A0A5K4F3B8_SCHMA Loading...

FYVE_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F3B8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 773 aa.

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(Predicted Aligned Error values between residue pairs)

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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	36.5	Very low	39.3	Very low	234 Å²	234	144.1 Å²	144.1	100%	1.153	78%	0.777	S	S	*	*				0	97.2	0	-65.2	160.7	179.9	0	0	106.2
2	S	36.4	Very low	39.1	Very low	91 Å²	91	140.3 Å²	140.3	64%	0.636	77%	0.77	S	S	*	*				76.6	119.7	68.3	64.7	0	0	0	0	111.8
3	Y	33.9	Very low	39.1	Very low	215 Å²	215	148.2 Å²	148.2	84%	0.843	78%	0.781	S	S	*	*			cis	-143.3	142.6	-4.3	-84.2	-82.8	0	0	0	106.4
4	S	37.8	Very low	39.7	Very low	91 Å²	91	144.4 Å²	144.4	64%	0.636	77%	0.769	S	S	*	*				86.3	140.3	62	-52.1	0	0	0	0	116
5	N	39.8	Very low	39.4	Very low	148 Å²	148	147.5 Å²	147.5	79%	0.791	77%	0.774	S	S	*	*			trans	87.8	153.4	162.9	-55.6	-9.9	0	0	0	119.9
6	I	39.4	Very low	39.3	Very low	133 Å²	133	149.5 Å²	149.5	68%	0.682	78%	0.778	S	S	*	*			cis	178.4	163.4	-46.5	-102.9	164.1	0	0	0	110.1
7	N	43	Very low	39.1	Very low	139 Å²	139	146.7 Å²	146.7	74%	0.743	77%	0.774	S	S	*	*			trans	85.4	150.8	170.8	-64.6	-36.1	0	0	0	119.2
8	N	38.5	Very low	39.2	Very low	146 Å²	146	146.9 Å²	146.9	78%	0.781	78%	0.782	S	S	*	*			cis	-165.2	159.9	-41.1	-129	1.8	0	0	0	110.9
9	P	47.4	Very low	39	Very low	105 Å²	105	147.3 Å²	147.3	68%	0.682	79%	0.785	S	S	*	*			trans	-120.7	169.4	-174.5	42.3	-32.5	0	0	0	116.7
10	T	39.7	Very low	39.1	Very low	134 Å²	134	147.3 Å²	147.3	82%	0.822	79%	0.785	S	S	*	*			trans	166.2	163.8	150.9	30.7	0	0	0	0	108.3
11	L	39.5	Very low	39	Very low	149 Å²	149	146.4 Å²	146.4	78%	0.78	78%	0.78	S	S	*	*			cis	-145.8	144.5	26.3	-71.6	166.4	0	0	0	107.8
12	S	37.6	Very low	39.1	Very low	99 Å²	99	144.6 Å²	144.6	69%	0.692	77%	0.766	S	S	*	*				67.8	134.3	61.5	84.8	0	0	0	0	115.7
13	R	39	Very low	39	Very low	242 Å²	242	150.7 Å²	150.7	91%	0.913	78%	0.775	S	S	*	*			cis	-164.3	-159.3	-4.7	-129.8	-164.5	177.8	-170.8	1.5	111.5
14	P	47.2	Very low	39.3	Very low	95 Å²	95	145.3 Å²	145.3	62%	0.617	77%	0.769	S	S	*	*			trans	-133.3	-168.6	-142.8	36.1	-10.1	0	0	0	119.5
15	F	36	Very low	39.3	Very low	192 Å²	192	152.2 Å²	152.2	84%	0.842	78%	0.781	S	S	*	*			trans	71.2	163.2	173.4	-74.9	-92.9	0	0	0	116.2
16	E	37.9	Very low	39.2	Very low	179 Å²	179	149.2 Å²	149.2	84%	0.836	77%	0.772	S	S	*	*			cis	-146.5	-161.2	19.1	-152.7	155.1	-127.3	0	0	113.5
17	S	34.8	Very low	39.2	Very low	102 Å²	102	150.2 Å²	150.2	71%	0.713	78%	0.778	S	S	*	*			trans	-141.8	150.2	-163.6	62.9	0	0	0	0	116.9
18	T	40.9	Very low	39	Very low	150 Å²	150	149 Å²	149	92%	0.92	78%	0.781	S	S	*	*			trans	-156.4	155.4	156.8	18.1	0	0	0	0	113.1
19	N	35.5	Very low	39.5	Very low	155 Å²	155	147.8 Å²	147.8	83%	0.829	78%	0.781	S	S	*	*			trans	-95.6	164.2	169.7	-62.7	-53.4	0	0	0	110.6
20	D	40.6	Very low	39.1	Very low	146 Å²	146	146.3 Å²	146.3	78%	0.781	78%	0.778	S	S	*	*				-163	177.8	111.7	-131.6	-40.1	0	0	0	114.5
21	N	37.2	Very low	39.2	Very low	129 Å²	129	147.9 Å²	147.9	69%	0.69	78%	0.775	S	S	*	*			trans	-100.1	160.3	-170.2	-60.7	-100.5	0	0	0	112.8
22	F	38.2	Very low	39.2	Very low	197 Å²	197	146.5 Å²	146.5	86%	0.864	77%	0.769	S	S	*	*				-177.2	141.6	110.8	-114.3	-94.2	0	0	0	115.7
23	R	36.1	Very low	39.2	Very low	218 Å²	218	149 Å²	149	82%	0.823	77%	0.773	S	S	*	*			trans	-59.2	150.2	178.3	-62.1	160.6	159.5	173.1	-5.3	116.1
24	S	38.4	Very low	39.2	Very low	102 Å²	102	140.6 Å²	140.6	71%	0.713	76%	0.762	S	S	*	*				153.7	137	106	-68.7	0	0	0	0	116.4
25	R	38.2	Very low	38.9	Very low	237 Å²	237	141.4 Å²	141.4	89%	0.894	77%	0.769	S	S	*	*			trans	43.3	151	134.5	-68	-178	174.3	-179.2	-2.9	121.8
26	S	38	Very low	39.2	Very low	84 Å²	84	141.2 Å²	141.2	59%	0.587	77%	0.768	S	S	*	*			cis	-179.4	164.5	-11.9	51.6	0	0	0	0	112.2
27	N	38.7	Very low	39.4	Very low	154 Å²	154	139.1 Å²	139.1	82%	0.824	77%	0.768	S	S	*	*			trans	92.1	142.6	156.2	-57.5	-15.8	0	0	0	121.5
28	S	39.8	Very low	39.7	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	77%	0.767	S	S	*	*			trans	-108.2	-151.6	167.6	-36.7	0	0	0	0	108.6
29	P	48.7	Very low	39.7	Very low	119 Å²	119	136.4 Å²	136.4	77%	0.773	77%	0.766	S	S	*	*			cis	-148.9	-178.4	7.6	47	-26.6	0	0	0	119.8
30	A	39.5	Very low	39.8	Very low	75 Å²	75	132.8 Å²	132.8	62%	0.62	76%	0.757	S	S	*	*			trans	83.7	151.5	135.6	0	0	0	0	0	126.3
31	H	41.8	Very low	39.6	Very low	166 Å²	166	135.6 Å²	135.6	77%	0.769	76%	0.763	S	S	*	*			trans	75.9	149	153	-67.1	-45.4	0	0	0	121.4
32	N	39	Very low	39.8	Very low	120 Å²	120	136.8 Å²	136.8	64%	0.642	77%	0.767	S	S	*	*			cis	-167.3	147.9	-25.5	-122	9.1	0	0	0	114.8
33	I	38.5	Very low	40	Very low	153 Å²	153	132.8 Å²	132.8	79%	0.785	76%	0.762	S	S	*	*			trans	56.5	133.7	140	-63.8	172	0	0	0	123.9
34	G	38.6	Very low	39.9	Very low	65 Å²	65	130 Å²	130	67%	0.67	76%	0.763	S	S	*	*			trans	166.9	106	151.6	0	0	0	0	0	113
35	S	40	Very low	40	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	77%	0.766	S	S	*	*				58.2	134.3	88.1	-74.1	0	0	0	0	114.8
36	K	43	Very low	39.8	Very low	188 Å²	188	126.8 Å²	126.8	82%	0.817	76%	0.763	S	S	*	*			cis	-169.2	171.9	1	-94.2	177.2	-177.4	179.2	0	106
37	T	42	Very low	39.5	Very low	136 Å²	136	128.5 Å²	128.5	83%	0.834	78%	0.776	S	S	*	*			cis	-173.2	167.5	-18.7	31.8	0	0	0	0	105.6
38	G	40.5	Very low	39.3	Very low	67 Å²	67	127.8 Å²	127.8	69%	0.691	77%	0.77	S	S	*	*			cis	158.1	172.5	2.9	0	0	0	0	0	110.5
39	S	40.6	Very low	38.9	Very low	128 Å²	128	126 Å²	126	90%	0.895	77%	0.77	S	S	*	*			trans	77	143.9	176.8	-161.5	0	0	0	0	118
40	A	37.9	Very low	38.1	Very low	79 Å²	79	124.9 Å²	124.9	65%	0.653	77%	0.765	S	S	*	*			cis	-170.4	145.3	-30.9	0	0	0	0	0	110.3
41	F	37.9	Very low	37.7	Very low	205 Å²	205	128.2 Å²	128.2	90%	0.899	78%	0.778	S	S	*	*			trans	-173	171.7	138.9	-110.6	-75.5	0	0	0	109.4
42	I	39.7	Very low	37.6	Very low	153 Å²	153	129.1 Å²	129.1	79%	0.785	78%	0.779	S	S	*	*			trans	-114.6	173.9	-153.8	4.1	179	0	0	0	113.4
43	P	43.9	Very low	37.3	Very low	114 Å²	114	128.8 Å²	128.8	74%	0.74	79%	0.786	S	S	*	*				-123.1	178.6	-123.2	43.2	-27.8	0	0	0	114.8
44	D	33.8	Very low	37.3	Very low	159 Å²	159	128.7 Å²	128.7	85%	0.85	79%	0.786	S	S	*	*			trans	-156.8	163.4	149.7	-136.1	-30.7	0	0	0	114.7
45	S	40.5	Very low	37.3	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	79%	0.788	S	S	*	*			trans	67.2	132	176.9	75.8	0	0	0	0	118.1
46	L	34.2	Very low	37.3	Very low	160 Å²	160	133.6 Å²	133.6	84%	0.838	79%	0.789	S	S	*	*			trans	-98.3	137.3	-178.8	-68.9	121.6	0	0	0	112.3	I48	L46-I48 HydrophobicContact CD2-CD1 3.86Å; L46-I48 HydrophobicContact CD2-CG1 4.24Å
47	S	31.4	Very low	37	Very low	121 Å²	121	134.6 Å²	134.6	85%	0.846	79%	0.789	S	S	*	*			trans	-128.8	107.9	154.4	55.9	0	0	0	0	109.7
48	I	34.8	Very low	36.9	Very low	138 Å²	138	132.7 Å²	132.7	71%	0.708	78%	0.78	S	S	*	*			trans	-107.4	103.6	179.3	-63.1	179.6	0	0	0	108.7	L46 S50	L46-I48 HydrophobicContact CD2-CD1 3.86Å; L46-I48 HydrophobicContact CD2-CG1 4.24Å; I48-S50 PolarHBondContact O-N 2.96Å
49	G	30.2	Very low	36.7	Very low	77 Å²	77	139.9 Å²	139.9	79%	0.794	79%	0.786	S	S	*	*			trans	-67.5	118.9	165.8	0	0	0	0	0	110.1
50	S	32.7	Very low	36.4	Very low	97 Å²	97	144.3 Å²	144.3	68%	0.678	79%	0.789	S	S	*	*			trans	-106.2	101.5	178.9	-171.1	0	0	0	0	110.8	I48 K52	I48-S50 PolarHBondContact O-N 2.96Å; S50-K52 PolarHBondContact O-N 3.15Å
51	T	31.9	Very low	36.6	Very low	144 Å²	144	144.3 Å²	144.3	88%	0.883	80%	0.797	S	S	*	*			trans	-70.2	88	171.7	40.9	0	0	0	0	110.2	S53	T51-S53 PolarHBondContact O-N 3.09Å
52	K	37.9	Very low	36.7	Very low	186 Å²	186	138.8 Å²	138.8	81%	0.809	78%	0.78	S	S	*	*			trans	-63.5	107.9	175.8	-75.3	-175.6	176.3	177.9	0	110.4	S50 I54	S50-K52 PolarHBondContact O-N 3.15Å; K52-I54 PolarHBondContact O-N 3.08Å
53	S	33.3	Very low	37.3	Very low	112 Å²	112	136.2 Å²	136.2	78%	0.783	77%	0.771	S	S	*	*			trans	-57.1	122.2	173.3	-176.1	0	0	0	0	110.7	T51 K55	T51-S53 PolarHBondContact O-N 3.09Å; S53-K55 PolarHBondContact O-N 2.85Å
54	I	38	Very low	37.8	Very low	152 Å²	152	134.4 Å²	134.4	78%	0.779	76%	0.755	S	S	*	*			trans	-74.9	107.9	177.2	-60.4	175	0	0	0	107.6	K52 S56	K52-I54 PolarHBondContact O-N 3.08Å; I54-S56 PolarHBondContact O-N 2.63Å
55	K	40	Very low	38.6	Very low	163 Å²	163	128.4 Å²	128.4	71%	0.709	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-59.1	120.2	172.1	-73.3	-172.9	176	-174.6	0	109.1	S53	S53-K55 PolarHBondContact O-N 2.85Å
56	S	39.7	Very low	39.2	Very low	116 Å²	116	130 Å²	130	81%	0.811	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-72.9	128.3	178.8	44.8	0	0	0	0	111.4	I54	I54-S56 PolarHBondContact O-N 2.63Å
57	Y	36.2	Very low	40.6	Very low	208 Å²	208	123.8 Å²	123.8	82%	0.816	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-70.8	148.7	176.7	-59.4	-82.1	0	0	0	111.6
58	P	39.9	Very low	42.3	Very low	97 Å²	97	126 Å²	126	63%	0.63	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-62.9	139.8	177.1	-19	31.5	0	0	0	112	T62	P58-T62 VanDerWaalsContact CB-OG1 3.27Å; P58-T62 WeakPolarHBondContact CB-OG1 3.42Å
59	R	36.8	Very low	44.1	Very low	218 Å²	218	120.7 Å²	120.7	82%	0.823	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-69.6	146.2	177.4	-61.2	-172.5	-172.5	-164.9	3.1	110.6	G61 T62	R59-G61 PolarHBondContact O-N 3.04Å; R59-T62 PolarHBondContact O-N 2.76Å; R59-T62 VanDerWaalsContact O-N 3.17Å; R59-T62 PolarHBondContact O-OG1 3.37Å; R59-T62 VanDerWaalsContact O-OG1 3.12Å
60	K	34.8	Very low	46.6	Very low	221 Å²	221	119.5 Å²	119.5	96%	0.961	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.4	116.4	169.2	-75.9	-177.1	176.8	175	0	109.8
61	G	40.5	Very low	48.8	Very low	79 Å²	79	119.2 Å²	119.2	81%	0.814	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.7	-22.3	179.8	0	0	0	0	0	115.3	R59 T63	R59-G61 PolarHBondContact O-N 3.04Å; G61-T63 PolarHBondContact O-N 3.09Å
62	T	41.7	Very low	51	Low	89 Å²	89	118.7 Å²	118.7	55%	0.546	63%	0.633	S	S	.	*			trans	-71.5	117.9	171.1	51.9	0	0	0	0	110.2	P58 R59	P58-T62 VanDerWaalsContact CB-OG1 3.27Å; P58-T62 WeakPolarHBondContact CB-OG1 3.42Å; R59-T62 PolarHBondContact O-N 2.76Å; R59-T62 VanDerWaalsContact O-N 3.17Å; R59-T62 PolarHBondContact O-OG1 3.37Å; R59-T62 VanDerWaalsContact O-OG1 3.12Å
63	T	51.2	Low	53.1	Low	98 Å²	98	113.6 Å²	113.6	60%	0.601	61%	0.612	S	S	*	*			trans	-66.3	147.7	168.9	50.9	0	0	0	0	110.1	G61 A65 N66	G61-T63 PolarHBondContact O-N 3.09Å; T63-A65 PolarHBondContact O-N 2.8Å; T63-N66 PolarHBondContact O-N 2.78Å
64	L	54.1	Low	55.3	Low	77 Å²	77	109.4 Å²	109.4	40%	0.403	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-61.8	-8.7	-179.1	-147.4	80.6	0	0	0	113.7	N66 A67 L69 L77 L200	L64-N66 PolarHBondContact O-N 2.9Å; L64-A67 PolarHBondContact O-N 3.17Å; L64-L69 HydrophobicContact CD2-CD1 4.01Å; L64-L69 HydrophobicContact CG-CD1 4.22Å; L64-L77 HydrophobicContact CD2-CD1 4.02Å; L64-L200 HydrophobicContact CD2-CD1 3.43Å; L64-L200 VanDerWaalsContact CD2-CD1 3.43Å
65	A	51.3	Low	57.4	Low	32 Å²	32	106.7 Å²	106.7	26%	0.264	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-60.5	-29.1	175.8	0	0	0	0	0	113.6	T63 R206	T63-A65 PolarHBondContact O-N 2.8Å; A65-R206 VanDerWaalsContact CA-NH2 3.32Å; A65-R206 PolarHBondContact O-NH2 2.83Å
66	N	53.6	Low	59.4	Low	144 Å²	144	104 Å²	104	77%	0.77	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-105.1	13.7	-174.7	-64.3	10.5	0	0	0	113	T63 L64	T63-N66 PolarHBondContact O-N 2.78Å; L64-N66 PolarHBondContact O-N 2.9Å
67	A	62.5	Low	61.5	Low	31 Å²	31	100.2 Å²	100.2	26%	0.256	53%	0.527	S	S	.	.			trans	-91	127.1	176	0	0	0	0	0	111	L64 L69	L64-A67 PolarHBondContact O-N 3.17Å; A67-L69 HydrophobicContact CB-CG 4.15Å; A67-L69 PolarHBondContact O-N 2.75Å
68	N	67.9	Low	63.7	Low	166 Å²	166	94.2 Å²	94.2	89%	0.888	51%	0.507	S	S	*	.			trans	-74.1	76.5	170	-77	-15.3	0	0	0	110
69	L	73	Confident	65.9	Low	28 Å²	28	93.8 Å²	93.8	15%	0.147	50%	0.496	C	S	.	.			trans	-71.6	127.5	-179.3	-72.2	161.5	0	0	0	111.3	L64 A67 E73 Q74 L77 I207	L64-L69 HydrophobicContact CD2-CD1 4.01Å; L64-L69 HydrophobicContact CG-CD1 4.22Å; A67-L69 HydrophobicContact CB-CG 4.15Å; A67-L69 PolarHBondContact O-N 2.75Å; L69-E73 VanDerWaalsContact CA-OE2 3.31Å; L69-E73 WeakPolarHBondContact CA-OE2 3.5Å; L69-E73 HydrophobicContact CB-CB 4.4Å; L69-E73 HydrophobicContact CD2-CB 3.87Å; L69-Q74 HydrophobicContact CB-CG 4.01Å; L69-Q74 PolarHBondContact O-NE2 2.79Å; L69-L77 HydrophobicContact CD1-CD1 3.82Å; L69-L77 HydrophobicContact CD2-CD1 3.97Å; L69-I207 HydrophobicContact CD1-CD1 3.82Å
70	T	81.3	Confident	68.1	Low	52 Å²	52	86.2 Å²	86.2	32%	0.319	48%	0.475	S	S	.	.			trans	-68	170.2	174.8	82.7	0	0	0	0	111.8	E72 E73 Q74	T70-E72 VanDerWaalsContact C-N 3.27Å; T70-E72 WeakPolarHBondContact CB-OE2 3.33Å; T70-E72 PolarHBondContact O-N 2.85Å; T70-E72 PolarHBondContact OG1-N 3.3Å; T70-E72 PolarHBondContact OG1-OE2 2.94Å; T70-E73 PolarHBondContact N-OE2 2.92Å; T70-E73 PolarHBondContact O-N 3.33Å; T70-E73 WeakPolarHBondContact OG1-CG 3.24Å; T70-E73 PolarHBondContact OG1-N 3.18Å; T70-Q74 WeakPolarHBondContact O-CB 3.37Å; T70-Q74 VanDerWaalsContact O-CG 3.3Å; T70-Q74 WeakPolarHBondContact O-CG 3.35Å; T70-Q74 PolarHBondContact O-N 2.9Å; T70-Q74 PolarHBondContact O-NE2 3.1Å
71	V	79.6	Confident	70.4	Confident	90 Å²	90	76.3 Å²	76.3	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-65.3	-36	177.8	179.6	0	0	0	0	110.6	Q74 N75	V71-Q74 PolarHBondContact O-N 2.92Å; V71-N75 WeakPolarHBondContact O-CB 3.43Å; V71-N75 PolarHBondContact O-N 3.07Å; V71-N75 PolarHBondContact O-ND2 3.03Å
72	E	78.2	Confident	72.4	Confident	133 Å²	133	74.9 Å²	74.9	62%	0.621	41%	0.409	S	S	*	.	H	α-helix	trans	-65.7	-43.7	175.6	-53.7	72	-155.3	0	0	111.2	T70 N75 H76	T70-E72 VanDerWaalsContact C-N 3.27Å; T70-E72 WeakPolarHBondContact CB-OE2 3.33Å; T70-E72 PolarHBondContact O-N 2.85Å; T70-E72 PolarHBondContact OG1-N 3.3Å; T70-E72 PolarHBondContact OG1-OE2 2.94Å; E72-N75 PolarHBondContact O-N 3.22Å; E72-H76 WeakPolarHBondContact O-CB 3.44Å; E72-H76 PolarHBondContact O-N 2.92Å
73	E	81.5	Confident	74.4	Confident	79 Å²	79	77.2 Å²	77.2	37%	0.369	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-39.5	176.1	-67.4	170.9	162.6	0	0	111.6	L69 T70 H76 L77	L69-E73 VanDerWaalsContact CA-OE2 3.31Å; L69-E73 WeakPolarHBondContact CA-OE2 3.5Å; L69-E73 HydrophobicContact CB-CB 4.4Å; L69-E73 HydrophobicContact CD2-CB 3.87Å; T70-E73 PolarHBondContact N-OE2 2.92Å; T70-E73 PolarHBondContact O-N 3.33Å; T70-E73 WeakPolarHBondContact OG1-CG 3.24Å; T70-E73 PolarHBondContact OG1-N 3.18Å; E73-H76 PolarHBondContact O-N 2.84Å; E73-L77 VanDerWaalsContact O-CG 3.27Å; E73-L77 WeakPolarHBondContact O-CG 3.24Å; E73-L77 PolarHBondContact O-N 3.19Å
74	Q	79.1	Confident	75.8	Confident	25 Å²	25	76.5 Å²	76.5	12%	0.117	40%	0.397	C	S	.	.	H	α-helix	trans	-63	-48.4	173.5	-72.8	173.3	58.8	0	0	111.8	L69 T70 V71 H76 L77 E78	L69-Q74 HydrophobicContact CB-CG 4.01Å; L69-Q74 PolarHBondContact O-NE2 2.79Å; T70-Q74 WeakPolarHBondContact O-CB 3.37Å; T70-Q74 VanDerWaalsContact O-CG 3.3Å; T70-Q74 WeakPolarHBondContact O-CG 3.35Å; T70-Q74 PolarHBondContact O-N 2.9Å; T70-Q74 PolarHBondContact O-NE2 3.1Å; V71-Q74 PolarHBondContact O-N 2.92Å; Q74-H76 VanDerWaalsContact C-N 3.29Å; Q74-H76 PolarHBondContact O-N 3.31Å; Q74-L77 PolarHBondContact O-N 3.13Å; Q74-E78 PolarHBondContact O-N 3.01Å
75	N	83.2	Confident	77.1	Confident	95 Å²	95	75.1 Å²	75.1	51%	0.508	39%	0.39	S	S	.	.	H	α-helix	trans	-59.4	-39.9	176.8	-70.6	-18	0	0	0	111.8	V71 E72 E78 E79	V71-N75 WeakPolarHBondContact O-CB 3.43Å; V71-N75 PolarHBondContact O-N 3.07Å; V71-N75 PolarHBondContact O-ND2 3.03Å; E72-N75 PolarHBondContact O-N 3.22Å; N75-E78 PolarHBondContact O-N 2.81Å; N75-E79 PolarHBondContact O-N 2.65Å
76	H	82.1	Confident	78.7	Confident	107 Å²	107	79.4 Å²	79.4	50%	0.495	40%	0.403	S	S	.	.	H	α-helix	trans	-65.8	-41.9	176.8	-174.6	63.2	0	0	0	112.3	E72 E73 Q74 E79 V80	E72-H76 WeakPolarHBondContact O-CB 3.44Å; E72-H76 PolarHBondContact O-N 2.92Å; E73-H76 PolarHBondContact O-N 2.84Å; Q74-H76 VanDerWaalsContact C-N 3.29Å; Q74-H76 PolarHBondContact O-N 3.31Å; H76-E79 WeakPolarHBondContact O-CB 3.24Å; H76-E79 PolarHBondContact O-N 3.26Å; H76-V80 WeakPolarHBondContact O-CG2 3.18Å; H76-V80 PolarHBondContact O-N 3.31Å
77	L	83.8	Confident	79.8	Confident	35 Å²	35	78.3 Å²	78.3	18%	0.183	39%	0.391	C	S	.	.	H	α-helix	trans	-65.9	-36.7	175.4	-68.4	166.9	0	0	0	112.4	L64 L69 E73 Q74 E79 V80 L81 L200 I204	L64-L77 HydrophobicContact CD2-CD1 4.02Å; L69-L77 HydrophobicContact CD1-CD1 3.82Å; L69-L77 HydrophobicContact CD2-CD1 3.97Å; E73-L77 VanDerWaalsContact O-CG 3.27Å; E73-L77 WeakPolarHBondContact O-CG 3.24Å; E73-L77 PolarHBondContact O-N 3.19Å; Q74-L77 PolarHBondContact O-N 3.13Å; L77-E79 VanDerWaalsContact C-N 3.35Å; L77-V80 PolarHBondContact O-N 3.43Å; L77-L81 WeakPolarHBondContact O-CG 3.26Å; L77-L81 PolarHBondContact O-N 3.39Å; L77-L200 HydrophobicContact CD1-CD1 4.31Å; L77-L200 HydrophobicContact CD2-CD1 4.26Å; L77-L200 HydrophobicContact CD2-CD2 4.24Å; L77-I204 HydrophobicContact CB-CD1 3.83Å
