	trans	-74.3	-39.9	171.7	177.8	0	0	0	0	109.7	L214 D216	L214-V224 HydrophobicContact CB-CB 4.1Å; L214-V224 WeakPolarHBondContact O-CB 3.45Å; L214-V224 PolarHBondContact O-N 3.17Å; D216-V224 HydrophobicContact CB-CG2 3.83Å
225	C	93.5	Very high	95.8	Very high	26 Å²	26	56.1 Å²	56.1	18%	0.176	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	155.1	172.6	-169.7	0	0	0	0	109.3	L214 L227 F263	L214-C225 HydrophobicContact CD1-CB 4.35Å; L214-C225 PolarHBondContact N-O 3.02Å; C225-L227 HydrophobicContact CB-CD2 4.47Å; C225-F263 HydrophobicContact CB-CE1 3.84Å; C225-F263 HydrophobicContact CB-CZ 4.48Å
226	S	95.3	Very high	95.8	Very high	44 Å²	44	55.6 Å²	55.6	31%	0.308	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.9	165	-60.8	0	0	0	0	109.1	K223 H228	K223-S226 WeakPolarHBondContact CD-OG 3.4Å; S226-H228 PolarHBondContact O-ND1 3.35Å
227	L	96.9	Very high	95.9	Very high	4 Å²	4	55 Å²	55	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	130.5	-179.2	-44.7	-178.5	0	0	0	109.2	T211 I212 L214 C225 L246 W258 T260 C268	T211-L227 WeakPolarHBondContact CA-O 3.43Å; I212-L227 HydrophobicContact CB-CB 4.16Å; I212-L227 HydrophobicContact CB-CD1 4.22Å; I212-L227 HydrophobicContact CB-CG 4.39Å; I212-L227 HydrophobicContact CD1-CB 4.46Å; I212-L227 HydrophobicContact CG2-CD1 4.24Å; I212-L227 PolarHBondContact N-O 2.89Å; I212-L227 VanDerWaalsContact N-O 3.08Å; I212-L227 WeakPolarHBondContact O-CG 3.48Å; I212-L227 PolarHBondContact O-N 2.85Å; L214-L227 HydrophobicContact CD1-CD2 4.48Å; L214-L227 HydrophobicContact CG-CD1 4.5Å; C225-L227 HydrophobicContact CB-CD2 4.47Å; L227-L246 HydrophobicContact CD1-CD2 3.91Å; L227-W258 HydrophobicContact CB-CD2 4.27Å; L227-W258 HydrophobicContact CB-CE3 3.78Å; L227-W258 HydrophobicContact CB-CH2 4.08Å; L227-W258 HydrophobicContact CB-CZ2 4.48Å; L227-W258 HydrophobicContact CB-CZ3 3.71Å; L227-W258 HydrophobicContact CD1-CB 4.33Å; L227-W258 HydrophobicContact CD1-CD2 3.92Å; L227-W258 HydrophobicContact CD1-CE3 4.07Å; L227-W258 HydrophobicContact CD1-CG 4.03Å; L227-W258 HydrophobicContact CD2-CE3 4.49Å; L227-W258 HydrophobicContact CG-CE3 4.34Å; L227-T260 HydrophobicContact CD1-CG2 4.27Å; L227-C268 HydrophobicContact CD2-CB 3.82Å; L227-C268 WeakPolarHBondContact CD2-SG 3.17Å
228	H	96.2	Very high	96	Very high	120 Å²	120	53.5 Å²	53.5	56%	0.556	28%	0.281	S	S	*	.			trans	-126.6	139.2	-177.2	-52.8	86.3	0	0	0	109.1	S226 W258	S226-H228 PolarHBondContact O-ND1 3.35Å; H228-W258 WeakPolarHBondContact O-CH2 3.34Å; H228-W258 WeakPolarHBondContact O-CZ3 3.46Å
229	G	94.8	Very high	96.1	Very high	29 Å²	29	46.1 Å²	46.1	30%	0.299	25%	0.253	S	S	.	.			trans	155.6	-13.2	-179.5	0	0	0	0	0	116.4	I256	G229-I256 WeakPolarHBondContact O-CD1 3.37Å
230	H	97.9	Very high	96.2	Very high	12 Å²	12	41 Å²	41	6%	0.056	23%	0.232	C	C	.	.			trans	-74.9	154.2	158.9	-78.6	-79.6	0	0	0	110.1	V234 T248 D252 N254	H230-V234 HydrophobicContact CB-CG2 3.74Å; H230-T248 PolarHBondContact NE2-OG1 2.57Å; H230-D252 WeakPolarHBondContact CA-OD2 3.17Å; H230-D252 IonicContact CE1-OD1 3.17Å; H230-D252 IonicContact CG-OD2 2.82Å; H230-D252 IonicContact ND1-OD1 2.71Å; H230-D252 PolarHBondContact ND1-OD1 2.84Å; H230-D252 IonicContact ND1-OD2 2.69Å; H230-D252 PolarHBondContact ND1-OD2 3.47Å; H230-N254 PolarHBondContact CE1-O 2.84Å
231	A	97.8	Very high	96	Very high	81 Å²	81	44.3 Å²	44.3	67%	0.669	25%	0.252	S	S	*	.	S	Bend	trans	-108.4	10.4	177.7	0	0	0	0	0	113.2	D252	A231-D252 HydrophobicContact CB-CB 4.19Å; A231-D252 PolarHBondContact N-OD2 2.84Å
232	S	98.1	Very high	96	Very high	39 Å²	39	43.8 Å²	43.8	27%	0.273	25%	0.25	S	C	.	.	S	Bend	trans	-166.2	179.9	180	-166.5	0	0	0	0	109.4	V234	S232-V234 PolarHBondContact O-N 2.81Å
233	W	98.1	Very high	95.9	Very high	114 Å²	114	44.6 Å²	44.6	43%	0.432	25%	0.253	S	S	.	.			trans	-43.8	123.3	-177.7	-65.5	-4.8	0	0	0	114.4	D208 K235 G250 F251	D208-W233 HydrophobicContact CB-CB 4.43Å; D208-W233 VanDerWaalsContact CB-CD1 3.45Å; D208-W233 HydrophobicContact CB-CD2 4.12Å; D208-W233 HydrophobicContact CB-CG 3.79Å; D208-W233 WeakPolarHBondContact OD1-CB 3.19Å; D208-W233 VanDerWaalsContact OD1-CG 3.26Å; W233-K235 HydrophobicContact CB-CD 4.33Å; W233-G250 CarbonylContact O-C 3.56Å; W233-G250 WeakPolarHBondContact O-CA 3.43Å; W233-F251 HydrophobicContact CB-CB 4.42Å; W233-F251 HydrophobicContact CB-CD2 4.2Å; W233-F251 HydrophobicContact CB-CG 4.47Å; W233-F251 HydrophobicContact CD2-CD2 4.36Å; W233-F251 AromaticContact CE3-CD2 3.58Å; W233-F251 HydrophobicContact CE3-CD2 3.58Å; W233-F251 AromaticContact CE3-CE2 3.71Å; W233-F251 HydrophobicContact CE3-CE2 3.71Å; W233-F251 HydrophobicContact CZ3-CD2 4.37Å; W233-F251 HydrophobicContact CZ3-CE2 4.22Å; W233-F251 PolarHBondContact O-N 3.4Å
234	V	98.7	Very high	95.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.4	179.3	-169.1	0	0	0	0	109.3	N193 C206 S207 T210 I212 H230 S232	N193-V234 WeakPolarHBondContact CB-O 3.34Å; N193-V234 PolarHBondContact ND2-O 3.17Å; C206-V234 HydrophobicContact CB-CB 3.86Å; C206-V234 HydrophobicContact CB-CG1 3.66Å; C206-V234 PolarHBondContact SG-O 2.73Å; S207-V234 PolarHBondContact O-N 2.93Å; T210-V234 WeakPolarHBondContact O-CG2 2.86Å; I212-V234 HydrophobicContact CD1-CG1 4.15Å; I212-V234 HydrophobicContact CD1-CG2 4.27Å; I212-V234 HydrophobicContact CG1-CG1 4Å; H230-V234 HydrophobicContact CB-CG2 3.74Å; S232-V234 PolarHBondContact O-N 2.81Å
235	K	97.3	Very high	95.8	Very high	21 Å²	21	46.2 Å²	46.2	9%	0.091	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-13.7	-169.1	-61.8	-53.2	-159.3	-176	0	114.8	N193 D208 W233 S249 F251	N193-K235 HydrophobicContact CB-CD 4.02Å; N193-K235 WeakPolarHBondContact OD1-CD 3.48Å; N193-K235 PolarHBondContact OD1-NZ 2.81Å; D208-K235 WeakPolarHBondContact OD1-CE 3.49Å; D208-K235 IonicContact OD1-NZ 2.73Å; D208-K235 PolarHBondContact OD1-NZ 3.33Å; D208-K235 IonicContact OD2-NZ 3.2Å; D208-K235 PolarHBondContact OD2-NZ 3.34Å; W233-K235 HydrophobicContact CB-CD 4.33Å; K235-S249 PolarHBondContact N-O 2.85Å; K235-F251 HydrophobicContact CB-CE1 4.48Å; K235-F251 HydrophobicContact CD-CZ 4.43Å; K235-F251 HydrophobicContact CG-CD1 3.88Å; K235-F251 HydrophobicContact CG-CD2 4.47Å; K235-F251 HydrophobicContact CG-CE1 3.66Å; K235-F251 HydrophobicContact CG-CE2 4.27Å; K235-F251 HydrophobicContact CG-CG 4.3Å; K235-F251 HydrophobicContact CG-CZ 3.88Å
236	N	97.9	Very high	96	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	150.5	175.6	-69.2	104.3	0	0	0	114.3	T248 S249 R281	N236-T248 WeakPolarHBondContact O-CA 3.31Å; N236-S249 PolarHBondContact N-O 2.85Å; N236-S249 VanDerWaalsContact N-O 3.16Å; N236-S249 PolarHBondContact O-N 2.81Å; N236-S249 VanDerWaalsContact O-N 3.09Å; N236-R281 WeakPolarHBondContact ND2-CD 3.2Å; N236-R281 WeakPolarHBondContact OD1-CA 3.39Å; N236-R281 WeakPolarHBondContact OD1-CD 3.39Å
237	I	98.6	Very high	96.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	135.1	166.8	-52.1	159.7	0	0	0	109.2	N194 R196 A204 C206 I212 L246 V247 T248	N194-I237 PolarHBondContact OD1-N 2.91Å; R196-I237 HydrophobicContact CB-CB 3.87Å; R196-I237 HydrophobicContact CB-CG2 3.68Å; R196-I237 WeakPolarHBondContact CD-O 3.37Å; R196-I237 HydrophobicContact CG-CG2 4.33Å; A204-I237 HydrophobicContact CB-CD1 3.86Å; A204-I237 HydrophobicContact CB-CG2 4.13Å; A204-I237 WeakPolarHBondContact O-CD1 3.42Å; C206-I237 HydrophobicContact CB-CD1 3.8Å; C206-I237 HydrophobicContact CB-CG1 3.91Å; I212-I237 HydrophobicContact CG2-CD1 4.26Å; I237-L246 HydrophobicContact CG2-CD1 3.54Å; I237-L246 HydrophobicContact CG2-CD2 4.28Å; I237-L246 HydrophobicContact CG2-CG 3.9Å; I237-V247 CarbonylContact C-O 3.27Å; I237-V247 WeakPolarHBondContact CA-O 3.4Å; I237-T248 HydrophobicContact CG1-CG2 4.38Å; I237-T248 HydrophobicContact CG2-CG2 4.5Å
238	E	98.3	Very high	96.2	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.028	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	165.4	163.3	-72.3	-65.1	172.2	0	0	109.9	R196 V247 M282 R283 L284	R196-E238 IonicContact CZ-OE2 3.92Å; R196-E238 IonicContact NE-OE1 3.7Å; R196-E238 IonicContact NE-OE2 3.31Å; R196-E238 PolarHBondContact NE-OE2 3.33Å; R196-E238 IonicContact NH2-OE1 2.83Å; R196-E238 IonicContact NH2-OE2 3.86Å; R196-E238 PolarHBondContact NH2-OE2 2.71Å; E238-V247 HydrophobicContact CB-CB 4.5Å; E238-V247 PolarHBondContact N-O 3.33Å; E238-V247 PolarHBondContact O-N 2.96Å; E238-M282 HydrophobicContact CB-CE 3.97Å; E238-M282 HydrophobicContact CB-SD 4.29Å; E238-M282 HydrophobicContact CG-CE 3.97Å; E238-M282 HydrophobicContact CG-SD 4.01Å; E238-R283 WeakPolarHBondContact OE1-CD 3.4Å; E238-R283 IonicContact OE1-CZ 2.9Å; E238-R283 IonicContact OE1-NE 3.21Å; E238-R283 IonicContact OE1-NH1 2.71Å; E238-R283 PolarHBondContact OE1-NH1 3.4Å; E238-L284 HydrophobicContact CB-CD1 3.97Å; E238-L284 HydrophobicContact CB-CG 3.89Å; E238-L284 HydrophobicContact CG-CG 4.32Å
239	Y	97.1	Very high	96.3	Very high	33 Å²	33	37 Å²	37	13%	0.129	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	120	178.8	-179.1	-119	0	0	0	110	L198 T241 R244 L245 L246	L198-Y239 HydrophobicContact CB-CD1 4.16Å; L198-Y239 HydrophobicContact CB-CD2 4.42Å; L198-Y239 HydrophobicContact CB-CE1 4Å; L198-Y239 HydrophobicContact CB-CE2 4.29Å; L198-Y239 HydrophobicContact CB-CG 4.36Å; L198-Y239 HydrophobicContact CD2-CD2 4.19Å; L198-Y239 HydrophobicContact CD2-CE2 3.96Å; L198-Y239 HydrophobicContact CG-CD1 4.37Å; L198-Y239 HydrophobicContact CG-CD2 3.86Å; L198-Y239 HydrophobicContact CG-CE1 4.47Å; L198-Y239 HydrophobicContact CG-CE2 3.99Å; L198-Y239 HydrophobicContact CG-CG 4.06Å; L198-Y239 WeakPolarHBondContact O-CE1 3.42Å; Y239-T241 HydrophobicContact CD1-CG2 4.01Å; Y239-T241 HydrophobicContact CE1-CG2 4.27Å; Y239-T241 PolarHBondContact O-N 3.27Å; Y239-R244 HydrophobicContact CE2-CB 4.44Å; Y239-L245 WeakPolarHBondContact CD2-O 3.43Å; Y239-L246 HydrophobicContact CD2-CD1 4.24Å
240	D	95.6	Very high	96.4	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.032	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	108	174.8	175.7	-3.8	0	0	0	109.1	N242 T243 R244 L245 L284 C288 L308	D240-N242 VanDerWaalsContact C-N 3.27Å; D240-N242 PolarHBondContact O-N 3.28Å; D240-N242 WeakPolarHBondContact OD1-CA 3.5Å; D240-N242 VanDerWaalsContact OD1-CB 3.3Å; D240-N242 WeakPolarHBondContact OD1-CB 3.3Å; D240-N242 PolarHBondContact OD1-N 2.73Å; D240-T243 WeakPolarHBondContact CB-OG1 3.35Å; D240-T243 PolarHBondContact OD1-N 3.13Å; D240-T243 VanDerWaalsContact OD1-N 3.16Å; D240-T243 WeakPolarHBondContact OD2-CB 3.1Å; D240-T243 WeakPolarHBondContact OD2-CG2 3.45Å; D240-T243 PolarHBondContact OD2-OG1 3.23Å; D240-R244 WeakPolarHBondContact O-CA 3.21Å; D240-R244 PolarHBondContact O-N 2.94Å; D240-L245 PolarHBondContact N-O 3Å; D240-L284 HydrophobicContact CB-CD1 4.05Å; D240-C288 WeakPolarHBondContact OD1-CB 3.25Å; D240-L308 HydrophobicContact CB-CD1 3.74Å
241	T	90.9	Very high	96.4	Very high	92 Å²	92	39 Å²	39	56%	0.564	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.4	-178.5	59.9	0	0	0	0	113.8	Y239	Y239-T241 HydrophobicContact CD1-CG2 4.01Å; Y239-T241 HydrophobicContact CE1-CG2 4.27Å; Y239-T241 PolarHBondContact O-N 3.27Å
242	N	90.1	Very high	96.3	Very high	115 Å²	115	36.4 Å²	36.4	62%	0.615	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-46.9	175.5	-61	-53.9	0	0	0	111.4	D240 D287	D240-N242 VanDerWaalsContact C-N 3.27Å; D240-N242 PolarHBondContact O-N 3.28Å; D240-N242 WeakPolarHBondContact OD1-CA 3.5Å; D240-N242 VanDerWaalsContact OD1-CB 3.3Å; D240-N242 WeakPolarHBondContact OD1-CB 3.3Å; D240-N242 PolarHBondContact OD1-N 2.73Å; N242-D287 PolarHBondContact ND2-O 2.99Å
243	T	91.3	Very high	96.2	Very high	56 Å²	56	34.7 Å²	34.7	34%	0.344	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-14.6	-178.6	65	0	0	0	0	114.1	D240 L245	D240-T243 WeakPolarHBondContact CB-OG1 3.35Å; D240-T243 PolarHBondContact OD1-N 3.13Å; D240-T243 VanDerWaalsContact OD1-N 3.16Å; D240-T243 WeakPolarHBondContact OD2-CB 3.1Å; D240-T243 WeakPolarHBondContact OD2-CG2 3.45Å; D240-T243 PolarHBondContact OD2-OG1 3.23Å; T243-L245 PolarHBondContact O-N 2.83Å; T243-L245 WeakPolarHBondContact OG1-CG 3.49Å
244	R	93.5	Very high	96.1	Very high	151 Å²	151	30 Å²	30	57%	0.57	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	29.2	-172.1	-55.7	-175.4	176.4	-164.3	-2.3	114.2	Y239 D240 N261	Y239-R244 HydrophobicContact CE2-CB 4.44Å; D240-R244 WeakPolarHBondContact O-CA 3.21Å; D240-R244 PolarHBondContact O-N 2.94Å; R244-N261 PolarHBondContact O-ND2 3.38Å
245	L	95	Very high	96	Very high	22 Å²	22	30 Å²	30	12%	0.115	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	133.6	173.7	-63.2	176.1	0	0	0	110.4	Y239 D240 T243 W258 D259 L308	Y239-L245 WeakPolarHBondContact CD2-O 3.43Å; D240-L245 PolarHBondContact N-O 3Å; T243-L245 PolarHBondContact O-N 2.83Å; T243-L245 WeakPolarHBondContact OG1-CG 3.49Å; L245-W258 WeakPolarHBondContact CA-O 3.45Å; L245-D259 HydrophobicContact CD2-CB 3.94Å; L245-L308 HydrophobicContact CB-CD1 4.49Å; L245-L308 HydrophobicContact CD1-CB 3.82Å
246	L	97.6	Very high	96	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	140.2	163.5	-161.3	73.9	0	0	0	108.3	L198 A204 I212 L214 L227 I237 Y239 T248 T257 W258 T260	L198-L246 HydrophobicContact CD1-CD1 3.97Å; L198-L246 HydrophobicContact CD2-CD1 4.3Å; L198-L246 HydrophobicContact CG-CD1 4.14Å; A204-L246 HydrophobicContact CB-CD1 4.07Å; A204-L246 HydrophobicContact CB-CD2 4Å; I212-L246 HydrophobicContact CG2-CD2 4.1Å; L214-L246 HydrophobicContact CD2-CD2 4.27Å; L227-L246 HydrophobicContact CD1-CD2 3.91Å; I237-L246 HydrophobicContact CG2-CD1 3.54Å; I237-L246 HydrophobicContact CG2-CD2 4.28Å; I237-L246 HydrophobicContact CG2-CG 3.9Å; Y239-L246 HydrophobicContact CD2-CD1 4.24Å; L246-T248 HydrophobicContact CD2-CG2 4.16Å; L246-T248 HydrophobicContact CG-CG2 4.36Å; L246-T257 CarbonylContact O-C 3.55Å; L246-T257 VanDerWaalsContact O-CA 3.31Å; L246-T257 WeakPolarHBondContact O-CA 3.21Å; L246-W258 HydrophobicContact CB-CB 4.24Å; L246-W258 PolarHBondContact N-O 3.32Å; L246-W258 PolarHBondContact O-N 2.62Å; L246-T260 HydrophobicContact CB-CG2 3.91Å; L246-T260 HydrophobicContact CD2-CG2 4.27Å
247	V	98.2	Very high	96	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.6	179.3	-166.4	0	0	0	0	108.9	I237 E238 V255 I256 T257 M282 L284 M291 L308	I237-V247 CarbonylContact C-O 3.27Å; I237-V247 WeakPolarHBondContact CA-O 3.4Å; E238-V247 HydrophobicContact CB-CB 4.5Å; E238-V247 PolarHBondContact N-O 3.33Å; E238-V247 PolarHBondContact O-N 2.96Å; V247-V255 HydrophobicContact CG1-CG1 3.57Å; V247-I256 WeakPolarHBondContact CA-O 3.45Å; V247-T257 HydrophobicContact CG1-CG2 4.34Å; V247-T257 HydrophobicContact CG2-CG2 4.31Å; V247-M282 HydrophobicContact CB-CE 4.07Å; V247-M282 HydrophobicContact CG1-CE 3.71Å; V247-M282 HydrophobicContact CG1-SD 4.32Å; V247-L284 HydrophobicContact CG2-CD1 4.15Å; V247-M291 HydrophobicContact CG1-CE 3.84Å; V247-L308 HydrophobicContact CG2-CD1 3.55Å
248	T	98.6	Very high	95.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	153.4	-176	63.5	0	0	0	0	110.4	I212 H230 N236 I237 L246 V255 I256 W258	I212-T248 HydrophobicContact CD1-CG2 3.87Å; I212-T248 HydrophobicContact CG1-CG2 3.83Å; H230-T248 PolarHBondContact NE2-OG1 2.57Å; N236-T248 WeakPolarHBondContact O-CA 3.31Å; I237-T248 HydrophobicContact CG1-CG2 4.38Å; I237-T248 HydrophobicContact CG2-CG2 4.5Å; L246-T248 HydrophobicContact CD2-CG2 4.16Å; L246-T248 HydrophobicContact CG-CG2 4.36Å; T248-V255 CarbonylContact O-C 3.43Å; T248-V255 VanDerWaalsContact O-CA 3.3Å; T248-V255 WeakPolarHBondContact O-CA 3.45Å; T248-I256 PolarHBondContact N-O 3.12Å; T248-I256 PolarHBondContact O-N 3.03Å; T248-W258 PolarHBondContact OG1-NE1 3.36Å
249	S	98.3	Very high	95.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	144	172.8	62.4	0	0	0	0	112.7	K235 N236 N254 M282	K235-S249 PolarHBondContact N-O 2.85Å; N236-S249 PolarHBondContact N-O 2.85Å; N236-S249 VanDerWaalsContact N-O 3.16Å; N236-S249 PolarHBondContact O-N 2.81Å; N236-S249 VanDerWaalsContact O-N 3.09Å; S249-N254 VanDerWaalsContact CA-O 3.31Å; S249-N254 WeakPolarHBondContact CA-O 3.31Å; S249-M282 WeakPolarHBondContact OG-CB 3.23Å
250	G	96.7	Very high	95.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	177.8	-175.6	0	0	0	0	0	114.2	W233 D252 G253 N254	W233-G250 CarbonylContact O-C 3.56Å; W233-G250 WeakPolarHBondContact O-CA 3.43Å; G250-D252 PolarHBondContact O-N 2.88Å; G250-G253 PolarHBondContact O-N 2.88Å; G250-N254 PolarHBondContact N-O 2.89Å
251	F	96.6	Very high	95	Very high	84 Å²	84	33.8 Å²	33.8	37%	0.368	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-5.3	178.6	-73	-8.2	0	0	0	113.8	W233 K235 G253 L279 M280	W233-F251 HydrophobicContact CB-CB 4.42Å; W233-F251 HydrophobicContact CB-CD2 4.2Å; W233-F251 HydrophobicContact CB-CG 4.47Å; W233-F251 HydrophobicContact CD2-CD2 4.36Å; W233-F251 AromaticContact CE3-CD2 3.58Å; W233-F251 HydrophobicContact CE3-CD2 3.58Å; W233-F251 AromaticContact CE3-CE2 3.71Å; W233-F251 HydrophobicContact CE3-CE2 3.71Å; W233-F251 HydrophobicContact CZ3-CD2 4.37Å; W233-F251 HydrophobicContact CZ3-CE2 4.22Å; W233-F251 PolarHBondContact O-N 3.4Å; K235-F251 HydrophobicContact CB-CE1 4.48Å; K235-F251 HydrophobicContact CD-CZ 4.43Å; K235-F251 HydrophobicContact CG-CD1 3.88Å; K235-F251 HydrophobicContact CG-CD2 4.47Å; K235-F251 HydrophobicContact CG-CE1 3.66Å; K235-F251 HydrophobicContact CG-CE2 4.27Å; K235-F251 HydrophobicContact CG-CG 4.3Å; K235-F251 HydrophobicContact CG-CZ 3.88Å; F251-G253 PolarHBondContact O-N 3.09Å; F251-L279 WeakPolarHBondContact CD1-O 3.31Å; F251-M280 HydrophobicContact CE1-SD 4.25Å; F251-M280 HydrophobicContact CZ-SD 4.44Å
252	D	96.4	Very high	94.6	Very high	25 Å²	25	37.3 Å²	37.3	13%	0.134	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	2.1	162.6	72.1	-13.8	0	0	0	113.1	H230 A231 G250 N254 H275	H230-D252 WeakPolarHBondContact CA-OD2 3.17Å; H230-D252 IonicContact CE1-OD1 3.17Å; H230-D252 IonicContact CG-OD2 2.82Å; H230-D252 IonicContact ND1-OD1 2.71Å; H230-D252 PolarHBondContact ND1-OD1 2.84Å; H230-D252 IonicContact ND1-OD2 2.69Å; H230-D252 PolarHBondContact ND1-OD2 3.47Å; A231-D252 HydrophobicContact CB-CB 4.19Å; A231-D252 PolarHBondContact N-OD2 2.84Å; G250-D252 PolarHBondContact O-N 2.88Å; D252-N254 PolarHBondContact O-N 2.82Å; D252-N254 PolarHBondContact O-ND2 3.41Å; D252-N254 WeakPolarHBondContact OD1-CB 3.3Å; D252-N254 PolarHBondContact OD1-N 2.91Å; D252-N254 VanDerWaalsContact OD1-N 3.12Å; D252-N254 PolarHBondContact OD2-ND2 2.75Å; D252-H275 PolarHBondContact O-CE1 3.33Å
253	G	95.4	Very high	94.1	Very high	3 Å²	3	37.4 Å²	37.4	3%	0.031	17%	0.17	C	C	.	.	S	Bend	trans	73	1.1	178.3	0	0	0	0	0	114.1	G250 F251 H275 T276	G250-G253 PolarHBondContact O-N 2.88Å; F251-G253 PolarHBondContact O-N 3.09Å; G253-H275 CarbonylContact O-C 3.49Å; G253-H275 VanDerWaalsContact O-CA 3.31Å; G253-H275 WeakPolarHBondContact O-CA 3.37Å; G253-H275 PolarHBondContact O-ND1 3.22Å; G253-T276 CarbonylContact C-O 3.52Å; G253-T276 WeakPolarHBondContact CA-O 3.42Å; G253-T276 PolarHBondContact O-N 3.13Å; G253-T276 VanDerWaalsContact O-O 3.13Å
254	N	96.2	Very high	93.6	Very high	16 Å²	16	38.3 Å²	38.3	9%	0.086	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	145.5	-176.2	-61.2	-48.3	0	0	0	110.7	H230 S249 G250 D252 I256 K272 H275	H230-N254 PolarHBondContact CE1-O 2.84Å; S249-N254 VanDerWaalsContact CA-O 3.31Å; S249-N254 WeakPolarHBondContact CA-O 3.31Å; G250-N254 PolarHBondContact N-O 2.89Å; D252-N254 PolarHBondContact O-N 2.82Å; D252-N254 PolarHBondContact O-ND2 3.41Å; D252-N254 WeakPolarHBondContact OD1-CB 3.3Å; D252-N254 PolarHBondContact OD1-N 2.91Å; D252-N254 VanDerWaalsContact OD1-N 3.12Å; D252-N254 PolarHBondContact OD2-ND2 2.75Å; N254-I256 HydrophobicContact CB-CD1 4.46Å; N254-I256 HydrophobicContact CB-CG1 4.14Å; N254-K272 HydrophobicContact CB-CD 4.43Å; N254-K272 PolarHBondContact ND2-NZ 2.89Å; N254-H275 PolarHBondContact OD1-ND1 3.2Å
255	V	97.4	Very high	92.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122	159.2	-175.1	0	0	0	0	107	V247 T248 F273 F274 L279 M291 I293	V247-V255 HydrophobicContact CG1-CG1 3.57Å; T248-V255 CarbonylContact O-C 3.43Å; T248-V255 VanDerWaalsContact O-CA 3.3Å; T248-V255 WeakPolarHBondContact O-CA 3.45Å; V255-F273 HydrophobicContact CG1-CD1 4.28Å; V255-F273 PolarHBondContact O-N 2.88Å; V255-F274 HydrophobicContact CB-CB 4.18Å; V255-F274 HydrophobicContact CG2-CB 4.31Å; V255-F274 HydrophobicContact CG2-CD1 4.28Å; V255-F274 PolarHBondContact N-O 3.44Å; V255-F274 PolarHBondContact O-N 2.84Å; V255-L279 HydrophobicContact CG2-CD1 3.91Å; V255-M291 HydrophobicContact CG1-CE 3.99Å; V255-M291 HydrophobicContact CG1-SD 4.06Å; V255-M291 HydrophobicContact CG2-SD 4.5Å; V255-I293 HydrophobicContact CG2-CD1 3.9Å
256	I	97.1	Very high	91.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.5	-176.4	-54.4	-173.4	0	0	0	109.2	G229 V247 T248 N254 W258 H270 K271 K272	G229-I256 WeakPolarHBondContact O-CD1 3.37Å; V247-I256 WeakPolarHBondContact CA-O 3.45Å; T248-I256 PolarHBondContact N-O 3.12Å; T248-I256 PolarHBondContact O-N 3.03Å; N254-I256 HydrophobicContact CB-CD1 4.46Å; N254-I256 HydrophobicContact CB-CG1 4.14Å; I256-W258 HydrophobicContact CB-CZ2 4Å; I256-W258 HydrophobicContact CD1-CZ2 4.27Å; I256-W258 HydrophobicContact CG2-CD2 4.09Å; I256-W258 VanDerWaalsContact CG2-CE2 3.48Å; I256-W258 HydrophobicContact CG2-CH2 4.12Å; I256-W258 HydrophobicContact CG2-CZ2 3.51Å; I256-H270 HydrophobicContact CG2-CB 4.16Å; I256-K271 WeakPolarHBondContact CA-O 3.34Å; I256-K271 WeakPolarHBondContact CG2-O 3.43Å; I256-K272 HydrophobicContact CD1-CG 4.38Å; I256-K272 HydrophobicContact CG1-CG 4.25Å