78	E	82.6	Confident	80.6	Confident	83 Å²	83	82.4 Å²	82.4	39%	0.388	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-36.4	171.1	-71.5	-168	171.7	0	0	112.1	Q74 N75 L81 S82 I204 Q208	Q74-E78 PolarHBondContact O-N 3.01Å; N75-E78 PolarHBondContact O-N 2.81Å; E78-L81 PolarHBondContact O-N 3.31Å; E78-S82 WeakPolarHBondContact O-CB 3.17Å; E78-S82 PolarHBondContact O-N 3.02Å; E78-I204 HydrophobicContact CG-CD1 4.31Å; E78-I204 HydrophobicContact CG-CG2 4.26Å; E78-Q208 PolarHBondContact OE1-NE2 2.67Å
79	E	84.7	Confident	81.3	Confident	87 Å²	87	80.1 Å²	80.1	41%	0.407	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-43.1	173.8	-149.8	-143.5	147.2	0	0	111.9	N75 H76 L77 L81 S82 R83	N75-E79 PolarHBondContact O-N 2.65Å; H76-E79 WeakPolarHBondContact O-CB 3.24Å; H76-E79 PolarHBondContact O-N 3.26Å; L77-E79 VanDerWaalsContact C-N 3.35Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 3.38Å; E79-S82 WeakPolarHBondContact O-CB 3.28Å; E79-S82 PolarHBondContact O-N 3.02Å; E79-S82 VanDerWaalsContact O-N 3.16Å; E79-R83 VanDerWaalsContact O-CG 3.31Å; E79-R83 WeakPolarHBondContact O-CG 3.45Å; E79-R83 PolarHBondContact O-N 3.24Å; E79-R83 IonicContact OE1-CZ 2.68Å; E79-R83 IonicContact OE1-NE 2.68Å; E79-R83 PolarHBondContact OE1-NE 3.19Å; E79-R83 IonicContact OE1-NH2 3.44Å; E79-R83 PolarHBondContact OE1-NH2 2.96Å; E79-R83 IonicContact OE2-CZ 3.51Å; E79-R83 IonicContact OE2-NE 2.72Å; E79-R83 IonicContact OE2-NH2 3.5Å; E79-R83 PolarHBondContact OE2-NH2 2.79Å
80	V	82.6	Confident	81.6	Confident	60 Å²	60	83.5 Å²	83.5	36%	0.364	40%	0.401	S	S	.	.	H	α-helix	trans	-59.9	-42.5	174.6	170	0	0	0	0	111.2	H76 L77 R83 F84	H76-V80 WeakPolarHBondContact O-CG2 3.18Å; H76-V80 PolarHBondContact O-N 3.31Å; L77-V80 PolarHBondContact O-N 3.43Å; V80-R83 PolarHBondContact O-N 3.25Å; V80-F84 WeakPolarHBondContact O-CB 3.34Å; V80-F84 PolarHBondContact O-N 2.92Å
81	L	84.8	Confident	81.5	Confident	12 Å²	12	84 Å²	84	6%	0.063	40%	0.4	C	S	.	.	H	α-helix	trans	-63.2	-41.7	173.3	-74.4	167.5	0	0	0	112.3	L77 E78 E79 R83 F84 D85 P197 L200 R201 I204	L77-L81 WeakPolarHBondContact O-CG 3.26Å; L77-L81 PolarHBondContact O-N 3.39Å; E78-L81 PolarHBondContact O-N 3.31Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 3.38Å; L81-R83 PolarHBondContact O-N 3.16Å; L81-F84 WeakPolarHBondContact O-CB 3.43Å; L81-F84 PolarHBondContact O-N 2.91Å; L81-D85 PolarHBondContact O-N 3.42Å; L81-P197 HydrophobicContact CD2-CB 3.86Å; L81-L200 HydrophobicContact CD1-CD2 4.15Å; L81-L200 HydrophobicContact CD1-CG 4.09Å; L81-L200 HydrophobicContact CD2-CB 4.48Å; L81-L200 HydrophobicContact CD2-CD2 4.02Å; L81-L200 HydrophobicContact CD2-CG 4.43Å; L81-L200 HydrophobicContact CG-CD2 3.95Å; L81-L200 HydrophobicContact CG-CG 4.41Å; L81-R201 HydrophobicContact CD1-CG 3.7Å; L81-R201 HydrophobicContact CD2-CG 4.07Å; L81-R201 HydrophobicContact CG-CG 4.49Å; L81-I204 HydrophobicContact CD1-CD1 3.75Å
82	S	82.6	Confident	81.4	Confident	49 Å²	49	83.4 Å²	83.4	34%	0.343	39%	0.394	S	S	.	.	H	α-helix	trans	-62.5	-40.9	175.4	-173	0	0	0	0	112.2	E78 E79 K86	E78-S82 WeakPolarHBondContact O-CB 3.17Å; E78-S82 PolarHBondContact O-N 3.02Å; E79-S82 WeakPolarHBondContact O-CB 3.28Å; E79-S82 PolarHBondContact O-N 3.02Å; E79-S82 VanDerWaalsContact O-N 3.16Å; S82-K86 WeakPolarHBondContact O-CD 3.18Å; S82-K86 VanDerWaalsContact O-CG 3.25Å; S82-K86 WeakPolarHBondContact O-CG 3.41Å; S82-K86 PolarHBondContact O-N 2.9Å; S82-K86 VanDerWaalsContact O-N 3.15Å; S82-K86 PolarHBondContact OG-NZ 2.79Å
83	R	81.8	Confident	81.8	Confident	138 Å²	138	83.2 Å²	83.2	52%	0.521	39%	0.391	S	S	.	.	H	α-helix	trans	-64.2	-43.7	173.2	-67.9	171.4	-174.6	-172.6	6.5	111.1	E79 V80 L81 K86 F87	E79-R83 VanDerWaalsContact O-CG 3.31Å; E79-R83 WeakPolarHBondContact O-CG 3.45Å; E79-R83 PolarHBondContact O-N 3.24Å; E79-R83 IonicContact OE1-CZ 2.68Å; E79-R83 IonicContact OE1-NE 2.68Å; E79-R83 PolarHBondContact OE1-NE 3.19Å; E79-R83 IonicContact OE1-NH2 3.44Å; E79-R83 PolarHBondContact OE1-NH2 2.96Å; E79-R83 IonicContact OE2-CZ 3.51Å; E79-R83 IonicContact OE2-NE 2.72Å; E79-R83 IonicContact OE2-NH2 3.5Å; E79-R83 PolarHBondContact OE2-NH2 2.79Å; V80-R83 PolarHBondContact O-N 3.25Å; L81-R83 PolarHBondContact O-N 3.16Å; R83-K86 PolarHBondContact O-N 3.27Å; R83-F87 PolarHBondContact O-N 2.87Å
84	F	80.9	Confident	82.2	Confident	84 Å²	84	82.7 Å²	82.7	37%	0.368	39%	0.385	S	S	.	.	H	α-helix	trans	-60.7	-46.6	176.7	178.8	-88.9	0	0	0	112.4	V80 L81 K86 F87 R88 P197	V80-F84 WeakPolarHBondContact O-CB 3.34Å; V80-F84 PolarHBondContact O-N 2.92Å; L81-F84 WeakPolarHBondContact O-CB 3.43Å; L81-F84 PolarHBondContact O-N 2.91Å; F84-K86 VanDerWaalsContact C-N 3.34Å; F84-K86 PolarHBondContact O-N 2.81Å; F84-F87 PolarHBondContact O-N 2.9Å; F84-R88 WeakPolarHBondContact O-CB 3.16Å; F84-R88 PolarHBondContact O-N 2.9Å; F84-P197 HydrophobicContact CD1-CB 4.07Å; F84-P197 HydrophobicContact CD1-CG 3.82Å; F84-P197 HydrophobicContact CD2-CG 4.25Å; F84-P197 HydrophobicContact CE1-CB 4Å; F84-P197 HydrophobicContact CE1-CG 3.49Å; F84-P197 VanDerWaalsContact CE1-CG 3.49Å; F84-P197 HydrophobicContact CE2-CG 3.94Å; F84-P197 HydrophobicContact CG-CG 4.2Å; F84-P197 HydrophobicContact CZ-CG 3.57Å
85	D	82	Confident	82.3	Confident	47 Å²	47	82.8 Å²	82.8	25%	0.251	39%	0.388	S	S	.	.	H	α-helix	trans	-66.6	-35.9	-179.9	-69.9	-29.1	0	0	0	112.2	L81 R88 Q89 R201	L81-D85 PolarHBondContact O-N 3.42Å; D85-R88 PolarHBondContact O-N 2.82Å; D85-Q89 WeakPolarHBondContact O-CG 3.11Å; D85-Q89 PolarHBondContact O-N 2.76Å; D85-R201 IonicContact OD1-CZ 3.61Å; D85-R201 IonicContact OD1-NH1 3.74Å; D85-R201 PolarHBondContact OD1-NH1 3.08Å; D85-R201 IonicContact OD1-NH2 3.63Å; D85-R201 PolarHBondContact OD1-NH2 2.86Å; D85-R201 IonicContact OD2-CZ 2.6Å; D85-R201 IonicContact OD2-NH1 2.79Å; D85-R201 PolarHBondContact OD2-NH1 2.62Å; D85-R201 IonicContact OD2-NH2 3.79Å
86	K	84.4	Confident	82.5	Confident	122 Å²	122	85.1 Å²	85.1	53%	0.53	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-46.2	171.5	-71.7	163.9	-173.2	165.6	0	111.5	S82 R83 F84 Q89 I90	S82-K86 WeakPolarHBondContact O-CD 3.18Å; S82-K86 VanDerWaalsContact O-CG 3.25Å; S82-K86 WeakPolarHBondContact O-CG 3.41Å; S82-K86 PolarHBondContact O-N 2.9Å; S82-K86 VanDerWaalsContact O-N 3.15Å; S82-K86 PolarHBondContact OG-NZ 2.79Å; R83-K86 PolarHBondContact O-N 3.27Å; F84-K86 VanDerWaalsContact C-N 3.34Å; F84-K86 PolarHBondContact O-N 2.81Å; K86-Q89 PolarHBondContact O-N 2.79Å; K86-I90 WeakPolarHBondContact O-CG1 3.23Å; K86-I90 PolarHBondContact O-N 2.99Å; K86-I90 VanDerWaalsContact O-N 3.11Å
87	F	78.2	Confident	82.9	Confident	122 Å²	122	85.9 Å²	85.9	54%	0.535	40%	0.397	S	S	.	.	H	α-helix	trans	-60.9	-45	176.3	-175.6	-94.7	0	0	0	111.7	R83 F84 Q89 I90 E91	R83-F87 PolarHBondContact O-N 2.87Å; F84-F87 PolarHBondContact O-N 2.9Å; F87-Q89 VanDerWaalsContact C-N 3.35Å; F87-Q89 PolarHBondContact O-N 2.96Å; F87-I90 WeakPolarHBondContact O-CB 3.41Å; F87-I90 PolarHBondContact O-N 2.81Å; F87-I90 VanDerWaalsContact O-N 3.13Å; F87-E91 PolarHBondContact O-N 2.98Å
88	R	79.2	Confident	83	Confident	117 Å²	117	84.7 Å²	84.7	44%	0.442	39%	0.391	S	S	.	.	H	α-helix	trans	-58.4	-42.3	175.3	-176.6	177.7	178.2	168.1	3.3	112.5	F84 D85 I90 E91 D92	F84-R88 WeakPolarHBondContact O-CB 3.16Å; F84-R88 PolarHBondContact O-N 2.9Å; D85-R88 PolarHBondContact O-N 2.82Å; R88-I90 VanDerWaalsContact C-N 3.34Å; R88-I90 PolarHBondContact O-N 2.9Å; R88-E91 PolarHBondContact O-N 3.34Å; R88-D92 WeakPolarHBondContact O-CB 3.28Å; R88-D92 PolarHBondContact O-N 2.82Å
89	Q	81.1	Confident	83.2	Confident	118 Å²	118	88.2 Å²	88.2	55%	0.551	40%	0.401	S	S	*	.	H	α-helix	trans	-65.3	-34.4	175.8	-72.7	176.6	32.4	0	0	113.3	D85 K86 F87 K93	D85-Q89 WeakPolarHBondContact O-CG 3.11Å; D85-Q89 PolarHBondContact O-N 2.76Å; K86-Q89 PolarHBondContact O-N 2.79Å; F87-Q89 VanDerWaalsContact C-N 3.35Å; F87-Q89 PolarHBondContact O-N 2.96Å; Q89-K93 VanDerWaalsContact O-CG 3.26Å; Q89-K93 WeakPolarHBondContact O-CG 3.38Å; Q89-K93 PolarHBondContact O-N 3Å
90	I	79.5	Confident	83.4	Confident	98 Å²	98	88.3 Å²	88.3	50%	0.503	40%	0.401	S	S	.	.	H	α-helix	trans	-67.9	-44.7	174.1	-66.7	164.2	0	0	0	109.9	K86 F87 R88 K93 R94	K86-I90 WeakPolarHBondContact O-CG1 3.23Å; K86-I90 PolarHBondContact O-N 2.99Å; K86-I90 VanDerWaalsContact O-N 3.11Å; F87-I90 WeakPolarHBondContact O-CB 3.41Å; F87-I90 PolarHBondContact O-N 2.81Å; F87-I90 VanDerWaalsContact O-N 3.13Å; R88-I90 VanDerWaalsContact C-N 3.34Å; R88-I90 PolarHBondContact O-N 2.9Å; I90-K93 WeakPolarHBondContact O-CB 3.2Å; I90-K93 PolarHBondContact O-N 2.88Å; I90-R94 PolarHBondContact O-N 2.9Å
91	E	78.8	Confident	83.7	Confident	64 Å²	64	89.7 Å²	89.7	30%	0.299	40%	0.403	S	S	.	.	H	α-helix	trans	-66.5	-43.1	178.9	-178.6	57.8	-166.3	0	0	112.3	F87 R88 K93 R94 V95	F87-E91 PolarHBondContact O-N 2.98Å; R88-E91 PolarHBondContact O-N 3.34Å; E91-K93 VanDerWaalsContact C-N 3.27Å; E91-K93 PolarHBondContact O-N 2.86Å; E91-R94 WeakPolarHBondContact O-CB 3.24Å; E91-R94 PolarHBondContact O-N 2.8Å; E91-R94 VanDerWaalsContact O-N 3.13Å; E91-R94 IonicContact OE1-CZ 3.82Å; E91-R94 IonicContact OE1-NE 3.54Å; E91-R94 PolarHBondContact OE1-NE 2.89Å; E91-R94 IonicContact OE1-NH2 3.84Å; E91-R94 PolarHBondContact OE1-NH2 2.68Å; E91-R94 IonicContact OE2-CZ 3.7Å; E91-R94 IonicContact OE2-NE 3.52Å; E91-R94 PolarHBondContact OE2-NE 2.94Å; E91-R94 IonicContact OE2-NH2 3.71Å; E91-V95 HydrophobicContact CG-CG2 4.46Å; E91-V95 WeakPolarHBondContact O-CB 3.46Å; E91-V95 WeakPolarHBondContact O-CG2 3.28Å; E91-V95 PolarHBondContact O-N 3.06Å
92	D	78.7	Confident	83.7	Confident	76 Å²	76	91.1 Å²	91.1	41%	0.406	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-35.1	174.3	-80.8	-33.1	0	0	0	112	R88 K96	R88-D92 WeakPolarHBondContact O-CB 3.28Å; R88-D92 PolarHBondContact O-N 2.82Å; D92-K96 WeakPolarHBondContact O-CB 3.23Å; D92-K96 WeakPolarHBondContact O-CD 3.33Å; D92-K96 VanDerWaalsContact O-CG 3.23Å; D92-K96 WeakPolarHBondContact O-CG 3.26Å; D92-K96 PolarHBondContact O-N 3.34Å; D92-K96 VanDerWaalsContact O-N 3.12Å
93	K	85.8	Confident	84	Confident	130 Å²	130	92.8 Å²	92.8	57%	0.565	42%	0.415	S	S	*	.	H	α-helix	trans	-66.9	-47.7	171.5	-75.1	170.5	179.8	-178.9	0	111.3	Q89 I90 E91 V95 K96 Q97	Q89-K93 VanDerWaalsContact O-CG 3.26Å; Q89-K93 WeakPolarHBondContact O-CG 3.38Å; Q89-K93 PolarHBondContact O-N 3Å; I90-K93 WeakPolarHBondContact O-CB 3.2Å; I90-K93 PolarHBondContact O-N 2.88Å; E91-K93 VanDerWaalsContact C-N 3.27Å; E91-K93 PolarHBondContact O-N 2.86Å; K93-V95 VanDerWaalsContact C-N 3.35Å; K93-V95 PolarHBondContact O-N 2.87Å; K93-K96 PolarHBondContact O-N 2.83Å; K93-Q97 WeakPolarHBondContact O-CG 3.5Å; K93-Q97 PolarHBondContact O-N 2.8Å
94	R	89.9	Confident	84.3	Confident	67 Å²	67	89.5 Å²	89.5	25%	0.253	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-44.9	177.9	-169	-170.1	73.8	89.8	3.8	111.7	I90 E91 Q97 L98 K173	I90-R94 PolarHBondContact O-N 2.9Å; E91-R94 WeakPolarHBondContact O-CB 3.24Å; E91-R94 PolarHBondContact O-N 2.8Å; E91-R94 VanDerWaalsContact O-N 3.13Å; E91-R94 IonicContact OE1-CZ 3.82Å; E91-R94 IonicContact OE1-NE 3.54Å; E91-R94 PolarHBondContact OE1-NE 2.89Å; E91-R94 IonicContact OE1-NH2 3.84Å; E91-R94 PolarHBondContact OE1-NH2 2.68Å; E91-R94 IonicContact OE2-CZ 3.7Å; E91-R94 IonicContact OE2-NE 3.52Å; E91-R94 PolarHBondContact OE2-NE 2.94Å; E91-R94 IonicContact OE2-NH2 3.71Å; R94-Q97 PolarHBondContact O-N 3.39Å; R94-L98 HydrophobicContact CG-CD1 4.15Å; R94-L98 VanDerWaalsContact NH1-CD1 3.32Å; R94-L98 WeakPolarHBondContact O-CB 3.19Å; R94-L98 WeakPolarHBondContact O-CG 3.11Å; R94-L98 PolarHBondContact O-N 3.45Å; R94-K173 PolarHBondContact NH1-O 2.77Å; R94-K173 PolarHBondContact NH2-O 2.87Å; R94-K173 VanDerWaalsContact NH2-O 3.08Å
95	V	82.4	Confident	84.4	Confident	28 Å²	28	89.7 Å²	89.7	17%	0.17	41%	0.408	C	S	.	.	H	α-helix	trans	-64.3	-40.7	177.6	168.3	0	0	0	0	111.4	E91 K93 R99 L174	E91-V95 HydrophobicContact CG-CG2 4.46Å; E91-V95 WeakPolarHBondContact O-CB 3.46Å; E91-V95 WeakPolarHBondContact O-CG2 3.28Å; E91-V95 PolarHBondContact O-N 3.06Å; K93-V95 VanDerWaalsContact C-N 3.35Å; K93-V95 PolarHBondContact O-N 2.87Å; V95-R99 VanDerWaalsContact O-CG 3.3Å; V95-R99 WeakPolarHBondContact O-CG 3.33Å; V95-R99 PolarHBondContact O-N 3.02Å; V95-R99 VanDerWaalsContact O-N 3.12Å; V95-L174 HydrophobicContact CB-CD2 4.31Å; V95-L174 HydrophobicContact CG1-CD2 3.99Å; V95-L174 HydrophobicContact CG2-CD2 4.4Å
96	K	86.7	Confident	84.5	Confident	143 Å²	143	91.1 Å²	91.1	62%	0.622	41%	0.413	S	S	*	.	H	α-helix	trans	-63.5	-47	174.3	-75.4	169.7	-176.5	178.2	0	112.1	D92 K93 R99 Q100	D92-K96 WeakPolarHBondContact O-CB 3.23Å; D92-K96 WeakPolarHBondContact O-CD 3.33Å; D92-K96 VanDerWaalsContact O-CG 3.23Å; D92-K96 WeakPolarHBondContact O-CG 3.26Å; D92-K96 PolarHBondContact O-N 3.34Å; D92-K96 VanDerWaalsContact O-N 3.12Å; K93-K96 PolarHBondContact O-N 2.83Å; K96-R99 PolarHBondContact O-N 2.82Å; K96-Q100 PolarHBondContact O-N 2.89Å
97	Q	89.9	Confident	84.6	Confident	123 Å²	123	91 Å²	91	58%	0.575	41%	0.413	S	S	*	.	H	α-helix	trans	-57.9	-50.6	177.6	-73.1	168.7	-22.9	0	0	111.8	K93 R94 R99 Q100 E101	K93-Q97 WeakPolarHBondContact O-CG 3.5Å; K93-Q97 PolarHBondContact O-N 2.8Å; R94-Q97 PolarHBondContact O-N 3.39Å; Q97-R99 VanDerWaalsContact C-N 3.3Å; Q97-R99 PolarHBondContact O-N 2.88Å; Q97-Q100 WeakPolarHBondContact O-CB 3.15Å; Q97-Q100 PolarHBondContact O-N 2.79Å; Q97-Q100 VanDerWaalsContact O-N 3.08Å; Q97-E101 PolarHBondContact O-N 3.3Å
98	L	86.5	Confident	84.8	Confident	10 Å²	10	87.4 Å²	87.4	5%	0.052	41%	0.406	C	S	.	.	H	α-helix	trans	-64.4	-31.4	-179.8	-69.8	171.6	0	0	0	113.4	R94 M102 K173 L174	R94-L98 HydrophobicContact CG-CD1 4.15Å; R94-L98 VanDerWaalsContact NH1-CD1 3.32Å; R94-L98 WeakPolarHBondContact O-CB 3.19Å; R94-L98 WeakPolarHBondContact O-CG 3.11Å; R94-L98 PolarHBondContact O-N 3.45Å; L98-M102 WeakPolarHBondContact O-CG 3.23Å; L98-M102 PolarHBondContact O-N 3.17Å; L98-K173 HydrophobicContact CD1-CB 3.89Å; L98-K173 HydrophobicContact CD1-CD 4.36Å; L98-K173 HydrophobicContact CD2-CB 4.45Å; L98-K173 HydrophobicContact CD2-CD 3.55Å; L98-L174 HydrophobicContact CB-CD1 4.42Å; L98-L174 HydrophobicContact CB-CD2 3.62Å; L98-L174 HydrophobicContact CB-CG 3.89Å; L98-L174 HydrophobicContact CD1-CD2 4.22Å; L98-L174 HydrophobicContact CD1-CG 4.38Å
99	R	87.9	Confident	84.8	Confident	157 Å²	157	85 Å²	85	59%	0.592	40%	0.397	S	S	*	.	H	α-helix	trans	-69.6	-41.1	171.2	-73.7	176.4	-175.6	-157.1	2.8	111.6	V95 K96 Q97 M102 I103 L174	V95-R99 VanDerWaalsContact O-CG 3.3Å; V95-R99 WeakPolarHBondContact O-CG 3.33Å; V95-R99 PolarHBondContact O-N 3.02Å; V95-R99 VanDerWaalsContact O-N 3.12Å; K96-R99 PolarHBondContact O-N 2.82Å; Q97-R99 VanDerWaalsContact C-N 3.3Å; Q97-R99 PolarHBondContact O-N 2.88Å; R99-M102 WeakPolarHBondContact O-CB 3.29Å; R99-M102 PolarHBondContact O-N 3.44Å; R99-I103 WeakPolarHBondContact O-CG1 3.45Å; R99-I103 PolarHBondContact O-N 2.9Å; R99-L174 HydrophobicContact CG-CD1 4.07Å; R99-L174 HydrophobicContact CG-CD2 4.04Å
100	Q	88.4	Confident	84.8	Confident	90 Å²	90	83.3 Å²	83.3	42%	0.421	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-45.2	177.5	-169	59.8	41.3	0	0	111.4	K96 Q97 M102 I103 D104	K96-Q100 PolarHBondContact O-N 2.89Å; Q97-Q100 WeakPolarHBondContact O-CB 3.15Å; Q97-Q100 PolarHBondContact O-N 2.79Å; Q97-Q100 VanDerWaalsContact O-N 3.08Å; Q100-M102 VanDerWaalsContact C-N 3.25Å; Q100-M102 PolarHBondContact O-N 3.46Å; Q100-I103 PolarHBondContact O-N 2.91Å; Q100-I103 VanDerWaalsContact O-N 3.09Å; Q100-D104 WeakPolarHBondContact CG-OD2 3.24Å; Q100-D104 PolarHBondContact NE2-OD1 3.26Å; Q100-D104 VanDerWaalsContact NE2-OD1 3.08Å; Q100-D104 PolarHBondContact NE2-OD2 3.47Å; Q100-D104 PolarHBondContact O-N 2.91Å
101	E	87.6	Confident	84.7	Confident	88 Å²	88	86 Å²	86	41%	0.411	40%	0.399	S	S	.	.	H	α-helix	trans	-54.9	-38.3	172.7	-75.3	-179.4	-130.2	0	0	112.8	Q97 K105 F166 H170	Q97-E101 PolarHBondContact O-N 3.3Å; E101-K105 WeakPolarHBondContact O-CB 3.47Å; E101-K105 PolarHBondContact O-N 3.18Å; E101-F166 HydrophobicContact CB-CZ 4.23Å; E101-H170 IonicContact OE2-CD2 2.76Å; E101-H170 IonicContact OE2-NE2 3.04Å; E101-H170 PolarHBondContact OE2-NE2 2.72Å
102	M	86	Confident	84.3	Confident	42 Å²	42	86.7 Å²	86.7	21%	0.207	40%	0.404	C	S	.	.	H	α-helix	trans	-67.9	-44.3	174.9	-74.2	-173.9	69	0	0	112.5	L98 R99 Q100 Q106 F166 E167 H170 K171 L174	L98-M102 WeakPolarHBondContact O-CG 3.23Å; L98-M102 PolarHBondContact O-N 3.17Å; R99-M102 WeakPolarHBondContact O-CB 3.29Å; R99-M102 PolarHBondContact O-N 3.44Å; Q100-M102 VanDerWaalsContact C-N 3.25Å; Q100-M102 PolarHBondContact O-N 3.46Å; M102-Q106 WeakPolarHBondContact O-CB 3.42Å; M102-Q106 PolarHBondContact O-N 3.44Å; M102-F166 HydrophobicContact CG-CE1 4.32Å; M102-E167 HydrophobicContact CE-CG 3.84Å; M102-H170 HydrophobicContact CG-CB 3.58Å; M102-H170 HydrophobicContact SD-CB 3.54Å; M102-H170 VanDerWaalsContact SD-CB 3.54Å; M102-K171 HydrophobicContact CE-CG 4.13Å; M102-L174 HydrophobicContact SD-CD1 3.74Å