257	T	97	Very high	91.3	Very high	4 Å²	4	48.5 Å²	48.5	3%	0.025	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135	173.9	55.7	0	0	0	0	110	L246 V247 H270 K271 F273 L308	L246-T257 CarbonylContact O-C 3.55Å; L246-T257 VanDerWaalsContact O-CA 3.31Å; L246-T257 WeakPolarHBondContact O-CA 3.21Å; V247-T257 HydrophobicContact CG1-CG2 4.34Å; V247-T257 HydrophobicContact CG2-CG2 4.31Å; T257-H270 WeakPolarHBondContact O-CA 3.02Å; T257-H270 WeakPolarHBondContact O-CB 3.47Å; T257-K271 PolarHBondContact N-O 2.8Å; T257-K271 PolarHBondContact O-N 3.29Å; T257-K271 VanDerWaalsContact O-N 3.09Å; T257-K271 VanDerWaalsContact OG1-CE 3.23Å; T257-K271 WeakPolarHBondContact OG1-CE 3.47Å; T257-K271 VanDerWaalsContact OG1-CG 3.28Å; T257-K271 WeakPolarHBondContact OG1-CG 3.22Å; T257-F273 HydrophobicContact CG2-CB 3.69Å; T257-F273 HydrophobicContact CG2-CG 4.08Å; T257-L308 HydrophobicContact CG2-CB 4.21Å; T257-L308 HydrophobicContact CG2-CD1 4.34Å; T257-L308 HydrophobicContact CG2-CD2 3.99Å; T257-L308 HydrophobicContact CG2-CG 4.42Å
258	W	96.2	Very high	90.8	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.008	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.7	-176.5	-41.2	76	0	0	0	110.6	I212 L227 H228 L245 L246 T248 I256 T260 H270	I212-W258 HydrophobicContact CD1-CH2 4.44Å; I212-W258 HydrophobicContact CD1-CZ2 3.73Å; L227-W258 HydrophobicContact CB-CD2 4.27Å; L227-W258 HydrophobicContact CB-CE3 3.78Å; L227-W258 HydrophobicContact CB-CH2 4.08Å; L227-W258 HydrophobicContact CB-CZ2 4.48Å; L227-W258 HydrophobicContact CB-CZ3 3.71Å; L227-W258 HydrophobicContact CD1-CB 4.33Å; L227-W258 HydrophobicContact CD1-CD2 3.92Å; L227-W258 HydrophobicContact CD1-CE3 4.07Å; L227-W258 HydrophobicContact CD1-CG 4.03Å; L227-W258 HydrophobicContact CD2-CE3 4.49Å; L227-W258 HydrophobicContact CG-CE3 4.34Å; H228-W258 WeakPolarHBondContact O-CH2 3.34Å; H228-W258 WeakPolarHBondContact O-CZ3 3.46Å; L245-W258 WeakPolarHBondContact CA-O 3.45Å; L246-W258 HydrophobicContact CB-CB 4.24Å; L246-W258 PolarHBondContact N-O 3.32Å; L246-W258 PolarHBondContact O-N 2.62Å; T248-W258 PolarHBondContact OG1-NE1 3.36Å; I256-W258 HydrophobicContact CB-CZ2 4Å; I256-W258 HydrophobicContact CD1-CZ2 4.27Å; I256-W258 HydrophobicContact CG2-CD2 4.09Å; I256-W258 VanDerWaalsContact CG2-CE2 3.48Å; I256-W258 HydrophobicContact CG2-CH2 4.12Å; I256-W258 HydrophobicContact CG2-CZ2 3.51Å; W258-T260 HydrophobicContact CB-CG2 4.19Å; W258-T260 PolarHBondContact O-N 3.31Å; W258-H270 HydrophobicContact CB-CB 4.39Å; W258-H270 HydrophobicContact CD2-CB 3.71Å; W258-H270 HydrophobicContact CE3-CB 3.25Å; W258-H270 AromaticContact CE3-CG 3.54Å; W258-H270 AromaticContact CE3-ND1 3.89Å; W258-H270 HydrophobicContact CG-CB 4.21Å; W258-H270 HydrophobicContact CZ3-CB 3.7Å; W258-H270 AromaticContact CZ3-CD2 3.78Å; W258-H270 AromaticContact CZ3-CG 3.41Å; W258-H270 VanDerWaalsContact CZ3-CG 3.41Å; W258-H270 AromaticContact CZ3-ND1 3.6Å
259	D	93.8	Very high	90.5	Very high	36 Å²	36	51.2 Å²	51.2	19%	0.193	26%	0.259	C	S	.	.			trans	-89.1	89.3	167.8	-173.5	-13	0	0	0	109.5	L245 N261 R262 P269	L245-D259 HydrophobicContact CD2-CB 3.94Å; D259-N261 PolarHBondContact O-N 3.25Å; D259-N261 WeakPolarHBondContact OD1-CB 3.35Å; D259-N261 PolarHBondContact OD1-N 2.82Å; D259-R262 PolarHBondContact O-N 2.88Å; D259-R262 PolarHBondContact OD1-N 3.28Å; D259-R262 WeakPolarHBondContact OD2-CD 3.42Å; D259-R262 VanDerWaalsContact OD2-CG 3.3Å; D259-R262 WeakPolarHBondContact OD2-CG 3.34Å; D259-P269 PolarHBondContact N-O 2.93Å
260	T	90.9	Very high	90.3	Very high	14 Å²	14	55.5 Å²	55.5	9%	0.086	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	2.6	-179.9	62.4	0	0	0	0	113.4	L214 L227 L246 W258	L214-T260 HydrophobicContact CD1-CG2 3.78Å; L214-T260 HydrophobicContact CD2-CG2 4.42Å; L227-T260 HydrophobicContact CD1-CG2 4.27Å; L246-T260 HydrophobicContact CB-CG2 3.91Å; L246-T260 HydrophobicContact CD2-CG2 4.27Å; W258-T260 HydrophobicContact CB-CG2 4.19Å; W258-T260 PolarHBondContact O-N 3.31Å
261	N	86.9	Confident	90	Very high	90 Å²	90	58.5 Å²	58.5	48%	0.481	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-8.6	175.6	-60.4	-91	0	0	0	111.8	R244 D259	R244-N261 PolarHBondContact O-ND2 3.38Å; D259-N261 PolarHBondContact O-N 3.25Å; D259-N261 WeakPolarHBondContact OD1-CB 3.35Å; D259-N261 PolarHBondContact OD1-N 2.82Å
262	R	83.9	Confident	89.9	Confident	166 Å²	166	59.7 Å²	59.7	63%	0.626	30%	0.297	S	S	*	.			trans	-124.3	123.4	-179.5	-60.2	-178.1	79.3	-172.5	-0.4	109.4	D259 P269	D259-R262 PolarHBondContact O-N 2.88Å; D259-R262 PolarHBondContact OD1-N 3.28Å; D259-R262 WeakPolarHBondContact OD2-CD 3.42Å; D259-R262 VanDerWaalsContact OD2-CG 3.3Å; D259-R262 WeakPolarHBondContact OD2-CG 3.34Å; R262-P269 HydrophobicContact CB-CG 4.36Å; R262-P269 WeakPolarHBondContact O-CD 3.22Å
263	F	78.5	Confident	89.7	Confident	117 Å²	117	58.5 Å²	58.5	51%	0.513	29%	0.29	S	S	.	.			trans	-108.5	130	172.6	-64.7	-87.4	0	0	0	108.6	C225 C268	C225-F263 HydrophobicContact CB-CE1 3.84Å; C225-F263 HydrophobicContact CB-CZ 4.48Å; F263-C268 WeakPolarHBondContact CE1-SG 3.31Å
264	T	81.8	Confident	89.6	Confident	74 Å²	74	58.5 Å²	58.5	45%	0.454	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-116.3	173.5	173.9	48.7	0	0	0	0	109.8	D266 G267 P269	T264-D266 PolarHBondContact O-N 3.17Å; T264-G267 PolarHBondContact N-O 2.83Å; T264-G267 PolarHBondContact O-N 3Å; T264-G267 PolarHBondContact OG1-O 3.29Å; T264-P269 HydrophobicContact CG2-CG 4.09Å
265	E	76.8	Confident	89.5	Confident	203 Å²	203	60.6 Å²	60.6	95%	0.949	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-34.3	177.7	-62.5	-179.2	173.3	0	0	111.5	G267	E265-G267 PolarHBondContact O-N 2.9Å
266	D	76.1	Confident	89.2	Confident	159 Å²	159	61.8 Å²	61.8	85%	0.85	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	12.4	173.6	-50.1	-67.2	0	0	0	114.5	T264	T264-D266 PolarHBondContact O-N 3.17Å
267	G	83.8	Confident	89	Confident	26 Å²	26	70.2 Å²	70.2	27%	0.268	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	90.2	-144.2	-176.8	0	0	0	0	0	113.8	T264 E265	T264-G267 PolarHBondContact N-O 2.83Å; T264-G267 PolarHBondContact O-N 3Å; T264-G267 PolarHBondContact OG1-O 3.29Å; E265-G267 PolarHBondContact O-N 2.9Å
268	C	88.8	Confident	88.8	Confident	8 Å²	8	76.7 Å²	76.7	5%	0.054	36%	0.363	C	S	.	.	S	Bend	trans	-81.9	128	178.7	-62.5	0	0	0	0	111.3	L227 F263 H270	L227-C268 HydrophobicContact CD2-CB 3.82Å; L227-C268 WeakPolarHBondContact CD2-SG 3.17Å; F263-C268 WeakPolarHBondContact CE1-SG 3.31Å; C268-H270 PolarHBondContact O-N 3.48Å; C268-H270 PolarHBondContact O-ND1 3.23Å; C268-H270 VanDerWaalsContact O-ND1 3.09Å
269	P	91.9	Very high	88.8	Confident	48 Å²	48	76.8 Å²	76.8	31%	0.312	36%	0.364	S	S	.	.			trans	-57.8	126.9	172.9	-24.9	35.3	0	0	0	111.6	D259 R262 T264	D259-P269 PolarHBondContact N-O 2.93Å; R262-P269 HydrophobicContact CB-CG 4.36Å; R262-P269 WeakPolarHBondContact O-CD 3.22Å; T264-P269 HydrophobicContact CG2-CG 4.09Å
270	H	93.4	Very high	88.9	Confident	90 Å²	90	76 Å²	76	42%	0.417	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	164.7	-177.5	67.7	-86.7	0	0	0	111.8	I256 T257 W258 C268	I256-H270 HydrophobicContact CG2-CB 4.16Å; T257-H270 WeakPolarHBondContact O-CA 3.02Å; T257-H270 WeakPolarHBondContact O-CB 3.47Å; W258-H270 HydrophobicContact CB-CB 4.39Å; W258-H270 HydrophobicContact CD2-CB 3.71Å; W258-H270 HydrophobicContact CE3-CB 3.25Å; W258-H270 AromaticContact CE3-CG 3.54Å; W258-H270 AromaticContact CE3-ND1 3.89Å; W258-H270 HydrophobicContact CG-CB 4.21Å; W258-H270 HydrophobicContact CZ3-CB 3.7Å; W258-H270 AromaticContact CZ3-CD2 3.78Å; W258-H270 AromaticContact CZ3-CG 3.41Å; W258-H270 VanDerWaalsContact CZ3-CG 3.41Å; W258-H270 AromaticContact CZ3-ND1 3.6Å; C268-H270 PolarHBondContact O-N 3.48Å; C268-H270 PolarHBondContact O-ND1 3.23Å; C268-H270 VanDerWaalsContact O-ND1 3.09Å
271	K	92	Very high	89.2	Confident	64 Å²	64	76.1 Å²	76.1	28%	0.278	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	150.5	177.4	66.6	-170.3	-177	-161.7	0	111	I256 T257 F273 L308 T309	I256-K271 WeakPolarHBondContact CA-O 3.34Å; I256-K271 WeakPolarHBondContact CG2-O 3.43Å; T257-K271 PolarHBondContact N-O 2.8Å; T257-K271 PolarHBondContact O-N 3.29Å; T257-K271 VanDerWaalsContact O-N 3.09Å; T257-K271 VanDerWaalsContact OG1-CE 3.23Å; T257-K271 WeakPolarHBondContact OG1-CE 3.47Å; T257-K271 VanDerWaalsContact OG1-CG 3.28Å; T257-K271 WeakPolarHBondContact OG1-CG 3.22Å; K271-F273 PolarHBondContact O-N 3.3Å; K271-L308 VanDerWaalsContact CE-O 3.24Å; K271-L308 WeakPolarHBondContact CE-O 3.25Å; K271-L308 PolarHBondContact NZ-O 2.88Å; K271-T309 PolarHBondContact NZ-O 3.06Å
272	K	93.5	Very high	89.7	Confident	108 Å²	108	71.8 Å²	71.8	47%	0.47	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	113.4	167	-56.4	-166.4	176.3	-162.2	0	107.8	N254 I256	N254-K272 HydrophobicContact CB-CD 4.43Å; N254-K272 PolarHBondContact ND2-NZ 2.89Å; I256-K272 HydrophobicContact CD1-CG 4.38Å; I256-K272 HydrophobicContact CG1-CG 4.25Å
273	F	92.7	Very high	90.4	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-39.9	-177.2	166.2	-103.1	0	0	0	111.8	V255 T257 K271 M291 L303 L306 L308 Q310 L312	V255-F273 HydrophobicContact CG1-CD1 4.28Å; V255-F273 PolarHBondContact O-N 2.88Å; T257-F273 HydrophobicContact CG2-CB 3.69Å; T257-F273 HydrophobicContact CG2-CG 4.08Å; K271-F273 PolarHBondContact O-N 3.3Å; F273-M291 HydrophobicContact CD1-CE 3.97Å; F273-M291 HydrophobicContact CD1-SD 4.49Å; F273-M291 HydrophobicContact CE1-CE 3.74Å; F273-M291 HydrophobicContact CE1-SD 4.16Å; F273-L303 HydrophobicContact CE1-CD1 3.95Å; F273-L303 HydrophobicContact CZ-CD1 4.49Å; F273-L306 HydrophobicContact CE1-CD1 4.1Å; F273-L306 HydrophobicContact CZ-CD1 3.76Å; F273-L308 HydrophobicContact CD1-CD2 3.94Å; F273-L308 HydrophobicContact CD2-CD2 4.07Å; F273-L308 HydrophobicContact CE1-CD2 3.74Å; F273-L308 HydrophobicContact CE2-CD2 3.88Å; F273-L308 HydrophobicContact CG-CD2 4.11Å; F273-L308 HydrophobicContact CZ-CD2 3.72Å; F273-Q310 WeakPolarHBondContact CD2-O 3.48Å; F273-Q310 VanDerWaalsContact CE2-O 3.27Å; F273-Q310 WeakPolarHBondContact CE2-O 3.48Å; F273-L312 HydrophobicContact CE1-CD1 4.08Å; F273-L312 HydrophobicContact CE2-CD1 4.22Å; F273-L312 HydrophobicContact CE2-CG 4.37Å; F273-L312 HydrophobicContact CZ-CD1 3.74Å; F273-L312 HydrophobicContact CZ-CG 4.38Å; F273-L312 WeakPolarHBondContact O-CA 3.5Å; F273-L312 VanDerWaalsContact O-CB 3.27Å; F273-L312 WeakPolarHBondContact O-CB 3.39Å; F273-L312 PolarHBondContact O-N 2.88Å
274	F	93.3	Very high	91.2	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	160.9	179.8	-176.5	-107.4	0	0	0	109.9	V255 T276 I293 L301 L303 L312 Y317 L363	V255-F274 HydrophobicContact CB-CB 4.18Å; V255-F274 HydrophobicContact CG2-CB 4.31Å; V255-F274 HydrophobicContact CG2-CD1 4.28Å; V255-F274 PolarHBondContact N-O 3.44Å; V255-F274 PolarHBondContact O-N 2.84Å; F274-T276 HydrophobicContact CE1-CG2 3.97Å; F274-I293 HydrophobicContact CD1-CD1 3.56Å; F274-I293 HydrophobicContact CE1-CD1 3.71Å; F274-L301 HydrophobicContact CE1-CD2 4.03Å; F274-L301 HydrophobicContact CZ-CD2 4.03Å; F274-L303 HydrophobicContact CB-CD1 4.43Å; F274-L303 HydrophobicContact CD1-CD1 4.34Å; F274-L303 HydrophobicContact CD2-CD1 4.11Å; F274-L303 HydrophobicContact CD2-CD2 4.48Å; F274-L303 HydrophobicContact CE2-CD1 4.46Å; F274-L303 HydrophobicContact CE2-CD2 4.29Å; F274-L303 HydrophobicContact CG-CD1 4.04Å; F274-L312 HydrophobicContact CB-CD1 4.35Å; F274-L312 HydrophobicContact CD2-CB 4.23Å; F274-L312 HydrophobicContact CD2-CD1 3.71Å; F274-L312 HydrophobicContact CG-CD1 4.42Å; F274-Y317 HydrophobicContact CD2-CD1 4.5Å; F274-Y317 AromaticContact CE2-CD1 3.9Å; F274-Y317 HydrophobicContact CE2-CD1 3.9Å; F274-Y317 AromaticContact CE2-CE1 3.77Å; F274-Y317 HydrophobicContact CE2-CE1 3.77Å; F274-L363 HydrophobicContact CE2-CD2 4.37Å; F274-L363 HydrophobicContact CZ-CD1 4.28Å; F274-L363 HydrophobicContact CZ-CD2 4.12Å
275	H	92.9	Very high	91.8	Very high	59 Å²	59	56.4 Å²	56.4	27%	0.273	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	134.5	173.4	175.8	90.7	0	0	0	111.1	D252 G253 N254 V314	D252-H275 PolarHBondContact O-CE1 3.33Å; G253-H275 CarbonylContact O-C 3.49Å; G253-H275 VanDerWaalsContact O-CA 3.31Å; G253-H275 WeakPolarHBondContact O-CA 3.37Å; G253-H275 PolarHBondContact O-ND1 3.22Å; N254-H275 PolarHBondContact OD1-ND1 3.2Å; H275-V314 HydrophobicContact CB-CG2 4.06Å
276	T	92.8	Very high	92.5	Very high	26 Å²	26	50 Å²	50	16%	0.16	24%	0.242	C	C	.	.			trans	-143.6	141.8	165.6	-179.2	0	0	0	0	110.6	G253 F274 L279 I293 L301	G253-T276 CarbonylContact C-O 3.52Å; G253-T276 WeakPolarHBondContact CA-O 3.42Å; G253-T276 PolarHBondContact O-N 3.13Å; G253-T276 VanDerWaalsContact O-O 3.13Å; F274-T276 HydrophobicContact CE1-CG2 3.97Å; T276-L279 HydrophobicContact CG2-CB 4.17Å; T276-L279 HydrophobicContact CG2-CD1 4.16Å; T276-I293 HydrophobicContact CG2-CG2 4.01Å; T276-L301 HydrophobicContact CG2-CD2 4.17Å
277	R	91.2	Very high	93.1	Very high	177 Å²	177	46.5 Å²	46.5	67%	0.668	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	155.9	167.4	-63.1	-172.5	180	-166	-0.7	110.4	L279	R277-L279 VanDerWaalsContact C-N 3.26Å; R277-L279 PolarHBondContact O-N 3.07Å
278	Y	93.6	Very high	93.5	Very high	139 Å²	139	45.9 Å²	45.9	55%	0.545	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	23.8	172.3	-47.3	-67.7	0	0	0	115.3	M280 T295 S296	Y278-M280 PolarHBondContact O-N 3.34Å; Y278-T295 CarbonylContact O-C 3.47Å; Y278-T295 WeakPolarHBondContact O-CA 3.42Å; Y278-T295 VanDerWaalsContact O-CB 3.26Å; Y278-T295 WeakPolarHBondContact O-CB 3.31Å; Y278-S296 PolarHBondContact O-N 3.11Å
279	L	96	Very high	93.6	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	124.3	177.2	-172.8	151.3	0	0	0	110.9	F251 V255 T276 R277 I293	F251-L279 WeakPolarHBondContact CD1-O 3.31Å; V255-L279 HydrophobicContact CG2-CD1 3.91Å; T276-L279 HydrophobicContact CG2-CB 4.17Å; T276-L279 HydrophobicContact CG2-CD1 4.16Å; R277-L279 VanDerWaalsContact C-N 3.26Å; R277-L279 PolarHBondContact O-N 3.07Å; L279-I293 HydrophobicContact CD1-CG2 3.78Å; L279-I293 HydrophobicContact CG-CG2 3.76Å
280	M	95.6	Very high	93.6	Very high	21 Å²	21	46.9 Å²	46.9	10%	0.103	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-46.7	177.8	-76.3	-66.7	-70.7	0	0	112.4	F251 Y278 S294 I380 T381 I443	F251-M280 HydrophobicContact CE1-SD 4.25Å; F251-M280 HydrophobicContact CZ-SD 4.44Å; Y278-M280 PolarHBondContact O-N 3.34Å; M280-S294 PolarHBondContact N-O 2.81Å; M280-I380 WeakPolarHBondContact CB-O 3.47Å; M280-T381 HydrophobicContact CE-CG2 4.31Å; M280-I443 HydrophobicContact CE-CD1 3.59Å; M280-I443 HydrophobicContact CE-CG1 4.07Å
281	R	97.2	Very high	93.7	Very high	15 Å²	15	42.6 Å²	42.6	6%	0.057	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.3	178.2	-65.7	-63.7	-178.4	-116.6	17.7	112.3	N236 I293 S294 T381 L383 E445	N236-R281 WeakPolarHBondContact ND2-CD 3.2Å; N236-R281 WeakPolarHBondContact OD1-CA 3.39Å; N236-R281 WeakPolarHBondContact OD1-CD 3.39Å; R281-I293 CarbonylContact O-C 3.57Å; R281-I293 VanDerWaalsContact O-CA 3.26Å; R281-I293 WeakPolarHBondContact O-CA 3.37Å; R281-S294 WeakPolarHBondContact CB-OG 3.49Å; R281-S294 PolarHBondContact N-OG 3.37Å; R281-S294 PolarHBondContact O-N 3.05Å; R281-T381 WeakPolarHBondContact CG-O 3.38Å; R281-L383 HydrophobicContact CB-CB 3.67Å; R281-L383 HydrophobicContact CB-CD2 4.31Å; R281-L383 HydrophobicContact CG-CB 4.28Å; R281-E445 IonicContact CZ-OE1 3.72Å; R281-E445 IonicContact NE-OE1 3.63Å; R281-E445 PolarHBondContact NE-OE1 2.75Å; R281-E445 IonicContact NH2-OE1 2.74Å; R281-E445 PolarHBondContact NH2-OE1 3.48Å
282	M	97.9	Very high	93.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.7	170.8	-177.7	-82.9	-59.5	0	0	109.6	E238 V247 S249 L284 M291 L292 I293	E238-M282 HydrophobicContact CB-CE 3.97Å; E238-M282 HydrophobicContact CB-SD 4.29Å; E238-M282 HydrophobicContact CG-CE 3.97Å; E238-M282 HydrophobicContact CG-SD 4.01Å; V247-M282 HydrophobicContact CB-CE 4.07Å; V247-M282 HydrophobicContact CG1-CE 3.71Å; V247-M282 HydrophobicContact CG1-SD 4.32Å; S249-M282 WeakPolarHBondContact OG-CB 3.23Å; M282-L284 HydrophobicContact SD-CD2 4.46Å; M282-M291 HydrophobicContact CG-CG 3.81Å; M282-M291 HydrophobicContact CG-SD 3.86Å; M282-M291 HydrophobicContact SD-CE 4.22Å; M282-M291 HydrophobicContact SD-CG 3.96Å; M282-M291 HydrophobicContact SD-SD 4.18Å; M282-L292 CarbonylContact C-O 3.44Å; M282-L292 WeakPolarHBondContact CA-O 3.42Å; M282-I293 HydrophobicContact CB-CG1 4.23Å; M282-I293 HydrophobicContact CG-CG1 3.9Å
283	R	98.1	Very high	94.1	Very high	17 Å²	17	34.5 Å²	34.5	6%	0.064	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.3	177	-68.3	-61.4	-173.1	-165.3	-5.4	111	E238 M291 L292 L383 L385	E238-R283 WeakPolarHBondContact OE1-CD 3.4Å; E238-R283 IonicContact OE1-CZ 2.9Å; E238-R283 IonicContact OE1-NE 3.21Å; E238-R283 IonicContact OE1-NH1 2.71Å; E238-R283 PolarHBondContact OE1-NH1 3.4Å; R283-M291 WeakPolarHBondContact O-CA 3.38Å; R283-L292 PolarHBondContact N-O 3.19Å; R283-L292 PolarHBondContact O-N 2.77Å; R283-L383 HydrophobicContact CB-CD2 4.2Å; R283-L383 HydrophobicContact CB-CG 4.35Å; R283-L383 HydrophobicContact CG-CB 4.37Å; R283-L383 HydrophobicContact CG-CD2 4.01Å; R283-L383 HydrophobicContact CG-CG 3.81Å; R283-L383 WeakPolarHBondContact CG-O 3.5Å; R283-L383 PolarHBondContact NE-O 2.84Å; R283-L385 HydrophobicContact CB-CD1 3.64Å; R283-L385 HydrophobicContact CB-CG 4.29Å
284	L	96.6	Very high	94.3	Very high	14 Å²	14	34.5 Å²	34.5	7%	0.073	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	144.5	167.2	-63.3	-178.4	0	0	0	110.2	E238 D240 V247 M282 M291 L306 L385	E238-L284 HydrophobicContact CB-CD1 3.97Å; E238-L284 HydrophobicContact CB-CG 3.89Å; E238-L284 HydrophobicContact CG-CG 4.32Å; D240-L284 HydrophobicContact CB-CD1 4.05Å; V247-L284 HydrophobicContact CG2-CD1 4.15Å; M282-L284 HydrophobicContact SD-CD2 4.46Å; L284-M291 HydrophobicContact CD2-CB 3.89Å; L284-M291 HydrophobicContact CD2-CE 3.81Å; L284-M291 HydrophobicContact CD2-CG 4.09Å; L284-L306 HydrophobicContact CD2-CD2 3.72Å; L284-L385 VanDerWaalsContact O-CD1 3.23Å; L284-L385 WeakPolarHBondContact O-CD1 3.49Å
285	T	94	Very high	94.4	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.012	16%	0.163	C	C	.	.			trans	-65.7	154.8	167.8	50.2	0	0	0	0	111.2	D287 C288 S289 K290 L292 L385	T285-D287 WeakPolarHBondContact CB-OD1 3.4Å; T285-D287 PolarHBondContact O-N 3.26Å; T285-D287 VanDerWaalsContact O-N 3.14Å; T285-D287 PolarHBondContact OG1-OD1 2.63Å; T285-C288 VanDerWaalsContact O-CA 3.28Å; T285-C288 WeakPolarHBondContact O-CA 3.45Å; T285-C288 PolarHBondContact O-N 3.29Å; T285-S289 PolarHBondContact OG1-N 2.89Å; T285-K290 HydrophobicContact CG2-CB 3.87Å; T285-K290 HydrophobicContact CG2-CG 4.47Å; T285-K290 PolarHBondContact N-O 2.89Å; T285-K290 PolarHBondContact OG1-N 2.76Å; T285-K290 PolarHBondContact OG1-O 3.12Å; T285-L292 HydrophobicContact CG2-CD1 4.17Å; T285-L385 HydrophobicContact CG2-CD1 4.06Å; T285-L385 HydrophobicContact CG2-CD2 4.4Å
286	P	91.5	Very high	94.4	Very high	69 Å²	69	33.6 Å²	33.6	45%	0.448	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.9	-177.2	-25.7	35.8	0	0	0	115.2	P387	P286-P387 WeakPolarHBondContact CG-O 3.35Å
287	D	88.8	Confident	94.3	Very high	86 Å²	86	35 Å²	35	46%	0.46	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.4	172.3	67	-15.2	0	0	0	113.3	N242 T285 S289	N242-D287 PolarHBondContact ND2-O 2.99Å; T285-D287 WeakPolarHBondContact CB-OD1 3.4Å; T285-D287 PolarHBondContact O-N 3.26Å; T285-D287 VanDerWaalsContact O-N 3.14Å; T285-D287 PolarHBondContact OG1-OD1 2.63Å; D287-S289 PolarHBondContact O-N 3.46Å; D287-S289 PolarHBondContact OD1-N 3.36Å; D287-S289 PolarHBondContact OD1-OG 2.85Å; D287-S289 VanDerWaalsContact OD1-OG 3.1Å; D287-S289 WeakPolarHBondContact OD2-CB 3.38Å; D287-S289 PolarHBondContact OD2-OG 3Å
288	C	92.9	Very high	94.3	Very high	12 Å²	12	27 Å²	27	8%	0.081	15%	0.147	C	C	.	.	S	Bend	trans	51.8	22.9	-169.2	-48.4	0	0	0	0	114.9	D240 T285 K290	D240-C288 WeakPolarHBondContact OD1-CB 3.25Å; T285-C288 VanDerWaalsContact O-CA 3.28Å; T285-C288 WeakPolarHBondContact O-CA 3.45Å; T285-C288 PolarHBondContact O-N 3.29Å; C288-K290 VanDerWaalsContact C-N 3.35Å
289	S	89.8	Confident	94.3	Very high	35 Å²	35	25.5 Å²	25.5	25%	0.245	14%	0.141	C	C	.	.	S	Bend	trans	-78.9	-14.7	178.7	73.6	0	0	0	0	114.4	T285 D287 D305 L306	T285-S289 PolarHBondContact OG1-N 2.89Å; D287-S289 PolarHBondContact O-N 3.46Å; D287-S289 PolarHBondContact OD1-N 3.36Å; D287-S289 PolarHBondContact OD1-OG 2.85Å; D287-S289 VanDerWaalsContact OD1-OG 3.1Å; D287-S289 WeakPolarHBondContact OD2-CB 3.38Å; D287-S289 PolarHBondContact OD2-OG 3Å; S289-D305 PolarHBondContact O-N 3.17Å; S289-L306 WeakPolarHBondContact O-CB 3.33Å; S289-L306 PolarHBondContact O-N 2.77Å
290	K	91.6	Very high	94.1	Very high	43 Å²	43	25.3 Å²	25.3	19%	0.187	14%	0.14	C	C	.	.			trans	-142.5	150.9	-179	-50.3	175	-170.1	64.7	0	111.2	T285 C288 L292 L303	T285-K290 HydrophobicContact CG2-CB 3.87Å; T285-K290 HydrophobicContact CG2-CG 4.47Å; T285-K290 PolarHBondContact N-O 2.89Å; T285-K290 PolarHBondContact OG1-N 2.76Å; T285-K290 PolarHBondContact OG1-O 3.12Å; C288-K290 VanDerWaalsContact C-N 3.35Å; K290-L292 HydrophobicContact CB-CD1 4.42Å; K290-L303 WeakPolarHBondContact CA-O 3.45Å; K290-L303 WeakPolarHBondContact CB-O 3.36Å
291	M	95.4	Very high	94.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128	168.2	178.3	-172	-66.2	0	0	108.8	V247 V255 F273 M282 R283 L284 I293 L303 L306 L308	V247-M291 HydrophobicContact CG1-CE 3.84Å; V255-M291 HydrophobicContact CG1-CE 3.99Å; V255-M291 HydrophobicContact CG1-SD 4.06Å; V255-M291 HydrophobicContact CG2-SD 4.5Å; F273-M291 HydrophobicContact CD1-CE 3.97Å; F273-M291 HydrophobicContact CD1-SD 4.49Å; F273-M291 HydrophobicContact CE1-CE 3.74Å; F273-M291 HydrophobicContact CE1-SD 4.16Å; M282-M291 HydrophobicContact CG-CG 3.81Å; M282-M291 HydrophobicContact CG-SD 3.86Å; M282-M291 HydrophobicContact SD-CE 4.22Å; M282-M291 HydrophobicContact SD-CG 3.96Å; M282-M291 HydrophobicContact SD-SD 4.18Å; R283-M291 WeakPolarHBondContact O-CA 3.38Å; L284-M291 HydrophobicContact CD2-CB 3.89Å; L284-M291 HydrophobicContact CD2-CE 3.81Å; L284-M291 HydrophobicContact CD2-CG 4.09Å; M291-I293 HydrophobicContact CG-CG1 4.2Å; M291-I293 HydrophobicContact SD-CD1 3.98Å; M291-I293 HydrophobicContact SD-CG1 4.25Å; M291-L303 HydrophobicContact CB-CB 4.26Å; M291-L303 HydrophobicContact CB-CD1 4.48Å; M291-L303 PolarHBondContact N-O 3.41Å; M291-L303 PolarHBondContact O-N 2.89Å; M291-L303 HydrophobicContact SD-CD1 4.06Å; M291-L306 HydrophobicContact CB-CD1 3.95Å; M291-L306 HydrophobicContact CB-CD2 4.17Å; M291-L306 HydrophobicContact CE-CD1 4.5Å; M291-L308 HydrophobicContact CE-CD2 3.88Å
292	L	96.8	Very high	93.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	138.4	172.6	-77.5	82.5	0	0	0	109.8	M282 R283 T285 K290 L300 L301 I302 L383 L385 T392 F411	M282-L292 CarbonylContact C-O 3.44Å; M282-L292 WeakPolarHBondContact CA-O 3.42Å; R283-L292 PolarHBondContact N-O 3.19Å; R283-L292 PolarHBondContact O-N 2.77Å; T285-L292 HydrophobicContact CG2-CD1 4.17Å; K290-L292 HydrophobicContact CB-CD1 4.42Å; L292-L300 HydrophobicContact CB-CD1 4.45Å; L292-L300 HydrophobicContact CD2-CD1 4.28Å; L292-L301 CarbonylContact C-O 3.5Å; L292-L301 WeakPolarHBondContact CA-O 3.41Å; L292-I302 HydrophobicContact CD1-CG2 4.26Å; L292-I302 HydrophobicContact CD2-CG1 4.36Å; L292-I302 HydrophobicContact CG-CG1 4.14Å; L292-I302 HydrophobicContact CG-CG2 4.27Å; L292-L383 HydrophobicContact CB-CD2 3.97Å; L292-L385 HydrophobicContact CD1-CD1 4.24Å; L292-L385 HydrophobicContact CD1-CD2 4.12Å; L292-L385 HydrophobicContact CD2-CD2 4.21Å; L292-T392 HydrophobicContact CD2-CG2 4.1Å; L292-F411 HydrophobicContact CD1-CE1 4.31Å; L292-F411 HydrophobicContact CD1-CZ 3.8Å; L292-F411 HydrophobicContact CD2-CE1 4.02Å; L292-F411 HydrophobicContact CD2-CZ 3.74Å; L292-F411 HydrophobicContact CG-CZ 4.39Å
293	I	97.4	Very high	93.5	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	126.1	177.3	-59.1	169.4	0	0	0	109	V255 F274 T276 L279 R281 M282 M291 L301	V255-I293 HydrophobicContact CG2-CD1 3.9Å; F274-I293 HydrophobicContact CD1-CD1 3.56Å; F274-I293 HydrophobicContact CE1-CD1 3.71Å; T276-I293 HydrophobicContact CG2-CG2 4.01Å; L279-I293 HydrophobicContact CD1-CG2 3.78Å; L279-I293 HydrophobicContact CG-CG2 3.76Å; R281-I293 CarbonylContact O-C 3.57Å; R281-I293 VanDerWaalsContact O-CA 3.26Å; R281-I293 WeakPolarHBondContact O-CA 3.37Å; M282-I293 HydrophobicContact CB-CG1 4.23Å; M282-I293 HydrophobicContact CG-CG1 3.9Å; M291-I293 HydrophobicContact CG-CG1 4.2Å; M291-I293 HydrophobicContact SD-CD1 3.98Å; M291-I293 HydrophobicContact SD-CG1 4.25Å; I293-L301 HydrophobicContact CB-CB 4.16Å; I293-L301 PolarHBondContact N-O 3.33Å; I293-L301 PolarHBondContact O-N 3.19Å
294	S	96.8	Very high	93	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	151.5	173.3	80.6	0	0	0	0	111.7	M280 R281 I380	M280-S294 PolarHBondContact N-O 2.81Å; R281-S294 WeakPolarHBondContact CB-OG 3.49Å; R281-S294 PolarHBondContact N-OG 3.37Å; R281-S294 PolarHBondContact O-N 3.05Å; S294-I380 VanDerWaalsContact CB-CG2 3.48Å; S294-I380 PolarHBondContact OG-O 3.28Å
295	T	95.7	Very high	92.5	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.012	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	155.3	175.3	77	0	0	0	0	113.9	Y278 S297 G298 Y299 L301 I380	Y278-T295 CarbonylContact O-C 3.47Å; Y278-T295 WeakPolarHBondContact O-CA 3.42Å; Y278-T295 VanDerWaalsContact O-CB 3.26Å; Y278-T295 WeakPolarHBondContact O-CB 3.31Å; T295-S297 WeakPolarHBondContact CB-OG 3.49Å; T295-S297 PolarHBondContact O-N 2.75Å; T295-S297 PolarHBondContact OG1-N 3.33Å; T295-S297 PolarHBondContact OG1-OG 3.46Å; T295-G298 PolarHBondContact O-N 3.09Å; T295-G298 VanDerWaalsContact O-N 3.15Å; T295-G298 PolarHBondContact OG1-N 2.88Å; T295-Y299 PolarHBondContact N-O 3.41Å; T295-Y299 PolarHBondContact OG1-N 3.17Å; T295-Y299 PolarHBondContact OG1-O 3.47Å; T295-L301 HydrophobicContact CG2-CD1 3.96Å; T295-I380 PolarHBondContact O-N 3.3Å
296	S	93.3	Very high	92.3	Very high	42 Å²	42	26.8 Å²	26.8	29%	0.294	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.6	171.3	58.6	0	0	0	0	113.2	Y278 G298 C379	Y278-S296 PolarHBondContact O-N 3.11Å; S296-G298 VanDerWaalsContact C-N 3.33Å; S296-C379 VanDerWaalsContact CA-SG 3.54Å; S296-C379 WeakPolarHBondContact O-CA 3.41Å
297	S	91.1	Very high	92.2	Very high	55 Å²	55	25.1 Å²	25.1	39%	0.385	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	8.2	171	49.5	0	0	0	0	114.2	T295	T295-S297 WeakPolarHBondContact CB-OG 3.49Å; T295-S297 PolarHBondContact O-N 2.75Å; T295-S297 PolarHBondContact OG1-N 3.33Å; T295-S297 PolarHBondContact OG1-OG 3.46Å
298	G	90.9	Very high	92.2	Very high	9 Å²	9	21 Å²	21	9%	0.093	12%	0.116	C	C	.	.	S	Bend	trans	83.6	15.2	170.6	0	0	0	0	0	115.7	T295 S296 P368 N378	T295-G298 PolarHBondContact O-N 3.09Å; T295-G298 VanDerWaalsContact O-N 3.15Å; T295-G298 PolarHBondContact OG1-N 2.88Å; S296-G298 VanDerWaalsContact C-N 3.33Å; G298-P368 WeakPolarHBondContact O-CD 3.34Å; G298-N378 WeakPolarHBondContact CA-O 3.32Å; G298-N378 PolarHBondContact N-O 3.15Å; G298-N378 VanDerWaalsContact N-O 3.11Å
299	Y	92.3	Very high	91.6	Very high	108 Å²	108	24.7 Å²	24.7	42%	0.424	14%	0.138	S	C	.	.			trans	-96.8	143.9	175.4	-62.4	-79.6	0	0	0	111.3	T295 V365 L366 T367	T295-Y299 PolarHBondContact N-O 3.41Å; T295-Y299 PolarHBondContact OG1-N 3.17Å; T295-Y299 PolarHBondContact OG1-O 3.47Å; Y299-V365 HydrophobicContact CD1-CG1 4.08Å; Y299-V365 HydrophobicContact CG-CG1 4.48Å; Y299-L366 WeakPolarHBondContact CA-O 3.33Å; Y299-T367 WeakPolarHBondContact CE1-OG1 3.06Å
300	L	93.5	Very high	91	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.2	168.9	-174.2	53	0	0	0	108.3	L292 L366 P368 I380 L383 T392 L427	L292-L300 HydrophobicContact CB-CD1 4.45Å; L292-L300 HydrophobicContact CD2-CD1 4.28Å; L300-L366 PolarHBondContact N-O 2.81Å; L300-L366 PolarHBondContact O-N 3.24Å; L300-P368 HydrophobicContact CB-CG 4.3Å; L300-I380 HydrophobicContact CB-CD1 4.34Å; L300-L383 HydrophobicContact CD1-CD1 4.02Å; L300-L383 HydrophobicContact CD1-CD2 4.41Å; L300-T392 HydrophobicContact CD2-CG2 4.4Å; L300-L427 HydrophobicContact CD2-CD1 3.47Å; L300-L427 VanDerWaalsContact CD2-CD1 3.47Å; L300-L427 HydrophobicContact CG-CD1 4.38Å
301	L	93.7	Very high	89.7	Confident	11 Å²	11	29.5 Å²	29.5	6%	0.058	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	138.6	179.4	-78.9	69.2	0	0	0	108.7	F274 T276 L292 I293 T295 L363 E364 V365	F274-L301 HydrophobicContact CE1-CD2 4.03Å; F274-L301 HydrophobicContact CZ-CD2 4.03Å; T276-L301 HydrophobicContact CG2-CD2 4.17Å; L292-L301 CarbonylContact C-O 3.5Å; L292-L301 WeakPolarHBondContact CA-O 3.41Å; I293-L301 HydrophobicContact CB-CB 4.16Å; I293-L301 PolarHBondContact N-O 3.33Å; I293-L301 PolarHBondContact O-N 3.19Å; T295-L301 HydrophobicContact CG2-CD1 3.96Å; L301-L363 HydrophobicContact CB-CD1 3.96Å; L301-L363 HydrophobicContact CD2-CD1 4.21Å; L301-L363 HydrophobicContact CD2-CD2 4.49Å; L301-L363 HydrophobicContact CG-CD1 4.2Å; L301-E364 WeakPolarHBondContact CA-O 3.48Å; L301-V365 HydrophobicContact CD1-CG1 4.14Å; L301-V365 HydrophobicContact CG-CG1 4.34Å; L301-V365 HydrophobicContact CG-CG2 4.26Å
302	I	92.5	Very high	88.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	111.3	178.8	-46.2	179.9	0	0	0	108.7	L292 E364 L366 F411 S426 L427	L292-I302 HydrophobicContact CD1-CG2 4.26Å; L292-I302 HydrophobicContact CD2-CG1 4.36Å; L292-I302 HydrophobicContact CG-CG1 4.14Å; L292-I302 HydrophobicContact CG-CG2 4.27Å; I302-E364 HydrophobicContact CB-CB 4.38Å; I302-E364 PolarHBondContact N-O 3.34Å; I302-E364 PolarHBondContact O-N 2.88Å; I302-L366 HydrophobicContact CD1-CD1 3.72Å; I302-F411 HydrophobicContact CD1-CE1 4.29Å; I302-S426 WeakPolarHBondContact CD1-OG 3.29Å; I302-L427 HydrophobicContact CD1-CD1 4.11Å; I302-L427 HydrophobicContact CD1-CG 4.07Å
303	L	91.3	Very high	86.7	Confident	1 Å²	1	37 Å²	37	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	112	169.1	-70.1	167.3	0	0	0	108.3	F273 F274 K290 M291 L306 L312 L363	F273-L303 HydrophobicContact CE1-CD1 3.95Å; F273-L303 HydrophobicContact CZ-CD1 4.49Å; F274-L303 HydrophobicContact CB-CD1 4.43Å; F274-L303 HydrophobicContact CD1-CD1 4.34Å; F274-L303 HydrophobicContact CD2-CD1 4.11Å; F274-L303 HydrophobicContact CD2-CD2 4.48Å; F274-L303 HydrophobicContact CE2-CD1 4.46Å; F274-L303 HydrophobicContact CE2-CD2 4.29Å; F274-L303 HydrophobicContact CG-CD1 4.04Å; K290-L303 WeakPolarHBondContact CA-O 3.45Å; K290-L303 WeakPolarHBondContact CB-O 3.36Å; M291-L303 HydrophobicContact CB-CB 4.26Å; M291-L303 HydrophobicContact CB-CD1 4.48Å; M291-L303 PolarHBondContact N-O 3.41Å; M291-L303 PolarHBondContact O-N 2.89Å; M291-L303 HydrophobicContact SD-CD1 4.06Å; L303-L306 HydrophobicContact CB-CD1 4.23Å; L303-L312 HydrophobicContact CD1-CD1 4Å; L303-L312 HydrophobicContact CD2-CD1 3.82Å; L303-L363 HydrophobicContact CD2-CB 3.83Å; L303-L363 HydrophobicContact CD2-CD1 3.73Å; L303-L363 HydrophobicContact CD2-CG 4.36Å; L303-L363 HydrophobicContact CG-CD1 3.97Å
304	H	88.3	Confident	84.5	Confident	15 Å²	15	42.2 Å²	42.2	7%	0.069	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	162.9	177.9	-58.9	-93.5	0	0	0	112.4	L306 N361 S362 E364	H304-L306 VanDerWaalsContact C-N 3.28Å; H304-L306 PolarHBondContact O-N 2.94Å; H304-N361 CarbonylContact O-C 3.59Å; H304-N361 WeakPolarHBondContact O-CA 3.42Å; H304-N361 PolarHBondContact O-N 3.16Å; H304-N361 VanDerWaalsContact O-N 3.15Å; H304-S362 PolarHBondContact N-O 2.9Å; H304-S362 PolarHBondContact O-N 2.7Å; H304-E364 IonicContact CD2-OE2 3.9Å; H304-E364 IonicContact CE1-OE2 3.76Å; H304-E364 IonicContact NE2-OE2 3.19Å; H304-E364 PolarHBondContact NE2-OE2 2.84Å
305	D	85.2	Confident	82.3	Confident	58 Å²	58	45 Å²	45	31%	0.31	26%	0.262	S	S	.	.	S	Bend	trans	53.5	44.6	-179.5	-62	-25.9	0	0	0	111.7	S289 S358 R360 N361	S289-D305 PolarHBondContact O-N 3.17Å; D305-S358 WeakPolarHBondContact OD2-CB 3.44Å; D305-S358 PolarHBondContact OD2-OG 2.88Å; D305-R360 WeakPolarHBondContact O-CD 3.49Å; D305-R360 PolarHBondContact O-NH1 3.01Å; D305-N361 PolarHBondContact O-N 3.39Å
306	L	89.6	Confident	80.1	Confident	15 Å²	15	48.6 Å²	48.6	8%	0.079	29%	0.287	C	S	.	.			trans	-56.1	136.3	-167.5	-164.6	72.7	0	0	0	112.7	F273 L284 S289 M291 L303 H304 L308 R360 N361	F273-L306 HydrophobicContact CE1-CD1 4.1Å; F273-L306 HydrophobicContact CZ-CD1 3.76Å; L284-L306 HydrophobicContact CD2-CD2 3.72Å; S289-L306 WeakPolarHBondContact O-CB 3.33Å; S289-L306 PolarHBondContact O-N 2.77Å; M291-L306 HydrophobicContact CB-CD1 3.95Å; M291-L306 HydrophobicContact CB-CD2 4.17Å; M291-L306 HydrophobicContact CE-CD1 4.5Å; L303-L306 HydrophobicContact CB-CD1 4.23Å; H304-L306 VanDerWaalsContact C-N 3.28Å; H304-L306 PolarHBondContact O-N 2.94Å; L306-L308 HydrophobicContact CD1-CD2 4.14Å; L306-L308 HydrophobicContact CD2-CD2 4Å; L306-L308 HydrophobicContact CD2-CG 4.14Å; L306-L308 HydrophobicContact CG-CD2 4.1Å; L306-L308 HydrophobicContact CG-CG 4.3Å; L306-R360 PolarHBondContact O-NH1 3.25Å; L306-N361 WeakPolarHBondContact CA-OD1 3.24Å
307	D	89.8	Confident	78.4	Confident	34 Å²	34	49.4 Å²	49.4	18%	0.182	28%	0.284	C	S	.	.			trans	-144.7	96.5	170.8	179.9	-5.7	0	0	0	108.4	T309 Q310 N361	D307-T309 PolarHBondContact O-N 2.96Å; D307-T309 WeakPolarHBondContact OD1-CA 3.07Å; D307-T309 VanDerWaalsContact OD1-CB 3.27Å; D307-T309 WeakPolarHBondContact OD1-CB 3.24Å; D307-T309 WeakPolarHBondContact OD1-CG2 3.41Å; D307-T309 PolarHBondContact OD1-N 2.81Å; D307-T309 PolarHBondContact OD1-OG1 3.38Å; D307-T309 PolarHBondContact OD2-OG1 3.03Å; D307-Q310 PolarHBondContact O-N 3.32Å; D307-Q310 PolarHBondContact OD2-NE2 3.22Å; D307-N361 PolarHBondContact N-OD1 3.41Å; D307-N361 PolarHBondContact O-ND2 3.15Å
308	L	89.6	Confident	76.6	Confident	1 Å²	1	56 Å²	56	1%	0.005	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-10.6	178.5	-63	-178.9	0	0	0	113.2	D240 L245 V247 T257 K271 F273 M291 L306 Q310	D240-L308 HydrophobicContact CB-CD1 3.74Å; L245-L308 HydrophobicContact CB-CD1 4.49Å; L245-L308 HydrophobicContact CD1-CB 3.82Å; V247-L308 HydrophobicContact CG2-CD1 3.55Å; T257-L308 HydrophobicContact CG2-CB 4.21Å; T257-L308 HydrophobicContact CG2-CD1 4.34Å; T257-L308 HydrophobicContact CG2-CD2 3.99Å; T257-L308 HydrophobicContact CG2-CG 4.42Å; K271-L308 VanDerWaalsContact CE-O 3.24Å; K271-L308 WeakPolarHBondContact CE-O 3.25Å; K271-L308 PolarHBondContact NZ-O 2.88Å; F273-L308 HydrophobicContact CD1-CD2 3.94Å; F273-L308 HydrophobicContact CD2-CD2 4.07Å; F273-L308 HydrophobicContact CE1-CD2 3.74Å; F273-L308 HydrophobicContact CE2-CD2 3.88Å; F273-L308 HydrophobicContact CG-CD2 4.11Å; F273-L308 HydrophobicContact CZ-CD2 3.72Å; M291-L308 HydrophobicContact CE-CD2 3.88Å; L306-L308 HydrophobicContact CD1-CD2 4.14Å; L306-L308 HydrophobicContact CD2-CD2 4Å; L306-L308 HydrophobicContact CD2-CG 4.14Å; L306-L308 HydrophobicContact CG-CD2 4.1Å; L306-L308 HydrophobicContact CG-CG 4.3Å; L308-Q310 VanDerWaalsContact C-N 3.31Å
309	T	80.1	Confident	75	Confident	89 Å²	89	60.5 Å²	60.5	55%	0.546	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-25.6	177	76	0	0	0	0	111.8	K271 D307	K271-T309 PolarHBondContact NZ-O 3.06Å; D307-T309 PolarHBondContact O-N 2.96Å; D307-T309 WeakPolarHBondContact OD1-CA 3.07Å; D307-T309 VanDerWaalsContact OD1-CB 3.27Å; D307-T309 WeakPolarHBondContact OD1-CB 3.24Å; D307-T309 WeakPolarHBondContact OD1-CG2 3.41Å; D307-T309 PolarHBondContact OD1-N 2.81Å; D307-T309 PolarHBondContact OD1-OG1 3.38Å; D307-T309 PolarHBondContact OD2-OG1 3.03Å
310	Q	75.4	Confident	73.3	Confident	105 Å²	105	58 Å²	58	49%	0.491	31%	0.314	S	S	.	.	S	Bend	trans	-100.7	123.5	178.2	-59.9	-178.7	54.1	0	0	110.9	F273 D307 L308	F273-Q310 WeakPolarHBondContact CD2-O 3.48Å; F273-Q310 VanDerWaalsContact CE2-O 3.27Å; F273-Q310 WeakPolarHBondContact CE2-O 3.48Å; D307-Q310 PolarHBondContact O-N 3.32Å; D307-Q310 PolarHBondContact OD2-NE2 3.22Å; L308-Q310 VanDerWaalsContact C-N 3.31Å
311	S	66.2	Low	71.1	Confident	73 Å²	73	68.3 Å²	68.3	51%	0.51	35%	0.353	S	S	.	.			trans	-74.9	136.1	177	45.8	0	0	0	0	112	E313	S311-E313 PolarHBondContact O-N 3.36Å
312	L	69.6	Low	68.6	Low	24 Å²	24	69.8 Å²	69.8	13%	0.126	37%	0.366	C	S	.	.			trans	-90.2	101.5	171.4	-60.8	161.3	0	0	0	109.7	F273 F274 L303 N361	F273-L312 HydrophobicContact CE1-CD1 4.08Å; F273-L312 HydrophobicContact CE2-CD1 4.22Å; F273-L312 HydrophobicContact CE2-CG 4.37Å; F273-L312 HydrophobicContact CZ-CD1 3.74Å; F273-L312 HydrophobicContact CZ-CG 4.38Å; F273-L312 WeakPolarHBondContact O-CA 3.5Å; F273-L312 VanDerWaalsContact O-CB 3.27Å; F273-L312 WeakPolarHBondContact O-CB 3.39Å; F273-L312 PolarHBondContact O-N 2.88Å; F274-L312 HydrophobicContact CB-CD1 4.35Å; F274-L312 HydrophobicContact CD2-CB 4.23Å; F274-L312 HydrophobicContact CD2-CD1 3.71Å; F274-L312 HydrophobicContact CG-CD1 4.42Å; L303-L312 HydrophobicContact CD1-CD1 4Å; L303-L312 HydrophobicContact CD2-CD1 3.82Å; L312-N361 HydrophobicContact CD1-CB 3.91Å; L312-N361 HydrophobicContact CD2-CB 3.46Å; L312-N361 VanDerWaalsContact CD2-CB 3.46Å; L312-N361 HydrophobicContact CG-CB 4.04Å
313	E	57.7	Low	65.9	Low	135 Å²	135	79.8 Å²	79.8	63%	0.631	40%	0.404	S	S	*	.			trans	-59.9	143.8	166.1	-68	176.3	158	0	0	110.8	S311 G315 S316	S311-E313 PolarHBondContact O-N 3.36Å; E313-G315 PolarHBondContact O-N 3Å; E313-G315 VanDerWaalsContact O-N 3.13Å; E313-S316 WeakPolarHBondContact CB-OG 3.37Å; E313-S316 PolarHBondContact O-N 2.87Å; E313-S316 PolarHBondContact OE2-OG 3Å
314	V	53.2	Low	63.1	Low	109 Å²	109	90.5 Å²	90.5	66%	0.661	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	114	-178.8	-178.8	0	0	0	0	109.6	H275	H275-V314 HydrophobicContact CB-CG2 4.06Å
315	G	49.8	Very low	60.4	Low	60 Å²	60	95.2 Å²	95.2	62%	0.619	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	-12.3	-175.9	0	0	0	0	0	115.2	E313	E313-G315 PolarHBondContact O-N 3Å; E313-G315 VanDerWaalsContact O-N 3.13Å
316	S	50.2	Low	57.7	Low	77 Å²	77	97.7 Å²	97.7	54%	0.538	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.7	179.8	-64	0	0	0	0	113.7	E313	E313-S316 WeakPolarHBondContact CB-OG 3.37Å; E313-S316 PolarHBondContact O-N 2.87Å; E313-S316 PolarHBondContact OE2-OG 3Å
317	Y	56.8	Low	54.9	Low	58 Å²	58	104.7 Å²	104.7	23%	0.227	53%	0.53	C	S	.	.	S	Bend	trans	-78.9	134.4	173.6	55.6	-99.2	0	0	0	112.3	F274 M319 L363	F274-Y317 HydrophobicContact CD2-CD1 4.5Å; F274-Y317 AromaticContact CE2-CD1 3.9Å; F274-Y317 HydrophobicContact CE2-CD1 3.9Å; F274-Y317 AromaticContact CE2-CE1 3.77Å; F274-Y317 HydrophobicContact CE2-CE1 3.77Å; Y317-M319 HydrophobicContact CD2-CG 4.06Å; Y317-M319 HydrophobicContact CE2-CG 3.84Å; Y317-M319 PolarHBondContact O-N 2.91Å; Y317-L363 HydrophobicContact CD2-CB 3.92Å; Y317-L363 HydrophobicContact CD2-CD2 3.56Å; Y317-L363 HydrophobicContact CD2-CG 4.39Å; Y317-L363 HydrophobicContact CE2-CD2 3.35Å; Y317-L363 HydrophobicContact CG-CB 4.4Å; Y317-L363 HydrophobicContact CG-CD2 4.37Å
318	R	53.6	Low	52.1	Low	193 Å²	193	108.5 Å²	108.5	73%	0.728	56%	0.56	S	S	*	*			trans	-79.3	108.5	174.3	-71.9	-168.5	176.3	-153.3	-0.8	110.7	L320	R318-L320 PolarHBondContact O-N 2.83Å
319	M	57.8	Low	49.3	Very low	104 Å²	104	113.6 Å²	113.6	51%	0.512	60%	0.596	S	S	.	*			trans	-64.8	116.2	175	-66.8	-171.2	80.8	0	0	112.3	Y317 R321 V365	Y317-M319 HydrophobicContact CD2-CG 4.06Å; Y317-M319 HydrophobicContact CE2-CG 3.84Å; Y317-M319 PolarHBondContact O-N 2.91Å; M319-R321 PolarHBondContact O-N 2.89Å; M319-R321 VanDerWaalsContact O-N 3.15Å; M319-V365 HydrophobicContact CE-CB 4.48Å; M319-V365 HydrophobicContact CE-CG2 3.78Å
320	L	56.4	Low	47.1	Very low	55 Å²	55	116.9 Å²	116.9	29%	0.288	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.6	88.5	164.6	-61.5	161	0	0	0	107.9	R318 A322 S362 L363 E364 R424	R318-L320 PolarHBondContact O-N 2.83Å; L320-A322 PolarHBondContact O-N 3.2Å; L320-S362 WeakPolarHBondContact CD1-OG 3.31Å; L320-L363 WeakPolarHBondContact CB-O 3.32Å; L320-L363 PolarHBondContact N-O 2.89Å; L320-E364 HydrophobicContact CB-CB 4.21Å; L320-E364 HydrophobicContact CB-CG 4.36Å; L320-E364 HydrophobicContact CD1-CB 4.27Å; L320-R424 VanDerWaalsContact CD1-NH1 3.27Å
321	R	47.1	Very low	44.9	Very low	218 Å²	218	115.9 Å²	115.9	82%	0.823	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66.6	105.1	177.1	-77.6	-174.5	176	169.4	-0.7	110.4	M319 R323	M319-R321 PolarHBondContact O-N 2.89Å; M319-R321 VanDerWaalsContact O-N 3.15Å; R321-R323 PolarHBondContact O-N 3.12Å
322	A	39.9	Very low	43	Very low	41 Å²	41	115.9 Å²	115.9	34%	0.339	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-59.1	125.4	160.3	0	0	0	0	0	108.9	L320 L366	L320-A322 PolarHBondContact O-N 3.2Å; A322-L366 HydrophobicContact CB-CD2 3.63Å
323	R	36.1	Very low	41.1	Very low	210 Å²	210	121.6 Å²	121.6	79%	0.792	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-89.1	120.8	-179.5	-167.6	-177.3	-168.5	-165.6	3.6	108	R321 T325	R321-R323 PolarHBondContact O-N 3.12Å; R323-T325 PolarHBondContact O-N 3.21Å
324	R	33.8	Very low	39.8	Very low	226 Å²	226	120.9 Å²	120.9	85%	0.853	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-48.5	125.3	167.6	-76.9	-174.9	174.5	-174.6	-3.5	108.8	P326	R324-P326 VanDerWaalsContact O-CD 3.31Å; R324-P326 WeakPolarHBondContact O-CD 3.48Å
325	T	30.2	Very low	38.6	Very low	114 Å²	114	119.9 Å²	119.9	70%	0.699	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-66.3	117.5	171.9	33	0	0	0	0	108.7	R323 L327	R323-T325 PolarHBondContact O-N 3.21Å; T325-L327 PolarHBondContact O-N 3.02Å
326	P	30	Very low	37.6	Very low	111 Å²	111	122.3 Å²	122.3	72%	0.721	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-66.4	133.7	168.8	-13.8	29.9	0	0	0	108.1	R324 S328	R324-P326 VanDerWaalsContact O-CD 3.31Å; R324-P326 WeakPolarHBondContact O-CD 3.48Å; P326-S328 PolarHBondContact O-N 2.93Å
327	L	30.5	Very low	36.8	Very low	161 Å²	161	130.1 Å²	130.1	84%	0.843	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-64.6	136.7	169.2	-80.8	75.6	0	0	0	108.7	T325 S329	T325-L327 PolarHBondContact O-N 3.02Å; L327-S329 PolarHBondContact O-N 3.44Å
328	S	29.4	Very low	35.5	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	74%	0.741	S	S	*	*			trans	-76.7	107.9	171.6	-167.8	0	0	0	0	109.2	P326	P326-S328 PolarHBondContact O-N 2.93Å
329	S	32	Very low	34.2	Very low	109 Å²	109	130 Å²	130	76%	0.762	75%	0.745	S	S	*	*			trans	-115.4	117.7	164.7	59.4	0	0	0	0	108.6	L327	L327-S329 PolarHBondContact O-N 3.44Å
330	D	32.4	Very low	32.8	Very low	158 Å²	158	131.5 Å²	131.5	85%	0.845	76%	0.76	S	S	*	*			trans	-69.6	149.9	-175.7	-78.3	-58.3	0	0	0	114.4
331	G	30.2	Very low	31.5	Very low	84 Å²	84	134.7 Å²	134.7	87%	0.866	78%	0.782	S	S	*	*			trans	91.8	106.4	156.5	0	0	0	0	0	117
332	G	27.2	Very low	30.7	Very low	72 Å²	72	130.3 Å²	130.3	74%	0.742	78%	0.781	S	S	*	*			trans	172.6	67.1	172.8	0	0	0	0	0	117.6
333	T	29.2	Very low	30.1	Very low	144 Å²	144	140 Å²	140	88%	0.883	81%	0.809	S	S	*	*			trans	27.1	106	153.4	52.8	0	0	0	0	121.2
334	S	29.7	Very low	29.9	Very low	121 Å²	121	139.8 Å²	139.8	85%	0.846	82%	0.817	S	S	*	*			trans	13	125.9	137.2	166.8	0	0	0	0	120.9
335	A	28.6	Very low	29.5	Very low	87 Å²	87	132.6 Å²	132.6	72%	0.719	81%	0.813	S	S	*	*			trans	-152.4	136.9	140.1	0	0	0	0	0	114.5
336	S	28.5	Very low	29.4	Very low	112 Å²	112	135.9 Å²	135.9	78%	0.783	82%	0.82	S	S	*	*			trans	38.2	123.3	152.9	57.2	0	0	0	0	122.5