103	I	87.7	Confident	84	Confident	84 Å²	84	85.9 Å²	85.9	43%	0.431	41%	0.405	S	S	.	.	H	α-helix	trans	-62.6	-50.3	179.3	-70.1	165.2	0	0	0	110.6	R99 Q100 K105 Q106 K107	R99-I103 WeakPolarHBondContact O-CG1 3.45Å; R99-I103 PolarHBondContact O-N 2.9Å; Q100-I103 PolarHBondContact O-N 2.91Å; Q100-I103 VanDerWaalsContact O-N 3.09Å; I103-K105 VanDerWaalsContact C-N 3.34Å; I103-K105 PolarHBondContact O-N 3.2Å; I103-Q106 PolarHBondContact O-N 2.95Å; I103-Q106 VanDerWaalsContact O-N 3.15Å; I103-K107 HydrophobicContact CG2-CD 4.33Å; I103-K107 WeakPolarHBondContact O-CG 3.37Å; I103-K107 PolarHBondContact O-N 3.41Å
104	D	88.3	Confident	83.2	Confident	69 Å²	69	85.8 Å²	85.8	37%	0.369	41%	0.406	S	S	.	.	H	α-helix	trans	-70.9	-32.5	-173.7	-66	-31.1	0	0	0	112.2	Q100 K107 A108	Q100-D104 WeakPolarHBondContact CG-OD2 3.24Å; Q100-D104 PolarHBondContact NE2-OD1 3.26Å; Q100-D104 VanDerWaalsContact NE2-OD1 3.08Å; Q100-D104 PolarHBondContact NE2-OD2 3.47Å; Q100-D104 PolarHBondContact O-N 2.91Å; D104-K107 PolarHBondContact O-N 2.81Å; D104-K107 IonicContact OD1-NZ 3.77Å; D104-K107 PolarHBondContact OD1-NZ 2.62Å; D104-A108 WeakPolarHBondContact O-CB 3.41Å; D104-A108 PolarHBondContact O-N 3.02Å
105	K	84.2	Confident	81.9	Confident	88 Å²	88	86 Å²	86	38%	0.383	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-36.3	171.2	-151.1	174.7	-158.9	156.8	0	112.3	E101 I103 A108 R109 F163 F166	E101-K105 WeakPolarHBondContact O-CB 3.47Å; E101-K105 PolarHBondContact O-N 3.18Å; I103-K105 VanDerWaalsContact C-N 3.34Å; I103-K105 PolarHBondContact O-N 3.2Å; K105-A108 PolarHBondContact O-N 2.9Å; K105-R109 PolarHBondContact O-N 3.31Å; K105-F163 HydrophobicContact CB-CE2 4.08Å; K105-F163 HydrophobicContact CD-CD2 4.43Å; K105-F163 HydrophobicContact CD-CE2 4.41Å; K105-F163 HydrophobicContact CG-CD2 4.16Å; K105-F163 HydrophobicContact CG-CE2 3.92Å; K105-F163 WeakPolarHBondContact O-CE2 3.24Å; K105-F166 HydrophobicContact CB-CE1 3.94Å; K105-F166 HydrophobicContact CB-CZ 4.3Å; K105-F166 HydrophobicContact CD-CB 4.44Å; K105-F166 HydrophobicContact CD-CD1 3.4Å; K105-F166 HydrophobicContact CD-CD2 3.88Å; K105-F166 HydrophobicContact CD-CE1 3.39Å; K105-F166 HydrophobicContact CD-CE2 3.85Å; K105-F166 HydrophobicContact CD-CG 3.65Å; K105-F166 HydrophobicContact CD-CZ 3.62Å; K105-F166 HydrophobicContact CG-CE1 4.3Å
106	Q	84.3	Confident	81.1	Confident	77 Å²	77	86.9 Å²	86.9	36%	0.36	42%	0.421	S	S	.	.	H	α-helix	trans	-65.9	-40.5	174.7	178.1	62.2	11	0	0	111.2	M102 I103 R109 I110 F163	M102-Q106 WeakPolarHBondContact O-CB 3.42Å; M102-Q106 PolarHBondContact O-N 3.44Å; I103-Q106 PolarHBondContact O-N 2.95Å; I103-Q106 VanDerWaalsContact O-N 3.15Å; Q106-R109 WeakPolarHBondContact O-CB 3.25Å; Q106-R109 PolarHBondContact O-N 3.06Å; Q106-I110 HydrophobicContact CG-CD1 4.26Å; Q106-I110 WeakPolarHBondContact O-CG1 3.45Å; Q106-I110 PolarHBondContact O-N 2.68Å; Q106-F163 HydrophobicContact CB-CZ 4.12Å
107	K	86.7	Confident	80.3	Confident	119 Å²	119	81.5 Å²	81.5	52%	0.517	41%	0.406	S	S	.	.	H	α-helix	trans	-58.1	-47.8	170.4	-69.3	172.7	-174.2	161.4	0	111.7	I103 D104 R109 I110 K111	I103-K107 HydrophobicContact CG2-CD 4.33Å; I103-K107 WeakPolarHBondContact O-CG 3.37Å; I103-K107 PolarHBondContact O-N 3.41Å; D104-K107 PolarHBondContact O-N 2.81Å; D104-K107 IonicContact OD1-NZ 3.77Å; D104-K107 PolarHBondContact OD1-NZ 2.62Å; K107-R109 VanDerWaalsContact C-N 3.28Å; K107-R109 PolarHBondContact O-N 2.94Å; K107-I110 PolarHBondContact O-N 2.85Å; K107-K111 PolarHBondContact O-N 2.89Å
108	A	81.4	Confident	79.8	Confident	47 Å²	47	84.5 Å²	84.5	39%	0.388	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-35.9	176.9	0	0	0	0	0	112.6	D104 K105 N112	D104-A108 WeakPolarHBondContact O-CB 3.41Å; D104-A108 PolarHBondContact O-N 3.02Å; K105-A108 PolarHBondContact O-N 2.9Å; A108-N112 WeakPolarHBondContact O-CB 3.45Å; A108-N112 PolarHBondContact O-N 3.09Å; A108-N112 PolarHBondContact O-OD1 2.94Å
109	R	80.1	Confident	79.7	Confident	68 Å²	68	86.1 Å²	86.1	26%	0.257	44%	0.439	S	S	.	.	H	α-helix	trans	-64.8	-44.2	174.3	-175.1	-171.9	-179.1	-176.1	-4.5	112.3	K105 Q106 K107 N112 S113 C141 F163	K105-R109 PolarHBondContact O-N 3.31Å; Q106-R109 WeakPolarHBondContact O-CB 3.25Å; Q106-R109 PolarHBondContact O-N 3.06Å; K107-R109 VanDerWaalsContact C-N 3.28Å; K107-R109 PolarHBondContact O-N 2.94Å; R109-N112 PolarHBondContact O-N 2.82Å; R109-S113 WeakPolarHBondContact O-CB 3.49Å; R109-S113 PolarHBondContact O-N 2.96Å; R109-S113 VanDerWaalsContact O-N 3.12Å; R109-C141 PolarHBondContact NH2-SG 3.47Å; R109-F163 HydrophobicContact CB-CD2 3.99Å; R109-F163 HydrophobicContact CB-CE2 3.93Å; R109-F163 HydrophobicContact CG-CD2 4.23Å; R109-F163 HydrophobicContact CG-CE2 4.47Å; R109-F163 HydrophobicContact CG-CG 4.45Å; R109-F163 VanDerWaalsContact NH1-CE1 3.32Å
110	I	80.5	Confident	79.7	Confident	82 Å²	82	83.7 Å²	83.7	42%	0.421	43%	0.43	S	S	.	.	H	α-helix	trans	-62.3	-52.9	178.2	-66.8	163.5	0	0	0	109.5	Q106 K107 N112 S113 E114	Q106-I110 HydrophobicContact CG-CD1 4.26Å; Q106-I110 WeakPolarHBondContact O-CG1 3.45Å; Q106-I110 PolarHBondContact O-N 2.68Å; K107-I110 PolarHBondContact O-N 2.85Å; I110-N112 VanDerWaalsContact C-N 3.28Å; I110-N112 PolarHBondContact O-N 2.89Å; I110-S113 WeakPolarHBondContact O-CA 3.19Å; I110-S113 WeakPolarHBondContact O-CB 3.14Å; I110-S113 PolarHBondContact O-N 3.26Å; I110-S113 PolarHBondContact O-OG 3.31Å; I110-E114 PolarHBondContact O-N 3.31Å
111	K	78	Confident	79.7	Confident	155 Å²	155	79.4 Å²	79.4	67%	0.674	41%	0.41	S	S	*	.	H	α-helix	trans	-56	-39	178	-174.4	172.7	-176.9	172.8	0	113.3	K107 S113	K107-K111 PolarHBondContact O-N 2.89Å; K111-S113 VanDerWaalsContact C-N 3.31Å; K111-S113 PolarHBondContact O-N 2.94Å
112	N	70.1	Confident	79.7	Confident	78 Å²	78	78 Å²	78	42%	0.417	41%	0.405	S	S	.	.	H	α-helix	trans	-69.6	-29.3	175.6	-72.6	5.4	0	0	0	112.5	A108 R109 I110 S115	A108-N112 WeakPolarHBondContact O-CB 3.45Å; A108-N112 PolarHBondContact O-N 3.09Å; A108-N112 PolarHBondContact O-OD1 2.94Å; R109-N112 PolarHBondContact O-N 2.82Å; I110-N112 VanDerWaalsContact C-N 3.28Å; I110-N112 PolarHBondContact O-N 2.89Å; N112-S115 PolarHBondContact O-N 2.67Å; N112-S115 PolarHBondContact O-OG 3.34Å
113	S	71.4	Confident	79.6	Confident	59 Å²	59	79.1 Å²	79.1	41%	0.413	41%	0.412	S	S	.	.	H	α-helix	trans	-73	-28	-174.1	72.8	0	0	0	0	114.5	R109 I110 K111 S115 I116	R109-S113 WeakPolarHBondContact O-CB 3.49Å; R109-S113 PolarHBondContact O-N 2.96Å; R109-S113 VanDerWaalsContact O-N 3.12Å; I110-S113 WeakPolarHBondContact O-CA 3.19Å; I110-S113 WeakPolarHBondContact O-CB 3.14Å; I110-S113 PolarHBondContact O-N 3.26Å; I110-S113 PolarHBondContact O-OG 3.31Å; K111-S113 VanDerWaalsContact C-N 3.31Å; K111-S113 PolarHBondContact O-N 2.94Å; S113-S115 PolarHBondContact O-N 3.4Å; S113-S115 VanDerWaalsContact O-N 3.11Å; S113-I116 PolarHBondContact O-N 3.1Å
114	E	68.3	Low	79.5	Confident	128 Å²	128	77.7 Å²	77.7	60%	0.598	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.3	176.2	-68	153.3	-156.6	0	0	112.9	I110	I110-E114 PolarHBondContact O-N 3.31Å
115	S	63.6	Low	79.3	Confident	72 Å²	72	76.5 Å²	76.5	50%	0.503	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-0.8	-176.4	74.7	0	0	0	0	115.5	N112 S113 G117 N125	N112-S115 PolarHBondContact O-N 2.67Å; N112-S115 PolarHBondContact O-OG 3.34Å; S113-S115 PolarHBondContact O-N 3.4Å; S113-S115 VanDerWaalsContact O-N 3.11Å; S115-G117 PolarHBondContact O-N 3.28Å; S115-N125 PolarHBondContact O-ND2 3.47Å
116	I	65.8	Low	79.3	Confident	46 Å²	46	75.5 Å²	75.5	24%	0.236	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-71.2	120.3	-175.6	-60.4	164.3	0	0	0	110.1	S113 N122	S113-I116 PolarHBondContact O-N 3.1Å; I116-N122 HydrophobicContact CD1-CB 3.77Å
117	G	69.1	Low	79.4	Confident	29 Å²	29	76.3 Å²	76.3	30%	0.299	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-89.9	159.6	165.4	0	0	0	0	0	111.8	S115 R120	S115-G117 PolarHBondContact O-N 3.28Å; G117-R120 WeakPolarHBondContact O-CB 3.47Å; G117-R120 PolarHBondContact O-N 2.77Å
118	E	80.3	Confident	79.5	Confident	187 Å²	187	72.4 Å²	72.4	87%	0.874	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	149.2	175.4	-63.1	-171.4	157.1	0	0	112.1	R120	E118-R120 VanDerWaalsContact C-N 3.26Å; E118-R120 PolarHBondContact O-N 2.95Å
119	G	83.7	Confident	79.6	Confident	43 Å²	43	73 Å²	73	44%	0.443	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	18.9	-177.9	0	0	0	0	0	114.9	F128	G119-F128 WeakPolarHBondContact O-CD2 3.47Å; G119-F128 PolarHBondContact O-N 3.18Å
120	R	89.2	Confident	79.3	Confident	107 Å²	107	75.1 Å²	75.1	40%	0.404	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-123.4	156.4	-178.4	-57.8	175	-175.9	-140	1.4	112.5	G117 E118 N122 N125 T126 L127 F128	G117-R120 WeakPolarHBondContact O-CB 3.47Å; G117-R120 PolarHBondContact O-N 2.77Å; E118-R120 VanDerWaalsContact C-N 3.26Å; E118-R120 PolarHBondContact O-N 2.95Å; R120-N122 PolarHBondContact O-N 2.92Å; R120-N122 PolarHBondContact O-OD1 3.2Å; R120-N125 WeakPolarHBondContact CB-OD1 3.15Å; R120-N125 WeakPolarHBondContact CD-O 3.24Å; R120-N125 WeakPolarHBondContact CD-OD1 3.44Å; R120-T126 WeakPolarHBondContact CA-O 3.43Å; R120-L127 HydrophobicContact CG-CD1 3.85Å; R120-F128 VanDerWaalsContact C-CE2 3.45Å; R120-F128 VanDerWaalsContact O-CE2 3.31Å; R120-F128 WeakPolarHBondContact O-CE2 3.28Å
121	C	88.4	Confident	79	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	44%	0.438	C	S	.	.			trans	-68.4	126.4	177.6	171.4	0	0	0	0	113	N123 C124 N125 T126 F128 F145 C146	C121-N123 PolarHBondContact O-N 3.43Å; C121-C124 PolarHBondContact O-N 3.35Å; C121-C124 VanDerWaalsContact SG-SG 3.61Å; C121-N125 WeakPolarHBondContact O-CA 3.43Å; C121-N125 PolarHBondContact O-N 3.18Å; C121-T126 PolarHBondContact N-O 3.25Å; C121-F128 HydrophobicContact CB-CE1 4.04Å; C121-F128 HydrophobicContact CB-CZ 4.19Å; C121-F145 VanDerWaalsContact SG-CA 3.59Å; C121-C146 HydrophobicContact CB-CB 4.08Å; C121-C146 PolarHBondContact SG-N 3.48Å
122	N	86.7	Confident	78.9	Confident	59 Å²	59	79.6 Å²	79.6	32%	0.316	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	27.6	-179.8	-60.5	30.7	0	0	0	115.3	I116 R120 D144 F145	I116-N122 HydrophobicContact CD1-CB 3.77Å; R120-N122 PolarHBondContact O-N 2.92Å; R120-N122 PolarHBondContact O-OD1 3.2Å; N122-D144 WeakPolarHBondContact CB-O 3.4Å; N122-D144 PolarHBondContact N-O 3.19Å; N122-D144 PolarHBondContact OD1-O 3Å; N122-F145 HydrophobicContact CB-CD1 4.31Å; N122-F145 HydrophobicContact CB-CE1 3.77Å; N122-F145 HydrophobicContact CB-CZ 3.91Å; N122-F145 WeakPolarHBondContact O-CE1 3.36Å
123	N	83.2	Confident	79	Confident	64 Å²	64	77.7 Å²	77.7	34%	0.342	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.6	-37.5	176.3	-177.2	86.7	0	0	0	113.5	C121 F145 C149	C121-N123 PolarHBondContact O-N 3.43Å; N123-F145 HydrophobicContact CB-CD1 3.87Å; N123-F145 HydrophobicContact CB-CE1 3.93Å; N123-C149 HydrophobicContact CB-CB 4.05Å; N123-C149 PolarHBondContact ND2-SG 2.66Å
124	C	85.4	Confident	79.6	Confident	55 Å²	55	78.2 Å²	78.2	37%	0.372	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	4.3	179.2	66.7	0	0	0	0	114.1	C121 T126 C149	C121-C124 PolarHBondContact O-N 3.35Å; C121-C124 VanDerWaalsContact SG-SG 3.61Å; C124-T126 PolarHBondContact O-N 3.44Å; C124-T126 PolarHBondContact O-OG1 3.39Å; C124-T126 PolarHBondContact SG-OG1 3.04Å; C124-C149 PolarHBondContact SG-SG 2.87Å
125	N	84.7	Confident	80.6	Confident	44 Å²	44	74.5 Å²	74.5	24%	0.235	43%	0.427	C	S	.	.			trans	54.1	13.7	177.7	-145.8	5.2	0	0	0	115.8	S115 R120 C121	S115-N125 PolarHBondContact O-ND2 3.47Å; R120-N125 WeakPolarHBondContact CB-OD1 3.15Å; R120-N125 WeakPolarHBondContact CD-O 3.24Å; R120-N125 WeakPolarHBondContact CD-OD1 3.44Å; C121-N125 WeakPolarHBondContact O-CA 3.43Å; C121-N125 PolarHBondContact O-N 3.18Å
126	T	84.6	Confident	81.9	Confident	67 Å²	67	73.3 Å²	73.3	41%	0.411	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-71.3	134.4	174.5	-40.9	0	0	0	0	109.7	R120 C121 C124 Q133	R120-T126 WeakPolarHBondContact CA-O 3.43Å; C121-T126 PolarHBondContact N-O 3.25Å; C124-T126 PolarHBondContact O-N 3.44Å; C124-T126 PolarHBondContact O-OG1 3.39Å; C124-T126 PolarHBondContact SG-OG1 3.04Å; T126-Q133 VanDerWaalsContact CG2-NE2 3.29Å
127	L	86.5	Confident	83.2	Confident	93 Å²	93	79 Å²	79	49%	0.487	43%	0.433	S	S	.	.	B	Isolated β-bridge	trans	-58.6	142.1	176.5	-159.7	73.3	0	0	0	111.3	R120 Q133	R120-L127 HydrophobicContact CG-CD1 3.85Å; L127-Q133 PolarHBondContact O-NE2 3.13Å
128	F	89	Confident	84.3	Confident	38 Å²	38	77.7 Å²	77.7	17%	0.167	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-76.2	134.1	165.3	-58.7	-53.1	0	0	0	109.2	G119 R120 C121 Q133 A135 D144 C146	G119-F128 WeakPolarHBondContact O-CD2 3.47Å; G119-F128 PolarHBondContact O-N 3.18Å; R120-F128 VanDerWaalsContact C-CE2 3.45Å; R120-F128 VanDerWaalsContact O-CE2 3.31Å; R120-F128 WeakPolarHBondContact O-CE2 3.28Å; C121-F128 HydrophobicContact CB-CE1 4.04Å; C121-F128 HydrophobicContact CB-CZ 4.19Å; F128-Q133 WeakPolarHBondContact CA-O 3.49Å; F128-A135 HydrophobicContact CD1-CB 4.01Å; F128-A135 HydrophobicContact CD2-CB 3.88Å; F128-A135 HydrophobicContact CE1-CB 3.96Å; F128-A135 HydrophobicContact CE2-CB 3.82Å; F128-A135 HydrophobicContact CG-CB 3.98Å; F128-A135 HydrophobicContact CZ-CB 3.86Å; F128-D144 HydrophobicContact CE2-CB 3.93Å; F128-D144 HydrophobicContact CZ-CB 3.77Å; F128-C146 HydrophobicContact CE1-CB 4.46Å
129	V	82.5	Confident	84.8	Confident	60 Å²	60	72.3 Å²	72.3	36%	0.364	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-122.7	122.9	178.3	-177.2	0	0	0	0	107	L131 L132 Q133	V129-L131 PolarHBondContact O-N 2.89Å; V129-L132 HydrophobicContact CB-CB 4.28Å; V129-L132 HydrophobicContact CG1-CB 4.13Å; V129-L132 HydrophobicContact CG1-CD1 4.06Å; V129-L132 HydrophobicContact CG1-CG 4.49Å; V129-L132 PolarHBondContact O-N 3.17Å; V129-Q133 PolarHBondContact N-O 3.25Å; V129-Q133 CarbonylContact O-C 3.56Å; V129-Q133 WeakPolarHBondContact O-CA 3.32Å; V129-Q133 PolarHBondContact O-N 3.28Å
130	P	75.2	Confident	85.1	Confident	112 Å²	112	73.6 Å²	73.6	73%	0.727	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	139.7	177.1	-29.2	36.3	0	0	0	112	L132	P130-L132 PolarHBondContact O-N 3.41Å
131	L	72.7	Confident	85.1	Confident	176 Å²	176	69.5 Å²	69.5	92%	0.921	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	-40.9	-175.6	-51.6	175.1	0	0	0	116.1	V129	V129-L131 PolarHBondContact O-N 2.89Å
132	L	76.6	Confident	85.2	Confident	154 Å²	154	73 Å²	73	81%	0.806	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-44	-176.9	-67.3	174.6	0	0	0	113.5	V129 P130	V129-L132 HydrophobicContact CB-CB 4.28Å; V129-L132 HydrophobicContact CG1-CB 4.13Å; V129-L132 HydrophobicContact CG1-CD1 4.06Å; V129-L132 HydrophobicContact CG1-CG 4.49Å; V129-L132 PolarHBondContact O-N 3.17Å; P130-L132 PolarHBondContact O-N 3.41Å
133	Q	73.3	Confident	85.3	Confident	38 Å²	38	70.9 Å²	70.9	18%	0.178	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-144	74	179.9	-172.1	167.7	-106.2	0	0	110.6	T126 L127 F128 V129 C146	T126-Q133 VanDerWaalsContact CG2-NE2 3.29Å; L127-Q133 PolarHBondContact O-NE2 3.13Å; F128-Q133 WeakPolarHBondContact CA-O 3.49Å; V129-Q133 PolarHBondContact N-O 3.25Å; V129-Q133 CarbonylContact O-C 3.56Å; V129-Q133 WeakPolarHBondContact O-CA 3.32Å; V129-Q133 PolarHBondContact O-N 3.28Å; Q133-C146 HydrophobicContact CG-CB 3.85Å
134	P	83.9	Confident	85.7	Confident	71 Å²	71	70.4 Å²	70.4	46%	0.461	39%	0.389	S	S	.	.			trans	-65.1	153.8	175.2	28.1	-35.3	0	0	0	111.9
135	A	89.1	Confident	85.9	Confident	50 Å²	50	68 Å²	68	41%	0.413	37%	0.372	S	S	.	.			trans	-65.4	135.7	168.3	0	0	0	0	0	110.8	F128 D144	F128-A135 HydrophobicContact CD1-CB 4.01Å; F128-A135 HydrophobicContact CD2-CB 3.88Å; F128-A135 HydrophobicContact CE1-CB 3.96Å; F128-A135 HydrophobicContact CE2-CB 3.82Å; F128-A135 HydrophobicContact CG-CB 3.98Å; F128-A135 HydrophobicContact CZ-CB 3.86Å; A135-D144 HydrophobicContact CB-CB 4.14Å
136	I	90.6	Very high	86.1	Confident	47 Å²	47	66 Å²	66	24%	0.241	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	111.7	173.1	-52.6	-179.1	0	0	0	108.2	F145 R147 T150 V159	I136-F145 WeakPolarHBondContact CB-O 3.35Å; I136-F145 PolarHBondContact N-O 2.96Å; I136-F145 PolarHBondContact O-N 3.45Å; I136-R147 HydrophobicContact CD1-CB 4.06Å; I136-R147 HydrophobicContact CD1-CG 4.37Å; I136-T150 HydrophobicContact CB-CG2 3.9Å; I136-T150 HydrophobicContact CG2-CG2 3.9Å; I136-V159 HydrophobicContact CG2-CB 4.46Å; I136-V159 HydrophobicContact CG2-CG1 3.91Å