337	R	34	Very low	29.4	Very low	241 Å²	241	137.1 Å²	137.1	91%	0.909	82%	0.821	S	S	*	*			trans	-64	151.1	154.6	-66.5	169.4	166	173.8	-6.5	111.7
338	S	28	Very low	29.2	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	82%	0.818	S	S	*	*			trans	-140.9	138.2	142.3	62.8	0	0	0	0	110.4
339	T	27.6	Very low	29.3	Very low	133 Å²	133	139.1 Å²	139.1	82%	0.816	82%	0.823	S	S	*	*			trans	-109.8	123.7	-179.9	45	0	0	0	0	109.7
340	V	27.9	Very low	29	Very low	135 Å²	135	141.2 Å²	141.2	82%	0.818	83%	0.825	S	S	*	*			trans	-122.4	122.3	170.9	-178.4	0	0	0	0	108.7
341	T	28.7	Very low	28.9	Very low	122 Å²	122	141.4 Å²	141.4	75%	0.748	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-86.8	133.6	177.2	45.6	0	0	0	0	110.6
342	P	30.5	Very low	28.9	Very low	125 Å²	125	143.5 Å²	143.5	81%	0.812	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.7	137.4	169.5	30.4	-32.9	0	0	0	110.2
343	R	27.5	Very low	29.1	Very low	245 Å²	245	147.8 Å²	147.8	93%	0.925	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-83.8	144.6	166.9	-80.1	-176.5	166.8	-176.3	-4.6	110
344	Q	31.7	Very low	29.2	Very low	206 Å²	206	152.7 Å²	152.7	96%	0.963	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-69.7	148.1	177.1	-67.8	170.8	-75.9	0	0	112.1
345	G	26.5	Very low	29.3	Very low	75 Å²	75	156 Å²	156	77%	0.773	82%	0.823	S	S	*	*			trans	-135.5	143.6	164.4	0	0	0	0	0	108.8
346	H	27.9	Very low	29.9	Very low	182 Å²	182	155.6 Å²	155.6	84%	0.843	83%	0.827	S	S	*	*			trans	-67	159.5	-159	-116.9	-75.8	0	0	0	116.9
347	D	29	Very low	30.5	Very low	137 Å²	137	158.2 Å²	158.2	73%	0.733	83%	0.832	S	S	*	*			trans	-36.5	145.6	177.4	-51.4	-67.1	0	0	0	118.8
348	S	27.5	Very low	31.3	Very low	113 Å²	113	149.7 Å²	149.7	79%	0.79	81%	0.809	S	S	*	*			trans	-135.4	152.3	130.5	55.5	0	0	0	0	109.5	L350	S348-L350 PolarHBondContact O-N 2.74Å
349	K	30.9	Very low	33	Very low	205 Å²	205	147.5 Å²	147.5	89%	0.891	79%	0.792	S	S	*	*			trans	-71.4	113.1	-159.8	-65.2	171.5	-178.5	171.7	0	113
350	L	26.5	Very low	35.4	Very low	153 Å²	153	148 Å²	148	80%	0.801	78%	0.778	S	S	*	*			trans	-84.8	126.9	162.8	-88.6	159.1	0	0	0	110.5	S348	S348-L350 PolarHBondContact O-N 2.74Å
351	H	29.4	Very low	38.2	Very low	162 Å²	162	141.7 Å²	141.7	75%	0.75	74%	0.74	S	S	*	*			trans	-71.6	149.7	165.2	-72	-79	0	0	0	110.2	H353	H351-H353 PolarHBondContact O-N 2.93Å
352	P	29.4	Very low	40.9	Very low	128 Å²	128	136 Å²	136	83%	0.831	71%	0.706	S	S	*	*			trans	-68	103	-179.6	27.4	-34.2	0	0	0	110.7	R354	P352-R354 PolarHBondContact O-N 3.19Å
353	H	31.3	Very low	43.6	Very low	162 Å²	162	130.1 Å²	130.1	75%	0.75	67%	0.667	S	S	*	*			trans	-63.9	122.6	172.7	-87.3	-80.2	0	0	0	110.3	H351 E355	H351-H353 PolarHBondContact O-N 2.93Å; H353-E355 PolarHBondContact O-N 2.96Å
354	R	31.7	Very low	46.4	Very low	246 Å²	246	118.5 Å²	118.5	93%	0.928	62%	0.623	S	S	*	*			trans	-65	115.9	173.5	-171.6	179.7	-171.8	174.8	2.7	109.6	P352	P352-R354 PolarHBondContact O-N 3.19Å
355	E	32.8	Very low	49.2	Very low	192 Å²	192	110.3 Å²	110.3	90%	0.897	59%	0.588	S	S	*	*			trans	-63.8	150.9	178	-57.1	-178.5	127.1	0	0	112	H353	H353-E355 PolarHBondContact O-N 2.96Å
356	G	39.7	Very low	52.1	Low	77 Å²	77	107.4 Å²	107.4	79%	0.794	55%	0.554	S	S	*	*			trans	119.3	1.2	150	0	0	0	0	0	119.8
357	L	41.1	Very low	55	Low	168 Å²	168	103.2 Å²	103.2	88%	0.88	54%	0.541	S	S	*	.			trans	-117.1	144.5	175.1	-66.1	176.1	0	0	0	112.1
358	S	51.5	Low	57.7	Low	61 Å²	61	97.3 Å²	97.3	43%	0.427	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-63.5	143	160.7	43.3	0	0	0	0	109.3	D305 R360	D305-S358 WeakPolarHBondContact OD2-CB 3.44Å; D305-S358 PolarHBondContact OD2-OG 2.88Å; S358-R360 PolarHBondContact O-N 2.86Å
359	P	64.3	Low	60.4	Low	70 Å²	70	98.1 Å²	98.1	46%	0.455	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-64.8	129.3	167.5	27.6	-31.3	0	0	0	108.5	S362	P359-S362 WeakPolarHBondContact O-CB 3.46Å
360	R	78.4	Confident	62.9	Low	143 Å²	143	89.7 Å²	89.7	54%	0.54	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	151.5	166.7	-78	-70.3	-176.2	173.6	-0.6	110.2	D305 L306 S358 S362	D305-R360 WeakPolarHBondContact O-CD 3.49Å; D305-R360 PolarHBondContact O-NH1 3.01Å; L306-R360 PolarHBondContact O-NH1 3.25Å; S358-R360 PolarHBondContact O-N 2.86Å; R360-S362 VanDerWaalsContact C-N 3.29Å; R360-S362 PolarHBondContact O-N 3.21Å
361	N	85.8	Confident	65.4	Low	4 Å²	4	83.6 Å²	83.6	2%	0.021	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	38.4	178.6	-66.4	-28.9	0	0	0	113.7	H304 D305 L306 D307 L312 L363	H304-N361 CarbonylContact O-C 3.59Å; H304-N361 WeakPolarHBondContact O-CA 3.42Å; H304-N361 PolarHBondContact O-N 3.16Å; H304-N361 VanDerWaalsContact O-N 3.15Å; D305-N361 PolarHBondContact O-N 3.39Å; L306-N361 WeakPolarHBondContact CA-OD1 3.24Å; D307-N361 PolarHBondContact N-OD1 3.41Å; D307-N361 PolarHBondContact O-ND2 3.15Å; L312-N361 HydrophobicContact CD1-CB 3.91Å; L312-N361 HydrophobicContact CD2-CB 3.46Å; L312-N361 VanDerWaalsContact CD2-CB 3.46Å; L312-N361 HydrophobicContact CG-CB 4.04Å; N361-L363 PolarHBondContact O-N 2.99Å
362	S	85.1	Confident	67.1	Low	3 Å²	3	78 Å²	78	2%	0.021	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	121.4	-178.2	72.3	0	0	0	0	111.4	H304 L320 P359 R360	H304-S362 PolarHBondContact N-O 2.9Å; H304-S362 PolarHBondContact O-N 2.7Å; L320-S362 WeakPolarHBondContact CD1-OG 3.31Å; P359-S362 WeakPolarHBondContact O-CB 3.46Å; R360-S362 VanDerWaalsContact C-N 3.29Å; R360-S362 PolarHBondContact O-N 3.21Å
363	L	87.1	Confident	68.4	Low	1 Å²	1	77.5 Å²	77.5	1%	0.005	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.8	-178.8	-177.2	68.5	0	0	0	112.4	F274 L301 L303 Y317 L320 N361 V365	F274-L363 HydrophobicContact CE2-CD2 4.37Å; F274-L363 HydrophobicContact CZ-CD1 4.28Å; F274-L363 HydrophobicContact CZ-CD2 4.12Å; L301-L363 HydrophobicContact CB-CD1 3.96Å; L301-L363 HydrophobicContact CD2-CD1 4.21Å; L301-L363 HydrophobicContact CD2-CD2 4.49Å; L301-L363 HydrophobicContact CG-CD1 4.2Å; L303-L363 HydrophobicContact CD2-CB 3.83Å; L303-L363 HydrophobicContact CD2-CD1 3.73Å; L303-L363 HydrophobicContact CD2-CG 4.36Å; L303-L363 HydrophobicContact CG-CD1 3.97Å; Y317-L363 HydrophobicContact CD2-CB 3.92Å; Y317-L363 HydrophobicContact CD2-CD2 3.56Å; Y317-L363 HydrophobicContact CD2-CG 4.39Å; Y317-L363 HydrophobicContact CE2-CD2 3.35Å; Y317-L363 HydrophobicContact CG-CB 4.4Å; Y317-L363 HydrophobicContact CG-CD2 4.37Å; L320-L363 WeakPolarHBondContact CB-O 3.32Å; L320-L363 PolarHBondContact N-O 2.89Å; N361-L363 PolarHBondContact O-N 2.99Å; L363-V365 HydrophobicContact CD1-CG2 4.46Å; L363-V365 HydrophobicContact CD2-CG2 3.8Å; L363-V365 HydrophobicContact CG-CG2 3.88Å
364	E	87.3	Confident	69.6	Low	0 Å²	0	78.8 Å²	78.8	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	142.2	162.2	-167.5	173.3	141.8	0	0	109.4	L301 I302 H304 L320 L366 R424 S426	L301-E364 WeakPolarHBondContact CA-O 3.48Å; I302-E364 HydrophobicContact CB-CB 4.38Å; I302-E364 PolarHBondContact N-O 3.34Å; I302-E364 PolarHBondContact O-N 2.88Å; H304-E364 IonicContact CD2-OE2 3.9Å; H304-E364 IonicContact CE1-OE2 3.76Å; H304-E364 IonicContact NE2-OE2 3.19Å; H304-E364 PolarHBondContact NE2-OE2 2.84Å; L320-E364 HydrophobicContact CB-CB 4.21Å; L320-E364 HydrophobicContact CB-CG 4.36Å; L320-E364 HydrophobicContact CD1-CB 4.27Å; E364-L366 HydrophobicContact CG-CD2 4.19Å; E364-L366 HydrophobicContact CG-CG 4.32Å; E364-R424 VanDerWaalsContact OE2-CB 3.31Å; E364-R424 WeakPolarHBondContact OE2-CB 3.44Å; E364-R424 WeakPolarHBondContact OE2-CD 3.35Å; E364-S426 WeakPolarHBondContact OE1-CB 3.19Å; E364-S426 PolarHBondContact OE1-N 3.34Å; E364-S426 PolarHBondContact OE1-OG 2.88Å; E364-S426 PolarHBondContact OE2-OG 3.49Å
365	V	89.6	Confident	70.8	Confident	35 Å²	35	75.1 Å²	75.1	21%	0.212	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.3	178.4	-171.6	0	0	0	0	108.7	Y299 L301 M319 L363	Y299-V365 HydrophobicContact CD1-CG1 4.08Å; Y299-V365 HydrophobicContact CG-CG1 4.48Å; L301-V365 HydrophobicContact CD1-CG1 4.14Å; L301-V365 HydrophobicContact CG-CG1 4.34Å; L301-V365 HydrophobicContact CG-CG2 4.26Å; M319-V365 HydrophobicContact CE-CB 4.48Å; M319-V365 HydrophobicContact CE-CG2 3.78Å; L363-V365 HydrophobicContact CD1-CG2 4.46Å; L363-V365 HydrophobicContact CD2-CG2 3.8Å; L363-V365 HydrophobicContact CG-CG2 3.88Å
366	L	88.1	Confident	72.3	Confident	14 Å²	14	69.7 Å²	69.7	7%	0.073	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149.7	-174.6	-59.8	176.4	0	0	0	110.9	Y299 L300 I302 A322 E364 L427	Y299-L366 WeakPolarHBondContact CA-O 3.33Å; L300-L366 PolarHBondContact N-O 2.81Å; L300-L366 PolarHBondContact O-N 3.24Å; I302-L366 HydrophobicContact CD1-CD1 3.72Å; A322-L366 HydrophobicContact CB-CD2 3.63Å; E364-L366 HydrophobicContact CG-CD2 4.19Å; E364-L366 HydrophobicContact CG-CG 4.32Å; L366-L427 HydrophobicContact CD1-CB 4Å; L366-L427 HydrophobicContact CD1-CD1 3.7Å; L366-L427 HydrophobicContact CD1-CG 3.75Å
367	T	88.2	Confident	73.9	Confident	93 Å²	93	67.7 Å²	67.7	57%	0.571	36%	0.361	S	S	*	.			trans	-107.4	100.3	162.3	-55.8	0	0	0	0	106.5	Y299	Y299-T367 WeakPolarHBondContact CE1-OG1 3.06Å
368	P	85.1	Confident	76	Confident	13 Å²	13	61.1 Å²	61.1	8%	0.084	33%	0.327	C	S	.	.			trans	-55.9	143.1	179.1	14.2	-26.6	0	0	0	113.1	G298 L300 I370 I380 I394 Y409	G298-P368 WeakPolarHBondContact O-CD 3.34Å; L300-P368 HydrophobicContact CB-CG 4.3Å; P368-I370 PolarHBondContact O-N 3.32Å; P368-I380 HydrophobicContact CG-CD1 3.57Å; P368-I394 HydrophobicContact CB-CD1 4.09Å; P368-I394 HydrophobicContact CG-CD1 4.11Å; P368-Y409 HydrophobicContact CB-CE1 3.99Å; P368-Y409 HydrophobicContact CB-CE2 4.11Å; P368-Y409 WeakPolarHBondContact CB-OH 3.33Å
369	E	85.3	Confident	77.9	Confident	130 Å²	130	59.3 Å²	59.3	61%	0.607	31%	0.314	S	S	*	.			trans	-78.7	95.3	177	-65.4	-167.1	147.9	0	0	110.7	Y409 L429	E369-Y409 VanDerWaalsContact C-OH 3.29Å; E369-Y409 PolarHBondContact N-OH 2.94Å; E369-Y409 VanDerWaalsContact N-OH 3.12Å; E369-Y409 PolarHBondContact O-OH 2.8Å; E369-L429 HydrophobicContact CB-CD2 4.46Å; E369-L429 WeakPolarHBondContact O-CD2 3.19Å
370	I	83.3	Confident	79.4	Confident	28 Å²	28	56 Å²	56	14%	0.144	29%	0.292	C	S	.	.			trans	-90.4	133.1	180	-63.8	162.7	0	0	0	109.4	P368 N378 C396 W405	P368-I370 PolarHBondContact O-N 3.32Å; I370-N378 HydrophobicContact CD1-CB 3.5Å; I370-C396 HydrophobicContact CD1-CB 3.88Å; I370-C396 VanDerWaalsContact CD1-SG 3.57Å; I370-W405 HydrophobicContact CG2-CB 4.27Å; I370-W405 HydrophobicContact CG2-CG 4.28Å
371	P	78	Confident	80.1	Confident	25 Å²	25	49.7 Å²	49.7	16%	0.162	27%	0.27	C	S	.	.	S	Bend	trans	-61.7	137.2	172.9	-17	28.3	0	0	0	111.4	W405 C407 Y432	P371-W405 HydrophobicContact CB-CD2 4.07Å; P371-W405 HydrophobicContact CB-CE3 3.84Å; P371-W405 HydrophobicContact CB-CH2 4.14Å; P371-W405 HydrophobicContact CB-CZ2 4.32Å; P371-W405 HydrophobicContact CB-CZ3 3.88Å; P371-W405 HydrophobicContact CG-CD2 4.33Å; P371-W405 HydrophobicContact CG-CE3 3.93Å; P371-W405 HydrophobicContact CG-CZ3 4.29Å; P371-W405 VanDerWaalsContact O-CE2 3.3Å; P371-W405 PolarHBondContact O-NE1 2.95Å; P371-W405 VanDerWaalsContact O-NE1 3.13Å; P371-C407 VanDerWaalsContact CD-SG 3.59Å; P371-Y432 HydrophobicContact CB-CD2 4.03Å; P371-Y432 HydrophobicContact CB-CE2 4.18Å; P371-Y432 HydrophobicContact CB-CG 4.4Å; P371-Y432 HydrophobicContact CG-CD1 3.94Å; P371-Y432 HydrophobicContact CG-CD2 3.45Å; P371-Y432 VanDerWaalsContact CG-CD2 3.45Å; P371-Y432 HydrophobicContact CG-CE1 4.47Å; P371-Y432 HydrophobicContact CG-CE2 4.03Å; P371-Y432 HydrophobicContact CG-CG 3.39Å
372	G	66.1	Low	80.7	Confident	44 Å²	44	49.5 Å²	49.5	45%	0.454	27%	0.269	S	S	.	.	S	Bend	trans	140	-165.6	-179.1	0	0	0	0	0	112.8	K374	G372-K374 PolarHBondContact O-N 3.37Å
373	E	57	Low	81.2	Confident	118 Å²	118	49.3 Å²	49.3	55%	0.551	27%	0.268	S	S	*	.			trans	-69.2	113	171	-70.4	-174.6	144.9	0	0	109.7	D375 R376	E373-D375 PolarHBondContact O-N 3.1Å; E373-R376 HydrophobicContact CB-CG 4.15Å; E373-R376 PolarHBondContact O-N 3.41Å; E373-R376 IonicContact OE2-CZ 3.78Å; E373-R376 IonicContact OE2-NE 2.74Å; E373-R376 PolarHBondContact OE2-NE 3Å; E373-R376 IonicContact OE2-NH2 2.68Å; E373-R376 PolarHBondContact OE2-NH2 2.99Å
374	K	56.3	Low	81.7	Confident	190 Å²	190	50.5 Å²	50.5	83%	0.826	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.4	-170.9	-65.6	-170.7	175.7	-169.7	0	115.4	G372	G372-K374 PolarHBondContact O-N 3.37Å
375	D	57.6	Low	82.1	Confident	168 Å²	168	51.6 Å²	51.6	90%	0.898	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-8.1	-179.1	-57	-51	0	0	0	113	E373	E373-D375 PolarHBondContact O-N 3.1Å
376	R	64.6	Low	82.3	Confident	79 Å²	79	49.9 Å²	49.9	30%	0.298	27%	0.269	S	S	.	.	S	Bend	trans	-82	124.9	170.7	-63.2	-170.2	-170.5	-152.1	4.9	110.2	E373 N378 D402	E373-R376 HydrophobicContact CB-CG 4.15Å; E373-R376 PolarHBondContact O-N 3.41Å; E373-R376 IonicContact OE2-CZ 3.78Å; E373-R376 IonicContact OE2-NE 2.74Å; E373-R376 PolarHBondContact OE2-NE 3Å; E373-R376 IonicContact OE2-NH2 2.68Å; E373-R376 PolarHBondContact OE2-NH2 2.99Å; R376-N378 PolarHBondContact O-ND2 2.71Å; R376-N378 VanDerWaalsContact O-ND2 3.12Å; R376-D402 IonicContact CZ-OD2 2.59Å; R376-D402 IonicContact NH1-OD1 2.79Å; R376-D402 PolarHBondContact NH1-OD1 3.4Å; R376-D402 IonicContact NH1-OD2 3.52Å; R376-D402 PolarHBondContact NH1-OD2 3.01Å
377	G	71.8	Confident	82.5	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	28%	0.28	S	S	.	.			trans	-62.8	157.4	165.5	0	0	0	0	0	111.5	N399	G377-N399 WeakPolarHBondContact O-CB 3.26Å; G377-N399 VanDerWaalsContact O-CG 3.23Å; G377-N399 PolarHBondContact O-N 2.82Å; G377-N399 PolarHBondContact O-OD1 3.1Å
378	N	85.7	Confident	82.4	Confident	30 Å²	30	50.9 Å²	50.9	16%	0.16	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.8	179.5	-62.5	-81.5	0	0	0	110.5	G298 I370 R376 S397 S398 N399	G298-N378 WeakPolarHBondContact CA-O 3.32Å; G298-N378 PolarHBondContact N-O 3.15Å; G298-N378 VanDerWaalsContact N-O 3.11Å; I370-N378 HydrophobicContact CD1-CB 3.5Å; R376-N378 PolarHBondContact O-ND2 2.71Å; R376-N378 VanDerWaalsContact O-ND2 3.12Å; N378-S397 WeakPolarHBondContact CA-O 2.99Å; N378-S398 WeakPolarHBondContact OD1-CA 3.47Å; N378-N399 WeakPolarHBondContact CA-OD1 3.23Å; N378-N399 PolarHBondContact N-OD1 2.73Å
379	C	91.6	Very high	82.5	Confident	23 Å²	23	51 Å²	51	16%	0.155	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129	169.9	173.3	0	0	0	0	109.6	S296 T381 C396 S397	S296-C379 VanDerWaalsContact CA-SG 3.54Å; S296-C379 WeakPolarHBondContact O-CA 3.41Å; C379-T381 HydrophobicContact CB-CG2 4.43Å; C379-T381 PolarHBondContact O-N 3.47Å; C379-C396 CarbonylContact O-C 3.44Å; C379-C396 WeakPolarHBondContact O-CA 3.28Å; C379-C396 WeakPolarHBondContact O-CB 3.21Å; C379-S397 PolarHBondContact N-O 2.83Å; C379-S397 PolarHBondContact O-N 3.35Å
380	I	94.9	Very high	82.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	93.1	176.1	-56.6	167.5	0	0	0	108.9	M280 S294 T295 L300 P368 I394 C396	M280-I380 WeakPolarHBondContact CB-O 3.47Å; S294-I380 VanDerWaalsContact CB-CG2 3.48Å; S294-I380 PolarHBondContact OG-O 3.28Å; T295-I380 PolarHBondContact O-N 3.3Å; L300-I380 HydrophobicContact CB-CD1 4.34Å; P368-I380 HydrophobicContact CG-CD1 3.57Å; I380-I394 HydrophobicContact CD1-CD1 4.45Å; I380-I394 HydrophobicContact CG1-CD1 4.44Å; I380-I394 HydrophobicContact CG2-CB 3.92Å; I380-I394 HydrophobicContact CG2-CD1 4.28Å; I380-I394 HydrophobicContact CG2-CG2 4Å; I380-C396 HydrophobicContact CG1-CB 4.4Å
381	T	94.8	Very high	83	Confident	11 Å²	11	46.4 Å²	46.4	7%	0.067	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	-42.1	-169	49.8	0	0	0	0	113.4	M280 R281 C379 R395 I443	M280-T381 HydrophobicContact CE-CG2 4.31Å; R281-T381 WeakPolarHBondContact CG-O 3.38Å; C379-T381 HydrophobicContact CB-CG2 4.43Å; C379-T381 PolarHBondContact O-N 3.47Å; T381-R395 PolarHBondContact N-O 2.79Å; T381-R395 PolarHBondContact OG1-O 2.85Å; T381-I443 WeakPolarHBondContact O-CG2 3.42Å
382	S	96.4	Very high	83.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	145.5	175.9	177.1	0	0	0	0	111.5	I394 R395 K444 E445	S382-I394 WeakPolarHBondContact O-CA 3.48Å; S382-R395 PolarHBondContact N-O 3.32Å; S382-R395 PolarHBondContact O-N 2.85Å; S382-K444 VanDerWaalsContact CB-O 3.31Å; S382-K444 WeakPolarHBondContact CB-O 3.41Å; S382-E445 PolarHBondContact OG-OE2 3.14Å
383	L	97.5	Very high	85.3	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	127.4	-179	175.1	66.3	0	0	0	109.4	R281 R283 L292 L300 T392 I394	R281-L383 HydrophobicContact CB-CB 3.67Å; R281-L383 HydrophobicContact CB-CD2 4.31Å; R281-L383 HydrophobicContact CG-CB 4.28Å; R283-L383 HydrophobicContact CB-CD2 4.2Å; R283-L383 HydrophobicContact CB-CG 4.35Å; R283-L383 HydrophobicContact CG-CB 4.37Å; R283-L383 HydrophobicContact CG-CD2 4.01Å; R283-L383 HydrophobicContact CG-CG 3.81Å; R283-L383 WeakPolarHBondContact CG-O 3.5Å; R283-L383 PolarHBondContact NE-O 2.84Å; L292-L383 HydrophobicContact CB-CD2 3.97Å; L300-L383 HydrophobicContact CD1-CD1 4.02Å; L300-L383 HydrophobicContact CD1-CD2 4.41Å; L383-T392 WeakPolarHBondContact CD1-OG1 3.48Å; L383-I394 HydrophobicContact CD1-CG2 3.7Å
384	Q	97.5	Very high	87.2	Confident	26 Å²	26	37.5 Å²	37.5	12%	0.121	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	160	-179.5	-62.6	-66.8	-19.2	0	0	110.3	T392 L393 E445 L446	Q384-T392 WeakPolarHBondContact O-CA 3.11Å; Q384-T392 PolarHBondContact O-OG1 2.94Å; Q384-L393 HydrophobicContact CB-CB 4.19Å; Q384-L393 HydrophobicContact CB-CD2 4.23Å; Q384-L393 HydrophobicContact CB-CG 4.4Å; Q384-L393 PolarHBondContact N-O 2.91Å; Q384-L393 PolarHBondContact O-N 2.82Å; Q384-E445 PolarHBondContact NE2-OE2 2.85Å; Q384-E445 VanDerWaalsContact NE2-OE2 3.1Å; Q384-L446 VanDerWaalsContact CD-O 3.27Å; Q384-L446 VanDerWaalsContact CG-O 3.27Å; Q384-L446 WeakPolarHBondContact CG-O 3.22Å; Q384-L446 PolarHBondContact NE2-O 3.47Å; Q384-L446 VanDerWaalsContact NE2-O 3.15Å
385	L	95.4	Very high	89.1	Confident	22 Å²	22	28.5 Å²	28.5	12%	0.115	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.7	177.9	-74.4	163.6	0	0	0	110.2	R283 L284 T285 L292 F411 F448	R283-L385 HydrophobicContact CB-CD1 3.64Å; R283-L385 HydrophobicContact CB-CG 4.29Å; L284-L385 VanDerWaalsContact O-CD1 3.23Å; L284-L385 WeakPolarHBondContact O-CD1 3.49Å; T285-L385 HydrophobicContact CG2-CD1 4.06Å; T285-L385 HydrophobicContact CG2-CD2 4.4Å; L292-L385 HydrophobicContact CD1-CD1 4.24Å; L292-L385 HydrophobicContact CD1-CD2 4.12Å; L292-L385 HydrophobicContact CD2-CD2 4.21Å; L385-F411 HydrophobicContact CD2-CE2 3.75Å; L385-F411 HydrophobicContact CD2-CZ 3.73Å; L385-F448 WeakPolarHBondContact O-CD2 3.17Å
386	H	94.1	Very high	90.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.111	C	C	.	.			trans	-62.9	139.1	177.1	-176.8	-102.9	0	0	0	109.5	K388 G389 W390 A391 F448 G452	H386-K388 PolarHBondContact ND1-N 2.98Å; H386-K388 PolarHBondContact O-N 2.72Å; H386-G389 WeakPolarHBondContact O-CA 3.28Å; H386-G389 PolarHBondContact O-N 2.98Å; H386-W390 AromaticContact CE1-CE2 3.74Å; H386-W390 AromaticContact CE1-CZ2 3.99Å; H386-W390 AromaticContact CE1-NE1 3.31Å; H386-W390 PolarHBondContact CE1-NE1 2.96Å; H386-W390 VanDerWaalsContact CE1-NE1 3.31Å; H386-W390 AromaticContact ND1-CD1 3.74Å; H386-W390 AromaticContact ND1-CE2 3.8Å; H386-W390 AromaticContact ND1-NE1 3.32Å; H386-W390 PolarHBondContact ND1-NE1 2.84Å; H386-A391 HydrophobicContact CB-CB 3.93Å; H386-A391 VanDerWaalsContact CB-O 3.31Å; H386-A391 WeakPolarHBondContact CB-O 3.24Å; H386-A391 PolarHBondContact N-O 2.99Å; H386-F448 VanDerWaalsContact CA-CE2 3.48Å; H386-F448 HydrophobicContact CB-CD2 4.42Å; H386-F448 HydrophobicContact CB-CE2 3.95Å; H386-F448 HydrophobicContact CB-CZ 4.06Å; H386-F448 AromaticContact CD2-CE1 3.86Å; H386-G452 WeakPolarHBondContact NE2-CA 3.45Å; H386-G452 PolarHBondContact NE2-O 2.98Å
387	P	91	Very high	92.1	Very high	49 Å²	49	17 Å²	17	32%	0.318	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.1	-173.3	-27.2	34	0	0	0	114.7	P286 F448 S449 P450	P286-P387 WeakPolarHBondContact CG-O 3.35Å; P387-F448 HydrophobicContact CG-CB 4.13Å; P387-S449 WeakPolarHBondContact CG-O 3.48Å; P387-P450 WeakPolarHBondContact CB-O 3.1Å
388	K	86.8	Confident	93	Very high	78 Å²	78	15.7 Å²	15.7	34%	0.339	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	9.9	177.1	-56.2	-178.9	-173	-175.3	0	113.7	D116 H386 W390 E474	D116-K388 IonicContact OD2-NZ 3.77Å; D116-K388 PolarHBondContact OD2-NZ 3.29Å; H386-K388 PolarHBondContact ND1-N 2.98Å; H386-K388 PolarHBondContact O-N 2.72Å; K388-W390 VanDerWaalsContact C-N 3.28Å; K388-W390 PolarHBondContact O-N 3.36Å; K388-W390 VanDerWaalsContact O-N 3.15Å; K388-E474 VanDerWaalsContact CD-OE1 3.22Å; K388-E474 WeakPolarHBondContact CD-OE1 3.26Å; K388-E474 WeakPolarHBondContact CE-OE1 3.27Å; K388-E474 VanDerWaalsContact NZ-CD 3.33Å; K388-E474 IonicContact NZ-OE1 3.73Å; K388-E474 PolarHBondContact NZ-OE1 2.79Å; K388-E474 IonicContact NZ-OE2 3.38Å; K388-E474 PolarHBondContact NZ-OE2 3.09Å
389	G	87.1	Confident	92.9	Very high	16 Å²	16	19.3 Å²	19.3	17%	0.165	10%	0.104	C	C	.	.	S	Bend	trans	74.9	-4.9	169.8	0	0	0	0	0	118	H386 F411	H386-G389 WeakPolarHBondContact O-CA 3.28Å; H386-G389 PolarHBondContact O-N 2.98Å; G389-F411 VanDerWaalsContact O-CD2 3.29Å; G389-F411 WeakPolarHBondContact O-CD2 3.46Å; G389-F411 WeakPolarHBondContact O-CE2 3.48Å
390	W	85.8	Confident	92.6	Very high	61 Å²	61	24.4 Å²	24.4	23%	0.231	13%	0.127	C	C	.	.	S	Bend	trans	-101.7	4.3	-169.2	67.5	-96.4	0	0	0	115.2	H386 K388 E410 F411 L475 A476 L479	H386-W390 AromaticContact CE1-CE2 3.74Å; H386-W390 AromaticContact CE1-CZ2 3.99Å; H386-W390 AromaticContact CE1-NE1 3.31Å; H386-W390 PolarHBondContact CE1-NE1 2.96Å; H386-W390 VanDerWaalsContact CE1-NE1 3.31Å; H386-W390 AromaticContact ND1-CD1 3.74Å; H386-W390 AromaticContact ND1-CE2 3.8Å; H386-W390 AromaticContact ND1-NE1 3.32Å; H386-W390 PolarHBondContact ND1-NE1 2.84Å; K388-W390 VanDerWaalsContact C-N 3.28Å; K388-W390 PolarHBondContact O-N 3.36Å; K388-W390 VanDerWaalsContact O-N 3.15Å; W390-E410 HydrophobicContact CZ3-CG 4.43Å; W390-F411 WeakPolarHBondContact O-CB 3.38Å; W390-F411 PolarHBondContact O-N 3.34Å; W390-L475 HydrophobicContact CH2-CB 3.48Å; W390-L475 VanDerWaalsContact CH2-CB 3.48Å; W390-L475 HydrophobicContact CH2-CD2 3.65Å; W390-L475 HydrophobicContact CH2-CG 3.42Å; W390-L475 VanDerWaalsContact CH2-CG 3.42Å; W390-L475 HydrophobicContact CZ2-CB 3.81Å; W390-L475 HydrophobicContact CZ2-CD2 4.32Å; W390-L475 HydrophobicContact CZ2-CG 4.22Å; W390-L475 HydrophobicContact CZ3-CD2 3.95Å; W390-L475 HydrophobicContact CZ3-CG 4.03Å; W390-A476 HydrophobicContact CH2-CB 3.68Å; W390-A476 HydrophobicContact CZ2-CB 3.71Å; W390-L479 HydrophobicContact CZ3-CD2 4.3Å
391	A	92.6	Very high	92.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	157.8	169.8	0	0	0	0	0	111.6	H386 Y409 L475	H386-A391 HydrophobicContact CB-CB 3.93Å; H386-A391 VanDerWaalsContact CB-O 3.31Å; H386-A391 WeakPolarHBondContact CB-O 3.24Å; H386-A391 PolarHBondContact N-O 2.99Å; A391-Y409 CarbonylContact C-O 3.51Å; A391-Y409 VanDerWaalsContact CA-O 3.22Å; A391-Y409 WeakPolarHBondContact CA-O 3.27Å; A391-Y409 VanDerWaalsContact CB-O 3.32Å; A391-Y409 WeakPolarHBondContact CB-O 3.41Å; A391-L475 HydrophobicContact CB-CD2 3.85Å
392	T	95.6	Very high	91.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	152.9	171.5	-172	0	0	0	0	111.1	L292 L300 L383 Q384 Y409 F411 L427	L292-T392 HydrophobicContact CD2-CG2 4.1Å; L300-T392 HydrophobicContact CD2-CG2 4.4Å; L383-T392 WeakPolarHBondContact CD1-OG1 3.48Å; Q384-T392 WeakPolarHBondContact O-CA 3.11Å; Q384-T392 PolarHBondContact O-OG1 2.94Å; T392-Y409 PolarHBondContact N-O 3.42Å; T392-Y409 PolarHBondContact O-N 2.82Å; T392-F411 HydrophobicContact CG2-CZ 4.35Å; T392-L427 HydrophobicContact CG2-CD1 4.1Å; T392-L427 HydrophobicContact CG2-CD2 3.78Å
393	L	97.3	Very high	91.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.1	-174.6	166.8	69.6	0	0	0	107.3	Q384 T406 C407 V408 L446 F448 I455	Q384-L393 HydrophobicContact CB-CB 4.19Å; Q384-L393 HydrophobicContact CB-CD2 4.23Å; Q384-L393 HydrophobicContact CB-CG 4.4Å; Q384-L393 PolarHBondContact N-O 2.91Å; Q384-L393 PolarHBondContact O-N 2.82Å; L393-T406 HydrophobicContact CD1-CG2 3.64Å; L393-C407 WeakPolarHBondContact CA-O 3.33Å; L393-V408 HydrophobicContact CD1-CG2 3.89Å; L393-L446 HydrophobicContact CD1-CD1 3.87Å; L393-L446 HydrophobicContact CD2-CD1 3.84Å; L393-L446 HydrophobicContact CG-CD1 3.66Å; L393-F448 HydrophobicContact CB-CD2 4.44Å; L393-F448 HydrophobicContact CB-CE2 3.44Å; L393-F448 VanDerWaalsContact CB-CE2 3.44Å; L393-F448 HydrophobicContact CB-CZ 3.56Å; L393-F448 HydrophobicContact CD2-CD1 4.44Å; L393-F448 HydrophobicContact CD2-CD2 3.92Å; L393-F448 HydrophobicContact CD2-CE1 4.14Å; L393-F448 HydrophobicContact CD2-CE2 3.61Å; L393-F448 HydrophobicContact CD2-CG 4.35Å; L393-F448 HydrophobicContact CD2-CZ 3.75Å; L393-F448 HydrophobicContact CG-CE2 4.18Å; L393-F448 HydrophobicContact CG-CZ 4.21Å; L393-I455 HydrophobicContact CD1-CD1 3.85Å; L393-I455 HydrophobicContact CD2-CD1 4.13Å; L393-I455 HydrophobicContact CD2-CG1 3.93Å; L393-I455 HydrophobicContact CD2-CG2 3.83Å
394	I	96.8	Very high	91.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	149.8	179.1	65.2	173.9	0	0	0	110.9	P368 I380 S382 L383 T406 C407 Y409	P368-I394 HydrophobicContact CB-CD1 4.09Å; P368-I394 HydrophobicContact CG-CD1 4.11Å; I380-I394 HydrophobicContact CD1-CD1 4.45Å; I380-I394 HydrophobicContact CG1-CD1 4.44Å; I380-I394 HydrophobicContact CG2-CB 3.92Å; I380-I394 HydrophobicContact CG2-CD1 4.28Å; I380-I394 HydrophobicContact CG2-CG2 4Å; S382-I394 WeakPolarHBondContact O-CA 3.48Å; L383-I394 HydrophobicContact CD1-CG2 3.7Å; I394-T406 CarbonylContact O-C 3.58Å; I394-T406 WeakPolarHBondContact O-CA 3.48Å; I394-C407 HydrophobicContact CD1-CB 4.46Å; I394-C407 HydrophobicContact CG1-CB 3.92Å; I394-C407 PolarHBondContact N-O 2.87Å; I394-C407 PolarHBondContact O-N 3.13Å; I394-Y409 HydrophobicContact CD1-CD2 4.44Å; I394-Y409 HydrophobicContact CD1-CE2 3.67Å; I394-Y409 HydrophobicContact CG1-CD2 4.4Å; I394-Y409 HydrophobicContact CG1-CE2 3.9Å
395	R	96.1	Very high	91.1	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	139.4	157.1	-171.2	-174	-168.9	123.4	-6.6	108.1	T381 S382 E404 W405 E435 L446 S457 P458	T381-R395 PolarHBondContact N-O 2.79Å; T381-R395 PolarHBondContact OG1-O 2.85Å; S382-R395 PolarHBondContact N-O 3.32Å; S382-R395 PolarHBondContact O-N 2.85Å; R395-E404 IonicContact CZ-OE2 2.73Å; R395-E404 VanDerWaalsContact CZ-OE2 3.29Å; R395-E404 IonicContact NE-OE2 2.75Å; R395-E404 PolarHBondContact NE-OE2 2.95Å; R395-E404 IonicContact NH2-OE2 3.91Å; R395-E404 PolarHBondContact NH2-OE2 2.87Å; R395-W405 WeakPolarHBondContact CA-O 3.35Å; R395-E435 HydrophobicContact CG-CG 4.46Å; R395-E435 IonicContact CZ-OE2 3.64Å; R395-E435 VanDerWaalsContact NH1-CD 3.25Å; R395-E435 IonicContact NH1-OE1 3.65Å; R395-E435 IonicContact NH1-OE2 2.75Å; R395-E435 PolarHBondContact NH1-OE2 2.69Å; R395-E435 VanDerWaalsContact NH1-OE2 3.11Å; R395-E435 IonicContact NH2-OE2 3.29Å; R395-E435 PolarHBondContact NH2-OE2 2.71Å; R395-L446 HydrophobicContact CB-CD1 4.34Å; R395-L446 HydrophobicContact CB-CD2 3.53Å; R395-L446 HydrophobicContact CB-CG 4.49Å; R395-L446 HydrophobicContact CG-CD2 4.11Å; R395-S457 PolarHBondContact NH1-OG 2.94Å; R395-S457 VanDerWaalsContact NH1-OG 3.12Å; R395-P458 PolarHBondContact NH1-O 3.12Å; R395-P458 PolarHBondContact NH2-O 2.88Å
396	C	94	Very high	91.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	142.5	-178.4	50.4	0	0	0	0	110.5	I370 C379 I380 E404 W405	I370-C396 HydrophobicContact CD1-CB 3.88Å; I370-C396 VanDerWaalsContact CD1-SG 3.57Å; C379-C396 CarbonylContact O-C 3.44Å; C379-C396 WeakPolarHBondContact O-CA 3.28Å; C379-C396 WeakPolarHBondContact O-CB 3.21Å; I380-C396 HydrophobicContact CG1-CB 4.4Å; C396-E404 CarbonylContact O-C 3.59Å; C396-E404 WeakPolarHBondContact O-CA 3.49Å; C396-W405 PolarHBondContact N-O 2.88Å; C396-W405 PolarHBondContact O-N 2.85Å; C396-W405 PolarHBondContact SG-O 2.8Å; C396-W405 VanDerWaalsContact SG-O 3.33Å
397	S	92	Very high	91.3	Very high	7 Å²	7	30.9 Å²	30.9	5%	0.049	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.8	179.9	-45.2	0	0	0	0	107.7	N378 C379 E404	N378-S397 WeakPolarHBondContact CA-O 2.99Å; C379-S397 PolarHBondContact N-O 2.83Å; C379-S397 PolarHBondContact O-N 3.35Å; S397-E404 PolarHBondContact OG-OE1 3.18Å
398	S	90	Very high	91.6	Very high	6 Å²	6	28.5 Å²	28.5	4%	0.042	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	152	176.8	58.6	0	0	0	0	112.2	N378 M400 D401 D402 Q403	N378-S398 WeakPolarHBondContact OD1-CA 3.47Å; S398-M400 PolarHBondContact O-N 2.98Å; S398-M400 VanDerWaalsContact O-N 3.1Å; S398-D401 WeakPolarHBondContact O-CA 3.27Å; S398-D401 PolarHBondContact O-N 2.73Å; S398-D401 PolarHBondContact OG-N 3.37Å; S398-D402 PolarHBondContact OG-N 3.17Å; S398-D402 VanDerWaalsContact OG-N 3.08Å; S398-D402 PolarHBondContact OG-OD1 2.73Å; S398-Q403 PolarHBondContact N-O 2.9Å; S398-Q403 PolarHBondContact OG-N 3.05Å; S398-Q403 PolarHBondContact OG-O 2.86Å
399	N	84.7	Confident	91.9	Very high	106 Å²	106	25.1 Å²	25.1	57%	0.567	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15	177	-79.3	16	0	0	0	114.3	G377 N378	G377-N399 WeakPolarHBondContact O-CB 3.26Å; G377-N399 VanDerWaalsContact O-CG 3.23Å; G377-N399 PolarHBondContact O-N 2.82Å; G377-N399 PolarHBondContact O-OD1 3.1Å; N378-N399 WeakPolarHBondContact CA-OD1 3.23Å; N378-N399 PolarHBondContact N-OD1 2.73Å
400	M	85	Confident	92.1	Very high	130 Å²	130	25.8 Å²	25.8	64%	0.64	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-2.2	173.2	-60.8	-55.1	-57.9	0	0	112.8	S398 D402	S398-M400 PolarHBondContact O-N 2.98Å; S398-M400 VanDerWaalsContact O-N 3.1Å; M400-D402 HydrophobicContact CB-CB 4.37Å; M400-D402 PolarHBondContact O-N 3.3Å; M400-D402 VanDerWaalsContact O-N 3.14Å
401	D	84.3	Confident	92.2	Very high	41 Å²	41	24.2 Å²	24.2	22%	0.219	12%	0.121	C	C	.	.	S	Bend	trans	48.7	32.3	-170.3	-153.5	21.3	0	0	0	112.8	S398 N437 R440	S398-D401 WeakPolarHBondContact O-CA 3.27Å; S398-D401 PolarHBondContact O-N 2.73Å; S398-D401 PolarHBondContact OG-N 3.37Å; D401-N437 PolarHBondContact O-ND2 2.94Å; D401-R440 PolarHBondContact O-NE 2.91Å; D401-R440 PolarHBondContact O-NH1 3.04Å; D401-R440 PolarHBondContact O-NH2 2.81Å; D401-R440 WeakPolarHBondContact OD2-CB 3.31Å; D401-R440 WeakPolarHBondContact OD2-CD 3.25Å; D401-R440 WeakPolarHBondContact OD2-CG 3.48Å
402	D	87.4	Confident	91.6	Very high	67 Å²	67	28.5 Å²	28.5	36%	0.358	14%	0.141	S	C	.	.	S	Bend	trans	-101	-25.9	-179.6	73.4	-22.4	0	0	0	113.4	R376 S398 M400 N437	R376-D402 IonicContact CZ-OD2 2.59Å; R376-D402 IonicContact NH1-OD1 2.79Å; R376-D402 PolarHBondContact NH1-OD1 3.4Å; R376-D402 IonicContact NH1-OD2 3.52Å; R376-D402 PolarHBondContact NH1-OD2 3.01Å; S398-D402 PolarHBondContact OG-N 3.17Å; S398-D402 VanDerWaalsContact OG-N 3.08Å; S398-D402 PolarHBondContact OG-OD1 2.73Å; M400-D402 HydrophobicContact CB-CB 4.37Å; M400-D402 PolarHBondContact O-N 3.3Å; M400-D402 VanDerWaalsContact O-N 3.14Å; D402-N437 VanDerWaalsContact CA-ND2 3.31Å; D402-N437 WeakPolarHBondContact CA-ND2 3.5Å; D402-N437 PolarHBondContact O-ND2 2.89Å
403	Q	90	Very high	90.2	Very high	52 Å²	52	37.2 Å²	37.2	24%	0.243	18%	0.182	C	C	.	.			trans	-123.8	149.4	171	-60.8	179.1	3.5	0	0	113	S398	S398-Q403 PolarHBondContact N-O 2.9Å; S398-Q403 PolarHBondContact OG-N 3.05Å; S398-Q403 PolarHBondContact OG-O 2.86Å
404	E	93.2	Very high	87.9	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.014	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145	165.4	-65.6	-156.9	144.9	0	0	111	R395 C396 S397 E435 N437 K444	R395-E404 IonicContact CZ-OE2 2.73Å; R395-E404 VanDerWaalsContact CZ-OE2 3.29Å; R395-E404 IonicContact NE-OE2 2.75Å; R395-E404 PolarHBondContact NE-OE2 2.95Å; R395-E404 IonicContact NH2-OE2 3.91Å; R395-E404 PolarHBondContact NH2-OE2 2.87Å; C396-E404 CarbonylContact O-C 3.59Å; C396-E404 WeakPolarHBondContact O-CA 3.49Å; S397-E404 PolarHBondContact OG-OE1 3.18Å; E404-E435 HydrophobicContact CB-CB 3.68Å; E404-E435 PolarHBondContact O-N 2.7Å; E404-N437 HydrophobicContact CG-CB 4.45Å; E404-K444 WeakPolarHBondContact OE1-CE 3.44Å; E404-K444 IonicContact OE1-NZ 3.68Å; E404-K444 PolarHBondContact OE1-NZ 3.32Å; E404-K444 IonicContact OE2-NZ 3.35Å; E404-K444 PolarHBondContact OE2-NZ 2.82Å
405	W	94.6	Very high	85	Confident	31 Å²	31	44.1 Å²	44.1	12%	0.117	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	139.3	-179.6	-65.2	90.6	0	0	0	111.6	I370 P371 R395 C396 Y432 E434	I370-W405 HydrophobicContact CG2-CB 4.27Å; I370-W405 HydrophobicContact CG2-CG 4.28Å; P371-W405 HydrophobicContact CB-CD2 4.07Å; P371-W405 HydrophobicContact CB-CE3 3.84Å; P371-W405 HydrophobicContact CB-CH2 4.14Å; P371-W405 HydrophobicContact CB-CZ2 4.32Å; P371-W405 HydrophobicContact CB-CZ3 3.88Å; P371-W405 HydrophobicContact CG-CD2 4.33Å; P371-W405 HydrophobicContact CG-CE3 3.93Å; P371-W405 HydrophobicContact CG-CZ3 4.29Å; P371-W405 VanDerWaalsContact O-CE2 3.3Å; P371-W405 PolarHBondContact O-NE1 2.95Å; P371-W405 VanDerWaalsContact O-NE1 3.13Å; R395-W405 WeakPolarHBondContact CA-O 3.35Å; C396-W405 PolarHBondContact N-O 2.88Å; C396-W405 PolarHBondContact O-N 2.85Å; C396-W405 PolarHBondContact SG-O 2.8Å; C396-W405 VanDerWaalsContact SG-O 3.33Å; W405-Y432 AromaticContact CE3-CD2 3.94Å; W405-Y432 HydrophobicContact CE3-CD2 3.94Å; W405-Y432 AromaticContact CZ3-CD2 3.68Å; W405-Y432 HydrophobicContact CZ3-CD2 3.68Å; W405-Y432 AromaticContact CZ3-CE2 3.93Å; W405-Y432 HydrophobicContact CZ3-CE2 3.93Å; W405-E434 HydrophobicContact CD2-CB 4.46Å; W405-E434 HydrophobicContact CE3-CB 3.99Å; W405-E434 HydrophobicContact CH2-CB 3.84Å; W405-E434 HydrophobicContact CH2-CG 4.12Å; W405-E434 HydrophobicContact CZ2-CB 4.34Å; W405-E434 HydrophobicContact CZ2-CG 4.14Å; W405-E434 HydrophobicContact CZ3-CB 3.65Å; W405-E434 HydrophobicContact CZ3-CG 4.33Å
406	T	96.5	Very high	82.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.2	166.4	-72.3	0	0	0	0	108.7	L393 I394 Y432 I433 E435 L446 L486	L393-T406 HydrophobicContact CD1-CG2 3.64Å; I394-T406 CarbonylContact O-C 3.58Å; I394-T406 WeakPolarHBondContact O-CA 3.48Å; T406-Y432 CarbonylContact O-C 3.59Å; T406-Y432 WeakPolarHBondContact O-CA 3.39Å; T406-I433 HydrophobicContact CG2-CG2 4.41Å; T406-I433 PolarHBondContact N-O 2.86Å; T406-I433 PolarHBondContact O-N 2.76Å; T406-E435 WeakPolarHBondContact CB-OE1 3.45Å; T406-E435 VanDerWaalsContact OG1-CD 3.3Å; T406-E435 WeakPolarHBondContact OG1-CG 3.24Å; T406-E435 PolarHBondContact OG1-OE1 3.45Å; T406-L446 HydrophobicContact CG2-CD1 3.88Å; T406-L486 HydrophobicContact CG2-CD1 4.36Å
407	C	96.5	Very high	79.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.7	-174.2	-65.2	0	0	0	0	112.4	P371 L393 I394 Y409 L429	P371-C407 VanDerWaalsContact CD-SG 3.59Å; L393-C407 WeakPolarHBondContact CA-O 3.33Å; I394-C407 HydrophobicContact CD1-CB 4.46Å; I394-C407 HydrophobicContact CG1-CB 3.92Å; I394-C407 PolarHBondContact N-O 2.87Å; I394-C407 PolarHBondContact O-N 3.13Å; C407-Y409 HydrophobicContact CB-CD2 4.36Å; C407-Y409 HydrophobicContact CB-CE2 3.56Å; C407-L429 HydrophobicContact CB-CD1 3.82Å
408	V	96.9	Very high	77.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.7	-179.5	-175.3	0	0	0	0	110.3	L393 T430 H431 I455 F468 L475 L486	L393-V408 HydrophobicContact CD1-CG2 3.89Å; V408-T430 PolarHBondContact O-N 3.02Å; V408-T430 PolarHBondContact O-OG1 3.39Å; V408-H431 HydrophobicContact CB-CB 4.09Å; V408-H431 HydrophobicContact CG2-CB 4.12Å; V408-H431 PolarHBondContact N-O 3.34Å; V408-H431 PolarHBondContact O-N 2.88Å; V408-I455 HydrophobicContact CG2-CD1 3.97Å; V408-F468 HydrophobicContact CG1-CE1 4.25Å; V408-F468 HydrophobicContact CG2-CE1 4.33Å; V408-L475 HydrophobicContact CG1-CD2 3.91Å; V408-L486 HydrophobicContact CG2-CD1 4.12Å; V408-L486 HydrophobicContact CG2-CD2 4.21Å
409	Y	94	Very high	74.9	Confident	6 Å²	6	70.7 Å²	70.7	2%	0.024	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.8	178.4	-63.2	-99.6	0	0	0	111.7	P368 E369 A391 T392 I394 C407 L427 R428 L429	P368-Y409 HydrophobicContact CB-CE1 3.99Å; P368-Y409 HydrophobicContact CB-CE2 4.11Å; P368-Y409 WeakPolarHBondContact CB-OH 3.33Å; E369-Y409 VanDerWaalsContact C-OH 3.29Å; E369-Y409 PolarHBondContact N-OH 2.94Å; E369-Y409 VanDerWaalsContact N-OH 3.12Å; E369-Y409 PolarHBondContact O-OH 2.8Å; A391-Y409 CarbonylContact C-O 3.51Å; A391-Y409 VanDerWaalsContact CA-O 3.22Å; A391-Y409 WeakPolarHBondContact CA-O 3.27Å; A391-Y409 VanDerWaalsContact CB-O 3.32Å; A391-Y409 WeakPolarHBondContact CB-O 3.41Å; T392-Y409 PolarHBondContact N-O 3.42Å; T392-Y409 PolarHBondContact O-N 2.82Å; I394-Y409 HydrophobicContact CD1-CD2 4.44Å; I394-Y409 HydrophobicContact CD1-CE2 3.67Å; I394-Y409 HydrophobicContact CG1-CD2 4.4Å; I394-Y409 HydrophobicContact CG1-CE2 3.9Å; C407-Y409 HydrophobicContact CB-CD2 4.36Å; C407-Y409 HydrophobicContact CB-CE2 3.56Å; Y409-L427 HydrophobicContact CD1-CB 4.01Å; Y409-L427 HydrophobicContact CD1-CD1 4.46Å; Y409-L427 HydrophobicContact CG-CB 4.41Å; Y409-L427 HydrophobicContact CG-CD1 4.35Å; Y409-R428 CarbonylContact C-O 3.36Å; Y409-R428 VanDerWaalsContact CA-O 3.23Å; Y409-R428 WeakPolarHBondContact CA-O 3.34Å; Y409-L429 HydrophobicContact CD1-CB 4.03Å; Y409-L429 HydrophobicContact CD1-CD1 4.36Å; Y409-L429 HydrophobicContact CD2-CD1 4.39Å; Y409-L429 HydrophobicContact CE1-CB 3.7Å; Y409-L429 HydrophobicContact CE1-CD1 3.84Å; Y409-L429 HydrophobicContact CE1-CG 4.36Å; Y409-L429 HydrophobicContact CE2-CD1 3.85Å
410	E	91.6	Very high	73.2	Confident	31 Å²	31	73.5 Å²	73.5	15%	0.145	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	135.5	170	168.7	-176.8	-147.8	0	0	109.9	W390 Q412 L427 R428 T430 L479	W390-E410 HydrophobicContact CZ3-CG 4.43Å; E410-Q412 PolarHBondContact O-N 3.12Å; E410-L427 CarbonylContact O-C 3.59Å; E410-L427 WeakPolarHBondContact O-CA 3.4Å; E410-R428 PolarHBondContact N-O 2.92Å; E410-R428 PolarHBondContact O-N 3.16Å; E410-R428 IonicContact OE2-CZ 3.14Å; E410-R428 IonicContact OE2-NH1 3.31Å; E410-R428 PolarHBondContact OE2-NH1 3.25Å; E410-T430 HydrophobicContact CB-CG2 3.61Å; E410-L479 HydrophobicContact CG-CD2 4.45Å; E410-L479 WeakPolarHBondContact OE1-CD1 3.19Å
411	F	87.4	Confident	71.4	Confident	27 Å²	27	74.1 Å²	74.1	12%	0.118	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	119.4	170.9	-72.9	-63.8	0	0	0	110.8	L292 I302 L385 G389 W390 T392 S426 L427	L292-F411 HydrophobicContact CD1-CE1 4.31Å; L292-F411 HydrophobicContact CD1-CZ 3.8Å; L292-F411 HydrophobicContact CD2-CE1 4.02Å; L292-F411 HydrophobicContact CD2-CZ 3.74Å; L292-F411 HydrophobicContact CG-CZ 4.39Å; I302-F411 HydrophobicContact CD1-CE1 4.29Å; L385-F411 HydrophobicContact CD2-CE2 3.75Å; L385-F411 HydrophobicContact CD2-CZ 3.73Å; G389-F411 VanDerWaalsContact O-CD2 3.29Å; G389-F411 WeakPolarHBondContact O-CD2 3.46Å; G389-F411 WeakPolarHBondContact O-CE2 3.48Å; W390-F411 WeakPolarHBondContact O-CB 3.38Å; W390-F411 PolarHBondContact O-N 3.34Å; T392-F411 HydrophobicContact CG2-CZ 4.35Å; F411-S426 CarbonylContact C-O 3.57Å; F411-S426 WeakPolarHBondContact CA-O 3.35Å; F411-L427 HydrophobicContact CD1-CD2 3.33Å; F411-L427 HydrophobicContact CD1-CG 4.44Å; F411-L427 HydrophobicContact CE1-CD2 3.46Å; F411-L427 VanDerWaalsContact CE1-CD2 3.46Å; F411-L427 HydrophobicContact CG-CD2 4.18Å; F411-L427 HydrophobicContact CZ-CD2 4.38Å
412	Q	80.1	Confident	69.2	Low	91 Å²	91	75.1 Å²	75.1	43%	0.425	42%	0.421	S	S	.	.			trans	-90.5	104.3	175.2	-61.4	-151.6	-35.2	0	0	111.6	E410 G414 S426 R428	E410-Q412 PolarHBondContact O-N 3.12Å; Q412-G414 VanDerWaalsContact C-N 3.33Å; Q412-G414 PolarHBondContact O-N 3.33Å; Q412-S426 PolarHBondContact N-O 3Å; Q412-R428 HydrophobicContact CG-CB 3.93Å; Q412-R428 VanDerWaalsContact NE2-CD 3.3Å
413	E	64.9	Low	67	Low	183 Å²	183	76.5 Å²	76.5	86%	0.855	43%	0.433	S	S	*	.			trans	-72.7	86.4	167	-66.9	-163	153.3	0	0	110.5	A415	E413-A415 PolarHBondContact O-N 3.18Å
414	G	50.2	Low	65	Low	67 Å²	67	79 Å²	79	69%	0.691	44%	0.44	S	S	*	.			trans	-61.6	123.9	179.1	0	0	0	0	0	112.8	Q412	Q412-G414 VanDerWaalsContact C-N 3.33Å; Q412-G414 PolarHBondContact O-N 3.33Å
415	A	35.3	Very low	63.1	Low	77 Å²	77	82 Å²	82	64%	0.636	46%	0.461	S	S	*	.			trans	-58.5	139.9	175.8	0	0	0	0	0	111.5	E413 T417	E413-A415 PolarHBondContact O-N 3.18Å; A415-T417 VanDerWaalsContact C-N 3.31Å; A415-T417 PolarHBondContact O-N 2.9Å; A415-T417 PolarHBondContact O-OG1 3.21Å
416	P	41.4	Very low	61.9	Low	132 Å²	132	80.9 Å²	80.9	86%	0.857	46%	0.458	S	S	*	.			trans	-71.7	81.7	-172.6	29.1	-36.1	0	0	0	112.2	R418	P416-R418 PolarHBondContact O-N 2.81Å
417	T	38.6	Very low	61.3	Low	83 Å²	83	81.4 Å²	81.4	51%	0.509	46%	0.461	S	S	.	.			trans	-73.8	108	179.7	29.6	0	0	0	0	110.8	A415 L420 S422	A415-T417 VanDerWaalsContact C-N 3.31Å; A415-T417 PolarHBondContact O-N 2.9Å; A415-T417 PolarHBondContact O-OG1 3.21Å; T417-L420 PolarHBondContact O-N 3.37Å; T417-S422 WeakPolarHBondContact OG1-CB 3.47Å; T417-S422 PolarHBondContact OG1-OG 3.5Å
418	R	36.4	Very low	61	Low	238 Å²	238	84.7 Å²	84.7	90%	0.898	47%	0.473	S	S	*	.	S	Bend	trans	-75.6	135.1	164.4	-70.5	-177.7	172.4	-170.9	-4	108.8	P416	P416-R418 PolarHBondContact O-N 2.81Å
419	P	44.9	Very low	60.8	Low	120 Å²	120	85.6 Å²	85.6	78%	0.779	48%	0.478	S	S	*	.	S	Bend	cis	-99.9	105.5	6	35.3	-29.6	0	0	0	114.5	V421	P419-V421 PolarHBondContact O-N 3.33Å
420	L	48.5	Very low	60.8	Low	165 Å²	165	85.3 Å²	85.3	86%	0.864	48%	0.477	S	S	*	.	S	Bend	trans	51.3	-0.6	141.9	-92.2	160.8	0	0	0	121.9	T417	T417-L420 PolarHBondContact O-N 3.37Å
421	V	46.1	Very low	61	Low	143 Å²	143	83.9 Å²	83.9	87%	0.867	47%	0.47	S	S	*	.			trans	-136.4	77.3	173.6	-170.7	0	0	0	0	109.5	P419	P419-V421 PolarHBondContact O-N 3.33Å
422	S	39	Very low	61.4	Low	62 Å²	62	85.7 Å²	85.7	43%	0.434	48%	0.477	S	S	.	.			trans	-126.8	143.7	168.7	48.3	0	0	0	0	108.5	T417 R424	T417-S422 WeakPolarHBondContact OG1-CB 3.47Å; T417-S422 PolarHBondContact OG1-OG 3.5Å; S422-R424 PolarHBondContact O-N 3.02Å
423	P	41.2	Very low	62.2	Low	96 Å²	96	82.5 Å²	82.5	62%	0.623	46%	0.462	S	S	*	.			trans	-69.6	119.9	-173.2	27.2	-32.9	0	0	0	110.1	C425	P423-C425 VanDerWaalsContact C-N 3.29Å; P423-C425 PolarHBondContact O-N 3.28Å
424	R	48.5	Very low	63.6	Low	103 Å²	103	79 Å²	79	39%	0.389	45%	0.446	S	S	.	.			trans	-66.4	99.9	150.3	-66.9	-175.5	-177.2	-174.2	0.2	106.5	L320 E364 S422 S426	L320-R424 VanDerWaalsContact CD1-NH1 3.27Å; E364-R424 VanDerWaalsContact OE2-CB 3.31Å; E364-R424 WeakPolarHBondContact OE2-CB 3.44Å; E364-R424 WeakPolarHBondContact OE2-CD 3.35Å; S422-R424 PolarHBondContact O-N 3.02Å; R424-S426 VanDerWaalsContact C-N 3.34Å
425	C	51.6	Low	65.8	Low	67 Å²	67	76.1 Å²	76.1	45%	0.453	42%	0.415	S	S	.	.			trans	-97	76.3	153.2	-166.2	0	0	0	0	104.6	P423 L427	P423-C425 VanDerWaalsContact C-N 3.29Å; P423-C425 PolarHBondContact O-N 3.28Å; C425-L427 PolarHBondContact O-N 2.97Å; C425-L427 PolarHBondContact SG-O 2.89Å
426	S	69.7	Low	68.4	Low	8 Å²	8	73.4 Å²	73.4	6%	0.056	39%	0.392	C	S	.	.			trans	-68.8	-0.6	-172.5	63.9	0	0	0	0	113.4	I302 E364 F411 Q412 R424	I302-S426 WeakPolarHBondContact CD1-OG 3.29Å; E364-S426 WeakPolarHBondContact OE1-CB 3.19Å; E364-S426 PolarHBondContact OE1-N 3.34Å; E364-S426 PolarHBondContact OE1-OG 2.88Å; E364-S426 PolarHBondContact OE2-OG 3.49Å; F411-S426 CarbonylContact C-O 3.57Å; F411-S426 WeakPolarHBondContact CA-O 3.35Å; Q412-S426 PolarHBondContact N-O 3Å; R424-S426 VanDerWaalsContact C-N 3.34Å