137	R	92.2	Very high	86.3	Confident	165 Å²	165	72.5 Å²	72.5	62%	0.623	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	128.3	-177.5	-156.5	169.3	-169	-177.6	5.5	111.1	H142 D144	R137-H142 WeakPolarHBondContact CG-O 3.5Å; R137-H142 PolarHBondContact NE-O 2.96Å; R137-H142 PolarHBondContact NH2-O 3.27Å; R137-D144 WeakPolarHBondContact CA-OD1 3.21Å; R137-D144 VanDerWaalsContact CB-OD1 3.3Å; R137-D144 WeakPolarHBondContact CB-OD1 3.06Å; R137-D144 WeakPolarHBondContact CG-OD1 3.43Å
138	C	92.4	Very high	86.5	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.007	39%	0.385	C	S	.	.			trans	-77.8	125.8	178.1	174.1	0	0	0	0	111	N140 H142 G143 F145 C161	C138-N140 PolarHBondContact O-N 3.46Å; C138-N140 VanDerWaalsContact O-N 3.16Å; C138-H142 WeakPolarHBondContact O-CA 3.35Å; C138-H142 PolarHBondContact O-N 3.44Å; C138-G143 PolarHBondContact N-O 2.96Å; C138-F145 HydrophobicContact CB-CD2 3.82Å; C138-F145 HydrophobicContact CB-CE2 3.62Å; C138-C161 HydrophobicContact CB-CB 4.04Å; C138-C161 PolarHBondContact SG-N 3.22Å; C138-C161 VanDerWaalsContact SG-SG 3.65Å
139	V	91.5	Very high	86.5	Confident	75 Å²	75	72.3 Å²	72.3	46%	0.455	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.5	-179.4	-63.1	0	0	0	0	115	H142 V158 V159 M160	V139-H142 PolarHBondContact O-CE1 3.29Å; V139-H142 PolarHBondContact O-NE2 3.45Å; V139-V158 HydrophobicContact CB-CG1 4.32Å; V139-V158 HydrophobicContact CG1-CG1 4Å; V139-V158 HydrophobicContact CG2-CG1 3.43Å; V139-V158 VanDerWaalsContact CG2-CG1 3.43Å; V139-V159 PolarHBondContact N-O 3.11Å; V139-M160 HydrophobicContact CG2-CB 4.36Å; V139-M160 HydrophobicContact CG2-CE 4.38Å
140	N	88.4	Confident	87	Confident	70 Å²	70	70.1 Å²	70.1	37%	0.374	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-29.8	-171.8	-173.3	66.1	0	0	0	113.8	C138 M160 C164	C138-N140 PolarHBondContact O-N 3.46Å; C138-N140 VanDerWaalsContact O-N 3.16Å; N140-M160 HydrophobicContact CB-CE 4.36Å; N140-C164 HydrophobicContact CB-CB 3.94Å; N140-C164 PolarHBondContact ND2-SG 3.26Å
141	C	89.6	Confident	87.6	Confident	20 Å²	20	68.2 Å²	68.2	14%	0.135	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-5	179.9	66.5	0	0	0	0	114.5	R109 G143 C161	R109-C141 PolarHBondContact NH2-SG 3.47Å; C141-G143 PolarHBondContact O-N 2.77Å; C141-C161 VanDerWaalsContact SG-SG 3.69Å
142	H	90.8	Very high	88.3	Confident	73 Å²	73	65.4 Å²	65.4	34%	0.338	33%	0.327	S	S	.	.			trans	58.1	7.7	175.1	-48.1	-95.1	0	0	0	116.5	R137 C138 V139 R281	R137-H142 WeakPolarHBondContact CG-O 3.5Å; R137-H142 PolarHBondContact NE-O 2.96Å; R137-H142 PolarHBondContact NH2-O 3.27Å; C138-H142 WeakPolarHBondContact O-CA 3.35Å; C138-H142 PolarHBondContact O-N 3.44Å; V139-H142 PolarHBondContact O-CE1 3.29Å; V139-H142 PolarHBondContact O-NE2 3.45Å; H142-R281 PolarHBondContact CD2-NH2 2.97Å
143	G	88.5	Confident	88.5	Confident	16 Å²	16	58.5 Å²	58.5	17%	0.165	29%	0.291	C	S	.	.			trans	-81.8	167.7	166.7	0	0	0	0	0	112.3	C138 C141 F145	C138-G143 PolarHBondContact N-O 2.96Å; C141-G143 PolarHBondContact O-N 2.77Å; G143-F145 VanDerWaalsContact C-CE2 3.44Å; G143-F145 WeakPolarHBondContact O-CD2 3.48Å; G143-F145 WeakPolarHBondContact O-CE2 3.34Å
144	D	91.3	Very high	88.6	Confident	54 Å²	54	60.5 Å²	60.5	29%	0.289	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139	-172.1	-68.3	-58.7	0	0	0	113.2	N122 F128 A135 R137	N122-D144 WeakPolarHBondContact CB-O 3.4Å; N122-D144 PolarHBondContact N-O 3.19Å; N122-D144 PolarHBondContact OD1-O 3Å; F128-D144 HydrophobicContact CE2-CB 3.93Å; F128-D144 HydrophobicContact CZ-CB 3.77Å; A135-D144 HydrophobicContact CB-CB 4.14Å; R137-D144 WeakPolarHBondContact CA-OD1 3.21Å; R137-D144 VanDerWaalsContact CB-OD1 3.3Å; R137-D144 WeakPolarHBondContact CB-OD1 3.06Å; R137-D144 WeakPolarHBondContact CG-OD1 3.43Å
145	F	90.7	Very high	88.2	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.018	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.3	-171.8	-60	-90.7	0	0	0	111.2	C121 N122 N123 I136 C138 G143 C149 T150 C161	C121-F145 VanDerWaalsContact SG-CA 3.59Å; N122-F145 HydrophobicContact CB-CD1 4.31Å; N122-F145 HydrophobicContact CB-CE1 3.77Å; N122-F145 HydrophobicContact CB-CZ 3.91Å; N122-F145 WeakPolarHBondContact O-CE1 3.36Å; N123-F145 HydrophobicContact CB-CD1 3.87Å; N123-F145 HydrophobicContact CB-CE1 3.93Å; I136-F145 WeakPolarHBondContact CB-O 3.35Å; I136-F145 PolarHBondContact N-O 2.96Å; I136-F145 PolarHBondContact O-N 3.45Å; C138-F145 HydrophobicContact CB-CD2 3.82Å; C138-F145 HydrophobicContact CB-CE2 3.62Å; G143-F145 VanDerWaalsContact C-CE2 3.44Å; G143-F145 WeakPolarHBondContact O-CD2 3.48Å; G143-F145 WeakPolarHBondContact O-CE2 3.34Å; F145-C149 HydrophobicContact CB-CB 4.11Å; F145-C149 HydrophobicContact CD1-CB 4.17Å; F145-T150 HydrophobicContact CB-CG2 3.72Å; F145-C161 HydrophobicContact CD1-CB 3.66Å; F145-C161 HydrophobicContact CD2-CB 3.53Å; F145-C161 HydrophobicContact CE1-CB 3.61Å; F145-C161 HydrophobicContact CE2-CB 3.48Å; F145-C161 VanDerWaalsContact CE2-CB 3.48Å; F145-C161 HydrophobicContact CG-CB 3.63Å; F145-C161 HydrophobicContact CZ-CB 3.53Å
146	C	89	Confident	87.8	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.007	33%	0.327	C	S	.	.			trans	-71.8	160.7	170.4	69.5	0	0	0	0	110	C121 F128 Q133 I148 C149 T150	C121-C146 HydrophobicContact CB-CB 4.08Å; C121-C146 PolarHBondContact SG-N 3.48Å; F128-C146 HydrophobicContact CE1-CB 4.46Å; Q133-C146 HydrophobicContact CG-CB 3.85Å; C146-I148 PolarHBondContact O-N 3.23Å; C146-C149 PolarHBondContact O-N 3.04Å; C146-C149 VanDerWaalsContact SG-SG 3.67Å; C146-T150 PolarHBondContact O-N 2.86Å
147	R	89.5	Confident	87.3	Confident	205 Å²	205	70.3 Å²	70.3	77%	0.774	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-29.3	178.5	-170	175.9	177.9	-177.6	-0.5	114.1	I136 T150	I136-R147 HydrophobicContact CD1-CB 4.06Å; I136-R147 HydrophobicContact CD1-CG 4.37Å; R147-T150 WeakPolarHBondContact CA-OG1 3.05Å; R147-T150 PolarHBondContact O-OG1 3.12Å; R147-T150 VanDerWaalsContact O-OG1 3.05Å
148	I	89.5	Confident	87	Confident	120 Å²	120	64.4 Å²	64.4	62%	0.615	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-29.4	177.8	-56.4	174.8	0	0	0	111.9	C146 K162	C146-I148 PolarHBondContact O-N 3.23Å; I148-K162 VanDerWaalsContact O-CE 3.25Å; I148-K162 WeakPolarHBondContact O-CE 3.16Å; I148-K162 PolarHBondContact O-NZ 3.47Å
149	C	90	Very high	86.7	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.041	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.1	180	-69.3	0	0	0	0	113.9	N123 C124 F145 C146 C161 K162	N123-C149 HydrophobicContact CB-CB 4.05Å; N123-C149 PolarHBondContact ND2-SG 2.66Å; C124-C149 PolarHBondContact SG-SG 2.87Å; F145-C149 HydrophobicContact CB-CB 4.11Å; F145-C149 HydrophobicContact CD1-CB 4.17Å; C146-C149 PolarHBondContact O-N 3.04Å; C146-C149 VanDerWaalsContact SG-SG 3.67Å; C149-C161 WeakPolarHBondContact O-CA 3.48Å; C149-K162 WeakPolarHBondContact O-CG 3.34Å; C149-K162 PolarHBondContact O-N 2.99Å
150	T	91.4	Very high	86.8	Confident	14 Å²	14	63 Å²	63	9%	0.086	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	161	172.2	53.6	0	0	0	0	113.8	I136 F145 C146 R147 V159 M160	I136-T150 HydrophobicContact CB-CG2 3.9Å; I136-T150 HydrophobicContact CG2-CG2 3.9Å; F145-T150 HydrophobicContact CB-CG2 3.72Å; C146-T150 PolarHBondContact O-N 2.86Å; R147-T150 WeakPolarHBondContact CA-OG1 3.05Å; R147-T150 PolarHBondContact O-OG1 3.12Å; R147-T150 VanDerWaalsContact O-OG1 3.05Å; T150-V159 HydrophobicContact CG2-CG1 4.09Å; T150-M160 CarbonylContact C-O 3.58Å; T150-M160 WeakPolarHBondContact CA-O 3.35Å
151	E	88.3	Confident	86.9	Confident	73 Å²	73	59.8 Å²	59.8	34%	0.341	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.6	168.6	-168.4	-179.5	128	0	0	109.4	M160 K162 R165	E151-M160 PolarHBondContact N-O 3Å; E151-M160 PolarHBondContact O-N 3.05Å; E151-K162 HydrophobicContact CB-CG 4.38Å; E151-R165 HydrophobicContact CB-CG 4.34Å; E151-R165 IonicContact OE1-CZ 3.37Å; E151-R165 IonicContact OE1-NE 3.52Å; E151-R165 PolarHBondContact OE1-NE 2.9Å; E151-R165 IonicContact OE1-NH2 3.01Å; E151-R165 PolarHBondContact OE1-NH2 3.4Å
152	K	87.4	Confident	87	Confident	117 Å²	117	63.5 Å²	63.5	51%	0.509	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.6	172.9	-177.8	172	178.9	166.3	0	109.1	T156 N157 V159	K152-T156 WeakPolarHBondContact CE-O 2.98Å; K152-N157 PolarHBondContact NZ-OD1 3.24Å; K152-V159 HydrophobicContact CB-CG2 4.34Å; K152-V159 HydrophobicContact CG-CG2 4.4Å
153	L	81	Confident	86.9	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.042	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-65.8	143	178.6	-87.4	148.1	0	0	0	111.3	T156 V158 M160 F287	L153-T156 VanDerWaalsContact CB-OG1 3.25Å; L153-T156 WeakPolarHBondContact CB-OG1 3.29Å; L153-V158 HydrophobicContact CB-CB 4.45Å; L153-V158 HydrophobicContact CD1-CB 3.76Å; L153-V158 HydrophobicContact CD1-CG1 3.56Å; L153-V158 PolarHBondContact N-O 3.25Å; L153-M160 HydrophobicContact CD1-CE 3.79Å; L153-M160 HydrophobicContact CD1-CG 4Å; L153-M160 HydrophobicContact CD1-SD 3.86Å; L153-M160 HydrophobicContact CD2-SD 4.42Å; L153-M160 HydrophobicContact CG-CG 4.31Å; L153-M160 HydrophobicContact CG-SD 4.16Å; L153-F287 HydrophobicContact CD1-CE2 4.26Å; L153-F287 HydrophobicContact CD1-CZ 3.66Å; L153-F287 HydrophobicContact CD2-CZ 4.34Å
154	P	75.3	Confident	87	Confident	80 Å²	80	59.9 Å²	59.9	52%	0.519	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	143.5	173.1	-24.7	34.6	0	0	0	111.7	T156	P154-T156 PolarHBondContact O-N 2.84Å
155	N	74.9	Confident	86.9	Confident	177 Å²	177	59 Å²	59	95%	0.947	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	10.3	174.1	-57.3	-8.3	0	0	0	116.9
156	T	80.2	Confident	86.8	Confident	57 Å²	57	60.2 Å²	60.2	35%	0.35	30%	0.299	S	S	.	.	S	Bend	trans	-131.4	167.6	178.7	68.5	0	0	0	0	111.4	K152 L153 P154 V158	K152-T156 WeakPolarHBondContact CE-O 2.98Å; L153-T156 VanDerWaalsContact CB-OG1 3.25Å; L153-T156 WeakPolarHBondContact CB-OG1 3.29Å; P154-T156 PolarHBondContact O-N 2.84Å; T156-V158 VanDerWaalsContact C-N 3.3Å; T156-V158 PolarHBondContact OG1-N 2.73Å
157	N	82.2	Confident	86.7	Confident	141 Å²	141	62 Å²	62	75%	0.754	31%	0.307	S	S	*	.	S	Bend	trans	-88.6	6	169.1	-79	-28.8	0	0	0	113.6	K152	K152-N157 PolarHBondContact NZ-OD1 3.24Å
158	V	85.2	Confident	86.4	Confident	41 Å²	41	52.9 Å²	52.9	25%	0.248	27%	0.274	C	S	.	.			trans	-76.3	132	-175.7	-175.2	0	0	0	0	110.8	V139 L153 T156 F287	V139-V158 HydrophobicContact CB-CG1 4.32Å; V139-V158 HydrophobicContact CG1-CG1 4Å; V139-V158 HydrophobicContact CG2-CG1 3.43Å; V139-V158 VanDerWaalsContact CG2-CG1 3.43Å; L153-V158 HydrophobicContact CB-CB 4.45Å; L153-V158 HydrophobicContact CD1-CB 3.76Å; L153-V158 HydrophobicContact CD1-CG1 3.56Å; L153-V158 PolarHBondContact N-O 3.25Å; T156-V158 VanDerWaalsContact C-N 3.3Å; T156-V158 PolarHBondContact OG1-N 2.73Å; V158-F287 HydrophobicContact CG2-CE2 4.48Å
159	V	86.5	Confident	86.2	Confident	42 Å²	42	50.4 Å²	50.4	26%	0.255	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.1	175.2	-173	0	0	0	0	109.4	I136 V139 T150 K152	I136-V159 HydrophobicContact CG2-CB 4.46Å; I136-V159 HydrophobicContact CG2-CG1 3.91Å; V139-V159 PolarHBondContact N-O 3.11Å; T150-V159 HydrophobicContact CG2-CG1 4.09Å; K152-V159 HydrophobicContact CB-CG2 4.34Å; K152-V159 HydrophobicContact CG-CG2 4.4Å
160	M	92.5	Very high	86	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.025	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	159	178.4	46.6	167.9	47.3	0	0	110.9	V139 N140 T150 E151 L153 R165	V139-M160 HydrophobicContact CG2-CB 4.36Å; V139-M160 HydrophobicContact CG2-CE 4.38Å; N140-M160 HydrophobicContact CB-CE 4.36Å; T150-M160 CarbonylContact C-O 3.58Å; T150-M160 WeakPolarHBondContact CA-O 3.35Å; E151-M160 PolarHBondContact N-O 3Å; E151-M160 PolarHBondContact O-N 3.05Å; L153-M160 HydrophobicContact CD1-CE 3.79Å; L153-M160 HydrophobicContact CD1-CG 4Å; L153-M160 HydrophobicContact CD1-SD 3.86Å; L153-M160 HydrophobicContact CD2-SD 4.42Å; L153-M160 HydrophobicContact CG-CG 4.31Å; L153-M160 HydrophobicContact CG-SD 4.16Å; M160-R165 HydrophobicContact CG-CB 4.19Å; M160-R165 VanDerWaalsContact SD-CA 3.51Å; M160-R165 HydrophobicContact SD-CB 3.8Å; M160-R165 HydrophobicContact SD-CG 4.47Å
161	C	91.7	Very high	85.6	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.007	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	150.4	173.8	71.6	0	0	0	0	111.1	C138 C141 F145 C149 F163 C164 R165	C138-C161 HydrophobicContact CB-CB 4.04Å; C138-C161 PolarHBondContact SG-N 3.22Å; C138-C161 VanDerWaalsContact SG-SG 3.65Å; C141-C161 VanDerWaalsContact SG-SG 3.69Å; F145-C161 HydrophobicContact CD1-CB 3.66Å; F145-C161 HydrophobicContact CD2-CB 3.53Å; F145-C161 HydrophobicContact CE1-CB 3.61Å; F145-C161 HydrophobicContact CE2-CB 3.48Å; F145-C161 VanDerWaalsContact CE2-CB 3.48Å; F145-C161 HydrophobicContact CG-CB 3.63Å; F145-C161 HydrophobicContact CZ-CB 3.53Å; C149-C161 WeakPolarHBondContact O-CA 3.48Å; C161-F163 PolarHBondContact O-N 2.87Å; C161-C164 PolarHBondContact O-N 2.81Å; C161-C164 VanDerWaalsContact O-N 3.11Å; C161-R165 WeakPolarHBondContact O-CB 3.44Å; C161-R165 PolarHBondContact O-N 3.32Å
162	K	90.1	Very high	85.2	Confident	98 Å²	98	51.2 Å²	51.2	43%	0.426	27%	0.265	S	S	.	.	H	α-helix	trans	-58.3	-22.6	-179.4	-76.2	176.1	173.7	173.8	0	113.5	I148 C149 E151 F166	I148-K162 VanDerWaalsContact O-CE 3.25Å; I148-K162 WeakPolarHBondContact O-CE 3.16Å; I148-K162 PolarHBondContact O-NZ 3.47Å; C149-K162 WeakPolarHBondContact O-CG 3.34Å; C149-K162 PolarHBondContact O-N 2.99Å; E151-K162 HydrophobicContact CB-CG 4.38Å; K162-F166 VanDerWaalsContact O-CB 3.3Å; K162-F166 WeakPolarHBondContact O-CB 3.36Å; K162-F166 PolarHBondContact O-N 3.41Å; K162-F166 VanDerWaalsContact O-N 3.1Å
163	F	89.6	Confident	85	Confident	14 Å²	14	49.9 Å²	49.9	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-68	-58.4	170.9	-173.8	-84.2	0	0	0	112.2	K105 Q106 R109 C161 R165 F166 E167	K105-F163 HydrophobicContact CB-CE2 4.08Å; K105-F163 HydrophobicContact CD-CD2 4.43Å; K105-F163 HydrophobicContact CD-CE2 4.41Å; K105-F163 HydrophobicContact CG-CD2 4.16Å; K105-F163 HydrophobicContact CG-CE2 3.92Å; K105-F163 WeakPolarHBondContact O-CE2 3.24Å; Q106-F163 HydrophobicContact CB-CZ 4.12Å; R109-F163 HydrophobicContact CB-CD2 3.99Å; R109-F163 HydrophobicContact CB-CE2 3.93Å; R109-F163 HydrophobicContact CG-CD2 4.23Å; R109-F163 HydrophobicContact CG-CE2 4.47Å; R109-F163 HydrophobicContact CG-CG 4.45Å; R109-F163 VanDerWaalsContact NH1-CE1 3.32Å; C161-F163 PolarHBondContact O-N 2.87Å; F163-R165 PolarHBondContact O-N 2.63Å; F163-F166 WeakPolarHBondContact O-CA 3.49Å; F163-F166 WeakPolarHBondContact O-CB 3.33Å; F163-F166 PolarHBondContact O-N 2.85Å; F163-E167 HydrophobicContact CE1-CB 4.3Å; F163-E167 PolarHBondContact O-N 3.27Å
164	C	89.9	Confident	85.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.1	-34.3	-179.1	-67	0	0	0	0	111.4	N140 C161 F166 E167 T168	N140-C164 HydrophobicContact CB-CB 3.94Å; N140-C164 PolarHBondContact ND2-SG 3.26Å; C161-C164 PolarHBondContact O-N 2.81Å; C161-C164 VanDerWaalsContact O-N 3.11Å; C164-F166 VanDerWaalsContact C-N 3.34Å; C164-F166 PolarHBondContact O-N 2.94Å; C164-E167 WeakPolarHBondContact O-CB 3.45Å; C164-E167 PolarHBondContact O-N 2.88Å; C164-T168 PolarHBondContact O-N 2.75Å; C164-T168 PolarHBondContact O-OG1 2.66Å; C164-T168 VanDerWaalsContact O-OG1 3.08Å
165	R	89.9	Confident	85.1	Confident	36 Å²	36	47.7 Å²	47.7	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-57.5	-45	170.7	-178.8	56.9	171.8	147	3.9	112.6	E151 M160 C161 F163 L169	E151-R165 HydrophobicContact CB-CG 4.34Å; E151-R165 IonicContact OE1-CZ 3.37Å; E151-R165 IonicContact OE1-NE 3.52Å; E151-R165 PolarHBondContact OE1-NE 2.9Å; E151-R165 IonicContact OE1-NH2 3.01Å; E151-R165 PolarHBondContact OE1-NH2 3.4Å; M160-R165 HydrophobicContact CG-CB 4.19Å; M160-R165 VanDerWaalsContact SD-CA 3.51Å; M160-R165 HydrophobicContact SD-CB 3.8Å; M160-R165 HydrophobicContact SD-CG 4.47Å; C161-R165 WeakPolarHBondContact O-CB 3.44Å; C161-R165 PolarHBondContact O-N 3.32Å; F163-R165 PolarHBondContact O-N 2.63Å; R165-L169 HydrophobicContact CG-CD1 4.31Å; R165-L169 WeakPolarHBondContact O-CB 3.31Å; R165-L169 WeakPolarHBondContact O-CD1 3.44Å; R165-L169 VanDerWaalsContact O-CG 3.23Å; R165-L169 WeakPolarHBondContact O-CG 3.49Å; R165-L169 PolarHBondContact O-N 3.05Å