427	L	85.3	Confident	70.7	Confident	11 Å²	11	68.9 Å²	68.9	6%	0.058	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.2	172.8	-67.2	-177.3	0	0	0	111.7	L300 I302 L366 T392 Y409 E410 F411 C425	L300-L427 HydrophobicContact CD2-CD1 3.47Å; L300-L427 VanDerWaalsContact CD2-CD1 3.47Å; L300-L427 HydrophobicContact CG-CD1 4.38Å; I302-L427 HydrophobicContact CD1-CD1 4.11Å; I302-L427 HydrophobicContact CD1-CG 4.07Å; L366-L427 HydrophobicContact CD1-CB 4Å; L366-L427 HydrophobicContact CD1-CD1 3.7Å; L366-L427 HydrophobicContact CD1-CG 3.75Å; T392-L427 HydrophobicContact CG2-CD1 4.1Å; T392-L427 HydrophobicContact CG2-CD2 3.78Å; Y409-L427 HydrophobicContact CD1-CB 4.01Å; Y409-L427 HydrophobicContact CD1-CD1 4.46Å; Y409-L427 HydrophobicContact CG-CB 4.41Å; Y409-L427 HydrophobicContact CG-CD1 4.35Å; E410-L427 CarbonylContact O-C 3.59Å; E410-L427 WeakPolarHBondContact O-CA 3.4Å; F411-L427 HydrophobicContact CD1-CD2 3.33Å; F411-L427 HydrophobicContact CD1-CG 4.44Å; F411-L427 HydrophobicContact CE1-CD2 3.46Å; F411-L427 VanDerWaalsContact CE1-CD2 3.46Å; F411-L427 HydrophobicContact CG-CD2 4.18Å; F411-L427 HydrophobicContact CZ-CD2 4.38Å; C425-L427 PolarHBondContact O-N 2.97Å; C425-L427 PolarHBondContact SG-O 2.89Å
428	R	89.3	Confident	73.2	Confident	69 Å²	69	67.3 Å²	67.3	26%	0.26	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.4	167.4	167.2	176.5	176.5	-120.6	3.8	109.3	Y409 E410 Q412 T430 P480 V481	Y409-R428 CarbonylContact C-O 3.36Å; Y409-R428 VanDerWaalsContact CA-O 3.23Å; Y409-R428 WeakPolarHBondContact CA-O 3.34Å; E410-R428 PolarHBondContact N-O 2.92Å; E410-R428 PolarHBondContact O-N 3.16Å; E410-R428 IonicContact OE2-CZ 3.14Å; E410-R428 IonicContact OE2-NH1 3.31Å; E410-R428 PolarHBondContact OE2-NH1 3.25Å; Q412-R428 HydrophobicContact CG-CB 3.93Å; Q412-R428 VanDerWaalsContact NE2-CD 3.3Å; R428-T430 HydrophobicContact CG-CG2 4.47Å; R428-T430 PolarHBondContact O-N 3.25Å; R428-P480 PolarHBondContact NH2-O 3.35Å; R428-V481 PolarHBondContact NH2-O 3Å
429	L	92.4	Very high	75.6	Confident	18 Å²	18	56.7 Å²	56.7	9%	0.094	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	126.6	169.9	-176.1	73.6	0	0	0	108.8	E369 C407 Y409 T483	E369-L429 HydrophobicContact CB-CD2 4.46Å; E369-L429 WeakPolarHBondContact O-CD2 3.19Å; C407-L429 HydrophobicContact CB-CD1 3.82Å; Y409-L429 HydrophobicContact CD1-CB 4.03Å; Y409-L429 HydrophobicContact CD1-CD1 4.36Å; Y409-L429 HydrophobicContact CD2-CD1 4.39Å; Y409-L429 HydrophobicContact CE1-CB 3.7Å; Y409-L429 HydrophobicContact CE1-CD1 3.84Å; Y409-L429 HydrophobicContact CE1-CG 4.36Å; Y409-L429 HydrophobicContact CE2-CD1 3.85Å; L429-T483 HydrophobicContact CB-CG2 4.47Å; L429-T483 HydrophobicContact CD2-CG2 3.55Å; L429-T483 HydrophobicContact CG-CG2 3.61Å
430	T	94.4	Very high	77.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-46.2	178.4	58.8	0	0	0	0	111.9	V408 E410 R428 L479 P480 T483 S484	V408-T430 PolarHBondContact O-N 3.02Å; V408-T430 PolarHBondContact O-OG1 3.39Å; E410-T430 HydrophobicContact CB-CG2 3.61Å; R428-T430 HydrophobicContact CG-CG2 4.47Å; R428-T430 PolarHBondContact O-N 3.25Å; T430-L479 HydrophobicContact CG2-CD2 4.08Å; T430-P480 WeakPolarHBondContact O-CG 3.43Å; T430-T483 WeakPolarHBondContact O-CA 3.46Å; T430-T483 WeakPolarHBondContact O-CG2 3.48Å; T430-S484 PolarHBondContact O-N 3.46Å
431	H	96.3	Very high	79.4	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	151.7	-177.7	-57.4	76.5	0	0	0	111.2	V408 F468 L475 S484 L486	V408-H431 HydrophobicContact CB-CB 4.09Å; V408-H431 HydrophobicContact CG2-CB 4.12Å; V408-H431 PolarHBondContact N-O 3.34Å; V408-H431 PolarHBondContact O-N 2.88Å; H431-F468 AromaticContact CE1-CD1 3.93Å; H431-F468 AromaticContact ND1-CD1 3.88Å; H431-L475 WeakPolarHBondContact CE1-CD1 3.5Å; H431-L475 WeakPolarHBondContact ND1-CD1 3.48Å; H431-S484 CarbonylContact C-O 3.44Å; H431-S484 VanDerWaalsContact CA-O 3.25Å; H431-S484 WeakPolarHBondContact CA-O 3.5Å; H431-S484 PolarHBondContact CD2-OG 2.75Å; H431-S484 PolarHBondContact NE2-OG 2.9Å; H431-L486 HydrophobicContact CB-CD2 3.51Å; H431-L486 HydrophobicContact CB-CG 3.79Å
432	Y	96.4	Very high	81.6	Confident	65 Å²	65	50.9 Å²	50.9	26%	0.255	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	168.2	170.4	64.8	-88.5	0	0	0	111.9	P371 W405 T406 T483 S484 C485 L486	P371-Y432 HydrophobicContact CB-CD2 4.03Å; P371-Y432 HydrophobicContact CB-CE2 4.18Å; P371-Y432 HydrophobicContact CB-CG 4.4Å; P371-Y432 HydrophobicContact CG-CD1 3.94Å; P371-Y432 HydrophobicContact CG-CD2 3.45Å; P371-Y432 VanDerWaalsContact CG-CD2 3.45Å; P371-Y432 HydrophobicContact CG-CE1 4.47Å; P371-Y432 HydrophobicContact CG-CE2 4.03Å; P371-Y432 HydrophobicContact CG-CG 3.39Å; W405-Y432 AromaticContact CE3-CD2 3.94Å; W405-Y432 HydrophobicContact CE3-CD2 3.94Å; W405-Y432 AromaticContact CZ3-CD2 3.68Å; W405-Y432 HydrophobicContact CZ3-CD2 3.68Å; W405-Y432 AromaticContact CZ3-CE2 3.93Å; W405-Y432 HydrophobicContact CZ3-CE2 3.93Å; T406-Y432 CarbonylContact O-C 3.59Å; T406-Y432 WeakPolarHBondContact O-CA 3.39Å; Y432-T483 HydrophobicContact CD1-CG2 3.59Å; Y432-T483 HydrophobicContact CE1-CG2 3.86Å; Y432-S484 WeakPolarHBondContact CD1-O 3.4Å; Y432-S484 PolarHBondContact N-O 2.98Å; Y432-C485 CarbonylContact O-C 3.54Å; Y432-C485 WeakPolarHBondContact O-CA 3.18Å; Y432-L486 PolarHBondContact O-N 2.97Å
433	I	96.3	Very high	84.2	Confident	24 Å²	24	49.8 Å²	49.8	12%	0.123	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	147.1	166.2	-166.9	167.1	0	0	0	110.1	T406 L466 L486	T406-I433 HydrophobicContact CG2-CG2 4.41Å; T406-I433 PolarHBondContact N-O 2.86Å; T406-I433 PolarHBondContact O-N 2.76Å; I433-L466 HydrophobicContact CD1-CD2 3.86Å; I433-L466 HydrophobicContact CG2-CD1 3.85Å; I433-L486 HydrophobicContact CB-CB 4.21Å; I433-L486 HydrophobicContact CG2-CB 4.37Å; I433-L486 HydrophobicContact CG2-CD1 4.09Å
434	E	94.8	Very high	86.8	Confident	109 Å²	109	45.3 Å²	45.3	51%	0.509	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	139.4	171.1	-164.9	172.7	-171.3	0	0	109.8	W405 R464	W405-E434 HydrophobicContact CD2-CB 4.46Å; W405-E434 HydrophobicContact CE3-CB 3.99Å; W405-E434 HydrophobicContact CH2-CB 3.84Å; W405-E434 HydrophobicContact CH2-CG 4.12Å; W405-E434 HydrophobicContact CZ2-CB 4.34Å; W405-E434 HydrophobicContact CZ2-CG 4.14Å; W405-E434 HydrophobicContact CZ3-CB 3.65Å; W405-E434 HydrophobicContact CZ3-CG 4.33Å; E434-R464 PolarHBondContact O-NH1 2.71Å; E434-R464 PolarHBondContact O-NH2 2.76Å
435	E	94.6	Very high	89.1	Confident	8 Å²	8	40.6 Å²	40.6	4%	0.037	22%	0.217	C	C	.	.			trans	-107.2	156	-177	-80.5	-66.4	161.1	0	0	112.2	R395 E404 T406 N437 S457 R464	R395-E435 HydrophobicContact CG-CG 4.46Å; R395-E435 IonicContact CZ-OE2 3.64Å; R395-E435 VanDerWaalsContact NH1-CD 3.25Å; R395-E435 IonicContact NH1-OE1 3.65Å; R395-E435 IonicContact NH1-OE2 2.75Å; R395-E435 PolarHBondContact NH1-OE2 2.69Å; R395-E435 VanDerWaalsContact NH1-OE2 3.11Å; R395-E435 IonicContact NH2-OE2 3.29Å; R395-E435 PolarHBondContact NH2-OE2 2.71Å; E404-E435 HydrophobicContact CB-CB 3.68Å; E404-E435 PolarHBondContact O-N 2.7Å; T406-E435 WeakPolarHBondContact CB-OE1 3.45Å; T406-E435 VanDerWaalsContact OG1-CD 3.3Å; T406-E435 WeakPolarHBondContact OG1-CG 3.24Å; T406-E435 PolarHBondContact OG1-OE1 3.45Å; E435-N437 PolarHBondContact O-N 3.43Å; E435-S457 VanDerWaalsContact CD-OG 3.26Å; E435-S457 WeakPolarHBondContact OE1-CB 3.25Å; E435-S457 PolarHBondContact OE1-OG 2.81Å; E435-S457 PolarHBondContact OE2-OG 2.78Å; E435-R464 IonicContact OE1-CZ 2.98Å; E435-R464 IonicContact OE1-NE 2.72Å; E435-R464 IonicContact OE1-NH2 3.69Å; E435-R464 PolarHBondContact OE1-NH2 2.86Å; E435-R464 IonicContact OE2-CZ 2.97Å; E435-R464 IonicContact OE2-NE 2.82Å; E435-R464 IonicContact OE2-NH2 2.79Å; E435-R464 PolarHBondContact OE2-NH2 3.49Å
436	A	90.6	Very high	91.3	Very high	19 Å²	19	37.4 Å²	37.4	16%	0.157	20%	0.195	C	C	.	.			trans	-68.4	106.9	174.6	0	0	0	0	0	110.6	V438 Y459	A436-V438 PolarHBondContact O-N 3.05Å; A436-Y459 HydrophobicContact CB-CD1 4.46Å; A436-Y459 HydrophobicContact CB-CD2 3.53Å; A436-Y459 HydrophobicContact CB-CE1 4.44Å; A436-Y459 HydrophobicContact CB-CE2 3.5Å; A436-Y459 HydrophobicContact CB-CG 4.04Å; A436-Y459 VanDerWaalsContact N-CE2 3.35Å
437	N	89.3	Confident	92.6	Very high	37 Å²	37	37.3 Å²	37.3	20%	0.198	20%	0.195	C	C	.	.			trans	-72.2	78.3	170.5	-177.7	-0.5	0	0	0	111.1	D401 D402 E404 E435 R440	D401-N437 PolarHBondContact O-ND2 2.94Å; D402-N437 VanDerWaalsContact CA-ND2 3.31Å; D402-N437 WeakPolarHBondContact CA-ND2 3.5Å; D402-N437 PolarHBondContact O-ND2 2.89Å; E404-N437 HydrophobicContact CG-CB 4.45Å; E435-N437 PolarHBondContact O-N 3.43Å; N437-R440 PolarHBondContact ND2-NH2 2.94Å; N437-R440 WeakPolarHBondContact OD1-CG 3.25Å; N437-R440 PolarHBondContact OD1-NE 3.28Å; N437-R440 VanDerWaalsContact OD1-NE 3.15Å
438	V	92	Very high	93.1	Very high	50 Å²	50	37.7 Å²	37.7	30%	0.303	20%	0.196	S	C	.	.			trans	-133.4	163.5	164.6	-61.6	0	0	0	0	109.5	A436 K444 V498	A436-V438 PolarHBondContact O-N 3.05Å; V438-K444 PolarHBondContact O-NZ 3.39Å; V438-V498 HydrophobicContact CB-CG2 4.22Å; V438-V498 HydrophobicContact CG2-CG1 3.74Å; V438-V498 HydrophobicContact CG2-CG2 3.93Å
439	G	85.8	Confident	93.3	Very high	15 Å²	15	34.4 Å²	34.4	16%	0.155	18%	0.184	C	C	.	.	S	Bend	trans	62.3	52.1	-174.1	0	0	0	0	0	111.2	Y442	G439-Y442 PolarHBondContact O-N 2.86Å
440	R	88.1	Confident	93.1	Very high	138 Å²	138	36.2 Å²	36.2	52%	0.521	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	147.4	179.9	-78.1	-169.2	-176.7	-171.6	-2.2	112.1	D401 N437 Y442	D401-R440 PolarHBondContact O-NE 2.91Å; D401-R440 PolarHBondContact O-NH1 3.04Å; D401-R440 PolarHBondContact O-NH2 2.81Å; D401-R440 WeakPolarHBondContact OD2-CB 3.31Å; D401-R440 WeakPolarHBondContact OD2-CD 3.25Å; D401-R440 WeakPolarHBondContact OD2-CG 3.48Å; N437-R440 PolarHBondContact ND2-NH2 2.94Å; N437-R440 WeakPolarHBondContact OD1-CG 3.25Å; N437-R440 PolarHBondContact OD1-NE 3.28Å; N437-R440 VanDerWaalsContact OD1-NE 3.15Å; R440-Y442 WeakPolarHBondContact O-CD2 3.47Å; R440-Y442 PolarHBondContact O-N 3.19Å; R440-Y442 VanDerWaalsContact O-N 3.09Å
441	G	86.1	Confident	92.7	Very high	76 Å²	76	37 Å²	37	78%	0.784	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.6	-23.8	-172.2	0	0	0	0	0	116.1
442	Y	91.8	Very high	92.4	Very high	93 Å²	93	37 Å²	37	37%	0.365	20%	0.2	S	C	.	.	S	Bend	trans	-83.7	136.5	179.5	-65.7	-88.2	0	0	0	112.6	F150 G439 R440 K444 L500 L516	F150-Y442 HydrophobicContact CE1-CD1 4.3Å; F150-Y442 HydrophobicContact CE1-CE1 4.4Å; G439-Y442 PolarHBondContact O-N 2.86Å; R440-Y442 WeakPolarHBondContact O-CD2 3.47Å; R440-Y442 PolarHBondContact O-N 3.19Å; R440-Y442 VanDerWaalsContact O-N 3.09Å; Y442-K444 WeakPolarHBondContact O-CE 3.39Å; Y442-L500 HydrophobicContact CD1-CD1 3.91Å; Y442-L500 HydrophobicContact CG-CD1 4.33Å; Y442-L500 HydrophobicContact CG-CD2 4.17Å; Y442-L516 HydrophobicContact CD1-CD2 3.69Å; Y442-L516 HydrophobicContact CD2-CD1 4.44Å; Y442-L516 HydrophobicContact CD2-CD2 3.88Å; Y442-L516 HydrophobicContact CE1-CD2 3.49Å; Y442-L516 VanDerWaalsContact CE1-CD2 3.49Å; Y442-L516 HydrophobicContact CE2-CD1 4.35Å; Y442-L516 HydrophobicContact CE2-CD2 3.69Å; Y442-L516 HydrophobicContact CG-CD2 3.88Å; Y442-L516 VanDerWaalsContact CZ-CD2 3.49Å
443	I	93.6	Very high	92.2	Very high	38 Å²	38	34.2 Å²	34.2	20%	0.195	19%	0.19	C	C	.	.			trans	-75.5	129.7	174.7	-60.2	172.3	0	0	0	109.5	M280 T381	M280-I443 HydrophobicContact CE-CD1 3.59Å; M280-I443 HydrophobicContact CE-CG1 4.07Å; T381-I443 WeakPolarHBondContact O-CG2 3.42Å
444	K	96.5	Very high	92	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.009	18%	0.184	C	C	.	.			trans	-107.4	109.5	-179.8	-81.3	151	-76	174.7	0	111	S382 E404 V438 Y442 L446 P458 L500	S382-K444 VanDerWaalsContact CB-O 3.31Å; S382-K444 WeakPolarHBondContact CB-O 3.41Å; E404-K444 WeakPolarHBondContact OE1-CE 3.44Å; E404-K444 IonicContact OE1-NZ 3.68Å; E404-K444 PolarHBondContact OE1-NZ 3.32Å; E404-K444 IonicContact OE2-NZ 3.35Å; E404-K444 PolarHBondContact OE2-NZ 2.82Å; V438-K444 PolarHBondContact O-NZ 3.39Å; Y442-K444 WeakPolarHBondContact O-CE 3.39Å; K444-L446 WeakPolarHBondContact O-CD2 3.48Å; K444-P458 HydrophobicContact CB-CB 4.18Å; K444-P458 HydrophobicContact CB-CG 4.11Å; K444-P458 HydrophobicContact CG-CB 4.18Å; K444-L500 CarbonylContact C-O 3.58Å; K444-L500 VanDerWaalsContact CA-O 3.25Å; K444-L500 WeakPolarHBondContact CA-O 3.47Å; K444-L500 HydrophobicContact CG-CD2 4.16Å
445	E	97.3	Very high	92.2	Very high	4 Å²	4	28 Å²	28	2%	0.019	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-88.2	111.5	-178.4	-65.8	-63.2	163.9	0	0	112.6	R281 S382 Q384 P458 L500 T501 T502	R281-E445 IonicContact CZ-OE1 3.72Å; R281-E445 IonicContact NE-OE1 3.63Å; R281-E445 PolarHBondContact NE-OE1 2.75Å; R281-E445 IonicContact NH2-OE1 2.74Å; R281-E445 PolarHBondContact NH2-OE1 3.48Å; S382-E445 PolarHBondContact OG-OE2 3.14Å; Q384-E445 PolarHBondContact NE2-OE2 2.85Å; Q384-E445 VanDerWaalsContact NE2-OE2 3.1Å; E445-P458 WeakPolarHBondContact O-CD 3.4Å; E445-P458 VanDerWaalsContact O-CG 3.27Å; E445-P458 WeakPolarHBondContact O-CG 3.22Å; E445-L500 PolarHBondContact N-O 2.69Å; E445-T501 WeakPolarHBondContact O-CA 3.33Å; E445-T502 PolarHBondContact O-N 3.12Å; E445-T502 PolarHBondContact O-OG1 2.73Å
446	L	96.9	Very high	92.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.158	C	C	.	.			trans	-90	165.5	170.7	26	156.1	0	0	0	110.2	Q384 L393 R395 T406 K444 C456 T502	Q384-L446 VanDerWaalsContact CD-O 3.27Å; Q384-L446 VanDerWaalsContact CG-O 3.27Å; Q384-L446 WeakPolarHBondContact CG-O 3.22Å; Q384-L446 PolarHBondContact NE2-O 3.47Å; Q384-L446 VanDerWaalsContact NE2-O 3.15Å; L393-L446 HydrophobicContact CD1-CD1 3.87Å; L393-L446 HydrophobicContact CD2-CD1 3.84Å; L393-L446 HydrophobicContact CG-CD1 3.66Å; R395-L446 HydrophobicContact CB-CD1 4.34Å; R395-L446 HydrophobicContact CB-CD2 3.53Å; R395-L446 HydrophobicContact CB-CG 4.49Å; R395-L446 HydrophobicContact CG-CD2 4.11Å; T406-L446 HydrophobicContact CG2-CD1 3.88Å; K444-L446 WeakPolarHBondContact O-CD2 3.48Å; L446-C456 VanDerWaalsContact CA-O 3.28Å; L446-C456 WeakPolarHBondContact CA-O 3.42Å; L446-C456 WeakPolarHBondContact CB-O 3.37Å; L446-T502 WeakPolarHBondContact CA-OG1 3.4Å
447	C	97	Very high	92.6	Very high	7 Å²	7	26.7 Å²	26.7	5%	0.047	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	153.4	175.7	59.6	0	0	0	0	112.6	I455 C456 T502 K503 F504	C447-I455 CarbonylContact O-C 3.56Å; C447-I455 WeakPolarHBondContact O-CA 3.18Å; C447-C456 PolarHBondContact N-O 3.34Å; C447-C456 PolarHBondContact O-N 2.82Å; C447-T502 VanDerWaalsContact SG-C 3.5Å; C447-T502 PolarHBondContact SG-O 3.36Å; C447-T502 VanDerWaalsContact SG-O 3.35Å; C447-K503 HydrophobicContact CB-CD 4.46Å; C447-K503 VanDerWaalsContact SG-CA 3.53Å; C447-F504 VanDerWaalsContact SG-CD2 3.52Å
448	F	95.9	Very high	93	Very high	18 Å²	18	25 Å²	25	8%	0.079	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	150.7	165.1	-76.2	-74	0	0	0	111	L385 H386 P387 L393 L454 I455 F468 F504	L385-F448 WeakPolarHBondContact O-CD2 3.17Å; H386-F448 VanDerWaalsContact CA-CE2 3.48Å; H386-F448 HydrophobicContact CB-CD2 4.42Å; H386-F448 HydrophobicContact CB-CE2 3.95Å; H386-F448 HydrophobicContact CB-CZ 4.06Å; H386-F448 AromaticContact CD2-CE1 3.86Å; P387-F448 HydrophobicContact CG-CB 4.13Å; L393-F448 HydrophobicContact CB-CD2 4.44Å; L393-F448 HydrophobicContact CB-CE2 3.44Å; L393-F448 VanDerWaalsContact CB-CE2 3.44Å; L393-F448 HydrophobicContact CB-CZ 3.56Å; L393-F448 HydrophobicContact CD2-CD1 4.44Å; L393-F448 HydrophobicContact CD2-CD2 3.92Å; L393-F448 HydrophobicContact CD2-CE1 4.14Å; L393-F448 HydrophobicContact CD2-CE2 3.61Å; L393-F448 HydrophobicContact CD2-CG 4.35Å; L393-F448 HydrophobicContact CD2-CZ 3.75Å; L393-F448 HydrophobicContact CG-CE2 4.18Å; L393-F448 HydrophobicContact CG-CZ 4.21Å; F448-L454 CarbonylContact C-O 3.55Å; F448-L454 WeakPolarHBondContact CA-O 3.26Å; F448-I455 HydrophobicContact CD1-CD1 4.43Å; F448-I455 HydrophobicContact CD1-CG1 3.59Å; F448-I455 HydrophobicContact CE1-CD1 3.86Å; F448-I455 HydrophobicContact CE1-CG1 3.53Å; F448-I455 HydrophobicContact CZ-CG1 4.43Å; F448-F468 HydrophobicContact CE1-CZ 4.09Å; F448-F504 VanDerWaalsContact C-CD2 3.46Å; F448-F504 VanDerWaalsContact O-CD2 3.25Å; F448-F504 WeakPolarHBondContact O-CD2 3.48Å
449	S	93.4	Very high	93.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.			trans	-60.9	157.9	161.7	58	0	0	0	0	110.8	P387 D451 G452 R453 L454 F504	P387-S449 WeakPolarHBondContact CG-O 3.48Å; S449-D451 WeakPolarHBondContact CB-OD1 3.5Å; S449-D451 PolarHBondContact O-N 2.83Å; S449-D451 VanDerWaalsContact O-N 3.13Å; S449-D451 PolarHBondContact OG-OD1 3.41Å; S449-G452 WeakPolarHBondContact O-CA 3.16Å; S449-G452 PolarHBondContact O-N 2.84Å; S449-G452 PolarHBondContact OG-N 2.95Å; S449-R453 PolarHBondContact OG-N 3.36Å; S449-L454 PolarHBondContact N-O 2.98Å; S449-L454 PolarHBondContact OG-N 2.85Å; S449-L454 PolarHBondContact OG-O 3.32Å; S449-F504 VanDerWaalsContact CA-CD2 3.48Å
450	P	89	Confident	93.7	Very high	57 Å²	57	25.1 Å²	25.1	37%	0.37	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-27.3	-177.2	-24.9	35.2	0	0	0	114.3	P387 F504 S505	P387-P450 WeakPolarHBondContact CB-O 3.1Å; P450-F504 HydrophobicContact CG-CB 4.44Å; P450-S505 WeakPolarHBondContact CG-O 3.12Å
451	D	85	Confident	94	Very high	16 Å²	16	24.4 Å²	24.4	9%	0.086	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-8	175	68.5	-9.7	0	0	0	114.2	A118 S449 R453	A118-D451 HydrophobicContact CB-CB 3.57Å; S449-D451 WeakPolarHBondContact CB-OD1 3.5Å; S449-D451 PolarHBondContact O-N 2.83Å; S449-D451 VanDerWaalsContact O-N 3.13Å; S449-D451 PolarHBondContact OG-OD1 3.41Å; D451-R453 VanDerWaalsContact C-N 3.35Å; D451-R453 PolarHBondContact OD1-N 3.31Å; D451-R453 WeakPolarHBondContact OD2-CD 3.38Å; D451-R453 WeakPolarHBondContact OD2-CG 3.32Å; D451-R453 IonicContact OD2-NE 3.38Å
452	G	90.2	Very high	94.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	81.7	-1.7	178.4	0	0	0	0	0	116.3	H386 S449 F468	H386-G452 WeakPolarHBondContact NE2-CA 3.45Å; H386-G452 PolarHBondContact NE2-O 2.98Å; S449-G452 WeakPolarHBondContact O-CA 3.16Å; S449-G452 PolarHBondContact O-N 2.84Å; S449-G452 PolarHBondContact OG-N 2.95Å; G452-F468 WeakPolarHBondContact O-CE2 3.46Å
453	R	91.2	Very high	94.7	Very high	7 Å²	7	16.4 Å²	16.4	3%	0.026	8%	0.08	C	C	.	.	S	Bend	trans	-76	-28	-173.3	-63.7	-178.7	-176.3	-101.1	-0.2	114.7	F122 S449 D451 F468 C472	F122-R453 VanDerWaalsContact CB-NE 3.26Å; F122-R453 VanDerWaalsContact CD2-NH1 3.26Å; S449-R453 PolarHBondContact OG-N 3.36Å; D451-R453 VanDerWaalsContact C-N 3.35Å; D451-R453 PolarHBondContact OD1-N 3.31Å; D451-R453 WeakPolarHBondContact OD2-CD 3.38Å; D451-R453 WeakPolarHBondContact OD2-CG 3.32Å; D451-R453 IonicContact OD2-NE 3.38Å; R453-F468 WeakPolarHBondContact O-CE2 3.17Å; R453-C472 WeakPolarHBondContact CD-O 3.18Å; R453-C472 PolarHBondContact NH1-O 3.19Å
454	L	93.9	Very high	94.8	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.01	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	152.3	-179.5	-62.2	177.8	0	0	0	110.3	Y129 F448 S449 L466 A467 C472 F504	Y129-L454 HydrophobicContact CD2-CD1 3.79Å; Y129-L454 HydrophobicContact CG-CD1 3.88Å; F448-L454 CarbonylContact C-O 3.55Å; F448-L454 WeakPolarHBondContact CA-O 3.26Å; S449-L454 PolarHBondContact N-O 2.98Å; S449-L454 PolarHBondContact OG-N 2.85Å; S449-L454 PolarHBondContact OG-O 3.32Å; L454-L466 WeakPolarHBondContact CA-O 3.2Å; L454-A467 HydrophobicContact CD2-CB 3.85Å; L454-C472 HydrophobicContact CD2-CB 4.04Å; L454-F504 HydrophobicContact CB-CZ 4.48Å
455	I	97.4	Very high	94.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.3	168	-63.9	157.6	0	0	0	107.2	L393 V408 C447 F448 L465 L466 F468 L486	L393-I455 HydrophobicContact CD1-CD1 3.85Å; L393-I455 HydrophobicContact CD2-CD1 4.13Å; L393-I455 HydrophobicContact CD2-CG1 3.93Å; L393-I455 HydrophobicContact CD2-CG2 3.83Å; V408-I455 HydrophobicContact CG2-CD1 3.97Å; C447-I455 CarbonylContact O-C 3.56Å; C447-I455 WeakPolarHBondContact O-CA 3.18Å; F448-I455 HydrophobicContact CD1-CD1 4.43Å; F448-I455 HydrophobicContact CD1-CG1 3.59Å; F448-I455 HydrophobicContact CE1-CD1 3.86Å; F448-I455 HydrophobicContact CE1-CG1 3.53Å; F448-I455 HydrophobicContact CZ-CG1 4.43Å; I455-L465 WeakPolarHBondContact O-CA 3.24Å; I455-L466 HydrophobicContact CB-CB 4.21Å; I455-L466 HydrophobicContact CG2-CD1 4.44Å; I455-L466 PolarHBondContact N-O 3.12Å; I455-L466 PolarHBondContact O-N 3.23Å; I455-F468 HydrophobicContact CD1-CE1 4.13Å; I455-F468 HydrophobicContact CD1-CZ 4.4Å; I455-L486 HydrophobicContact CD1-CD1 3.89Å; I455-L486 HydrophobicContact CD1-CD2 4.36Å
456	C	97.5	Very high	94.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.7	163.9	-170.6	0	0	0	0	108.6	L446 C447 R464 L465 T502 F504 L511	L446-C456 VanDerWaalsContact CA-O 3.28Å; L446-C456 WeakPolarHBondContact CA-O 3.42Å; L446-C456 WeakPolarHBondContact CB-O 3.37Å; C447-C456 PolarHBondContact N-O 3.34Å; C447-C456 PolarHBondContact O-N 2.82Å; C456-R464 WeakPolarHBondContact CA-O 3.42Å; C456-L465 HydrophobicContact CB-CD2 4.04Å; C456-T502 PolarHBondContact O-OG1 3.28Å; C456-F504 HydrophobicContact CB-CD2 4.33Å; C456-F504 HydrophobicContact CB-CE2 3.49Å; C456-F504 VanDerWaalsContact CB-CE2 3.49Å; C456-F504 HydrophobicContact CB-CZ 3.75Å; C456-L511 HydrophobicContact CB-CD1 3.85Å; C456-L511 HydrophobicContact CB-CD2 4.49Å; C456-L511 VanDerWaalsContact SG-CD2 3.56Å
457	S	97.7	Very high	94.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135	178.6	-166.7	0	0	0	0	111.1	R395 E435 Y459 V463 R464	R395-S457 PolarHBondContact NH1-OG 2.94Å; R395-S457 VanDerWaalsContact NH1-OG 3.12Å; E435-S457 VanDerWaalsContact CD-OG 3.26Å; E435-S457 WeakPolarHBondContact OE1-CB 3.25Å; E435-S457 PolarHBondContact OE1-OG 2.81Å; E435-S457 PolarHBondContact OE2-OG 2.78Å; S457-Y459 PolarHBondContact O-N 2.89Å; S457-V463 WeakPolarHBondContact O-CA 3.36Å; S457-R464 PolarHBondContact N-O 2.79Å; S457-R464 PolarHBondContact O-N 2.8Å
458	P	97.4	Very high	94.6	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.006	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	124.8	166.1	-18.2	28.7	0	0	0	110.6	R395 K444 E445 V499 T502	R395-P458 PolarHBondContact NH1-O 3.12Å; R395-P458 PolarHBondContact NH2-O 2.88Å; K444-P458 HydrophobicContact CB-CB 4.18Å; K444-P458 HydrophobicContact CB-CG 4.11Å; K444-P458 HydrophobicContact CG-CB 4.18Å; E445-P458 WeakPolarHBondContact O-CD 3.4Å; E445-P458 VanDerWaalsContact O-CG 3.27Å; E445-P458 WeakPolarHBondContact O-CG 3.22Å; P458-V499 HydrophobicContact CB-CB 4.13Å; P458-V499 HydrophobicContact CB-CG1 3.93Å; P458-V499 VanDerWaalsContact CB-O 3.27Å; P458-V499 WeakPolarHBondContact CB-O 3.38Å; P458-T502 HydrophobicContact CG-CG2 4.06Å
459	Y	96.4	Very high	94.3	Very high	58 Å²	58	15.7 Å²	15.7	23%	0.227	8%	0.076	C	C	.	.			trans	-146	98.4	-173.2	-169.1	-98.7	0	0	0	111	A436 S457 G462 R464 Y493	A436-Y459 HydrophobicContact CB-CD1 4.46Å; A436-Y459 HydrophobicContact CB-CD2 3.53Å; A436-Y459 HydrophobicContact CB-CE1 4.44Å; A436-Y459 HydrophobicContact CB-CE2 3.5Å; A436-Y459 HydrophobicContact CB-CG 4.04Å; A436-Y459 VanDerWaalsContact N-CE2 3.35Å; S457-Y459 PolarHBondContact O-N 2.89Å; Y459-G462 CarbonylContact C-O 3.49Å; Y459-G462 PolarHBondContact N-O 3.48Å; Y459-G462 CarbonylContact O-C 3.5Å; Y459-G462 PolarHBondContact O-N 3.09Å; Y459-G462 VanDerWaalsContact O-O 3.12Å; Y459-R464 HydrophobicContact CD2-CG 4.38Å; Y459-R464 VanDerWaalsContact CD2-CZ 3.49Å; Y459-R464 VanDerWaalsContact CD2-NE 3.33Å; Y459-R464 VanDerWaalsContact CE2-CZ 3.5Å; Y459-R464 VanDerWaalsContact CE2-NH1 3.29Å; Y459-R464 HydrophobicContact CG-CB 4.5Å; Y459-R464 HydrophobicContact CG-CG 4.09Å; Y459-Y493 HydrophobicContact CD1-CE1 4.36Å; Y459-Y493 WeakPolarHBondContact CD1-OH 3.31Å; Y459-Y493 WeakPolarHBondContact CE1-OH 3.34Å
460	G	95.4	Very high	94	Very high	11 Å²	11	22.8 Å²	22.8	11%	0.113	11%	0.109	C	C	.	.	S	Bend	trans	65.4	-137.6	-176.1	0	0	0	0	0	112.6	G462 V499	G460-G462 PolarHBondContact O-N 3.38Å; G460-G462 VanDerWaalsContact O-N 3.12Å; G460-V499 PolarHBondContact O-N 3.13Å
461	Y	95.2	Very high	93.9	Very high	122 Å²	122	28.7 Å²	28.7	48%	0.478	12%	0.124	S	C	.	.	S	Bend	trans	-81	28.9	175.4	-54.5	-85.7	0	0	0	112.4	S494 H495 D497 V498	Y461-S494 PolarHBondContact O-N 3.42Å; Y461-H495 PolarHBondContact O-N 2.85Å; Y461-H495 VanDerWaalsContact O-N 3.1Å; Y461-D497 VanDerWaalsContact CD1-C 3.49Å; Y461-V498 HydrophobicContact CE1-CG2 4.45Å
462	G	95.2	Very high	94.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	-169.6	-169	0	0	0	0	0	114.1	Y459 G460 I492 V499	Y459-G462 CarbonylContact C-O 3.49Å; Y459-G462 PolarHBondContact N-O 3.48Å; Y459-G462 CarbonylContact O-C 3.5Å; Y459-G462 PolarHBondContact O-N 3.09Å; Y459-G462 VanDerWaalsContact O-O 3.12Å; G460-G462 PolarHBondContact O-N 3.38Å; G460-G462 VanDerWaalsContact O-N 3.12Å; G462-I492 CarbonylContact C-O 3.56Å; G462-I492 WeakPolarHBondContact CA-O 3.38Å; G462-V499 WeakPolarHBondContact O-CB 3.33Å; G462-V499 VanDerWaalsContact O-CG2 3.3Å; G462-V499 WeakPolarHBondContact O-CG2 3.37Å
463	V	96	Very high	94	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	148.8	177.8	-62.4	0	0	0	0	109.9	S457 S491 I492 V499 T502 L511 Y523	S457-V463 WeakPolarHBondContact O-CA 3.36Å; V463-S491 CarbonylContact O-C 3.54Å; V463-S491 WeakPolarHBondContact O-CA 3.44Å; V463-I492 HydrophobicContact CG2-CB 4.05Å; V463-I492 PolarHBondContact N-O 2.94Å; V463-I492 PolarHBondContact O-N 3.42Å; V463-V499 HydrophobicContact CG1-CG1 4.14Å; V463-T502 HydrophobicContact CB-CG2 4.39Å; V463-T502 HydrophobicContact CG1-CG2 3.51Å; V463-L511 HydrophobicContact CG2-CD2 4.15Å; V463-Y523 HydrophobicContact CG1-CE2 4.24Å; V463-Y523 HydrophobicContact CG2-CE1 4.35Å; V463-Y523 HydrophobicContact CG2-CE2 3.85Å
464	R	95.8	Very high	93.7	Very high	6 Å²	6	29.2 Å²	29.2	2%	0.023	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.4	168.7	69.3	-179.1	179.1	169.7	2.4	112	E434 E435 C456 S457 Y459 L466 E488 R490 S491	E434-R464 PolarHBondContact O-NH1 2.71Å; E434-R464 PolarHBondContact O-NH2 2.76Å; E435-R464 IonicContact OE1-CZ 2.98Å; E435-R464 IonicContact OE1-NE 2.72Å; E435-R464 IonicContact OE1-NH2 3.69Å; E435-R464 PolarHBondContact OE1-NH2 2.86Å; E435-R464 IonicContact OE2-CZ 2.97Å; E435-R464 IonicContact OE2-NE 2.82Å; E435-R464 IonicContact OE2-NH2 2.79Å; E435-R464 PolarHBondContact OE2-NH2 3.49Å; C456-R464 WeakPolarHBondContact CA-O 3.42Å; S457-R464 PolarHBondContact N-O 2.79Å; S457-R464 PolarHBondContact O-N 2.8Å; Y459-R464 HydrophobicContact CD2-CG 4.38Å; Y459-R464 VanDerWaalsContact CD2-CZ 3.49Å; Y459-R464 VanDerWaalsContact CD2-NE 3.33Å; Y459-R464 VanDerWaalsContact CE2-CZ 3.5Å; Y459-R464 VanDerWaalsContact CE2-NH1 3.29Å; Y459-R464 HydrophobicContact CG-CB 4.5Å; Y459-R464 HydrophobicContact CG-CG 4.09Å; R464-L466 HydrophobicContact CG-CD2 3.96Å; R464-L466 HydrophobicContact CG-CG 4.18Å; R464-E488 HydrophobicContact CB-CG 4.31Å; R464-E488 WeakPolarHBondContact CD-OE2 3.26Å; R464-E488 IonicContact NH1-OE2 3.17Å; R464-R490 CarbonylContact C-O 3.59Å; R464-R490 WeakPolarHBondContact CA-O 3.31Å; R464-S491 WeakPolarHBondContact CB-OG 3.5Å
465	L	96.1	Very high	93.3	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	121.9	172.5	-62.2	-178.5	0	0	0	108.9	Y129 I455 C456 I489 R490 F504 L511	Y129-L465 WeakPolarHBondContact O-CD1 3.47Å; I455-L465 WeakPolarHBondContact O-CA 3.24Å; C456-L465 HydrophobicContact CB-CD2 4.04Å; L465-I489 PolarHBondContact O-N 3.47Å; L465-R490 PolarHBondContact N-O 2.82Å; L465-R490 PolarHBondContact O-N 3.19Å; L465-F504 HydrophobicContact CD2-CE1 4.32Å; L465-F504 HydrophobicContact CD2-CZ 3.84Å; L465-L511 HydrophobicContact CD2-CD2 4.37Å
466	L	97	Very high	92.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	147.6	-178.8	-53.4	174.5	0	0	0	110.1	I433 L454 I455 R464 L486 R487 E488	I433-L466 HydrophobicContact CD1-CD2 3.86Å; I433-L466 HydrophobicContact CG2-CD1 3.85Å; L454-L466 WeakPolarHBondContact CA-O 3.2Å; I455-L466 HydrophobicContact CB-CB 4.21Å; I455-L466 HydrophobicContact CG2-CD1 4.44Å; I455-L466 PolarHBondContact N-O 3.12Å; I455-L466 PolarHBondContact O-N 3.23Å; R464-L466 HydrophobicContact CG-CD2 3.96Å; R464-L466 HydrophobicContact CG-CG 4.18Å; L466-L486 HydrophobicContact CB-CB 4.4Å; L466-L486 HydrophobicContact CB-CD1 4.29Å; L466-L486 HydrophobicContact CD1-CD1 3.91Å; L466-R487 CarbonylContact C-O 3.59Å; L466-R487 VanDerWaalsContact CA-O 3.27Å; L466-R487 WeakPolarHBondContact CA-O 3.3Å; L466-E488 HydrophobicContact CD2-CB 3.98Å; L466-E488 HydrophobicContact CD2-CG 4.25Å
467	A	95.5	Very high	91.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	166	174.2	0	0	0	0	0	111.6	L454 C472 R487 I489	L454-A467 HydrophobicContact CD2-CB 3.85Å; A467-C472 HydrophobicContact CB-CB 4.33Å; A467-C472 VanDerWaalsContact CB-SG 3.59Å; A467-R487 PolarHBondContact N-O 3.11Å; A467-R487 PolarHBondContact O-N 2.82Å; A467-I489 HydrophobicContact CB-CD1 3.94Å; A467-I489 HydrophobicContact CB-CG1 3.63Å
468	F	94.5	Very high	91.2	Very high	9 Å²	9	37.5 Å²	37.5	4%	0.039	18%	0.181	C	C	.	.	S	Bend	trans	-76.3	-32.8	177.4	-47.9	-64.4	0	0	0	112.6	V408 H431 F448 G452 R453 I455 L475 S478 L486	V408-F468 HydrophobicContact CG1-CE1 4.25Å; V408-F468 HydrophobicContact CG2-CE1 4.33Å; H431-F468 AromaticContact CE1-CD1 3.93Å; H431-F468 AromaticContact ND1-CD1 3.88Å; F448-F468 HydrophobicContact CE1-CZ 4.09Å; G452-F468 WeakPolarHBondContact O-CE2 3.46Å; R453-F468 WeakPolarHBondContact O-CE2 3.17Å; I455-F468 HydrophobicContact CD1-CE1 4.13Å; I455-F468 HydrophobicContact CD1-CZ 4.4Å; F468-L475 HydrophobicContact CB-CD1 4.43Å; F468-L475 HydrophobicContact CD1-CB 4.36Å; F468-L475 HydrophobicContact CD1-CD1 3.58Å; F468-L475 HydrophobicContact CD1-CG 4.41Å; F468-L475 HydrophobicContact CD2-CB 3.81Å; F468-L475 HydrophobicContact CD2-CD1 4.4Å; F468-L475 HydrophobicContact CE1-CB 4.22Å; F468-L475 HydrophobicContact CE1-CD1 3.86Å; F468-L475 HydrophobicContact CE1-CD2 4.21Å; F468-L475 HydrophobicContact CE1-CG 4.3Å; F468-L475 HydrophobicContact CE2-CB 3.66Å; F468-L475 HydrophobicContact CG-CB 4.16Å; F468-L475 HydrophobicContact CG-CD1 3.86Å; F468-L475 HydrophobicContact CZ-CB 3.86Å; F468-L475 HydrophobicContact CZ-CD1 4.39Å; F468-L475 HydrophobicContact CZ-CD2 4.29Å; F468-L475 HydrophobicContact CZ-CG 4.39Å; F468-S478 WeakPolarHBondContact CB-OG 3.44Å; F468-L486 HydrophobicContact CD1-CD2 3.67Å; F468-L486 HydrophobicContact CE1-CD2 4.07Å
469	D	91.2	Very high	90.7	Very high	38 Å²	38	40.3 Å²	40.3	20%	0.203	20%	0.196	C	C	.	.	S	Bend	trans	-142.9	175.4	176.1	76.6	-3.4	0	0	0	112.1	R471 C472 S473	D469-R471 PolarHBondContact O-N 3.32Å; D469-R471 VanDerWaalsContact O-N 3.12Å; D469-R471 WeakPolarHBondContact OD1-CA 3.25Å; D469-R471 PolarHBondContact OD1-N 3.18Å; D469-C472 PolarHBondContact O-N 2.91Å; D469-C472 PolarHBondContact OD1-N 3.33Å; D469-S473 VanDerWaalsContact CG-OG 3.31Å; D469-S473 PolarHBondContact OD1-N 2.81Å; D469-S473 PolarHBondContact OD1-OG 2.91Å; D469-S473 VanDerWaalsContact OD2-CB 3.31Å; D469-S473 WeakPolarHBondContact OD2-CB 3.44Å; D469-S473 PolarHBondContact OD2-OG 2.89Å
470	E	87.3	Confident	90.2	Very high	148 Å²	148	38.8 Å²	38.8	69%	0.692	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-6.1	178.5	-67.8	162.2	-157.9	0	0	113.9	R487	E470-R487 IonicContact OE1-CZ 3.67Å; E470-R487 IonicContact OE1-NE 3.78Å; E470-R487 IonicContact OE1-NH2 3.72Å; E470-R487 PolarHBondContact OE1-NH2 3.15Å
471	R	87	Confident	89.7	Confident	181 Å²	181	45 Å²	45	68%	0.683	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-4.7	-177.4	-62.9	178.6	175.5	-175.7	-0.3	112.7	D469 S473	D469-R471 PolarHBondContact O-N 3.32Å; D469-R471 VanDerWaalsContact O-N 3.12Å; D469-R471 WeakPolarHBondContact OD1-CA 3.25Å; D469-R471 PolarHBondContact OD1-N 3.18Å; R471-S473 VanDerWaalsContact C-N 3.25Å; R471-S473 PolarHBondContact O-N 2.88Å
472	C	89.1	Confident	89.3	Confident	4 Å²	4	47 Å²	47	3%	0.027	24%	0.242	C	C	.	.			trans	51.4	47.7	-169.2	-53.1	0	0	0	0	111.4	T126 R453 L454 A467 D469	T126-C472 HydrophobicContact CG2-CB 3.53Å; T126-C472 WeakPolarHBondContact CG2-SG 3.05Å; R453-C472 WeakPolarHBondContact CD-O 3.18Å; R453-C472 PolarHBondContact NH1-O 3.19Å; L454-C472 HydrophobicContact CD2-CB 4.04Å; A467-C472 HydrophobicContact CB-CB 4.33Å; A467-C472 VanDerWaalsContact CB-SG 3.59Å; D469-C472 PolarHBondContact O-N 2.91Å; D469-C472 PolarHBondContact OD1-N 3.33Å
473	S	86.5	Confident	89.2	Confident	21 Å²	21	50 Å²	50	15%	0.147	26%	0.26	C	S	.	.			trans	-59.5	158	171.6	-61.2	0	0	0	0	111.2	D469 R471	D469-S473 VanDerWaalsContact CG-OG 3.31Å; D469-S473 PolarHBondContact OD1-N 2.81Å; D469-S473 PolarHBondContact OD1-OG 2.91Å; D469-S473 VanDerWaalsContact OD2-CB 3.31Å; D469-S473 WeakPolarHBondContact OD2-CB 3.44Å; D469-S473 PolarHBondContact OD2-OG 2.89Å; R471-S473 VanDerWaalsContact C-N 3.25Å; R471-S473 PolarHBondContact O-N 2.88Å
474	E	85.9	Confident	89.1	Confident	9 Å²	9	51.5 Å²	51.5	4%	0.042	27%	0.272	C	S	.	.			trans	-67.7	137.6	167.1	178.9	166.1	-166.7	0	0	107.7	R119 K388 A476 D477 S478	R119-E474 IonicContact CZ-OE2 3.17Å; R119-E474 IonicContact NE-OE2 2.68Å; R119-E474 PolarHBondContact NE-OE2 2.8Å; R119-E474 VanDerWaalsContact NE-OE2 3.14Å; R119-E474 IonicContact NH2-OE2 2.8Å; R119-E474 PolarHBondContact NH2-OE2 2.74Å; K388-E474 VanDerWaalsContact CD-OE1 3.22Å; K388-E474 WeakPolarHBondContact CD-OE1 3.26Å; K388-E474 WeakPolarHBondContact CE-OE1 3.27Å; K388-E474 VanDerWaalsContact NZ-CD 3.33Å; K388-E474 IonicContact NZ-OE1 3.73Å; K388-E474 PolarHBondContact NZ-OE1 2.79Å; K388-E474 IonicContact NZ-OE2 3.38Å; K388-E474 PolarHBondContact NZ-OE2 3.09Å; E474-A476 HydrophobicContact CG-CB 4.46Å; E474-A476 PolarHBondContact O-N 3.2Å; E474-D477 WeakPolarHBondContact O-CB 3.38Å; E474-D477 PolarHBondContact O-N 2.84Å; E474-S478 PolarHBondContact O-N 3.33Å; E474-S478 PolarHBondContact O-OG 2.86Å
475	L	85.4	Confident	89.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-29.9	-174.8	174.7	62.5	0	0	0	112.9	W390 A391 V408 H431 F468 S478 L479	W390-L475 HydrophobicContact CH2-CB 3.48Å; W390-L475 VanDerWaalsContact CH2-CB 3.48Å; W390-L475 HydrophobicContact CH2-CD2 3.65Å; W390-L475 HydrophobicContact CH2-CG 3.42Å; W390-L475 VanDerWaalsContact CH2-CG 3.42Å; W390-L475 HydrophobicContact CZ2-CB 3.81Å; W390-L475 HydrophobicContact CZ2-CD2 4.32Å; W390-L475 HydrophobicContact CZ2-CG 4.22Å; W390-L475 HydrophobicContact CZ3-CD2 3.95Å; W390-L475 HydrophobicContact CZ3-CG 4.03Å; A391-L475 HydrophobicContact CB-CD2 3.85Å; V408-L475 HydrophobicContact CG1-CD2 3.91Å; H431-L475 WeakPolarHBondContact CE1-CD1 3.5Å; H431-L475 WeakPolarHBondContact ND1-CD1 3.48Å; F468-L475 HydrophobicContact CB-CD1 4.43Å; F468-L475 HydrophobicContact CD1-CB 4.36Å; F468-L475 HydrophobicContact CD1-CD1 3.58Å; F468-L475 HydrophobicContact CD1-CG 4.41Å; F468-L475 HydrophobicContact CD2-CB 3.81Å; F468-L475 HydrophobicContact CD2-CD1 4.4Å; F468-L475 HydrophobicContact CE1-CB 4.22Å; F468-L475 HydrophobicContact CE1-CD1 3.86Å; F468-L475 HydrophobicContact CE1-CD2 4.21Å; F468-L475 HydrophobicContact CE1-CG 4.3Å; F468-L475 HydrophobicContact CE2-CB 3.66Å; F468-L475 HydrophobicContact CG-CB 4.16Å; F468-L475 HydrophobicContact CG-CD1 3.86Å; F468-L475 HydrophobicContact CZ-CB 3.86Å; F468-L475 HydrophobicContact CZ-CD1 4.39Å; F468-L475 HydrophobicContact CZ-CD2 4.29Å; F468-L475 HydrophobicContact CZ-CG 4.39Å; L475-S478 CarbonylContact O-C 3.55Å; L475-S478 PolarHBondContact O-N 3.28Å; L475-L479 HydrophobicContact CD1-CD2 4.26Å; L475-L479 HydrophobicContact CG-CD2 4.2Å; L475-L479 VanDerWaalsContact O-CG 3.31Å; L475-L479 WeakPolarHBondContact O-CG 3.27Å; L475-L479 PolarHBondContact O-N 2.74Å
476	A	83.5	Confident	89.1	Confident	46 Å²	46	54.4 Å²	54.4	38%	0.38	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-31.3	-178.6	0	0	0	0	0	112.6	W390 E474 S478	W390-A476 HydrophobicContact CH2-CB 3.68Å; W390-A476 HydrophobicContact CZ2-CB 3.71Å; E474-A476 HydrophobicContact CG-CB 4.46Å; E474-A476 PolarHBondContact O-N 3.2Å; A476-S478 VanDerWaalsContact C-N 3.33Å
477	D	82.7	Confident	89	Confident	111 Å²	111	60.1 Å²	60.1	59%	0.594	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-16.7	175.7	-54.2	-36.7	0	0	0	111.2	E474	E474-D477 WeakPolarHBondContact O-CB 3.38Å; E474-D477 PolarHBondContact O-N 2.84Å
478	S	82.9	Confident	89.1	Confident	19 Å²	19	64.2 Å²	64.2	13%	0.133	33%	0.332	C	S	.	.	S	Bend	trans	-120.5	23.9	-177.7	65.2	0	0	0	0	114.7	F468 E474 L475 A476 P480	F468-S478 WeakPolarHBondContact CB-OG 3.44Å; E474-S478 PolarHBondContact O-N 3.33Å; E474-S478 PolarHBondContact O-OG 2.86Å; L475-S478 CarbonylContact O-C 3.55Å; L475-S478 PolarHBondContact O-N 3.28Å; A476-S478 VanDerWaalsContact C-N 3.33Å; S478-P480 VanDerWaalsContact O-CD 3.26Å; S478-P480 WeakPolarHBondContact O-CD 3.21Å; S478-P480 VanDerWaalsContact O-N 3.13Å
479	L	86.3	Confident	89	Confident	61 Å²	61	66.5 Å²	66.5	32%	0.319	34%	0.344	S	S	.	.			trans	-60.1	113.8	174.3	-72.2	174.4	0	0	0	110.2	W390 E410 T430 L475	W390-L479 HydrophobicContact CZ3-CD2 4.3Å; E410-L479 HydrophobicContact CG-CD2 4.45Å; E410-L479 WeakPolarHBondContact OE1-CD1 3.19Å; T430-L479 HydrophobicContact CG2-CD2 4.08Å; L475-L479 HydrophobicContact CD1-CD2 4.26Å; L475-L479 HydrophobicContact CG-CD2 4.2Å; L475-L479 VanDerWaalsContact O-CG 3.31Å; L475-L479 WeakPolarHBondContact O-CG 3.27Å; L475-L479 PolarHBondContact O-N 2.74Å
480	P	85.9	Confident	89.1	Confident	26 Å²	26	68 Å²	68	17%	0.169	35%	0.347	C	S	.	.			trans	-80.1	155	-174.3	37	-38.3	0	0	0	109.7	R428 T430 S478 Q482	R428-P480 PolarHBondContact NH2-O 3.35Å; T430-P480 WeakPolarHBondContact O-CG 3.43Å; S478-P480 VanDerWaalsContact O-CD 3.26Å; S478-P480 WeakPolarHBondContact O-CD 3.21Å; S478-P480 VanDerWaalsContact O-N 3.13Å; P480-Q482 VanDerWaalsContact CB-O 3.24Å; P480-Q482 WeakPolarHBondContact CB-O 2.9Å; P480-Q482 WeakPolarHBondContact CG-O 3.41Å
481	V	84.9	Confident	89.4	Confident	141 Å²	141	62.3 Å²	62.3	86%	0.855	32%	0.324	S	S	*	.	S	Bend	trans	-71.1	-45.7	-179	179.3	0	0	0	0	110.9	R428	R428-V481 PolarHBondContact NH2-O 3Å
482	Q	87.7	Confident	89.7	Confident	163 Å²	163	54.2 Å²	54.2	76%	0.762	29%	0.294	S	S	*	.	S	Bend	trans	-110	159.5	169.1	-64.5	177.1	-7.4	0	0	108.6	P480 S484	P480-Q482 VanDerWaalsContact CB-O 3.24Å; P480-Q482 WeakPolarHBondContact CB-O 2.9Å; P480-Q482 WeakPolarHBondContact CG-O 3.41Å; Q482-S484 PolarHBondContact O-N 3.11Å
483	T	91.6	Very high	89.9	Confident	63 Å²	63	60.7 Å²	60.7	39%	0.387	32%	0.319	S	S	.	.			trans	-57.5	134.3	178.1	-40.6	0	0	0	0	111.9	L429 T430 Y432	L429-T483 HydrophobicContact CB-CG2 4.47Å; L429-T483 HydrophobicContact CD2-CG2 3.55Å; L429-T483 HydrophobicContact CG-CG2 3.61Å; T430-T483 WeakPolarHBondContact O-CA 3.46Å; T430-T483 WeakPolarHBondContact O-CG2 3.48Å; Y432-T483 HydrophobicContact CD1-CG2 3.59Å; Y432-T483 HydrophobicContact CE1-CG2 3.86Å
484	S	93.9	Very high	89.9	Confident	34 Å²	34	60.7 Å²	60.7	24%	0.238	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	169	-178.8	61.5	0	0	0	0	112.5	T430 H431 Y432 Q482	T430-S484 PolarHBondContact O-N 3.46Å; H431-S484 CarbonylContact C-O 3.44Å; H431-S484 VanDerWaalsContact CA-O 3.25Å; H431-S484 WeakPolarHBondContact CA-O 3.5Å; H431-S484 PolarHBondContact CD2-OG 2.75Å; H431-S484 PolarHBondContact NE2-OG 2.9Å; Y432-S484 WeakPolarHBondContact CD1-O 3.4Å; Y432-S484 PolarHBondContact N-O 2.98Å; Q482-S484 PolarHBondContact O-N 3.11Å
485	C	95.6	Very high	90.2	Very high	64 Å²	64	61 Å²	61	43%	0.432	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	141	167	-59.4	0	0	0	0	110.5	Y432	Y432-C485 CarbonylContact O-C 3.54Å; Y432-C485 WeakPolarHBondContact O-CA 3.18Å
486	L	97	Very high	90.4	Very high	5 Å²	5	64.9 Å²	64.9	3%	0.026	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-59.1	146.4	161.4	-68.9	175.2	0	0	0	109.6	T406 V408 H431 Y432 I433 I455 L466 F468	T406-L486 HydrophobicContact CG2-CD1 4.36Å; V408-L486 HydrophobicContact CG2-CD1 4.12Å; V408-L486 HydrophobicContact CG2-CD2 4.21Å; H431-L486 HydrophobicContact CB-CD2 3.51Å; H431-L486 HydrophobicContact CB-CG 3.79Å; Y432-L486 PolarHBondContact O-N 2.97Å; I433-L486 HydrophobicContact CB-CB 4.21Å; I433-L486 HydrophobicContact CG2-CB 4.37Å; I433-L486 HydrophobicContact CG2-CD1 4.09Å; I455-L486 HydrophobicContact CD1-CD1 3.89Å; I455-L486 HydrophobicContact CD1-CD2 4.36Å; L466-L486 HydrophobicContact CB-CB 4.4Å; L466-L486 HydrophobicContact CB-CD1 4.29Å; L466-L486 HydrophobicContact CD1-CD1 3.91Å; F468-L486 HydrophobicContact CD1-CD2 3.67Å; F468-L486 HydrophobicContact CE1-CD2 4.07Å
487	R	95.4	Very high	90.9	Very high	120 Å²	120	65 Å²	65	45%	0.453	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.8	174.2	-62.2	-52.9	-148.2	174.4	10.6	109.5	L466 A467 E470 I489	L466-R487 CarbonylContact C-O 3.59Å; L466-R487 VanDerWaalsContact CA-O 3.27Å; L466-R487 WeakPolarHBondContact CA-O 3.3Å; A467-R487 PolarHBondContact N-O 3.11Å; A467-R487 PolarHBondContact O-N 2.82Å; E470-R487 IonicContact OE1-CZ 3.67Å; E470-R487 IonicContact OE1-NE 3.78Å; E470-R487 IonicContact OE1-NH2 3.72Å; E470-R487 PolarHBondContact OE1-NH2 3.15Å; R487-I489 HydrophobicContact CB-CD1 4.03Å; R487-I489 PolarHBondContact O-N 2.85Å
488	E	95.9	Very high	91.6	Very high	86 Å²	86	60.2 Å²	60.2	40%	0.402	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	119.4	163.4	-172.3	174.7	134.4	0	0	109	R464 L466 S491	R464-E488 HydrophobicContact CB-CG 4.31Å; R464-E488 WeakPolarHBondContact CD-OE2 3.26Å; R464-E488 IonicContact NH1-OE2 3.17Å; L466-E488 HydrophobicContact CD2-CB 3.98Å; L466-E488 HydrophobicContact CD2-CG 4.25Å; E488-S491 VanDerWaalsContact CD-OG 3.32Å; E488-S491 WeakPolarHBondContact OE1-CB 2.94Å; E488-S491 PolarHBondContact OE1-OG 2.93Å
489	I	93.9	Very high	92.2	Very high	56 Å²	56	59.3 Å²	59.3	29%	0.287	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-36.8	179.6	-55.4	-57.7	0	0	0	110.1	C130 L465 A467 R487	C130-I489 WeakPolarHBondContact SG-CG2 3.32Å; L465-I489 PolarHBondContact O-N 3.47Å; A467-I489 HydrophobicContact CB-CD1 3.94Å; A467-I489 HydrophobicContact CB-CG1 3.63Å; R487-I489 HydrophobicContact CB-CD1 4.03Å; R487-I489 PolarHBondContact O-N 2.85Å
490	R	92.4	Very high	92.8	Very high	70 Å²	70	56.5 Å²	56.5	26%	0.264	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	136.9	175.7	-172.1	164.8	175.4	-149.9	-17.5	113	C130 S131 M132 R464 L465 I492	C130-R490 VanDerWaalsContact O-CD 3.25Å; C130-R490 WeakPolarHBondContact O-CD 3.36Å; C130-R490 PolarHBondContact O-NH1 3.12Å; S131-R490 VanDerWaalsContact C-NH1 3.29Å; M132-R490 PolarHBondContact O-NH1 3.01Å; M132-R490 PolarHBondContact O-NH2 3.3Å; R464-R490 CarbonylContact C-O 3.59Å; R464-R490 WeakPolarHBondContact CA-O 3.31Å; L465-R490 PolarHBondContact N-O 2.82Å; L465-R490 PolarHBondContact O-N 3.19Å; R490-I492 HydrophobicContact CG-CG1 4.2Å
491	S	94.3	Very high	93.3	Very high	29 Å²	29	55.4 Å²	55.4	20%	0.203	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	146.1	161.8	-81.9	0	0	0	0	112	V463 R464 E488	V463-S491 CarbonylContact O-C 3.54Å; V463-S491 WeakPolarHBondContact O-CA 3.44Å; R464-S491 WeakPolarHBondContact CB-OG 3.5Å; E488-S491 VanDerWaalsContact CD-OG 3.32Å; E488-S491 WeakPolarHBondContact OE1-CB 2.94Å; E488-S491 PolarHBondContact OE1-OG 2.93Å