166	F	89.8	Confident	84.9	Confident	29 Å²	29	41.9 Å²	41.9	13%	0.127	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-45.1	173.5	167.3	-84.7	0	0	0	111.4	E101 M102 K105 K162 F163 C164 L169 H170	E101-F166 HydrophobicContact CB-CZ 4.23Å; M102-F166 HydrophobicContact CG-CE1 4.32Å; K105-F166 HydrophobicContact CB-CE1 3.94Å; K105-F166 HydrophobicContact CB-CZ 4.3Å; K105-F166 HydrophobicContact CD-CB 4.44Å; K105-F166 HydrophobicContact CD-CD1 3.4Å; K105-F166 HydrophobicContact CD-CD2 3.88Å; K105-F166 HydrophobicContact CD-CE1 3.39Å; K105-F166 HydrophobicContact CD-CE2 3.85Å; K105-F166 HydrophobicContact CD-CG 3.65Å; K105-F166 HydrophobicContact CD-CZ 3.62Å; K105-F166 HydrophobicContact CG-CE1 4.3Å; K162-F166 VanDerWaalsContact O-CB 3.3Å; K162-F166 WeakPolarHBondContact O-CB 3.36Å; K162-F166 PolarHBondContact O-N 3.41Å; K162-F166 VanDerWaalsContact O-N 3.1Å; F163-F166 WeakPolarHBondContact O-CA 3.49Å; F163-F166 WeakPolarHBondContact O-CB 3.33Å; F163-F166 PolarHBondContact O-N 2.85Å; C164-F166 VanDerWaalsContact C-N 3.34Å; C164-F166 PolarHBondContact O-N 2.94Å; F166-L169 PolarHBondContact O-N 2.75Å; F166-H170 AromaticContact CD1-ND1 3.94Å; F166-H170 AromaticContact CD2-CE1 3.26Å; F166-H170 WeakPolarHBondContact CD2-CE1 3.4Å; F166-H170 AromaticContact CD2-ND1 3.48Å; F166-H170 WeakPolarHBondContact CD2-ND1 3.23Å; F166-H170 AromaticContact CE1-ND1 3.94Å; F166-H170 AromaticContact CE2-CE1 3.1Å; F166-H170 WeakPolarHBondContact CE2-CE1 3.42Å; F166-H170 AromaticContact CE2-ND1 3.5Å; F166-H170 WeakPolarHBondContact CE2-ND1 3.35Å; F166-H170 AromaticContact CE2-NE2 3.59Å; F166-H170 AromaticContact CG-CE1 3.98Å; F166-H170 AromaticContact CG-ND1 3.72Å; F166-H170 AromaticContact CZ-CE1 3.7Å; F166-H170 AromaticContact CZ-CG 3.98Å; F166-H170 AromaticContact CZ-ND1 3.72Å; F166-H170 AromaticContact CZ-NE2 3.96Å; F166-H170 PolarHBondContact O-N 3.29Å; F166-H170 PolarHBondContact O-ND1 3.15Å
167	E	85.7	Confident	84	Confident	38 Å²	38	42 Å²	42	18%	0.178	21%	0.213	C	C	.	.	H	α-helix	trans	-58.6	-49.3	-179.7	-166.4	-157.7	138.2	0	0	112.1	M102 F163 C164 L169 H170 K171	M102-E167 HydrophobicContact CE-CG 3.84Å; F163-E167 HydrophobicContact CE1-CB 4.3Å; F163-E167 PolarHBondContact O-N 3.27Å; C164-E167 WeakPolarHBondContact O-CB 3.45Å; C164-E167 PolarHBondContact O-N 2.88Å; E167-L169 PolarHBondContact O-N 2.93Å; E167-H170 PolarHBondContact O-N 3.04Å; E167-K171 WeakPolarHBondContact O-CG 3.46Å; E167-K171 PolarHBondContact O-N 3.49Å; E167-K171 WeakPolarHBondContact OE1-CE 3.29Å; E167-K171 IonicContact OE1-NZ 3.34Å; E167-K171 PolarHBondContact OE1-NZ 3.07Å
168	T	83.5	Confident	83.2	Confident	13 Å²	13	40.3 Å²	40.3	8%	0.08	20%	0.199	C	C	.	.	H	α-helix	trans	-57.9	-47.8	174	-54.5	0	0	0	0	111.1	C164 H170 K171 C172	C164-T168 PolarHBondContact O-N 2.75Å; C164-T168 PolarHBondContact O-OG1 2.66Å; C164-T168 VanDerWaalsContact O-OG1 3.08Å; T168-H170 VanDerWaalsContact C-N 3.28Å; T168-H170 PolarHBondContact O-N 2.83Å; T168-K171 PolarHBondContact O-N 3.43Å; T168-C172 PolarHBondContact O-N 2.88Å; T168-C172 PolarHBondContact O-SG 2.88Å
169	L	85	Confident	82.3	Confident	68 Å²	68	41.4 Å²	41.4	36%	0.356	21%	0.206	S	C	.	.	H	α-helix	trans	-61.4	-34.3	179.3	-73.9	169.8	0	0	0	112.7	R165 F166 E167 C172 K173	R165-L169 HydrophobicContact CG-CD1 4.31Å; R165-L169 WeakPolarHBondContact O-CB 3.31Å; R165-L169 WeakPolarHBondContact O-CD1 3.44Å; R165-L169 VanDerWaalsContact O-CG 3.23Å; R165-L169 WeakPolarHBondContact O-CG 3.49Å; R165-L169 PolarHBondContact O-N 3.05Å; F166-L169 PolarHBondContact O-N 2.75Å; E167-L169 PolarHBondContact O-N 2.93Å; L169-C172 PolarHBondContact O-N 2.87Å; L169-K173 WeakPolarHBondContact O-CG 3.49Å; L169-K173 PolarHBondContact O-N 2.9Å
170	H	86.6	Confident	81.4	Confident	9 Å²	9	43 Å²	43	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-79	-36.5	178.9	-70.9	67.7	0	0	0	112	E101 M102 F166 E167 T168 C172 K173 L174	E101-H170 IonicContact OE2-CD2 2.76Å; E101-H170 IonicContact OE2-NE2 3.04Å; E101-H170 PolarHBondContact OE2-NE2 2.72Å; M102-H170 HydrophobicContact CG-CB 3.58Å; M102-H170 HydrophobicContact SD-CB 3.54Å; M102-H170 VanDerWaalsContact SD-CB 3.54Å; F166-H170 AromaticContact CD1-ND1 3.94Å; F166-H170 AromaticContact CD2-CE1 3.26Å; F166-H170 WeakPolarHBondContact CD2-CE1 3.4Å; F166-H170 AromaticContact CD2-ND1 3.48Å; F166-H170 WeakPolarHBondContact CD2-ND1 3.23Å; F166-H170 AromaticContact CE1-ND1 3.94Å; F166-H170 AromaticContact CE2-CE1 3.1Å; F166-H170 WeakPolarHBondContact CE2-CE1 3.42Å; F166-H170 AromaticContact CE2-ND1 3.5Å; F166-H170 WeakPolarHBondContact CE2-ND1 3.35Å; F166-H170 AromaticContact CE2-NE2 3.59Å; F166-H170 AromaticContact CG-CE1 3.98Å; F166-H170 AromaticContact CG-ND1 3.72Å; F166-H170 AromaticContact CZ-CE1 3.7Å; F166-H170 AromaticContact CZ-CG 3.98Å; F166-H170 AromaticContact CZ-ND1 3.72Å; F166-H170 AromaticContact CZ-NE2 3.96Å; F166-H170 PolarHBondContact O-N 3.29Å; F166-H170 PolarHBondContact O-ND1 3.15Å; E167-H170 PolarHBondContact O-N 3.04Å; T168-H170 VanDerWaalsContact C-N 3.28Å; T168-H170 PolarHBondContact O-N 2.83Å; H170-C172 PolarHBondContact O-N 3.11Å; H170-K173 PolarHBondContact NE2-NZ 3.08Å; H170-K173 PolarHBondContact O-N 2.87Å; H170-L174 VanDerWaalsContact O-CB 3.24Å; H170-L174 WeakPolarHBondContact O-CB 3.22Å; H170-L174 VanDerWaalsContact O-CG 3.32Å; H170-L174 WeakPolarHBondContact O-CG 3.31Å; H170-L174 PolarHBondContact O-N 3.08Å
171	K	82.9	Confident	80.2	Confident	73 Å²	73	47.4 Å²	47.4	32%	0.317	23%	0.232	S	C	.	.	H	α-helix	trans	-56.6	-37.8	166.9	-74.6	172.3	169.3	172	0	111.9	M102 E167 T168 V176	M102-K171 HydrophobicContact CE-CG 4.13Å; E167-K171 WeakPolarHBondContact O-CG 3.46Å; E167-K171 PolarHBondContact O-N 3.49Å; E167-K171 WeakPolarHBondContact OE1-CE 3.29Å; E167-K171 IonicContact OE1-NZ 3.34Å; E167-K171 PolarHBondContact OE1-NZ 3.07Å; T168-K171 PolarHBondContact O-N 3.43Å; K171-V176 PolarHBondContact O-N 3.47Å
172	C	79	Confident	78.9	Confident	28 Å²	28	49.6 Å²	49.6	19%	0.189	24%	0.243	C	C	.	.	H	α-helix	trans	-67.7	-52.5	171.3	-63.5	0	0	0	0	112.8	T168 L169 H170 L174 G175 L295	T168-C172 PolarHBondContact O-N 2.88Å; T168-C172 PolarHBondContact O-SG 2.88Å; L169-C172 PolarHBondContact O-N 2.87Å; H170-C172 PolarHBondContact O-N 3.11Å; C172-L174 PolarHBondContact O-N 2.67Å; C172-G175 PolarHBondContact O-N 3.43Å; C172-L295 HydrophobicContact CB-CD1 4.04Å
173	K	83.2	Confident	77.9	Confident	90 Å²	90	49.8 Å²	49.8	39%	0.391	24%	0.244	S	C	.	.	H	α-helix	trans	-56.5	-33.3	178.6	-74.5	179.8	178.4	-178.2	0	113.4	R94 L98 L169 H170 G175	R94-K173 PolarHBondContact NH1-O 2.77Å; R94-K173 PolarHBondContact NH2-O 2.87Å; R94-K173 VanDerWaalsContact NH2-O 3.08Å; L98-K173 HydrophobicContact CD1-CB 3.89Å; L98-K173 HydrophobicContact CD1-CD 4.36Å; L98-K173 HydrophobicContact CD2-CB 4.45Å; L98-K173 HydrophobicContact CD2-CD 3.55Å; L169-K173 WeakPolarHBondContact O-CG 3.49Å; L169-K173 PolarHBondContact O-N 2.9Å; H170-K173 PolarHBondContact NE2-NZ 3.08Å; H170-K173 PolarHBondContact O-N 2.87Å; K173-G175 VanDerWaalsContact C-N 3.29Å
174	L	83	Confident	77.2	Confident	20 Å²	20	55.1 Å²	55.1	11%	0.105	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.5	179.3	-79.1	168.8	0	0	0	113.6	V95 L98 R99 M102 H170 C172 V176	V95-L174 HydrophobicContact CB-CD2 4.31Å; V95-L174 HydrophobicContact CG1-CD2 3.99Å; V95-L174 HydrophobicContact CG2-CD2 4.4Å; L98-L174 HydrophobicContact CB-CD1 4.42Å; L98-L174 HydrophobicContact CB-CD2 3.62Å; L98-L174 HydrophobicContact CB-CG 3.89Å; L98-L174 HydrophobicContact CD1-CD2 4.22Å; L98-L174 HydrophobicContact CD1-CG 4.38Å; R99-L174 HydrophobicContact CG-CD1 4.07Å; R99-L174 HydrophobicContact CG-CD2 4.04Å; M102-L174 HydrophobicContact SD-CD1 3.74Å; H170-L174 VanDerWaalsContact O-CB 3.24Å; H170-L174 WeakPolarHBondContact O-CB 3.22Å; H170-L174 VanDerWaalsContact O-CG 3.32Å; H170-L174 WeakPolarHBondContact O-CG 3.31Å; H170-L174 PolarHBondContact O-N 3.08Å; C172-L174 PolarHBondContact O-N 2.67Å; L174-V176 HydrophobicContact CB-CG2 3.65Å; L174-V176 HydrophobicContact CD1-CG2 4.47Å; L174-V176 PolarHBondContact O-N 2.93Å
175	G	76.8	Confident	76.1	Confident	21 Å²	21	55.8 Å²	55.8	22%	0.216	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	19.1	-177.9	0	0	0	0	0	114.3	C172 K173 W177 F178 T179	C172-G175 PolarHBondContact O-N 3.43Å; K173-G175 VanDerWaalsContact C-N 3.29Å; G175-W177 VanDerWaalsContact C-N 3.29Å; G175-W177 PolarHBondContact O-N 3.07Å; G175-F178 WeakPolarHBondContact O-CB 3.45Å; G175-F178 PolarHBondContact O-N 2.97Å; G175-T179 PolarHBondContact O-N 3.4Å
176	V	68.9	Low	75.1	Confident	56 Å²	56	60.9 Å²	60.9	34%	0.339	29%	0.294	S	S	.	.	H	α-helix	trans	-57.1	-43.8	-169.9	-176.7	0	0	0	0	111.4	K171 L174 F178 T179 E180	K171-V176 PolarHBondContact O-N 3.47Å; L174-V176 HydrophobicContact CB-CG2 3.65Å; L174-V176 HydrophobicContact CD1-CG2 4.47Å; L174-V176 PolarHBondContact O-N 2.93Å; V176-F178 VanDerWaalsContact C-N 3.29Å; V176-F178 PolarHBondContact O-N 3.49Å; V176-T179 WeakPolarHBondContact CA-OG1 3.41Å; V176-T179 PolarHBondContact O-N 3.37Å; V176-T179 PolarHBondContact O-OG1 3.01Å; V176-E180 PolarHBondContact O-N 3.11Å
177	W	62.1	Low	74.3	Confident	58 Å²	58	64 Å²	64	22%	0.22	32%	0.324	C	S	.	.	H	α-helix	trans	-55.5	-42	177.4	68.8	-89.6	0	0	0	112.4	G175 Q181 S292 S296	G175-W177 VanDerWaalsContact C-N 3.29Å; G175-W177 PolarHBondContact O-N 3.07Å; W177-Q181 PolarHBondContact O-N 3.45Å; W177-S292 VanDerWaalsContact CE3-OG 3.3Å; W177-S296 VanDerWaalsContact CH2-CB 3.46Å; W177-S296 WeakPolarHBondContact CH2-OG 3.49Å
178	F	64.7	Low	74	Confident	106 Å²	106	65.1 Å²	65.1	47%	0.465	34%	0.337	S	S	.	.	H	α-helix	trans	-71.8	-42.9	178.5	177.6	-113.8	0	0	0	111	G175 V176 E180 Q181 L182	G175-F178 WeakPolarHBondContact O-CB 3.45Å; G175-F178 PolarHBondContact O-N 2.97Å; V176-F178 VanDerWaalsContact C-N 3.29Å; V176-F178 PolarHBondContact O-N 3.49Å; F178-E180 VanDerWaalsContact C-N 3.28Å; F178-E180 PolarHBondContact O-N 3.14Å; F178-Q181 PolarHBondContact O-N 3.18Å; F178-L182 HydrophobicContact CD1-CD1 3.99Å; F178-L182 HydrophobicContact CE1-CD1 3.45Å; F178-L182 VanDerWaalsContact CE1-CD1 3.45Å; F178-L182 HydrophobicContact CE2-CD1 4.15Å; F178-L182 HydrophobicContact CZ-CD1 3.55Å; F178-L182 HydrophobicContact CZ-CG 4.4Å; F178-L182 WeakPolarHBondContact O-CB 3.25Å; F178-L182 PolarHBondContact O-N 3.15Å
179	T	66.9	Low	73.2	Confident	65 Å²	65	67.5 Å²	67.5	40%	0.399	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-32.1	177.1	59.9	0	0	0	0	112.8	G175 V176 L182 K183	G175-T179 PolarHBondContact O-N 3.4Å; V176-T179 WeakPolarHBondContact CA-OG1 3.41Å; V176-T179 PolarHBondContact O-N 3.37Å; V176-T179 PolarHBondContact O-OG1 3.01Å; T179-L182 PolarHBondContact O-N 2.92Å; T179-K183 WeakPolarHBondContact O-CG 3.3Å; T179-K183 PolarHBondContact O-N 2.85Å
180	E	67.3	Low	72.3	Confident	76 Å²	76	73.7 Å²	73.7	36%	0.355	38%	0.382	S	S	.	.	H	α-helix	trans	-75	-43.7	178.6	-144.2	62.1	-139.6	0	0	111.8	V176 F178 L182 K183 Q184	V176-E180 PolarHBondContact O-N 3.11Å; F178-E180 VanDerWaalsContact C-N 3.28Å; F178-E180 PolarHBondContact O-N 3.14Å; E180-L182 VanDerWaalsContact C-N 3.27Å; E180-L182 PolarHBondContact O-N 3.18Å; E180-K183 WeakPolarHBondContact O-CB 3.41Å; E180-K183 PolarHBondContact O-N 3Å; E180-K183 WeakPolarHBondContact OE1-CD 3.5Å; E180-K183 IonicContact OE1-NZ 2.7Å; E180-K183 PolarHBondContact OE1-NZ 2.64Å; E180-K183 IonicContact OE2-NZ 3.41Å; E180-K183 PolarHBondContact OE2-NZ 2.98Å; E180-Q184 WeakPolarHBondContact O-CG 3.35Å; E180-Q184 PolarHBondContact O-N 3.48Å
181	Q	67	Low	71	Confident	97 Å²	97	76.1 Å²	76.1	45%	0.453	40%	0.397	S	S	.	.	H	α-helix	trans	-60.3	-37.3	170.5	-72.3	-170.1	0.8	0	0	111.9	W177 F178 Q184 A185	W177-Q181 PolarHBondContact O-N 3.45Å; F178-Q181 PolarHBondContact O-N 3.18Å; Q181-Q184 PolarHBondContact O-N 2.94Å; Q181-A185 VanDerWaalsContact O-CB 3.29Å; Q181-A185 WeakPolarHBondContact O-CB 3.42Å; Q181-A185 PolarHBondContact O-N 3.25Å
182	L	65.1	Low	69.8	Low	47 Å²	47	83.6 Å²	83.6	25%	0.246	42%	0.424	C	S	.	.	H	α-helix	trans	-65.7	-38.8	174.5	-102.1	168	0	0	0	113.3	F178 T179 E180 R186	F178-L182 HydrophobicContact CD1-CD1 3.99Å; F178-L182 HydrophobicContact CE1-CD1 3.45Å; F178-L182 VanDerWaalsContact CE1-CD1 3.45Å; F178-L182 HydrophobicContact CE2-CD1 4.15Å; F178-L182 HydrophobicContact CZ-CD1 3.55Å; F178-L182 HydrophobicContact CZ-CG 4.4Å; F178-L182 WeakPolarHBondContact O-CB 3.25Å; F178-L182 PolarHBondContact O-N 3.15Å; T179-L182 PolarHBondContact O-N 2.92Å; E180-L182 VanDerWaalsContact C-N 3.27Å; E180-L182 PolarHBondContact O-N 3.18Å; L182-R186 WeakPolarHBondContact O-CB 3.45Å; L182-R186 WeakPolarHBondContact O-CD 3.37Å; L182-R186 WeakPolarHBondContact O-CG 3.43Å; L182-R186 PolarHBondContact O-N 3.02Å
183	K	69.4	Low	68.5	Low	102 Å²	102	85.2 Å²	85.2	44%	0.443	45%	0.445	S	S	.	.	H	α-helix	trans	-62.2	-49	171.5	-73.2	165.2	176.6	173.3	0	110.6	T179 E180 A185 R186 A187	T179-K183 WeakPolarHBondContact O-CG 3.3Å; T179-K183 PolarHBondContact O-N 2.85Å; E180-K183 WeakPolarHBondContact O-CB 3.41Å; E180-K183 PolarHBondContact O-N 3Å; E180-K183 WeakPolarHBondContact OE1-CD 3.5Å; E180-K183 IonicContact OE1-NZ 2.7Å; E180-K183 PolarHBondContact OE1-NZ 2.64Å; E180-K183 IonicContact OE2-NZ 3.41Å; E180-K183 PolarHBondContact OE2-NZ 2.98Å; K183-A185 VanDerWaalsContact C-N 3.35Å; K183-A185 PolarHBondContact O-N 3.06Å; K183-R186 PolarHBondContact O-N 3.35Å; K183-A187 WeakPolarHBondContact O-CB 3.42Å; K183-A187 PolarHBondContact O-N 2.92Å
184	Q	73.8	Confident	67.2	Low	125 Å²	125	86.3 Å²	86.3	58%	0.584	46%	0.459	S	S	*	.	H	α-helix	trans	-59.7	-44.3	179.7	-70.1	171.3	0.3	0	0	111.5	E180 Q181 R186 A187 S188	E180-Q184 WeakPolarHBondContact O-CG 3.35Å; E180-Q184 PolarHBondContact O-N 3.48Å; Q181-Q184 PolarHBondContact O-N 2.94Å; Q184-R186 VanDerWaalsContact C-N 3.34Å; Q184-R186 PolarHBondContact O-N 3.23Å; Q184-A187 PolarHBondContact O-N 3.36Å; Q184-S188 WeakPolarHBondContact O-CB 3.35Å; Q184-S188 PolarHBondContact O-N 2.85Å; Q184-S188 PolarHBondContact O-OG 2.83Å
185	A	68.5	Low	66.4	Low	15 Å²	15	88 Å²	88	12%	0.124	47%	0.473	C	S	.	.	H	α-helix	trans	-69.7	-26.9	177.8	0	0	0	0	0	113.7	Q181 K183 R190 V191	Q181-A185 VanDerWaalsContact O-CB 3.29Å; Q181-A185 WeakPolarHBondContact O-CB 3.42Å; Q181-A185 PolarHBondContact O-N 3.25Å; K183-A185 VanDerWaalsContact C-N 3.35Å; K183-A185 PolarHBondContact O-N 3.06Å; A185-R190 HydrophobicContact CB-CB 4.49Å; A185-R190 WeakPolarHBondContact O-CA 3.27Å; A185-R190 WeakPolarHBondContact O-CB 3.29Å; A185-R190 PolarHBondContact O-N 3.1Å; A185-V191 HydrophobicContact CB-CG2 3.92Å; A185-V191 PolarHBondContact O-N 3.2Å
186	R	68.7	Low	66.1	Low	143 Å²	143	89.2 Å²	89.2	54%	0.54	49%	0.485	S	S	.	.	H	α-helix	trans	-74.7	-46.1	170.1	-74.3	168.8	-178.6	-179.2	1.2	111.4	L182 K183 Q184 S188 G189 V191	L182-R186 WeakPolarHBondContact O-CB 3.45Å; L182-R186 WeakPolarHBondContact O-CD 3.37Å; L182-R186 WeakPolarHBondContact O-CG 3.43Å; L182-R186 PolarHBondContact O-N 3.02Å; K183-R186 PolarHBondContact O-N 3.35Å; Q184-R186 VanDerWaalsContact C-N 3.34Å; Q184-R186 PolarHBondContact O-N 3.23Å; R186-S188 VanDerWaalsContact C-N 3.3Å; R186-S188 PolarHBondContact O-N 2.98Å; R186-G189 PolarHBondContact O-N 3.46Å; R186-V191 HydrophobicContact CG-CB 4.36Å
187	A	72.6	Confident	66.4	Low	93 Å²	93	87.7 Å²	87.7	77%	0.769	48%	0.477	S	S	*	.	H	α-helix	trans	-62.7	-35.3	177.3	0	0	0	0	0	112.2	K183 Q184 G189	K183-A187 WeakPolarHBondContact O-CB 3.42Å; K183-A187 PolarHBondContact O-N 2.92Å; Q184-A187 PolarHBondContact O-N 3.36Å; A187-G189 PolarHBondContact O-N 2.91Å
188	S	79.8	Confident	66.9	Low	63 Å²	63	88.3 Å²	88.3	44%	0.441	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	15.5	173.8	89.4	0	0	0	0	113.8	Q184 R186 R190	Q184-S188 WeakPolarHBondContact O-CB 3.35Å; Q184-S188 PolarHBondContact O-N 2.85Å; Q184-S188 PolarHBondContact O-OG 2.83Å; R186-S188 VanDerWaalsContact C-N 3.3Å; R186-S188 PolarHBondContact O-N 2.98Å; S188-R190 PolarHBondContact O-N 3.15Å
189	G	65.7	Low	67.2	Low	62 Å²	62	85.7 Å²	85.7	64%	0.639	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	0.3	179.8	0	0	0	0	0	116.6	R186 A187 V191	R186-G189 PolarHBondContact O-N 3.46Å; A187-G189 PolarHBondContact O-N 2.91Å; G189-V191 VanDerWaalsContact C-N 3.31Å; G189-V191 PolarHBondContact O-N 3.05Å
190	R	66.7	Low	67.8	Low	199 Å²	199	84.2 Å²	84.2	75%	0.751	47%	0.469	S	S	*	.	S	Bend	trans	-73.9	-20.2	-171.1	-164.4	-177.4	-62.5	144.3	2.3	113	A185 S188	A185-R190 HydrophobicContact CB-CB 4.49Å; A185-R190 WeakPolarHBondContact O-CA 3.27Å; A185-R190 WeakPolarHBondContact O-CB 3.29Å; A185-R190 PolarHBondContact O-N 3.1Å; S188-R190 PolarHBondContact O-N 3.15Å
191	V	58.4	Low	68.3	Low	59 Å²	59	83.2 Å²	83.2	36%	0.358	46%	0.462	S	S	.	.	S	Bend	trans	-133	112.8	177.3	178.8	0	0	0	0	110.2	A185 R186 G189 G193	A185-V191 HydrophobicContact CB-CG2 3.92Å; A185-V191 PolarHBondContact O-N 3.2Å; R186-V191 HydrophobicContact CG-CB 4.36Å; G189-V191 VanDerWaalsContact C-N 3.31Å; G189-V191 PolarHBondContact O-N 3.05Å; V191-G193 PolarHBondContact O-N 3.43Å
192	R	57.9	Low	68.7	Low	230 Å²	230	82 Å²	82	87%	0.868	46%	0.464	S	S	*	.			trans	-71	123.1	170.4	-76.1	-173.2	173.3	-172.8	-2.1	110.5	V194	R192-V194 PolarHBondContact O-N 3.23Å
193	G	52.2	Low	69.2	Low	63 Å²	63	80.4 Å²	80.4	65%	0.649	46%	0.457	S	S	*	.			trans	-79.2	71.5	-178.5	0	0	0	0	0	114.2	V191	V191-G193 PolarHBondContact O-N 3.43Å