492	I	93.2	Very high	94	Very high	11 Å²	11	48.8 Å²	48.8	6%	0.056	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	106.7	176.6	-52.7	178	0	0	0	108.9	M132 G462 V463 R490 Y523	M132-I492 HydrophobicContact CB-CD1 4.22Å; M132-I492 WeakPolarHBondContact O-CD1 2.96Å; G462-I492 CarbonylContact C-O 3.56Å; G462-I492 WeakPolarHBondContact CA-O 3.38Å; V463-I492 HydrophobicContact CG2-CB 4.05Å; V463-I492 PolarHBondContact N-O 2.94Å; V463-I492 PolarHBondContact O-N 3.42Å; R490-I492 HydrophobicContact CG-CG1 4.2Å; I492-Y523 HydrophobicContact CB-CE1 4.39Å; I492-Y523 HydrophobicContact CD1-CD1 4.45Å; I492-Y523 HydrophobicContact CG2-CD1 4.08Å; I492-Y523 HydrophobicContact CG2-CE1 3.66Å
493	Y	92.4	Very high	94.4	Very high	139 Å²	139	43 Å²	43	55%	0.545	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	121.7	174.1	-56.9	-80.9	0	0	0	109.4	Y459	Y459-Y493 HydrophobicContact CD1-CE1 4.36Å; Y459-Y493 WeakPolarHBondContact CD1-OH 3.31Å; Y459-Y493 WeakPolarHBondContact CE1-OH 3.34Å
494	S	88.3	Confident	94.6	Very high	21 Å²	21	40.5 Å²	40.5	15%	0.147	20%	0.204	C	C	.	.			trans	-144.3	-13.1	-174.4	60.1	0	0	0	0	114	Y461 R519 Y523	Y461-S494 PolarHBondContact O-N 3.42Å; S494-R519 PolarHBondContact O-NH1 2.84Å; S494-R519 PolarHBondContact O-NH2 3.07Å; S494-Y523 WeakPolarHBondContact OG-CE1 3.38Å; S494-Y523 PolarHBondContact OG-OH 2.79Å
495	H	91.6	Very high	94.5	Very high	15 Å²	15	38.9 Å²	38.9	7%	0.069	19%	0.193	C	C	.	.			trans	-97	158.2	-177.6	-68.8	-84.4	0	0	0	111.4	Y461 D497 V499 S513 C515 R519	Y461-H495 PolarHBondContact O-N 2.85Å; Y461-H495 VanDerWaalsContact O-N 3.1Å; H495-D497 WeakPolarHBondContact CB-O 3.37Å; H495-V499 HydrophobicContact CB-CG2 4.17Å; H495-V499 WeakPolarHBondContact CD2-CG2 3.21Å; H495-S513 PolarHBondContact NE2-OG 2.87Å; H495-C515 HydrophobicContact CB-CB 4.23Å; H495-R519 PolarHBondContact CE1-O 3.44Å
496	S	89.8	Confident	94.2	Very high	83 Å²	83	38.7 Å²	38.7	58%	0.58	19%	0.191	S	C	*	.	S	Bend	trans	-89.3	-8.3	172	39.5	0	0	0	0	112.7
497	D	93.7	Very high	93.7	Very high	49 Å²	49	42 Å²	42	26%	0.262	21%	0.212	S	C	.	.	S	Bend	trans	-146.1	170.2	-174.5	-152.5	-19.3	0	0	0	110.3	Y461 H495 V499 L516 S517	Y461-D497 VanDerWaalsContact CD1-C 3.49Å; H495-D497 WeakPolarHBondContact CB-O 3.37Å; D497-V499 PolarHBondContact O-N 3.2Å; D497-L516 HydrophobicContact CB-CB 4.29Å; D497-L516 WeakPolarHBondContact OD2-CB 3.34Å; D497-S517 PolarHBondContact OD2-N 3.08Å
498	V	96.2	Very high	93.2	Very high	9 Å²	9	39.7 Å²	39.7	6%	0.055	21%	0.206	C	C	.	.			trans	-64	128.7	-174.2	-176.4	0	0	0	0	111.1	V438 Y461 C515 L516	V438-V498 HydrophobicContact CB-CG2 4.22Å; V438-V498 HydrophobicContact CG2-CG1 3.74Å; V438-V498 HydrophobicContact CG2-CG2 3.93Å; Y461-V498 HydrophobicContact CE1-CG2 4.45Å; V498-C515 CarbonylContact O-C 3.39Å; V498-C515 WeakPolarHBondContact O-CA 3.45Å; V498-C515 WeakPolarHBondContact O-CB 3.37Å; V498-L516 HydrophobicContact CB-CD1 3.86Å; V498-L516 HydrophobicContact CB-CG 4.39Å; V498-L516 HydrophobicContact CG2-CD1 4.24Å; V498-L516 PolarHBondContact O-N 3.49Å
499	V	97.3	Very high	92.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	131.1	175.7	-176.8	0	0	0	0	109.5	P458 G460 G462 V463 H495 D497 T502 G514 C515	P458-V499 HydrophobicContact CB-CB 4.13Å; P458-V499 HydrophobicContact CB-CG1 3.93Å; P458-V499 VanDerWaalsContact CB-O 3.27Å; P458-V499 WeakPolarHBondContact CB-O 3.38Å; G460-V499 PolarHBondContact O-N 3.13Å; G462-V499 WeakPolarHBondContact O-CB 3.33Å; G462-V499 VanDerWaalsContact O-CG2 3.3Å; G462-V499 WeakPolarHBondContact O-CG2 3.37Å; V463-V499 HydrophobicContact CG1-CG1 4.14Å; H495-V499 HydrophobicContact CB-CG2 4.17Å; H495-V499 WeakPolarHBondContact CD2-CG2 3.21Å; D497-V499 PolarHBondContact O-N 3.2Å; V499-T502 HydrophobicContact CG1-CG2 4.32Å; V499-G514 WeakPolarHBondContact CG1-O 3.11Å; V499-C515 HydrophobicContact CG2-CB 4.48Å
500	L	97.3	Very high	92.4	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-29.8	177.4	-64.9	-165.2	0	0	0	113	A148 F150 Y442 K444 E445 G514 L516	A148-L500 HydrophobicContact CB-CD1 4.07Å; F150-L500 HydrophobicContact CD1-CD1 3.91Å; F150-L500 HydrophobicContact CE1-CD1 4.04Å; Y442-L500 HydrophobicContact CD1-CD1 3.91Å; Y442-L500 HydrophobicContact CG-CD1 4.33Å; Y442-L500 HydrophobicContact CG-CD2 4.17Å; K444-L500 CarbonylContact C-O 3.58Å; K444-L500 VanDerWaalsContact CA-O 3.25Å; K444-L500 WeakPolarHBondContact CA-O 3.47Å; K444-L500 HydrophobicContact CG-CD2 4.16Å; E445-L500 PolarHBondContact N-O 2.69Å; L500-G514 PolarHBondContact N-O 3.15Å; L500-L516 HydrophobicContact CD1-CD2 3.78Å; L500-L516 HydrophobicContact CD1-CG 4.32Å; L500-L516 HydrophobicContact CD2-CD2 4.2Å; L500-L516 HydrophobicContact CD2-CG 4.15Å; L500-L516 HydrophobicContact CG-CD2 4.18Å; L500-L516 HydrophobicContact CG-CG 4.18Å
501	T	97.8	Very high	92.4	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	148.4	-172.3	-173.9	0	0	0	0	112.5	V149 L152 E445 S513 G514	V149-T501 HydrophobicContact CB-CG2 4.32Å; V149-T501 HydrophobicContact CG1-CG2 3.71Å; V149-T501 WeakPolarHBondContact O-CG2 3.16Å; L152-T501 HydrophobicContact CD1-CG2 3.81Å; L152-T501 HydrophobicContact CG-CG2 3.74Å; E445-T501 WeakPolarHBondContact O-CA 3.33Å; T501-S513 CarbonylContact O-C 3.57Å; T501-S513 WeakPolarHBondContact O-CA 3.38Å; T501-G514 PolarHBondContact N-O 3.01Å; T501-G514 PolarHBondContact O-N 2.57Å
502	T	97.8	Very high	92.4	Very high	3 Å²	3	30 Å²	30	2%	0.018	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	145.2	179.8	56.6	0	0	0	0	110.6	E445 L446 C447 C456 P458 V463 V499 A512	E445-T502 PolarHBondContact O-N 3.12Å; E445-T502 PolarHBondContact O-OG1 2.73Å; L446-T502 WeakPolarHBondContact CA-OG1 3.4Å; C447-T502 VanDerWaalsContact SG-C 3.5Å; C447-T502 PolarHBondContact SG-O 3.36Å; C447-T502 VanDerWaalsContact SG-O 3.35Å; C456-T502 PolarHBondContact O-OG1 3.28Å; P458-T502 HydrophobicContact CG-CG2 4.06Å; V463-T502 HydrophobicContact CB-CG2 4.39Å; V463-T502 HydrophobicContact CG1-CG2 3.51Å; V499-T502 HydrophobicContact CG1-CG2 4.32Å; T502-A512 CarbonylContact C-O 3.58Å; T502-A512 WeakPolarHBondContact CA-O 3.43Å
503	K	97.4	Very high	92.6	Very high	41 Å²	41	29.4 Å²	29.4	18%	0.178	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	123.9	178.4	-159.7	66.3	161.5	-119.4	0	112.3	L152 E153 Y154 C447 L511 A512	L152-K503 HydrophobicContact CB-CB 3.75Å; L152-K503 HydrophobicContact CB-CG 4.48Å; L152-K503 WeakPolarHBondContact O-CD 3.47Å; L152-K503 WeakPolarHBondContact O-CG 3.16Å; L152-K503 PolarHBondContact O-NZ 3.28Å; E153-K503 WeakPolarHBondContact OE2-CE 3.47Å; E153-K503 IonicContact OE2-NZ 2.93Å; E153-K503 PolarHBondContact OE2-NZ 2.82Å; Y154-K503 HydrophobicContact CD2-CB 4.36Å; Y154-K503 HydrophobicContact CD2-CG 3.84Å; Y154-K503 HydrophobicContact CE2-CB 4.24Å; Y154-K503 HydrophobicContact CE2-CG 4.2Å; C447-K503 HydrophobicContact CB-CD 4.46Å; C447-K503 VanDerWaalsContact SG-CA 3.53Å; K503-L511 CarbonylContact O-C 3.57Å; K503-A512 PolarHBondContact N-O 2.89Å; K503-A512 PolarHBondContact O-N 3.3Å
504	F	95.4	Very high	92.8	Very high	10 Å²	10	22.8 Å²	22.8	4%	0.044	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	146.9	167.4	-70.3	-82.5	0	0	0	111.2	Y129 Y154 C447 F448 S449 P450 L454 C456 L465 L511	Y129-F504 AromaticContact CD1-CD1 4Å; Y129-F504 HydrophobicContact CD1-CD1 4Å; Y129-F504 AromaticContact CD1-CE1 3.59Å; Y129-F504 HydrophobicContact CD1-CE1 3.59Å; Y129-F504 AromaticContact CE1-CD1 3.51Å; Y129-F504 HydrophobicContact CE1-CD1 3.51Å; Y129-F504 AromaticContact CE1-CE1 3.6Å; Y129-F504 HydrophobicContact CE1-CE1 3.6Å; Y129-F504 HydrophobicContact CG-CE1 4.38Å; Y154-F504 WeakPolarHBondContact CD2-O 3.46Å; C447-F504 VanDerWaalsContact SG-CD2 3.52Å; F448-F504 VanDerWaalsContact C-CD2 3.46Å; F448-F504 VanDerWaalsContact O-CD2 3.25Å; F448-F504 WeakPolarHBondContact O-CD2 3.48Å; S449-F504 VanDerWaalsContact CA-CD2 3.48Å; P450-F504 HydrophobicContact CG-CB 4.44Å; L454-F504 HydrophobicContact CB-CZ 4.48Å; C456-F504 HydrophobicContact CB-CD2 4.33Å; C456-F504 HydrophobicContact CB-CE2 3.49Å; C456-F504 VanDerWaalsContact CB-CE2 3.49Å; C456-F504 HydrophobicContact CB-CZ 3.75Å; L465-F504 HydrophobicContact CD2-CE1 4.32Å; L465-F504 HydrophobicContact CD2-CZ 3.84Å; F504-L511 HydrophobicContact CD1-CB 4.13Å; F504-L511 HydrophobicContact CD1-CD1 3.93Å; F504-L511 HydrophobicContact CD2-CD1 4.22Å; F504-L511 HydrophobicContact CE1-CB 4.33Å; F504-L511 HydrophobicContact CE1-CD1 4.04Å; F504-L511 HydrophobicContact CE2-CD1 4.35Å; F504-L511 HydrophobicContact CG-CD1 4.05Å; F504-L511 HydrophobicContact CZ-CD1 4.28Å
505	S	92.4	Very high	93.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.126	C	C	.	.			trans	-68.2	138.6	167.5	-178	0	0	0	0	110.1	P450 T507 H508 Q510	P450-S505 WeakPolarHBondContact CG-O 3.12Å; S505-T507 VanDerWaalsContact C-N 3.32Å; S505-H508 WeakPolarHBondContact CB-O 3.44Å; S505-H508 PolarHBondContact OG-N 3.12Å; S505-Q510 PolarHBondContact N-O 3.1Å
506	P	89.4	Confident	93.2	Very high	60 Å²	60	22.5 Å²	22.5	39%	0.39	13%	0.13	S	C	.	.	S	Bend	trans	-73.7	-23	179.3	28.8	-34.5	0	0	0	113.3	Y154 S155	Y154-P506 VanDerWaalsContact CB-CD 3.49Å; S155-P506 WeakPolarHBondContact O-CG 3.21Å
507	T	85.6	Confident	93.3	Very high	75 Å²	75	21.4 Å²	21.4	46%	0.46	12%	0.122	S	C	.	.	S	Bend	trans	-119.5	-24.5	-171.1	48.4	0	0	0	0	114.2	D157 G158 S505	D157-T507 VanDerWaalsContact C-OG1 3.31Å; D157-T507 WeakPolarHBondContact O-CB 3.17Å; D157-T507 VanDerWaalsContact O-CG2 3.31Å; D157-T507 WeakPolarHBondContact O-CG2 3.32Å; D157-T507 PolarHBondContact O-OG1 3.28Å; G158-T507 WeakPolarHBondContact CA-OG1 3.37Å; S505-T507 VanDerWaalsContact C-N 3.32Å
508	H	84.3	Confident	93.1	Very high	71 Å²	71	19.4 Å²	19.4	33%	0.329	11%	0.113	S	C	.	.	S	Bend	trans	-112.8	154.4	-178.7	-57.8	97.4	0	0	0	111.3	S505 Q510	S505-H508 WeakPolarHBondContact CB-O 3.44Å; S505-H508 PolarHBondContact OG-N 3.12Å; H508-Q510 HydrophobicContact CB-CB 4.33Å; H508-Q510 HydrophobicContact CB-CG 4.03Å; H508-Q510 PolarHBondContact O-N 3.2Å
509	C	86.3	Confident	92.8	Very high	25 Å²	25	21.3 Å²	21.3	17%	0.169	12%	0.119	C	C	.	.	S	Bend	trans	-75.3	73.7	168.1	-166.5	0	0	0	0	109.1	M125 L128 M132 P525	M125-C509 HydrophobicContact CE-CB 3.9Å; L128-C509 VanDerWaalsContact CB-SG 3.52Å; M132-C509 VanDerWaalsContact CE-O 3.24Å; M132-C509 WeakPolarHBondContact CE-O 3.46Å; C509-P525 HydrophobicContact CB-CG 4.28Å; C509-P525 WeakPolarHBondContact O-CD 3.19Å
510	Q	87.8	Confident	92.5	Very high	12 Å²	12	21.3 Å²	21.3	6%	0.056	12%	0.119	C	C	.	.			trans	-139.6	155.5	-177.4	-74	-172.6	-20.6	0	0	111	P175 S505 H508 Y523	P175-Q510 PolarHBondContact O-NE2 2.9Å; P175-Q510 PolarHBondContact O-OE1 3.15Å; S505-Q510 PolarHBondContact N-O 3.1Å; H508-Q510 HydrophobicContact CB-CB 4.33Å; H508-Q510 HydrophobicContact CB-CG 4.03Å; H508-Q510 PolarHBondContact O-N 3.2Å; Q510-Y523 WeakPolarHBondContact CA-O 3.38Å
511	L	92.3	Very high	92.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.1	174.6	171.3	73.4	0	0	0	108.5	M132 C456 V463 L465 K503 F504 L522 Y523	M132-L511 HydrophobicContact CE-CB 4.32Å; M132-L511 HydrophobicContact SD-CB 3.81Å; C456-L511 HydrophobicContact CB-CD1 3.85Å; C456-L511 HydrophobicContact CB-CD2 4.49Å; C456-L511 VanDerWaalsContact SG-CD2 3.56Å; V463-L511 HydrophobicContact CG2-CD2 4.15Å; L465-L511 HydrophobicContact CD2-CD2 4.37Å; K503-L511 CarbonylContact O-C 3.57Å; F504-L511 HydrophobicContact CD1-CB 4.13Å; F504-L511 HydrophobicContact CD1-CD1 3.93Å; F504-L511 HydrophobicContact CD2-CD1 4.22Å; F504-L511 HydrophobicContact CE1-CB 4.33Å; F504-L511 HydrophobicContact CE1-CD1 4.04Å; F504-L511 HydrophobicContact CE2-CD1 4.35Å; F504-L511 HydrophobicContact CG-CD1 4.05Å; F504-L511 HydrophobicContact CZ-CD1 4.28Å; L511-L522 CarbonylContact O-C 3.54Å; L511-L522 WeakPolarHBondContact O-CA 3.35Å; L511-Y523 HydrophobicContact CB-CD2 4.02Å; L511-Y523 HydrophobicContact CD2-CD2 3.62Å; L511-Y523 HydrophobicContact CD2-CE2 4Å; L511-Y523 HydrophobicContact CD2-CG 4.36Å; L511-Y523 HydrophobicContact CG-CD2 3.73Å; L511-Y523 HydrophobicContact CG-CE2 4.27Å; L511-Y523 PolarHBondContact N-O 3.13Å; L511-Y523 VanDerWaalsContact N-O 3.09Å; L511-Y523 WeakPolarHBondContact O-CD2 3.33Å; L511-Y523 PolarHBondContact O-N 2.9Å
512	A	95.2	Very high	92	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	153.5	170.6	0	0	0	0	0	110.4	L152 Y154 L161 T502 K503 A521 L522	L152-A512 HydrophobicContact CD1-CB 3.91Å; Y154-A512 HydrophobicContact CE2-CB 4.05Å; L161-A512 HydrophobicContact CD1-CB 4.41Å; L161-A512 HydrophobicContact CD2-CB 3.63Å; T502-A512 CarbonylContact C-O 3.58Å; T502-A512 WeakPolarHBondContact CA-O 3.43Å; K503-A512 PolarHBondContact N-O 2.89Å; K503-A512 PolarHBondContact O-N 3.3Å; A512-A521 CarbonylContact C-O 3.54Å; A512-A521 WeakPolarHBondContact CA-O 3.47Å; A512-L522 HydrophobicContact CB-CD2 3.81Å
513	S	96.7	Very high	91.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.2	171.6	63.6	0	0	0	0	112.2	L152 H495 T501 V520 A521 Y523	L152-S513 VanDerWaalsContact CD1-CA 3.48Å; H495-S513 PolarHBondContact NE2-OG 2.87Å; T501-S513 CarbonylContact O-C 3.57Å; T501-S513 WeakPolarHBondContact O-CA 3.38Å; S513-V520 WeakPolarHBondContact O-CA 3.37Å; S513-A521 PolarHBondContact N-O 3.1Å; S513-A521 PolarHBondContact O-N 2.78Å; S513-A521 PolarHBondContact OG-O 3.05Å; S513-Y523 WeakPolarHBondContact OG-CE2 3.31Å; S513-Y523 PolarHBondContact OG-OH 2.88Å; S513-Y523 VanDerWaalsContact OG-OH 3.05Å
514	G	95.4	Very high	91.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	147.1	179.7	0	0	0	0	0	112.2	V499 L500 T501 R519	V499-G514 WeakPolarHBondContact CG1-O 3.11Å; L500-G514 PolarHBondContact N-O 3.15Å; T501-G514 PolarHBondContact N-O 3.01Å; T501-G514 PolarHBondContact O-N 2.57Å; G514-R519 WeakPolarHBondContact CA-O 3.45Å
515	C	94.9	Very high	90.5	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	175.2	-173.8	73.2	0	0	0	0	114	V149 H495 V498 V499 S517 G518 R519	V149-C515 PolarHBondContact N-O 3.27Å; H495-C515 HydrophobicContact CB-CB 4.23Å; V498-C515 CarbonylContact O-C 3.39Å; V498-C515 WeakPolarHBondContact O-CA 3.45Å; V498-C515 WeakPolarHBondContact O-CB 3.37Å; V499-C515 HydrophobicContact CG2-CB 4.48Å; C515-S517 VanDerWaalsContact C-N 3.26Å; C515-S517 PolarHBondContact O-N 3.17Å; C515-S517 PolarHBondContact SG-N 3.44Å; C515-S517 PolarHBondContact SG-OG 2.96Å; C515-S517 VanDerWaalsContact SG-OG 3.38Å; C515-G518 PolarHBondContact O-N 2.98Å; C515-R519 PolarHBondContact N-O 2.99Å
516	L	94.1	Very high	89.4	Confident	30 Å²	30	29.6 Å²	29.6	16%	0.157	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-34.2	174.8	-77.8	174.3	0	0	0	113.9	A148 Y442 D497 V498 L500 G518	A148-L516 WeakPolarHBondContact CA-O 3.21Å; A148-L516 HydrophobicContact CB-CD2 3.99Å; A148-L516 PolarHBondContact N-O 2.97Å; Y442-L516 HydrophobicContact CD1-CD2 3.69Å; Y442-L516 HydrophobicContact CD2-CD1 4.44Å; Y442-L516 HydrophobicContact CD2-CD2 3.88Å; Y442-L516 HydrophobicContact CE1-CD2 3.49Å; Y442-L516 VanDerWaalsContact CE1-CD2 3.49Å; Y442-L516 HydrophobicContact CE2-CD1 4.35Å; Y442-L516 HydrophobicContact CE2-CD2 3.69Å; Y442-L516 HydrophobicContact CG-CD2 3.88Å; Y442-L516 VanDerWaalsContact CZ-CD2 3.49Å; D497-L516 HydrophobicContact CB-CB 4.29Å; D497-L516 WeakPolarHBondContact OD2-CB 3.34Å; V498-L516 HydrophobicContact CB-CD1 3.86Å; V498-L516 HydrophobicContact CB-CG 4.39Å; V498-L516 HydrophobicContact CG2-CD1 4.24Å; V498-L516 PolarHBondContact O-N 3.49Å; L500-L516 HydrophobicContact CD1-CD2 3.78Å; L500-L516 HydrophobicContact CD1-CG 4.32Å; L500-L516 HydrophobicContact CD2-CD2 4.2Å; L500-L516 HydrophobicContact CD2-CG 4.15Å; L500-L516 HydrophobicContact CG-CD2 4.18Å; L500-L516 HydrophobicContact CG-CG 4.18Å; L516-G518 PolarHBondContact O-N 3.01Å
517	S	91.2	Very high	88	Confident	59 Å²	59	38 Å²	38	41%	0.413	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	21.2	179.8	83.9	0	0	0	0	114.3	D497 C515 R519	D497-S517 PolarHBondContact OD2-N 3.08Å; C515-S517 VanDerWaalsContact C-N 3.26Å; C515-S517 PolarHBondContact O-N 3.17Å; C515-S517 PolarHBondContact SG-N 3.44Å; C515-S517 PolarHBondContact SG-OG 2.96Å; C515-S517 VanDerWaalsContact SG-OG 3.38Å; S517-R519 PolarHBondContact O-N 2.72Å; S517-R519 VanDerWaalsContact O-N 3.09Å
518	G	90.3	Very high	88.1	Confident	8 Å²	8	36.2 Å²	36.2	8%	0.082	18%	0.175	C	C	.	.	S	Bend	trans	67.8	6	178.9	0	0	0	0	0	116.5	G147 C515 L516	G147-G518 WeakPolarHBondContact O-CA 3.24Å; G147-G518 PolarHBondContact O-N 3.1Å; C515-G518 PolarHBondContact O-N 2.98Å; L516-G518 PolarHBondContact O-N 3.01Å
519	R	89.6	Confident	88.3	Confident	49 Å²	49	34.4 Å²	34.4	19%	0.185	17%	0.167	C	C	.	.			trans	-82.2	135.1	-176.5	-170.5	179.8	178.7	-153.6	-9.5	110.7	S138 N140 S494 H495 G514 C515 S517	S138-R519 PolarHBondContact OG-NH2 3.09Å; N140-R519 WeakPolarHBondContact OD1-CD 3.13Å; N140-R519 PolarHBondContact OD1-NE 3.14Å; S494-R519 PolarHBondContact O-NH1 2.84Å; S494-R519 PolarHBondContact O-NH2 3.07Å; H495-R519 PolarHBondContact CE1-O 3.44Å; G514-R519 WeakPolarHBondContact CA-O 3.45Å; C515-R519 PolarHBondContact N-O 2.99Å; S517-R519 PolarHBondContact O-N 2.72Å; S517-R519 VanDerWaalsContact O-N 3.09Å
520	V	92.1	Very high	88.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.9	175.4	-178.7	0	0	0	0	109.3	V139 V149 V163 S513	V139-V520 PolarHBondContact N-O 3.45Å; V139-V520 VanDerWaalsContact N-O 3.13Å; V149-V520 HydrophobicContact CG2-CG2 4.15Å; V163-V520 HydrophobicContact CG1-CG2 3.92Å; V163-V520 HydrophobicContact CG2-CG2 4.22Å; S513-V520 WeakPolarHBondContact O-CA 3.37Å
521	A	91.9	Very high	88.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	117.9	174.5	0	0	0	0	0	110.3	A512 S513 Y523	A512-A521 CarbonylContact C-O 3.54Å; A512-A521 WeakPolarHBondContact CA-O 3.47Å; S513-A521 PolarHBondContact N-O 3.1Å; S513-A521 PolarHBondContact O-N 2.78Å; S513-A521 PolarHBondContact OG-O 3.05Å; A521-Y523 HydrophobicContact CB-CE2 4.48Å
522	L	91.6	Very high	88.2	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.4	166.3	-66.7	172.6	0	0	0	109.3	P134 A135 L161 L511 A512	P134-L522 CarbonylContact C-O 3.56Å; P134-L522 WeakPolarHBondContact CA-O 3.37Å; A135-L522 PolarHBondContact N-O 3.03Å; L161-L522 HydrophobicContact CD2-CD2 3.72Å; L511-L522 CarbonylContact O-C 3.54Å; L511-L522 WeakPolarHBondContact O-CA 3.35Å; A512-L522 HydrophobicContact CB-CD2 3.81Å
523	Y	90.1	Very high	87.8	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.7	175.2	-46.8	-90.7	0	0	0	110.7	N133 P134 V463 I492 S494 Q510 L511 S513 A521	N133-Y523 CarbonylContact O-C 3.52Å; N133-Y523 WeakPolarHBondContact O-CA 3.17Å; P134-Y523 HydrophobicContact CB-CD1 4Å; P134-Y523 HydrophobicContact CB-CE1 4.1Å; V463-Y523 HydrophobicContact CG1-CE2 4.24Å; V463-Y523 HydrophobicContact CG2-CE1 4.35Å; V463-Y523 HydrophobicContact CG2-CE2 3.85Å; I492-Y523 HydrophobicContact CB-CE1 4.39Å; I492-Y523 HydrophobicContact CD1-CD1 4.45Å; I492-Y523 HydrophobicContact CG2-CD1 4.08Å; I492-Y523 HydrophobicContact CG2-CE1 3.66Å; S494-Y523 WeakPolarHBondContact OG-CE1 3.38Å; S494-Y523 PolarHBondContact OG-OH 2.79Å; Q510-Y523 WeakPolarHBondContact CA-O 3.38Å; L511-Y523 HydrophobicContact CB-CD2 4.02Å; L511-Y523 HydrophobicContact CD2-CD2 3.62Å; L511-Y523 HydrophobicContact CD2-CE2 4Å; L511-Y523 HydrophobicContact CD2-CG 4.36Å; L511-Y523 HydrophobicContact CG-CD2 3.73Å; L511-Y523 HydrophobicContact CG-CE2 4.27Å; L511-Y523 PolarHBondContact N-O 3.13Å; L511-Y523 VanDerWaalsContact N-O 3.09Å; L511-Y523 WeakPolarHBondContact O-CD2 3.33Å; L511-Y523 PolarHBondContact O-N 2.9Å; S513-Y523 WeakPolarHBondContact OG-CE2 3.31Å; S513-Y523 PolarHBondContact OG-OH 2.88Å; S513-Y523 VanDerWaalsContact OG-OH 3.05Å; A521-Y523 HydrophobicContact CB-CE2 4.48Å
524	Q	86.3	Confident	87.1	Confident	76 Å²	76	44 Å²	44	36%	0.355	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152.1	178.6	59.7	-175.2	-8.8	0	0	110.6	M132 N133	M132-Q524 CarbonylContact C-O 3.58Å; M132-Q524 WeakPolarHBondContact CA-O 3.37Å; N133-Q524 PolarHBondContact N-O 2.98Å; N133-Q524 PolarHBondContact O-N 2.68Å
525	P	82.5	Confident	86.5	Confident	13 Å²	13	47.4 Å²	47.4	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	143	171.1	-26.9	35	0	0	0	111.7	L128 S131 C509 F527	L128-P525 HydrophobicContact CB-CB 4.36Å; L128-P525 HydrophobicContact CB-CG 3.84Å; L128-P525 HydrophobicContact CD2-CB 3.84Å; L128-P525 HydrophobicContact CD2-CG 4.1Å; S131-P525 WeakPolarHBondContact OG-CB 3.38Å; C509-P525 HydrophobicContact CB-CG 4.28Å; C509-P525 WeakPolarHBondContact O-CD 3.19Å; P525-F527 HydrophobicContact CB-CD2 4.38Å; P525-F527 HydrophobicContact CB-CE2 3.83Å; P525-F527 HydrophobicContact CB-CZ 3.95Å; P525-F527 HydrophobicContact CG-CE2 4.46Å; P525-F527 HydrophobicContact CG-CZ 4.42Å
526	K	69.3	Low	85.8	Confident	139 Å²	139	51.3 Å²	51.3	60%	0.604	25%	0.245	S	C	*	.			trans	-89	130.8	159.9	-77.6	179.9	177.4	161.1	0	108.1	N133	N133-K526 HydrophobicContact CB-CD 4Å; N133-K526 HydrophobicContact CB-CG 4.04Å; N133-K526 VanDerWaalsContact CG-CE 3.41Å; N133-K526 WeakPolarHBondContact OD1-CE 3.27Å; N133-K526 PolarHBondContact OD1-NZ 2.93Å
527	F	60.6	Low	85	Confident	237 Å²	237	53.3 Å²	53.3	100%	1.039	25%	0.253	S	S	*	.			trans	-107.2	0	173.5	-63.5	-82.6	0	0	0	109.2	L128 P525	L128-F527 HydrophobicContact CD2-CD1 4.39Å; L128-F527 HydrophobicContact CD2-CE1 3.52Å; L128-F527 HydrophobicContact CD2-CZ 3.82Å; P525-F527 HydrophobicContact CB-CD2 4.38Å; P525-F527 HydrophobicContact CB-CE2 3.83Å; P525-F527 HydrophobicContact CB-CZ 3.95Å; P525-F527 HydrophobicContact CG-CE2 4.46Å; P525-F527 HydrophobicContact CG-CZ 4.42Å

Retrieved 527 of 527 residues in 858 ms (Link to these results)

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