194	V	55.5	Low	69.6	Low	113 Å²	113	75.8 Å²	75.8	69%	0.685	44%	0.437	S	S	*	.			trans	-93.1	120.3	169.1	-174.3	0	0	0	0	109.4	R192 G196 A199	R192-V194 PolarHBondContact O-N 3.23Å; V194-G196 PolarHBondContact O-N 3.08Å; V194-A199 HydrophobicContact CG1-CB 4.25Å
195	S	66.4	Low	69.9	Low	55 Å²	55	75.1 Å²	75.1	39%	0.385	43%	0.434	S	S	.	.			trans	-80.5	107.3	171.5	-173.8	0	0	0	0	109.5	E198 A199	S195-E198 VanDerWaalsContact CB-OE2 3.31Å; S195-E198 WeakPolarHBondContact CB-OE2 3.35Å; S195-E198 PolarHBondContact O-N 2.91Å; S195-E198 PolarHBondContact OG-OE2 2.78Å; S195-A199 PolarHBondContact O-N 3.04Å
196	G	70.3	Confident	70.4	Confident	46 Å²	46	77.7 Å²	77.7	47%	0.474	44%	0.441	S	S	.	.	H	α-helix	trans	-51.2	-47.6	179.4	0	0	0	0	0	114.3	V194 E198 A199 L200	V194-G196 PolarHBondContact O-N 3.08Å; G196-E198 PolarHBondContact O-N 2.64Å; G196-A199 PolarHBondContact O-N 2.92Å; G196-L200 WeakPolarHBondContact O-CB 3.45Å; G196-L200 PolarHBondContact O-N 3.41Å
197	P	75.1	Confident	70.7	Confident	25 Å²	25	71.9 Å²	71.9	16%	0.162	42%	0.42	C	S	.	.	H	α-helix	trans	-58	-42.8	175.9	-26.6	34.7	0	0	0	113.6	L81 F84 L200 R201	L81-P197 HydrophobicContact CD2-CB 3.86Å; F84-P197 HydrophobicContact CD1-CB 4.07Å; F84-P197 HydrophobicContact CD1-CG 3.82Å; F84-P197 HydrophobicContact CD2-CG 4.25Å; F84-P197 HydrophobicContact CE1-CB 4Å; F84-P197 HydrophobicContact CE1-CG 3.49Å; F84-P197 VanDerWaalsContact CE1-CG 3.49Å; F84-P197 HydrophobicContact CE2-CG 3.94Å; F84-P197 HydrophobicContact CG-CG 4.2Å; F84-P197 HydrophobicContact CZ-CG 3.57Å; P197-L200 PolarHBondContact O-N 2.68Å; P197-R201 WeakPolarHBondContact O-CB 3.3Å; P197-R201 VanDerWaalsContact O-CG 3.27Å; P197-R201 WeakPolarHBondContact O-CG 3.33Å; P197-R201 PolarHBondContact O-N 2.76Å
198	E	72.2	Confident	70.9	Confident	71 Å²	71	70 Å²	70	33%	0.332	40%	0.395	S	S	.	.	H	α-helix	trans	-71.3	-39.1	179.2	-80.2	65.1	-98.8	0	0	111.6	S195 G196 L200 R201 S202	S195-E198 VanDerWaalsContact CB-OE2 3.31Å; S195-E198 WeakPolarHBondContact CB-OE2 3.35Å; S195-E198 PolarHBondContact O-N 2.91Å; S195-E198 PolarHBondContact OG-OE2 2.78Å; G196-E198 PolarHBondContact O-N 2.64Å; E198-L200 VanDerWaalsContact C-N 3.32Å; E198-L200 PolarHBondContact O-N 3.29Å; E198-R201 PolarHBondContact O-N 3.32Å; E198-R201 IonicContact OE1-CZ 2.73Å; E198-R201 IonicContact OE1-NE 3.91Å; E198-R201 PolarHBondContact OE1-NE 3.44Å; E198-R201 IonicContact OE1-NH2 2.86Å; E198-R201 PolarHBondContact OE1-NH2 2.73Å; E198-S202 PolarHBondContact O-N 2.85Å; E198-S202 PolarHBondContact O-OG 2.68Å
199	A	72.9	Confident	70.8	Confident	50 Å²	50	74.4 Å²	74.4	41%	0.413	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-40	173	0	0	0	0	0	112.1	V194 S195 G196 S202 S203	V194-A199 HydrophobicContact CG1-CB 4.25Å; S195-A199 PolarHBondContact O-N 3.04Å; G196-A199 PolarHBondContact O-N 2.92Å; A199-S202 PolarHBondContact O-N 3.32Å; A199-S203 PolarHBondContact O-N 3.24Å; A199-S203 VanDerWaalsContact O-N 3.1Å
200	L	77.8	Confident	71.3	Confident	34 Å²	34	75.6 Å²	75.6	18%	0.178	39%	0.391	C	S	.	.	H	α-helix	trans	-64.9	-48.4	175.5	-179.7	58.5	0	0	0	111.5	L64 L77 L81 G196 P197 E198 S202 S203 I204	L64-L200 HydrophobicContact CD2-CD1 3.43Å; L64-L200 VanDerWaalsContact CD2-CD1 3.43Å; L77-L200 HydrophobicContact CD1-CD1 4.31Å; L77-L200 HydrophobicContact CD2-CD1 4.26Å; L77-L200 HydrophobicContact CD2-CD2 4.24Å; L81-L200 HydrophobicContact CD1-CD2 4.15Å; L81-L200 HydrophobicContact CD1-CG 4.09Å; L81-L200 HydrophobicContact CD2-CB 4.48Å; L81-L200 HydrophobicContact CD2-CD2 4.02Å; L81-L200 HydrophobicContact CD2-CG 4.43Å; L81-L200 HydrophobicContact CG-CD2 3.95Å; L81-L200 HydrophobicContact CG-CG 4.41Å; G196-L200 WeakPolarHBondContact O-CB 3.45Å; G196-L200 PolarHBondContact O-N 3.41Å; P197-L200 PolarHBondContact O-N 2.68Å; E198-L200 VanDerWaalsContact C-N 3.32Å; E198-L200 PolarHBondContact O-N 3.29Å; L200-S202 VanDerWaalsContact C-N 3.34Å; L200-S202 PolarHBondContact O-N 2.84Å; L200-S203 WeakPolarHBondContact O-CB 3.33Å; L200-S203 PolarHBondContact O-N 2.79Å; L200-S203 VanDerWaalsContact O-N 3.09Å; L200-I204 HydrophobicContact CD1-CD1 4.14Å; L200-I204 HydrophobicContact CD1-CG1 4.4Å; L200-I204 HydrophobicContact CG-CD1 4.03Å; L200-I204 WeakPolarHBondContact O-CG1 3.04Å; L200-I204 PolarHBondContact O-N 3.22Å
201	R	79.6	Confident	71.5	Confident	55 Å²	55	69 Å²	69	21%	0.208	38%	0.379	C	S	.	.	H	α-helix	trans	-53.7	-48.4	173.8	-74.6	176.3	-124.8	-95.3	13.7	111.8	L81 D85 P197 E198 S203 I204 Q205	L81-R201 HydrophobicContact CD1-CG 3.7Å; L81-R201 HydrophobicContact CD2-CG 4.07Å; L81-R201 HydrophobicContact CG-CG 4.49Å; D85-R201 IonicContact OD1-CZ 3.61Å; D85-R201 IonicContact OD1-NH1 3.74Å; D85-R201 PolarHBondContact OD1-NH1 3.08Å; D85-R201 IonicContact OD1-NH2 3.63Å; D85-R201 PolarHBondContact OD1-NH2 2.86Å; D85-R201 IonicContact OD2-CZ 2.6Å; D85-R201 IonicContact OD2-NH1 2.79Å; D85-R201 PolarHBondContact OD2-NH1 2.62Å; D85-R201 IonicContact OD2-NH2 3.79Å; P197-R201 WeakPolarHBondContact O-CB 3.3Å; P197-R201 VanDerWaalsContact O-CG 3.27Å; P197-R201 WeakPolarHBondContact O-CG 3.33Å; P197-R201 PolarHBondContact O-N 2.76Å; E198-R201 PolarHBondContact O-N 3.32Å; E198-R201 IonicContact OE1-CZ 2.73Å; E198-R201 IonicContact OE1-NE 3.91Å; E198-R201 PolarHBondContact OE1-NE 3.44Å; E198-R201 IonicContact OE1-NH2 2.86Å; E198-R201 PolarHBondContact OE1-NH2 2.73Å; R201-S203 VanDerWaalsContact C-N 3.27Å; R201-S203 PolarHBondContact O-N 3.39Å; R201-I204 PolarHBondContact O-N 2.9Å; R201-Q205 WeakPolarHBondContact O-CB 3.23Å; R201-Q205 VanDerWaalsContact O-CG 3.3Å; R201-Q205 WeakPolarHBondContact O-CG 3.5Å; R201-Q205 PolarHBondContact O-N 3.32Å
202	S	75.2	Confident	72	Confident	72 Å²	72	75.4 Å²	75.4	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-63.6	-31.2	178.6	-64.1	0	0	0	0	113.2	E198 A199 L200 R206	E198-S202 PolarHBondContact O-N 2.85Å; E198-S202 PolarHBondContact O-OG 2.68Å; A199-S202 PolarHBondContact O-N 3.32Å; L200-S202 VanDerWaalsContact C-N 3.34Å; L200-S202 PolarHBondContact O-N 2.84Å; S202-R206 PolarHBondContact O-N 3.43Å
203	S	75	Confident	72.6	Confident	14 Å²	14	69.1 Å²	69.1	10%	0.098	39%	0.388	C	S	.	.	H	α-helix	trans	-69.8	-49.7	174.5	-159.8	0	0	0	0	111.8	A199 L200 R201 Q205 R206 I207	A199-S203 PolarHBondContact O-N 3.24Å; A199-S203 VanDerWaalsContact O-N 3.1Å; L200-S203 WeakPolarHBondContact O-CB 3.33Å; L200-S203 PolarHBondContact O-N 2.79Å; L200-S203 VanDerWaalsContact O-N 3.09Å; R201-S203 VanDerWaalsContact C-N 3.27Å; R201-S203 PolarHBondContact O-N 3.39Å; S203-Q205 PolarHBondContact O-N 2.93Å; S203-R206 WeakPolarHBondContact O-CB 3.35Å; S203-R206 PolarHBondContact O-N 2.9Å; S203-I207 WeakPolarHBondContact O-CG1 3.12Å; S203-I207 PolarHBondContact O-N 2.85Å
204	I	77.2	Confident	72.9	Confident	4 Å²	4	70.4 Å²	70.4	2%	0.021	39%	0.387	C	S	.	.	H	α-helix	trans	-59.5	-48.1	178	-63.6	164.3	0	0	0	110.4	L77 E78 L81 L200 R201 R206 I207 Q208	L77-I204 HydrophobicContact CB-CD1 3.83Å; E78-I204 HydrophobicContact CG-CD1 4.31Å; E78-I204 HydrophobicContact CG-CG2 4.26Å; L81-I204 HydrophobicContact CD1-CD1 3.75Å; L200-I204 HydrophobicContact CD1-CD1 4.14Å; L200-I204 HydrophobicContact CD1-CG1 4.4Å; L200-I204 HydrophobicContact CG-CD1 4.03Å; L200-I204 WeakPolarHBondContact O-CG1 3.04Å; L200-I204 PolarHBondContact O-N 3.22Å; R201-I204 PolarHBondContact O-N 2.9Å; I204-R206 PolarHBondContact O-N 2.85Å; I204-R206 VanDerWaalsContact O-N 3.14Å; I204-I207 PolarHBondContact O-N 3.42Å; I204-Q208 HydrophobicContact CG2-CG 4.3Å; I204-Q208 WeakPolarHBondContact O-CB 3.49Å; I204-Q208 WeakPolarHBondContact O-CG 3.3Å; I204-Q208 PolarHBondContact O-N 2.8Å
205	Q	79.5	Confident	72.7	Confident	112 Å²	112	68 Å²	68	52%	0.523	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-21.9	176.5	-74.1	178.9	-8.4	0	0	113.9	R201 S203 R209	R201-Q205 WeakPolarHBondContact O-CB 3.23Å; R201-Q205 VanDerWaalsContact O-CG 3.3Å; R201-Q205 WeakPolarHBondContact O-CG 3.5Å; R201-Q205 PolarHBondContact O-N 3.32Å; S203-Q205 PolarHBondContact O-N 2.93Å; Q205-R209 WeakPolarHBondContact O-CG 3.09Å; Q205-R209 PolarHBondContact O-NE 3.13Å
206	R	79	Confident	71.6	Confident	69 Å²	69	71 Å²	71	26%	0.26	40%	0.397	S	S	.	.	H	α-helix	trans	-81.3	-48.7	172.7	-175.4	-179	55	79.5	13	111.1	A65 S202 S203 I204 Q208 R209 E210	A65-R206 VanDerWaalsContact CA-NH2 3.32Å; A65-R206 PolarHBondContact O-NH2 2.83Å; S202-R206 PolarHBondContact O-N 3.43Å; S203-R206 WeakPolarHBondContact O-CB 3.35Å; S203-R206 PolarHBondContact O-N 2.9Å; I204-R206 PolarHBondContact O-N 2.85Å; I204-R206 VanDerWaalsContact O-N 3.14Å; R206-Q208 VanDerWaalsContact C-N 3.28Å; R206-Q208 PolarHBondContact O-N 3.43Å; R206-R209 WeakPolarHBondContact O-CA 3.13Å; R206-R209 WeakPolarHBondContact O-CB 3.37Å; R206-R209 PolarHBondContact O-N 3Å; R206-E210 VanDerWaalsContact CD-OE1 3.28Å; R206-E210 WeakPolarHBondContact CD-OE1 3.14Å; R206-E210 HydrophobicContact CG-CG 4.38Å; R206-E210 WeakPolarHBondContact CG-OE1 3.29Å; R206-E210 IonicContact CZ-OE1 3.61Å; R206-E210 IonicContact CZ-OE2 3.64Å; R206-E210 IonicContact NE-OE1 2.72Å; R206-E210 IonicContact NH1-OE1 3.16Å; R206-E210 PolarHBondContact NH1-OE1 2.73Å; R206-E210 IonicContact NH1-OE2 3.61Å; R206-E210 PolarHBondContact NH1-OE2 3.12Å; R206-E210 PolarHBondContact O-N 3.38Å
207	I	75.5	Confident	70.1	Confident	21 Å²	21	80.7 Å²	80.7	11%	0.108	42%	0.419	C	S	.	.	H	α-helix	trans	-56.4	-43.7	177.6	-65.4	166	0	0	0	110.6	L69 S203 I204 R209 E210 A211	L69-I207 HydrophobicContact CD1-CD1 3.82Å; S203-I207 WeakPolarHBondContact O-CG1 3.12Å; S203-I207 PolarHBondContact O-N 2.85Å; I204-I207 PolarHBondContact O-N 3.42Å; I207-R209 VanDerWaalsContact C-N 3.3Å; I207-R209 PolarHBondContact O-N 3.31Å; I207-E210 PolarHBondContact O-N 3.2Å; I207-A211 WeakPolarHBondContact O-CB 3.33Å; I207-A211 PolarHBondContact O-N 2.71Å
208	Q	77.3	Confident	68.6	Low	53 Å²	53	84.9 Å²	84.9	25%	0.248	45%	0.449	C	S	.	.	H	α-helix	trans	-64	-28.5	175.6	-71.1	175.2	-5.2	0	0	113.9	E78 I204 R206 R212	E78-Q208 PolarHBondContact OE1-NE2 2.67Å; I204-Q208 HydrophobicContact CG2-CG 4.3Å; I204-Q208 WeakPolarHBondContact O-CB 3.49Å; I204-Q208 WeakPolarHBondContact O-CG 3.3Å; I204-Q208 PolarHBondContact O-N 2.8Å; R206-Q208 VanDerWaalsContact C-N 3.28Å; R206-Q208 PolarHBondContact O-N 3.43Å; Q208-R212 VanDerWaalsContact O-CD 3.28Å; Q208-R212 WeakPolarHBondContact O-CD 3.29Å; Q208-R212 WeakPolarHBondContact O-CG 3.32Å; Q208-R212 PolarHBondContact O-N 3.34Å
209	R	78.6	Confident	66.8	Low	156 Å²	156	93.4 Å²	93.4	59%	0.589	48%	0.478	S	S	*	.	H	α-helix	trans	-78.2	-41.8	173.6	-79.5	177.9	-71.1	142.5	-2.6	111.6	Q205 R206 I207 R212 S213	Q205-R209 WeakPolarHBondContact O-CG 3.09Å; Q205-R209 PolarHBondContact O-NE 3.13Å; R206-R209 WeakPolarHBondContact O-CA 3.13Å; R206-R209 WeakPolarHBondContact O-CB 3.37Å; R206-R209 PolarHBondContact O-N 3Å; I207-R209 VanDerWaalsContact C-N 3.3Å; I207-R209 PolarHBondContact O-N 3.31Å; R209-R212 PolarHBondContact O-N 2.95Å; R209-S213 PolarHBondContact O-N 2.98Å
210	E	75.8	Confident	64.9	Low	87 Å²	87	95 Å²	95	41%	0.407	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-49.3	177.5	-73	163.1	178.1	0	0	110.2	R206 I207 R212 S213 S214	R206-E210 VanDerWaalsContact CD-OE1 3.28Å; R206-E210 WeakPolarHBondContact CD-OE1 3.14Å; R206-E210 HydrophobicContact CG-CG 4.38Å; R206-E210 WeakPolarHBondContact CG-OE1 3.29Å; R206-E210 IonicContact CZ-OE1 3.61Å; R206-E210 IonicContact CZ-OE2 3.64Å; R206-E210 IonicContact NE-OE1 2.72Å; R206-E210 IonicContact NH1-OE1 3.16Å; R206-E210 PolarHBondContact NH1-OE1 2.73Å; R206-E210 IonicContact NH1-OE2 3.61Å; R206-E210 PolarHBondContact NH1-OE2 3.12Å; R206-E210 PolarHBondContact O-N 3.38Å; I207-E210 PolarHBondContact O-N 3.2Å; E210-R212 VanDerWaalsContact C-N 3.31Å; E210-R212 PolarHBondContact O-N 3.42Å; E210-S213 WeakPolarHBondContact O-CA 3.42Å; E210-S213 PolarHBondContact O-N 2.81Å; E210-S213 PolarHBondContact O-OG 2.98Å; E210-S214 PolarHBondContact O-N 2.95Å; E210-S214 PolarHBondContact O-OG 3.21Å
211	A	70.1	Confident	62.9	Low	59 Å²	59	97.7 Å²	97.7	49%	0.488	53%	0.527	S	S	.	.	H	α-helix	trans	-58.4	-37	175.2	0	0	0	0	0	113.8	I207 S213 S214	I207-A211 WeakPolarHBondContact O-CB 3.33Å; I207-A211 PolarHBondContact O-N 2.71Å; A211-S213 VanDerWaalsContact C-N 3.34Å; A211-S214 WeakPolarHBondContact CA-OG 3.43Å; A211-S214 PolarHBondContact O-OG 3.16Å
212	R	70	Confident	61.2	Low	195 Å²	195	98.9 Å²	98.9	74%	0.736	54%	0.538	S	S	*	.	H	α-helix	trans	-70.8	-28.3	174.1	-72.8	170.9	-166.2	-165.8	5.3	112.8	Q208 R209 E210	Q208-R212 VanDerWaalsContact O-CD 3.28Å; Q208-R212 WeakPolarHBondContact O-CD 3.29Å; Q208-R212 WeakPolarHBondContact O-CG 3.32Å; Q208-R212 PolarHBondContact O-N 3.34Å; R209-R212 PolarHBondContact O-N 2.95Å; E210-R212 VanDerWaalsContact C-N 3.31Å; E210-R212 PolarHBondContact O-N 3.42Å
213	S	68.6	Low	59.8	Low	98 Å²	98	100.1 Å²	100.1	69%	0.685	54%	0.542	S	S	*	.	H	α-helix	trans	-80.3	-25.7	178.1	72.8	0	0	0	0	113.6	R209 E210 A211	R209-S213 PolarHBondContact O-N 2.98Å; E210-S213 WeakPolarHBondContact O-CA 3.42Å; E210-S213 PolarHBondContact O-N 2.81Å; E210-S213 PolarHBondContact O-OG 2.98Å; A211-S213 VanDerWaalsContact C-N 3.34Å
214	S	60.2	Low	58.4	Low	90 Å²	90	106.7 Å²	106.7	63%	0.629	57%	0.571	S	S	*	*	S	Bend	trans	-84.5	-3.8	177.6	51.7	0	0	0	0	114.8	E210 A211	E210-S214 PolarHBondContact O-N 2.95Å; E210-S214 PolarHBondContact O-OG 3.21Å; A211-S214 WeakPolarHBondContact CA-OG 3.43Å; A211-S214 PolarHBondContact O-OG 3.16Å
215	A	50.4	Low	57	Low	61 Å²	61	112 Å²	112	50%	0.504	60%	0.596	S	S	.	*	S	Bend	trans	-69.6	129.3	178.8	0	0	0	0	0	111.2	R217	A215-R217 PolarHBondContact O-N 2.82Å
216	P	42.8	Very low	55.5	Low	119 Å²	119	111.7 Å²	111.7	77%	0.773	60%	0.597	S	S	*	*			trans	-66.2	133.9	-179	26.2	-33.5	0	0	0	111.1	S218	P216-S218 VanDerWaalsContact C-N 3.26Å; P216-S218 PolarHBondContact O-N 3.49Å
217	R	39.7	Very low	54.2	Low	249 Å²	249	112.4 Å²	112.4	94%	0.94	61%	0.605	S	S	*	*			trans	-72.6	73.9	176.3	-69.7	-177.5	174.4	-174	-1.6	111.5	A215	A215-R217 PolarHBondContact O-N 2.82Å
218	S	42.9	Very low	53	Low	114 Å²	114	116.9 Å²	116.9	80%	0.797	63%	0.625	S	S	*	*			trans	-63.3	137.7	165.8	49.5	0	0	0	0	110.2	P216	P216-S218 VanDerWaalsContact C-N 3.26Å; P216-S218 PolarHBondContact O-N 3.49Å
219	R	35.5	Very low	51.6	Low	249 Å²	249	120.6 Å²	120.6	94%	0.94	64%	0.643	S	S	*	*			trans	-83.9	135.3	-175.2	-73	172.8	166.6	157.5	-7.1	111.2
220	G	33.1	Very low	50.1	Low	84 Å²	84	119.5 Å²	119.5	87%	0.866	64%	0.644	S	S	*	*			trans	61	86.5	145.2	0	0	0	0	0	118.4
221	A	35	Very low	48.6	Very low	91 Å²	91	122.8 Å²	122.8	75%	0.752	65%	0.653	S	S	*	*			trans	-138.5	152.5	152	0	0	0	0	0	109.2	V223	A221-V223 PolarHBondContact O-N 2.77Å
222	N	45	Very low	47.4	Very low	79 Å²	79	128.6 Å²	128.6	42%	0.422	66%	0.662	S	S	.	*			trans	-70.2	97.2	-158	-165.6	-5.1	0	0	0	115	Q224 E225	N222-Q224 PolarHBondContact O-N 3.04Å; N222-Q224 PolarHBondContact OD1-N 3.3Å; N222-Q224 VanDerWaalsContact OD1-N 3.16Å; N222-E225 WeakPolarHBondContact CB-OE2 3.31Å; N222-E225 WeakPolarHBondContact ND2-CG 3.43Å; N222-E225 PolarHBondContact ND2-OE2 2.94Å
223	V	45	Very low	46.2	Very low	99 Å²	99	125.8 Å²	125.8	60%	0.6	66%	0.661	S	S	*	*	H	α-helix	trans	-66.7	-23.3	178.3	178.4	0	0	0	0	112.7	A221 I227	A221-V223 PolarHBondContact O-N 2.77Å; V223-I227 HydrophobicContact CG1-CD1 3.78Å; V223-I227 HydrophobicContact CG1-CG1 4.48Å; V223-I227 WeakPolarHBondContact O-CG1 3.3Å; V223-I227 PolarHBondContact O-N 2.97Å
224	Q	46.1	Very low	44.8	Very low	151 Å²	151	125 Å²	125	71%	0.706	66%	0.655	S	S	*	*	H	α-helix	trans	-76.5	-32.2	-177	-70.2	177	-56.2	0	0	112.9	N222 Q228	N222-Q224 PolarHBondContact O-N 3.04Å; N222-Q224 PolarHBondContact OD1-N 3.3Å; N222-Q224 VanDerWaalsContact OD1-N 3.16Å; Q224-Q228 PolarHBondContact O-N 3.19Å
225	E	47	Very low	43.7	Very low	115 Å²	115	126.4 Å²	126.4	54%	0.537	66%	0.656	S	S	.	*	H	α-helix	trans	-68.5	-43.9	177.1	-78.9	174.9	124.6	0	0	112.2	N222 I227 Q228 Q229	N222-E225 WeakPolarHBondContact CB-OE2 3.31Å; N222-E225 WeakPolarHBondContact ND2-CG 3.43Å; N222-E225 PolarHBondContact ND2-OE2 2.94Å; E225-I227 VanDerWaalsContact C-N 3.3Å; E225-I227 PolarHBondContact O-N 2.79Å; E225-Q228 PolarHBondContact O-N 2.88Å; E225-Q228 VanDerWaalsContact O-N 3.11Å; E225-Q229 PolarHBondContact O-N 3.44Å
226	I	48.8	Very low	43.1	Very low	107 Å²	107	128.7 Å²	128.7	55%	0.549	66%	0.663	S	S	.	*	H	α-helix	trans	-61.8	-41	177.4	-58.9	175.7	0	0	0	110.4	Q228 Q229 H230	I226-Q228 VanDerWaalsContact C-N 3.32Å; I226-Q228 PolarHBondContact O-N 3.11Å; I226-Q229 PolarHBondContact O-N 3.05Å; I226-H230 PolarHBondContact O-N 3.17Å
227	I	51.1	Low	42.6	Very low	84 Å²	84	131 Å²	131	43%	0.431	67%	0.669	S	S	.	*	H	α-helix	trans	-68.1	-29	176.8	-70	174.6	0	0	0	112.3	V223 E225 R231	V223-I227 HydrophobicContact CG1-CD1 3.78Å; V223-I227 HydrophobicContact CG1-CG1 4.48Å; V223-I227 WeakPolarHBondContact O-CG1 3.3Å; V223-I227 PolarHBondContact O-N 2.97Å; E225-I227 VanDerWaalsContact C-N 3.3Å; E225-I227 PolarHBondContact O-N 2.79Å; I227-R231 VanDerWaalsContact CG2-NH2 3.33Å; I227-R231 PolarHBondContact O-N 3.32Å
228	Q	50.7	Low	42	Very low	115 Å²	115	124.5 Å²	124.5	54%	0.537	66%	0.66	S	S	.	*	H	α-helix	trans	-76.4	-40.5	172.4	-76.7	-169.1	1.5	0	0	112.6	Q224 E225 I226 R231 R232	Q224-Q228 PolarHBondContact O-N 3.19Å; E225-Q228 PolarHBondContact O-N 2.88Å; E225-Q228 VanDerWaalsContact O-N 3.11Å; I226-Q228 VanDerWaalsContact C-N 3.32Å; I226-Q228 PolarHBondContact O-N 3.11Å; Q228-R231 PolarHBondContact O-N 3.08Å; Q228-R232 WeakPolarHBondContact O-CG 3.35Å; Q228-R232 PolarHBondContact O-N 3.09Å
229	Q	47.5	Very low	41.4	Very low	130 Å²	130	129.7 Å²	129.7	61%	0.607	67%	0.669	S	S	*	*	H	α-helix	trans	-63.5	-44.1	176.6	-72.6	-178.8	-7.2	0	0	111.7	E225 I226 R231 R232 L233	E225-Q229 PolarHBondContact O-N 3.44Å; I226-Q229 PolarHBondContact O-N 3.05Å; Q229-R231 VanDerWaalsContact C-N 3.25Å; Q229-R231 PolarHBondContact O-N 2.91Å; Q229-R232 PolarHBondContact O-N 3.04Å; Q229-L233 PolarHBondContact O-N 3.35Å
230	H	46.8	Very low	41.1	Very low	134 Å²	134	121.3 Å²	121.3	62%	0.62	66%	0.659	S	S	*	*	H	α-helix	trans	-63.5	-30.3	175	-112.2	-72.8	0	0	0	113.1	I226 S234	I226-H230 PolarHBondContact O-N 3.17Å; H230-S234 PolarHBondContact O-N 3.22Å; H230-S234 PolarHBondContact O-OG 3.43Å
231	R	45.5	Very low	40.9	Very low	156 Å²	156	125.1 Å²	125.1	59%	0.589	66%	0.66	S	S	*	*	H	α-helix	trans	-70.9	-48.4	175.7	-137.9	173.5	-65.5	-164.2	-2.1	111.3	I227 Q228 Q229 L233 S234 D235	I227-R231 VanDerWaalsContact CG2-NH2 3.33Å; I227-R231 PolarHBondContact O-N 3.32Å; Q228-R231 PolarHBondContact O-N 3.08Å; Q229-R231 VanDerWaalsContact C-N 3.25Å; Q229-R231 PolarHBondContact O-N 2.91Å; R231-L233 PolarHBondContact O-N 2.94Å; R231-L233 VanDerWaalsContact O-N 3.13Å; R231-S234 WeakPolarHBondContact O-CA 3.46Å; R231-S234 VanDerWaalsContact O-CB 3.26Å; R231-S234 WeakPolarHBondContact O-CB 3.21Å; R231-S234 PolarHBondContact O-N 2.76Å; R231-D235 PolarHBondContact O-N 3.26Å
232	R	44.8	Very low	40.6	Very low	180 Å²	180	127.2 Å²	127.2	68%	0.679	66%	0.663	S	S	*	*	H	α-helix	trans	-59.6	-24.6	176.6	-69.2	-178.5	-174.8	-178.6	4.2	114.2	Q228 Q229	Q228-R232 WeakPolarHBondContact O-CG 3.35Å; Q228-R232 PolarHBondContact O-N 3.09Å; Q229-R232 PolarHBondContact O-N 3.04Å
233	L	43.7	Very low	39.9	Very low	137 Å²	137	130.7 Å²	130.7	72%	0.717	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-8.3	173	-68.6	171.7	0	0	0	114	Q229 R231	Q229-L233 PolarHBondContact O-N 3.35Å; R231-L233 PolarHBondContact O-N 2.94Å; R231-L233 VanDerWaalsContact O-N 3.13Å
234	S	39.7	Very low	39.4	Very low	80 Å²	80	134.6 Å²	134.6	56%	0.559	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-23.2	175.9	-53.8	0	0	0	0	112.5	H230 R231 T236	H230-S234 PolarHBondContact O-N 3.22Å; H230-S234 PolarHBondContact O-OG 3.43Å; R231-S234 WeakPolarHBondContact O-CA 3.46Å; R231-S234 VanDerWaalsContact O-CB 3.26Å; R231-S234 WeakPolarHBondContact O-CB 3.21Å; R231-S234 PolarHBondContact O-N 2.76Å; S234-T236 PolarHBondContact O-N 2.88Å
235	D	36.1	Very low	38.7	Very low	120 Å²	120	134.4 Å²	134.4	64%	0.642	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-3.7	-169.1	-59.8	-36.8	0	0	0	114.3	R231	R231-D235 PolarHBondContact O-N 3.26Å
236	T	38.6	Very low	37.8	Very low	109 Å²	109	136.3 Å²	136.3	67%	0.669	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	2.5	-168.9	-21.3	0	0	0	0	115.5	S234	S234-T236 PolarHBondContact O-N 2.88Å
237	L	31.9	Very low	36.9	Very low	168 Å²	168	140.2 Å²	140.2	88%	0.88	72%	0.723	S	S	*	*	S	Bend	trans	-131.7	47.1	-174.7	-72.5	175.6	0	0	0	113.7
238	C	28	Very low	35.9	Very low	112 Å²	112	146.1 Å²	146.1	76%	0.757	75%	0.746	S	S	*	*			trans	-136.3	97.2	174.6	-80.9	0	0	0	0	112.4
239	F	30.5	Very low	34.8	Very low	224 Å²	224	143.8 Å²	143.8	98%	0.982	75%	0.752	S	S	*	*			trans	-142.6	125.6	163.7	-94.4	-85.2	0	0	0	108.4
240	G	28.5	Very low	33.9	Very low	72 Å²	72	147.1 Å²	147.1	74%	0.742	77%	0.765	S	S	*	*	S	Bend	trans	153.1	47.6	179.4	0	0	0	0	0	118.1
241	N	29.4	Very low	33.2	Very low	165 Å²	165	148.1 Å²	148.1	88%	0.882	78%	0.775	S	S	*	*			trans	51.8	107.7	162.4	-65.4	-3.1	0	0	0	119.9
242	T	27.1	Very low	32.5	Very low	134 Å²	134	146.5 Å²	146.5	82%	0.822	78%	0.778	S	S	*	*			trans	-130.2	127.9	148.6	54.9	0	0	0	0	109.2
243	N	31	Very low	31.6	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	78%	0.782	S	S	*	*			trans	-159.9	165.9	163.3	-104	-29.6	0	0	0	110.1
244	E	35.4	Very low	30.9	Very low	182 Å²	182	147.1 Å²	147.1	85%	0.85	79%	0.793	S	S	*	*			trans	72.6	73.5	-165.3	-56	-161.8	171.6	0	0	113.7
245	I	31	Very low	30.2	Very low	146 Å²	146	154.9 Å²	154.9	75%	0.749	81%	0.81	S	S	*	*				85	111.7	62.9	-61.4	163	0	0	0	113.1
246	N	27.6	Very low	29.7	Very low	156 Å²	156	152.9 Å²	152.9	83%	0.834	81%	0.805	S	S	*	*			trans	-52.1	137.6	178.4	-51.3	-65.9	0	0	0	114.9
247	K	30.7	Very low	29.1	Very low	188 Å²	188	157 Å²	157	82%	0.817	82%	0.819	S	S	*	*			trans	-164	139.3	141.7	-116.4	162.6	-173.5	174.6	0	112.9
248	F	30.2	Very low	28.8	Very low	209 Å²	209	153 Å²	153	92%	0.917	81%	0.805	S	S	*	*			trans	59.5	151.4	-179.3	-65	-89.1	0	0	0	116
249	G	27.8	Very low	28.7	Very low	65 Å²	65	155.2 Å²	155.2	67%	0.67	81%	0.809	S	S	*	*			cis	-178	132.1	-6.9	0	0	0	0	0	110.4	N251	G249-N251 PolarHBondContact O-N 3.22Å
250	K	28.8	Very low	28.5	Very low	201 Å²	201	154.4 Å²	154.4	87%	0.874	81%	0.805	S	S	*	*			trans	-41	127.7	-176.4	-60.6	165.6	179.5	175	0	114
251	N	32.3	Very low	28.3	Very low	155 Å²	155	161.5 Å²	161.5	83%	0.829	81%	0.811	S	S	*	*				-171	121.5	118.5	-91.8	-13.4	0	0	0	113.9	G249	G249-N251 PolarHBondContact O-N 3.22Å
252	D	29.5	Very low	28.2	Very low	122 Å²	122	159.4 Å²	159.4	65%	0.652	81%	0.81	S	S	*	*			trans	50.9	132.3	144.7	-90.5	19.7	0	0	0	126.4
253	K	26.2	Very low	28.3	Very low	178 Å²	178	163 Å²	163	77%	0.774	81%	0.814	S	S	*	*			trans	72.8	58.3	138.2	-65.9	170.6	179.2	127.5	0	120.6
254	T	29.6	Very low	28	Very low	152 Å²	152	164.3 Å²	164.3	93%	0.933	82%	0.815	S	S	*	*			trans	-129.2	80.9	143.3	53.2	0	0	0	0	112.1
255	R	25.1	Very low	27.8	Very low	242 Å²	242	162.3 Å²	162.3	91%	0.913	82%	0.815	S	S	*	*			trans	-121.3	125.5	174	-177.8	179.2	179.4	-178.1	-0.1	110.1
256	S	25.6	Very low	27.6	Very low	79 Å²	79	162.4 Å²	162.4	55%	0.552	82%	0.817	S	S	*	*			trans	63.2	110.9	176.3	-153	0	0	0	0	116.2	S258	S256-S258 PolarHBondContact OG-O 3.32Å; S256-S258 PolarHBondContact OG-OG 2.91Å
257	M	26	Very low	27.8	Very low	194 Å²	194	164.4 Å²	164.4	96%	0.956	82%	0.821	S	S	*	*	S	Bend	trans	-111.6	30.2	156	-144.6	-167.7	82.5	0	0	111.9
258	S	25.4	Very low	27.7	Very low	85 Å²	85	164.5 Å²	164.5	59%	0.594	83%	0.825	S	S	*	*			trans	-106.7	156.1	153.3	53.9	0	0	0	0	108.6	S256	S256-S258 PolarHBondContact OG-O 3.32Å; S256-S258 PolarHBondContact OG-OG 2.91Å
259	L	25.5	Very low	27.8	Very low	158 Å²	158	159.8 Å²	159.8	83%	0.827	82%	0.815	S	S	*	*			trans	78	77.3	-170.1	-53.1	165.7	0	0	0	115.8
260	F	25.3	Very low	28	Very low	207 Å²	207	164.1 Å²	164.1	91%	0.908	82%	0.823	S	S	*	*			trans	-139.4	149	142.1	-89.1	-76	0	0	0	108.9
261	Y	25.5	Very low	28	Very low	221 Å²	221	163.4 Å²	163.4	87%	0.867	82%	0.82	S	S	*	*	S	Bend	trans	68	68.9	-167.8	-72.8	-86.4	0	0	0	116.6
262	S	25.9	Very low	27.8	Very low	122 Å²	122	162.2 Å²	162.2	85%	0.853	82%	0.818	S	S	*	*			trans	-173.1	100.6	132.6	-101.2	0	0	0	0	111
263	K	29.9	Very low	27.8	Very low	209 Å²	209	161.7 Å²	161.7	91%	0.909	82%	0.824	S	S	*	*			trans	-169.3	130.3	151.2	-115.7	-179.5	179.3	-170.5	0	110.3
264	E	25.7	Very low	28	Very low	180 Å²	180	156.8 Å²	156.8	84%	0.841	82%	0.824	S	S	*	*			trans	-88.5	143.4	173	-58.3	133.4	138.5	0	0	110
265	V	31.5	Very low	27.9	Very low	140 Å²	140	155.7 Å²	155.7	85%	0.848	81%	0.812	S	S	*	*			trans	-144.1	133.1	148.8	-174.6	0	0	0	0	106.1
266	N	26.1	Very low	28.1	Very low	148 Å²	148	152 Å²	152	79%	0.791	81%	0.811	S	S	*	*			trans	-88.7	139.1	173.6	-58.3	-46.6	0	0	0	109.6
267	E	31.4	Very low	28.2	Very low	197 Å²	197	156.2 Å²	156.2	92%	0.921	82%	0.822	S	S	*	*			trans	-162.7	155.1	146	-114.2	157.5	-154.1	0	0	110.4
268	E	29.2	Very low	28.3	Very low	190 Å²	190	156 Å²	156	89%	0.888	82%	0.816	S	S	*	*			trans	-90.3	159.8	-164.7	-92.8	-163.3	134.6	0	0	114.8
269	P	30.9	Very low	28.4	Very low	110 Å²	110	159.1 Å²	159.1	71%	0.714	83%	0.825	S	S	*	*			trans	-86.6	147	-164.8	33.8	-36.1	0	0	0	114.1
270	N	33	Very low	28.5	Very low	157 Å²	157	158.8 Å²	158.8	84%	0.84	82%	0.824	S	S	*	*			trans	-146.3	159.1	154.5	-111.2	-56.5	0	0	0	113.7
271	K	28.2	Very low	28.7	Very low	186 Å²	186	156.9 Å²	156.9	81%	0.809	81%	0.811	S	S	*	*			trans	-62.7	154.8	-174.2	-57	153	-176.3	170.1	0	110.5
272	V	28.4	Very low	28.9	Very low	130 Å²	130	152.7 Å²	152.7	79%	0.788	80%	0.803	S	S	*	*				-165.7	161.4	68.6	157.7	0	0	0	0	111.3
273	S	28.7	Very low	29.3	Very low	111 Å²	111	156.5 Å²	156.5	78%	0.776	80%	0.799	S	S	*	*			trans	-34	148.9	179.5	55.8	0	0	0	0	120.3
274	G	30.6	Very low	29.4	Very low	75 Å²	75	152 Å²	152	77%	0.773	79%	0.785	S	S	*	*			trans	-179.2	104	160.9	0	0	0	0	0	111.6
275	D	28.6	Very low	30	Very low	129 Å²	129	149 Å²	149	69%	0.69	78%	0.779	S	S	*	*			trans	-66.1	142.2	-165.4	-66.3	-77.5	0	0	0	116.3
276	N	29.1	Very low	30.4	Very low	165 Å²	165	145.9 Å²	145.9	88%	0.882	76%	0.763	S	S	*	*			trans	-163.2	91.2	145.7	-109	-68	0	0	0	110.3
277	Q	26.6	Very low	30.9	Very low	167 Å²	167	141.7 Å²	141.7	78%	0.78	74%	0.738	S	S	*	*			trans	-93.3	114.7	-177.7	-62.2	-175.7	25.3	0	0	111.9
278	F	28.1	Very low	31.2	Very low	189 Å²	189	136.9 Å²	136.9	83%	0.829	71%	0.714	S	S	*	*			trans	-133.1	84.2	161	-106.7	-80.9	0	0	0	112.8
279	L	28.7	Very low	31.6	Very low	151 Å²	151	132 Å²	132	79%	0.791	70%	0.695	S	S	*	*			trans	57.6	66.6	151.7	-56.9	176.5	0	0	0	117.4
280	N	26.6	Very low	32.1	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	69%	0.693	S	S	*	*			trans	-55.7	138.5	144.8	-83	-10.3	0	0	0	109.3
281	R	30.8	Very low	32.3	Very low	168 Å²	168	127.4 Å²	127.4	63%	0.634	67%	0.666	S	S	*	*			trans	-135.8	58.7	171.9	-158.5	-177.6	-170.7	157.6	11.7	111.4	H142 R283	H142-R281 PolarHBondContact CD2-NH2 2.97Å; R281-R283 PolarHBondContact O-N 3.08Å
282	D	28.8	Very low	32.8	Very low	133 Å²	133	119.4 Å²	119.4	71%	0.711	63%	0.634	S	S	*	*			trans	-62.8	119.8	167.8	-60.1	-71	0	0	0	110.3
283	R	34.3	Very low	33.3	Very low	202 Å²	202	120.3 Å²	120.3	76%	0.762	63%	0.63	S	S	*	*			trans	-160.5	141.8	161.4	-108.7	164	-155.6	-143.5	0.9	110.5	R281	R281-R283 PolarHBondContact O-N 3.08Å
284	D	32.4	Very low	33.7	Very low	114 Å²	114	117.8 Å²	117.8	61%	0.61	62%	0.615	S	S	*	*			trans	58.9	64.2	163.1	-50.3	-17.1	0	0	0	117	S286 F287	D284-S286 PolarHBondContact O-N 3.33Å; D284-F287 PolarHBondContact O-N 3.3Å
285	T	37.7	Very low	34	Very low	117 Å²	117	117.6 Å²	117.6	72%	0.718	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	-36.5	165.6	42.5	0	0	0	0	113.2	F287 F288	T285-F287 PolarHBondContact O-N 3.02Å; T285-F288 WeakPolarHBondContact O-CB 3.15Å; T285-F288 PolarHBondContact O-N 3.43Å
286	S	39.5	Very low	34.6	Very low	74 Å²	74	112.8 Å²	112.8	52%	0.517	57%	0.573	S	S	.	*	H	α-helix	trans	-58.9	-19.9	-178	58.2	0	0	0	0	115.3	D284 N290	D284-S286 PolarHBondContact O-N 3.33Å; S286-N290 PolarHBondContact O-ND2 3.12Å
287	F	37.4	Very low	34.9	Very low	61 Å²	61	110 Å²	110	27%	0.268	56%	0.556	S	S	.	*	H	α-helix	trans	-75.6	-29.2	173.4	-171.2	-94.4	0	0	0	112.4	L153 V158 D284 T285	L153-F287 HydrophobicContact CD1-CE2 4.26Å; L153-F287 HydrophobicContact CD1-CZ 3.66Å; L153-F287 HydrophobicContact CD2-CZ 4.34Å; V158-F287 HydrophobicContact CG2-CE2 4.48Å; D284-F287 PolarHBondContact O-N 3.3Å; T285-F287 PolarHBondContact O-N 3.02Å
288	F	37.9	Very low	35.4	Very low	95 Å²	95	103.6 Å²	103.6	42%	0.417	53%	0.527	S	S	.	.	H	α-helix	trans	-74.1	-38.5	-178	-81	-85.4	0	0	0	112.7	T285 N290 C291 S292	T285-F288 WeakPolarHBondContact O-CB 3.15Å; T285-F288 PolarHBondContact O-N 3.43Å; F288-N290 PolarHBondContact O-N 3.44Å; F288-C291 CarbonylContact O-C 3.5Å; F288-C291 PolarHBondContact O-N 3.4Å; F288-C291 VanDerWaalsContact O-N 3.11Å; F288-S292 VanDerWaalsContact O-CB 3.31Å; F288-S292 WeakPolarHBondContact O-CB 3.4Å; F288-S292 PolarHBondContact O-N 2.95Å
289	D	38.5	Very low	35.7	Very low	89 Å²	89	100.1 Å²	100.1	48%	0.476	51%	0.512	S	S	.	.	H	α-helix	trans	-60	-46.9	-178.1	-56.5	-46.1	0	0	0	111.7	C291 S292 E293	D289-C291 PolarHBondContact O-N 2.88Å; D289-S292 WeakPolarHBondContact O-CB 3.49Å; D289-S292 PolarHBondContact O-N 2.94Å; D289-E293 PolarHBondContact O-N 2.96Å
290	N	39.8	Very low	36.1	Very low	128 Å²	128	98.6 Å²	98.6	68%	0.684	50%	0.504	S	S	*	.	H	α-helix	trans	-62.8	-24.1	177.2	-73.7	-84.6	0	0	0	114	S286 F288	S286-N290 PolarHBondContact O-ND2 3.12Å; F288-N290 PolarHBondContact O-N 3.44Å
291	C	37.6	Very low	36.7	Very low	41 Å²	41	97.3 Å²	97.3	28%	0.277	49%	0.491	S	S	.	.	H	α-helix	trans	-94.9	-18.8	171.7	-90.8	0	0	0	0	113.3	F288 D289 L295	F288-C291 CarbonylContact O-C 3.5Å; F288-C291 PolarHBondContact O-N 3.4Å; F288-C291 VanDerWaalsContact O-N 3.11Å; D289-C291 PolarHBondContact O-N 2.88Å; C291-L295 WeakPolarHBondContact O-CD1 3.42Å; C291-L295 WeakPolarHBondContact O-CG 3.46Å
292	S	39.4	Very low	37	Very low	18 Å²	18	92.9 Å²	92.9	13%	0.126	48%	0.48	C	S	.	.	H	α-helix	trans	-69	-56.8	-179.8	-176.5	0	0	0	0	110.6	W177 F288 D289 A294 L295 S296	W177-S292 VanDerWaalsContact CE3-OG 3.3Å; F288-S292 VanDerWaalsContact O-CB 3.31Å; F288-S292 WeakPolarHBondContact O-CB 3.4Å; F288-S292 PolarHBondContact O-N 2.95Å; D289-S292 WeakPolarHBondContact O-CB 3.49Å; D289-S292 PolarHBondContact O-N 2.94Å; S292-A294 VanDerWaalsContact C-N 3.34Å; S292-A294 PolarHBondContact O-N 2.85Å; S292-L295 PolarHBondContact O-N 3.22Å; S292-L295 VanDerWaalsContact O-N 3.07Å; S292-S296 WeakPolarHBondContact O-CB 3.35Å; S292-S296 PolarHBondContact O-N 3.03Å
293	E	38.1	Very low	37.3	Very low	149 Å²	149	91 Å²	91	70%	0.696	47%	0.47	S	S	*	.	H	α-helix	trans	-56.7	-47.1	-176.4	-62.8	-171.5	131.8	0	0	112.3	D289 L295 M297	D289-E293 PolarHBondContact O-N 2.96Å; E293-L295 PolarHBondContact O-N 3.27Å; E293-M297 WeakPolarHBondContact O-CG 3.38Å; E293-M297 PolarHBondContact O-N 3.11Å
294	A	36.5	Very low	37.2	Very low	58 Å²	58	84.6 Å²	84.6	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-67.3	-13.7	-178.6	0	0	0	0	0	114.6	S292 N298	S292-A294 VanDerWaalsContact C-N 3.34Å; S292-A294 PolarHBondContact O-N 2.85Å; A294-N298 PolarHBondContact O-ND2 2.89Å
295	L	38.5	Very low	37.3	Very low	72 Å²	72	86.5 Å²	86.5	38%	0.377	47%	0.468	S	S	.	.	H	α-helix	trans	-113.2	-31.3	178.2	-65.5	176.1	0	0	0	112.6	C172 C291 S292 E293 N298 F299	C172-L295 HydrophobicContact CB-CD1 4.04Å; C291-L295 WeakPolarHBondContact O-CD1 3.42Å; C291-L295 WeakPolarHBondContact O-CG 3.46Å; S292-L295 PolarHBondContact O-N 3.22Å; S292-L295 VanDerWaalsContact O-N 3.07Å; E293-L295 PolarHBondContact O-N 3.27Å; L295-N298 PolarHBondContact O-N 2.91Å; L295-F299 PolarHBondContact O-N 2.71Å
296	S	39.6	Very low	37.1	Very low	28 Å²	28	89 Å²	89	20%	0.196	47%	0.472	C	S	.	.	H	α-helix	trans	-58	-50.6	174.3	179.2	0	0	0	0	111.6	W177 S292 N298 F299 L300	W177-S296 VanDerWaalsContact CH2-CB 3.46Å; W177-S296 WeakPolarHBondContact CH2-OG 3.49Å; S292-S296 WeakPolarHBondContact O-CB 3.35Å; S292-S296 PolarHBondContact O-N 3.03Å; S296-N298 PolarHBondContact O-N 3.1Å; S296-N298 VanDerWaalsContact O-N 3.12Å; S296-F299 PolarHBondContact O-N 3.47Å; S296-L300 PolarHBondContact O-N 3.18Å
297	M	35.7	Very low	36.7	Very low	106 Å²	106	93 Å²	93	52%	0.522	49%	0.488	S	S	.	.	H	α-helix	trans	-59.2	-27.1	178.7	-67	-65.3	-75.3	0	0	113.2	E293	E293-M297 WeakPolarHBondContact O-CG 3.38Å; E293-M297 PolarHBondContact O-N 3.11Å
298	N	37.6	Very low	36.6	Very low	32 Å²	32	94.4 Å²	94.4	17%	0.171	51%	0.51	C	S	.	.	H	α-helix	trans	-83.5	-26.5	178	-76.8	-56.3	0	0	0	113.6	A294 L295 S296 N302 E467 A471	A294-N298 PolarHBondContact O-ND2 2.89Å; L295-N298 PolarHBondContact O-N 2.91Å; S296-N298 PolarHBondContact O-N 3.1Å; S296-N298 VanDerWaalsContact O-N 3.12Å; N298-N302 PolarHBondContact O-ND2 2.93Å; N298-E467 WeakPolarHBondContact OD1-CG 3.46Å; N298-A471 WeakPolarHBondContact ND2-CB 3.46Å; N298-A471 WeakPolarHBondContact OD1-CB 3.27Å
299	F	35	Very low	36.4	Very low	117 Å²	117	96.6 Å²	96.6	51%	0.513	53%	0.531	S	S	.	.	H	α-helix	trans	-85.2	-32.1	-178.1	-135.6	-88.6	0	0	0	112.5	L295 S296 N303	L295-F299 PolarHBondContact O-N 2.71Å; S296-F299 PolarHBondContact O-N 3.47Å; F299-N303 PolarHBondContact O-ND2 3.42Å
300	L	37.2	Very low	36	Very low	118 Å²	118	100 Å²	100	62%	0.618	55%	0.549	S	S	*	.	H	α-helix	trans	-73.4	-46.7	176.8	-70.7	167.5	0	0	0	112.1	S296 N302 N303	S296-L300 PolarHBondContact O-N 3.18Å; L300-N302 VanDerWaalsContact C-N 3.26Å; L300-N302 PolarHBondContact O-N 2.85Å; L300-N303 PolarHBondContact O-N 3.09Å
301	K	38.4	Very low	35.7	Very low	123 Å²	123	96.8 Å²	96.8	54%	0.535	55%	0.547	S	S	.	.	H	α-helix	trans	-63.2	-27.9	-179.4	-75.8	-164.3	172.1	-167.5	0	114.1	E601	K301-E601 IonicContact NZ-OE1 3.6Å; K301-E601 PolarHBondContact NZ-OE1 2.9Å; K301-E601 IonicContact NZ-OE2 2.73Å; K301-E601 PolarHBondContact NZ-OE2 3.25Å
302	N	36.7	Very low	35.3	Very low	76 Å²	76	103.1 Å²	103.1	41%	0.406	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	4.9	-178.3	-75.9	-62.6	0	0	0	114.9	N298 L300 E467	N298-N302 PolarHBondContact O-ND2 2.93Å; L300-N302 VanDerWaalsContact C-N 3.26Å; L300-N302 PolarHBondContact O-N 2.85Å; N302-E467 PolarHBondContact ND2-OE1 3.38Å
303	N	35.9	Very low	34.8	Very low	94 Å²	94	107.9 Å²	107.9	50%	0.503	60%	0.603	S	S	.	*	S	Bend	trans	-128.9	6.3	177.3	-68.7	-82.2	0	0	0	113.7	F299 L300 I305	F299-N303 PolarHBondContact O-ND2 3.42Å; L300-N303 PolarHBondContact O-N 3.09Å; N303-I305 PolarHBondContact O-N 3.15Å
304	A	32.4	Very low	34.3	Very low	66 Å²	66	109.1 Å²	109.1	55%	0.545	61%	0.609	S	S	.	*			trans	-82.8	101.3	176.7	0	0	0	0	0	110.3	E306	A304-E306 PolarHBondContact O-N 3.42Å
305	I	33.4	Very low	34	Very low	154 Å²	154	112.4 Å²	112.4	79%	0.79	62%	0.623	S	S	*	*			trans	-87.2	96.3	167.5	-58.2	176.6	0	0	0	106.9	N303	N303-I305 PolarHBondContact O-N 3.15Å
306	E	34.7	Very low	33.5	Very low	169 Å²	169	116.2 Å²	116.2	79%	0.79	64%	0.643	S	S	*	*			trans	-94.7	94.5	176.2	-68	-168.6	151	0	0	111	A304 A308	A304-E306 PolarHBondContact O-N 3.42Å; E306-A308 VanDerWaalsContact C-N 3.28Å; E306-A308 PolarHBondContact O-N 3.1Å
307	D	30.4	Very low	33.1	Very low	160 Å²	160	122.5 Å²	122.5	86%	0.856	67%	0.669	S	S	*	*			trans	-72.7	84.6	160.7	-76.5	-47.3	0	0	0	109
308	A	34.2	Very low	32.9	Very low	89 Å²	89	127.1 Å²	127.1	74%	0.736	69%	0.689	S	S	*	*			trans	-100.4	100.2	-179.8	0	0	0	0	0	111.6	E306	E306-A308 VanDerWaalsContact C-N 3.28Å; E306-A308 PolarHBondContact O-N 3.1Å
309	V	35.5	Very low	32.5	Very low	142 Å²	142	132.9 Å²	132.9	86%	0.861	72%	0.72	S	S	*	*			trans	-83.9	135.3	164.5	177.6	0	0	0	0	108.8
310	D	30	Very low	32.3	Very low	159 Å²	159	136.6 Å²	136.6	85%	0.85	74%	0.739	S	S	*	*			trans	-70.4	150.5	-171.1	-155.8	-9.7	0	0	0	113.3
311	G	33.1	Very low	31.8	Very low	62 Å²	62	137 Å²	137	64%	0.639	75%	0.751	S	S	*	*			trans	158.9	81.8	-176.8	0	0	0	0	0	115.1
312	Q	28.1	Very low	31.6	Very low	173 Å²	173	137.3 Å²	137.3	81%	0.808	76%	0.763	S	S	*	*			trans	-63.1	144.5	160.5	-74	-75.6	-84.2	0	0	110.8
313	P	30.7	Very low	31.2	Very low	118 Å²	118	142.8 Å²	142.8	77%	0.766	78%	0.778	S	S	*	*				-139.3	169.2	107.7	38.9	-28.4	0	0	0	114.5
314	E	26.1	Very low	30.9	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	80%	0.796	S	S	*	*			trans	-67.9	163.3	177.7	-56.1	168.3	106.4	0	0	113.7
315	V	30.8	Very low	30.8	Very low	128 Å²	128	146.5 Å²	146.5	78%	0.776	80%	0.797	S	S	*	*				158.9	121.1	118.8	162	0	0	0	0	112.4
316	N	28.8	Very low	30.8	Very low	152 Å²	152	146.2 Å²	146.2	81%	0.813	80%	0.802	S	S	*	*			trans	52.3	145.4	156.6	-86.8	-31.4	0	0	0	124.4
317	H	29.5	Very low	30.8	Very low	160 Å²	160	144 Å²	144	74%	0.741	80%	0.801	S	S	*	*			trans	-69.7	152.5	170.3	-59.1	-94.4	0	0	0	113.6
318	Q	31.7	Very low	30.8	Very low	202 Å²	202	144 Å²	144	94%	0.944	80%	0.795	S	S	*	*				-165.1	102.2	121.7	-108.1	166.7	-0.7	0	0	111.1
319	D	29.6	Very low	30.8	Very low	153 Å²	153	148.6 Å²	148.6	82%	0.818	80%	0.802	S	S	*	*			trans	-89.9	138.4	172.4	-75.1	-62.5	0	0	0	111.5
320	Q	30.5	Very low	30.6	Very low	196 Å²	196	149.6 Å²	149.6	92%	0.916	80%	0.795	S	S	*	*			trans	-158.4	157.5	160.6	-110	179.4	36	0	0	110.9
321	C	27.8	Very low	30.9	Very low	126 Å²	126	151.3 Å²	151.3	85%	0.851	80%	0.797	S	S	*	*			trans	80.3	123.4	173.7	-151.2	0	0	0	0	116.2
322	V	33	Very low	30.9	Very low	130 Å²	130	157.2 Å²	157.2	79%	0.788	81%	0.808	S	S	*	*			cis	-147.1	157	-12.9	110.4	0	0	0	0	112.2
323	R	28.6	Very low	31.2	Very low	191 Å²	191	154.3 Å²	154.3	72%	0.721	81%	0.807	S	S	*	*			trans	-66.1	144.2	-178.1	-173.9	-172	-154.6	156.7	3.1	114.3	N325	R323-N325 WeakPolarHBondContact CG-OD1 3.43Å; R323-N325 PolarHBondContact NE-OD1 3.1Å
324	C	29.8	Very low	31.4	Very low	132 Å²	132	154.1 Å²	154.1	89%	0.892	81%	0.809	S	S	*	*			trans	-134.2	105.1	156.1	-78.2	0	0	0	0	108.5
325	N	30.3	Very low	31.9	Very low	105 Å²	105	151.9 Å²	151.9	56%	0.561	81%	0.812	S	S	*	*			trans	-95.9	136.1	176.3	-85.9	42.7	0	0	0	110	R323	R323-N325 WeakPolarHBondContact CG-OD1 3.43Å; R323-N325 PolarHBondContact NE-OD1 3.1Å
326	T	34.7	Very low	32.2	Very low	148 Å²	148	155.6 Å²	155.6	91%	0.908	82%	0.818	S	S	*	*			trans	-126.8	139.1	146.8	41.5	0	0	0	0	107.9
327	T	34	Very low	32.6	Very low	122 Å²	122	153.8 Å²	153.8	75%	0.748	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-102.3	136.9	-169	37.9	0	0	0	0	112
328	E	30.1	Very low	32.9	Very low	160 Å²	160	152.7 Å²	152.7	75%	0.748	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.7	136.4	161.4	-60.8	-175.2	148.5	0	0	109.7	K330	E328-K330 WeakPolarHBondContact OE2-CE 3.3Å; E328-K330 IonicContact OE2-NZ 3.68Å
329	E	34	Very low	33	Very low	186 Å²	186	151 Å²	151	87%	0.869	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-103.3	136.3	154.3	-71.6	-166.8	141.5	0	0	109.5
330	K	31.8	Very low	33.3	Very low	163 Å²	163	152.7 Å²	152.7	71%	0.709	81%	0.807	S	S	*	*			trans	-113.2	129.3	177.8	-73.5	172.7	-179.5	163.5	0	109.4	E328	E328-K330 WeakPolarHBondContact OE2-CE 3.3Å; E328-K330 IonicContact OE2-NZ 3.68Å
331	H	36.9	Very low	33.3	Very low	196 Å²	196	147.4 Å²	147.4	91%	0.907	79%	0.791	S	S	*	*			trans	-127.2	143.1	153.7	-86.4	-78.4	0	0	0	110.5
332	Q	31.6	Very low	33.7	Very low	185 Å²	185	150.6 Å²	150.6	86%	0.864	79%	0.791	S	S	*	*			trans	-117.7	132.2	-172.1	-62.8	172.5	-70.5	0	0	110.6
333	S	35.6	Very low	33.5	Very low	113 Å²	113	149.3 Å²	149.3	79%	0.79	79%	0.787	S	S	*	*			trans	-171.4	126	147.1	29.8	0	0	0	0	107.5
334	S	33.5	Very low	33.7	Very low	114 Å²	114	148.3 Å²	148.3	80%	0.797	80%	0.795	S	S	*	*			cis	92.8	76	35.8	79.2	0	0	0	0	114.5
335	S	37.4	Very low	33.9	Very low	128 Å²	128	149.7 Å²	149.7	90%	0.895	79%	0.788	S	S	*	*			trans	-158.9	170.4	148.8	47.8	0	0	0	0	110.1
336	K	36.1	Very low	33.8	Very low	206 Å²	206	150.8 Å²	150.8	90%	0.896	79%	0.794	S	S	*	*			trans	-119.4	164.5	-166.4	-98.8	-176.5	176.7	177.5	0	112.9
337	P	38.3	Very low	33.6	Very low	114 Å²	114	147.8 Å²	147.8	74%	0.74	78%	0.779	S	S	*	*			trans	-99.7	172.8	-164.6	40.1	-37.5	0	0	0	114
338	D	35	Very low	33.4	Very low	136 Å²	136	150.4 Å²	150.4	73%	0.727	78%	0.783	S	S	*	*			trans	-148.4	-175.8	143.9	-134.7	-44.3	0	0	0	113.5
339	K	34.3	Very low	33.4	Very low	168 Å²	168	147.2 Å²	147.2	73%	0.73	78%	0.778	S	S	*	*			trans	-102.6	173.5	-155.1	-56	157.5	-156.5	88.6	0	115.3
340	Q	35.6	Very low	33.3	Very low	188 Å²	188	145 Å²	145	88%	0.879	77%	0.772	S	S	*	*			trans	115.1	147.7	158.5	-66	178.4	34.7	0	0	113.4
341	S	31.5	Very low	33.3	Very low	84 Å²	84	143.3 Å²	143.3	59%	0.587	77%	0.774	S	S	*	*			cis	162.5	142.8	-40.1	53.7	0	0	0	0	107.3
342	K	34.9	Very low	33	Very low	194 Å²	194	141 Å²	141	84%	0.843	77%	0.769	S	S	*	*			trans	71.6	114.8	-178.6	-52.8	172.7	-175.5	175.3	0	112.3
343	S	30	Very low	33.1	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	76%	0.763	S	S	*	*				87.3	110.9	50.2	74.1	0	0	0	0	114.1
344	L	32.7	Very low	32.7	Very low	170 Å²	170	135 Å²	135	89%	0.89	76%	0.757	S	S	*	*			trans	-178.9	-177.1	131.5	-97.9	164.4	0	0	0	112.3
345	H	32.6	Very low	32.4	Very low	160 Å²	160	139.5 Å²	139.5	74%	0.741	76%	0.759	S	S	*	*			trans	-85.9	163.6	-155.3	-98.5	-91.7	0	0	0	118.3
346	N	28.9	Very low	32	Very low	129 Å²	129	139.1 Å²	139.1	69%	0.69	75%	0.75	S	S	*	*			trans	77.7	106.7	141.3	-79.6	21.2	0	0	0	123.3
347	S	29.7	Very low	31.9	Very low	84 Å²	84	133.8 Å²	133.8	59%	0.587	74%	0.737	S	S	*	*				82.2	146.9	107.9	-52.8	0	0	0	0	122.5
348	Q	30.5	Very low	31.5	Very low	178 Å²	178	136.7 Å²	136.7	83%	0.832	74%	0.741	S	S	*	*			trans	61	147.7	178	-83.6	79.4	28.6	0	0	115
349	S	29.8	Very low	31.1	Very low	92 Å²	92	140 Å²	140	64%	0.643	74%	0.743	S	S	*	*			cis	-157.1	-176.9	-9.6	46.9	0	0	0	0	107
350	L	31.8	Very low	31	Very low	141 Å²	141	138 Å²	138	74%	0.738	75%	0.745	S	S	*	*			cis	-154.9	159.1	29.9	-78.3	98.3	0	0	0	111.3
351	V	32.7	Very low	30.7	Very low	126 Å²	126	137.2 Å²	137.2	76%	0.764	74%	0.741	S	S	*	*			trans	52.6	156.8	149.1	-57.8	0	0	0	0	120.5
352	D	30.4	Very low	30.6	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	74%	0.741	S	S	*	*			cis	-143.5	170.5	11	-147.4	-10	0	0	0	114.8
353	S	33.8	Very low	30.2	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	75%	0.747	S	S	*	*			trans	-10.6	147.8	169.5	-164.5	0	0	0	0	121
354	G	26.7	Very low	30.2	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	75%	0.745	S	S	*	*			cis	135.1	76.9	-4	0	0	0	0	0	116.4
355	Y	28.5	Very low	30.3	Very low	210 Å²	210	140.2 Å²	140.2	82%	0.824	74%	0.739	S	S	*	*			trans	-156.8	135.9	161.6	-156.8	-99.3	0	0	0	115.4
356	V	28.7	Very low	30.4	Very low	119 Å²	119	139.3 Å²	139.3	72%	0.721	74%	0.74	S	S	*	*			trans	-162.2	151	176	171.3	0	0	0	0	106.2
357	P	33.7	Very low	30.7	Very low	95 Å²	95	142.3 Å²	142.3	62%	0.617	75%	0.749	S	S	*	*			cis	-121	-171	-8.6	39.7	-25.3	0	0	0	112.9
358	Q	30.4	Very low	31	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	76%	0.76	S	S	*	*				-163.8	152.7	121.3	-108.9	175.8	12.9	0	0	112.6
359	R	26.5	Very low	31.3	Very low	206 Å²	206	139.7 Å²	139.7	78%	0.777	76%	0.757	S	S	*	*			trans	-98.6	132.5	160.6	-74.6	-179	175.4	-169.5	-4.5	107.7
360	T	32.7	Very low	31.6	Very low	125 Å²	125	141.7 Å²	141.7	77%	0.767	77%	0.768	S	S	*	*			trans	-132.8	154.5	166	46.5	0	0	0	0	109.9
361	H	28.9	Very low	31.8	Very low	172 Å²	172	141.2 Å²	141.2	80%	0.796	77%	0.771	S	S	*	*			trans	-104.7	161.7	-168.9	-96.3	-122.8	0	0	0	112.7
362	S	29	Very low	32.1	Very low	85 Å²	85	141.8 Å²	141.8	59%	0.594	77%	0.774	S	S	*	*			trans	44.3	128	147.1	60.2	0	0	0	0	120.7
363	W	26.7	Very low	32.5	Very low	253 Å²	253	140 Å²	140	96%	0.958	77%	0.765	S	S	*	*			trans	-101.9	141	130.1	-72.2	91.5	0	0	0	108.6
364	I	29.7	Very low	32.7	Very low	134 Å²	134	142.1 Å²	142.1	69%	0.687	76%	0.761	S	S	*	*			trans	-123.2	-175.2	167.4	-67.4	176.9	0	0	0	105.4
365	D	35.4	Very low	33.3	Very low	141 Å²	141	146.4 Å²	146.4	75%	0.754	76%	0.763	S	S	*	*			trans	91.5	127	178.2	-43.7	-19.8	0	0	0	111.8
366	D	33.8	Very low	33.6	Very low	142 Å²	142	145 Å²	145	76%	0.759	76%	0.763	S	S	*	*			cis	-151	-179.3	3.8	-147.2	-20.7	0	0	0	112
367	E	35	Very low	33.8	Very low	191 Å²	191	144.3 Å²	144.3	89%	0.893	76%	0.764	S	S	*	*			trans	112.9	109.9	176.9	-68	-90.4	120.6	0	0	114.5
368	T	36.6	Very low	33.8	Very low	133 Å²	133	145 Å²	145	82%	0.816	77%	0.772	S	S	*	*			trans	-121.2	128.8	-168.7	55.3	0	0	0	0	116.8
369	G	35.6	Very low	33.8	Very low	74 Å²	74	143 Å²	143	76%	0.763	77%	0.771	S	S	*	*			trans	93.5	175.2	139.2	0	0	0	0	0	119.1
370	P	37.9	Very low	34.3	Very low	135 Å²	135	139.1 Å²	139.1	88%	0.877	77%	0.772	S	S	*	*			cis	-114.9	174.2	-8.2	39.1	-27.1	0	0	0	114.1
371	T	34	Very low	34.1	Very low	130 Å²	130	141.4 Å²	141.4	80%	0.798	78%	0.775	S	S	*	*			trans	-106.7	157.2	-170.7	47.5	0	0	0	0	114.9
372	V	40.7	Very low	34.2	Very low	139 Å²	139	140.2 Å²	140.2	84%	0.842	77%	0.773	S	S	*	*			trans	-140.8	104.3	156.9	-172.3	0	0	0	0	110.3
373	D	38.1	Very low	34.4	Very low	111 Å²	111	143.7 Å²	143.7	59%	0.594	78%	0.78	S	S	*	*				21.3	146.4	124.7	-76.4	18.4	0	0	0	120.1
374	K	38.7	Very low	34.5	Very low	150 Å²	150	140.3 Å²	140.3	65%	0.652	78%	0.775	S	S	*	*			cis	-168	164.7	17.6	-126.7	164.6	178.5	119.6	0	113.9
375	H	38	Very low	34.7	Very low	154 Å²	154	141.3 Å²	141.3	71%	0.713	78%	0.78	S	S	*	*			trans	66.7	125.8	152.4	-66.1	-52.9	0	0	0	124.5
376	H	34.4	Very low	34.3	Very low	180 Å²	180	140.1 Å²	140.1	83%	0.833	78%	0.783	S	S	*	*			trans	-54.3	158.2	165.6	-40.3	-100.4	0	0	0	116.8
377	S	33.4	Very low	34.4	Very low	106 Å²	106	142 Å²	142	74%	0.741	79%	0.789	S	S	*	*				-171.3	129.6	116.5	-163.2	0	0	0	0	114.9
378	S	34.8	Very low	34.2	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	78%	0.779	S	S	*	*			trans	41.5	132.9	138.6	-40.5	0	0	0	0	125
379	T	30.6	Very low	34.1	Very low	133 Å²	133	140.3 Å²	140.3	82%	0.816	78%	0.78	S	S	*	*			trans	-70.6	177	153.2	10.4	0	0	0	0	112.1
380	P	35.4	Very low	34	Very low	123 Å²	123	145.3 Å²	145.3	80%	0.799	78%	0.783	S	S	*	*			cis	-146.5	-146.3	38.2	44.7	-21.1	0	0	0	117
381	Q	29.9	Very low	33.8	Very low	174 Å²	174	142.9 Å²	142.9	81%	0.813	77%	0.77	S	S	*	*			trans	-86	-174.7	-165.6	-58.2	171.8	-19.8	0	0	115.1
382	L	29.5	Very low	33.7	Very low	147 Å²	147	144 Å²	144	77%	0.77	77%	0.771	S	S	*	*			trans	108.1	150.3	174.7	-78.2	53.8	0	0	0	112.6
383	H	33.9	Very low	33.3	Very low	157 Å²	157	144 Å²	144	73%	0.727	77%	0.765	S	S	*	*			cis	-144.5	170.4	3.2	-141.1	89.8	0	0	0	111.2
384	Q	28.4	Very low	33.1	Very low	183 Å²	183	145.3 Å²	145.3	86%	0.855	77%	0.768	S	S	*	*			trans	-79.3	140.9	162.4	-66.1	177.2	-74.5	0	0	110.6
385	I	34.7	Very low	32.7	Very low	154 Å²	154	145.7 Å²	145.7	79%	0.79	77%	0.769	S	S	*	*			trans	-135.1	127.3	159.3	-60.7	-178.2	0	0	0	109.2	M387	I385-M387 HydrophobicContact CG2-CG 4.07Å
386	S	26.8	Very low	32.4	Very low	117 Å²	117	146.8 Å²	146.8	82%	0.818	78%	0.775	S	S	*	*			trans	-107.7	131.1	163.5	56	0	0	0	0	109.1
387	M	35.9	Very low	32.2	Very low	180 Å²	180	145.8 Å²	145.8	89%	0.887	78%	0.775	S	S	*	*			trans	-127.8	157.8	164.3	-71	-151.8	74.2	0	0	110.6	I385	I385-M387 HydrophobicContact CG2-CG 4.07Å
388	S	30.9	Very low	32.4	Very low	99 Å²	99	146.8 Å²	146.8	69%	0.692	78%	0.78	S	S	*	*			trans	-153.5	154.3	-161.1	63.9	0	0	0	0	113
389	K	33.7	Very low	32	Very low	190 Å²	190	144.6 Å²	144.6	83%	0.826	77%	0.774	S	S	*	*			trans	83.4	160.4	167.1	-61.8	-179	170.6	-178.5	0	117.3
390	E	34.3	Very low	32.2	Very low	179 Å²	179	148.5 Å²	148.5	84%	0.836	78%	0.78	S	S	*	*			trans	85.2	133.1	166.6	-56.1	-173.2	-178.6	0	0	117.6
391	S	34.4	Very low	31.9	Very low	85 Å²	85	148 Å²	148	59%	0.594	78%	0.779	S	S	*	*			cis	-177.9	131.8	-46.4	39.3	0	0	0	0	110.3
392	N	30.9	Very low	32.2	Very low	153 Å²	153	144.4 Å²	144.4	82%	0.818	77%	0.773	S	S	*	*			trans	62	165.9	170.4	-52.9	-48.5	0	0	0	113.8
393	L	32	Very low	32.4	Very low	138 Å²	138	141.4 Å²	141.4	72%	0.723	77%	0.765	S	S	*	*			cis	-161.6	140.6	20.1	-171.9	76.9	0	0	0	109.5
394	H	33.7	Very low	32.4	Very low	140 Å²	140	142.5 Å²	142.5	65%	0.648	77%	0.77	S	S	*	*			trans	57.8	153.7	151.8	-83.1	43.8	0	0	0	120.2
395	K	31.2	Very low	32.6	Very low	157 Å²	157	137.5 Å²	137.5	68%	0.683	75%	0.754	S	S	*	*			cis	-173.2	170.8	-20.8	-152.1	-178.8	-143.2	156	0	107.7
396	Q	32.7	Very low	32.5	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	76%	0.757	S	S	*	*			trans	88.3	120.2	161.5	-60.5	171.3	2.1	0	0	120.2
397	N	30.2	Very low	32.7	Very low	158 Å²	158	139.8 Å²	139.8	85%	0.845	75%	0.753	S	S	*	*			trans	-89.9	160.2	146.8	-76	-18.1	0	0	0	108.4
398	P	36.3	Very low	32.7	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	75%	0.747	S	S	*	*				-130.4	168.4	89.3	27.4	-11.3	0	0	0	112.2
399	G	27.5	Very low	32.8	Very low	63 Å²	63	137.4 Å²	137.4	65%	0.649	75%	0.752	S	S	*	*			cis	120.6	109.8	4.6	0	0	0	0	0	111.6
400	F	33.8	Very low	32.7	Very low	216 Å²	216	136 Å²	136	95%	0.947	75%	0.752	S	S	*	*			trans	-146.5	142	173.5	-113	-85.7	0	0	0	112.1
401	S	29.5	Very low	32.5	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	75%	0.745	S	S	*	*			trans	-83.6	173	170.6	-148.3	0	0	0	0	109.4
402	S	35.3	Very low	32.1	Very low	99 Å²	99	133.7 Å²	133.7	69%	0.692	75%	0.753	S	S	*	*			cis	-156.3	-170.4	18.8	66.2	0	0	0	0	109.9
403	S	35.5	Very low	32.2	Very low	85 Å²	85	133.9 Å²	133.9	59%	0.594	75%	0.753	S	S	*	*			cis	-165.9	145.6	3.4	13.8	0	0	0	0	109.8
404	E	33.8	Very low	32.1	Very low	180 Å²	180	132.4 Å²	132.4	84%	0.841	75%	0.75	S	S	*	*			trans	66.5	149.4	141	-63.6	-179.7	-171.4	0	0	120.2
405	C	31.1	Very low	31.8	Very low	77 Å²	77	133.9 Å²	133.9	52%	0.52	76%	0.757	S	S	.	*			cis	-162.9	156.9	-5.6	-121.1	0	0	0	0	113.8
406	Y	32.9	Very low	31.8	Very low	213 Å²	213	136.5 Å²	136.5	84%	0.835	77%	0.769	S	S	*	*			trans	55.1	147.9	158.7	-56.5	-55.9	0	0	0	121.1
407	S	32.1	Very low	31.4	Very low	107 Å²	107	136.7 Å²	136.7	75%	0.748	77%	0.767	S	S	*	*			cis	-164.9	155.4	-26.4	-115	0	0	0	0	111
408	P	35	Very low	31.5	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	77%	0.769	S	S	*	*			trans	-109.1	156	-174.5	39.6	-33.8	0	0	0	116.6
409	S	32.8	Very low	30.9	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	77%	0.769	S	S	*	*			trans	-176.1	161.2	167.9	-81.2	0	0	0	0	109.5
410	L	31.7	Very low	31.1	Very low	160 Å²	160	142.6 Å²	142.6	84%	0.838	78%	0.777	S	S	*	*			cis	-157.7	153.5	-17.4	-107	170.1	0	0	0	107.4
411	P	30.5	Very low	30.7	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	77%	0.766	S	S	*	*			trans	-112.7	171.6	-169.2	40.9	-34	0	0	0	117.2
412	S	26.1	Very low	30.8	Very low	109 Å²	109	142.9 Å²	142.9	76%	0.762	77%	0.772	S	S	*	*			trans	80.3	131.4	164.1	79.5	0	0	0	0	119.5
413	L	32	Very low	30.5	Very low	156 Å²	156	143 Å²	143	82%	0.817	77%	0.769	S	S	*	*				-169.1	126.8	112.7	-99.8	166.6	0	0	0	113.2
414	T	30.4	Very low	30.1	Very low	108 Å²	108	145.4 Å²	145.4	66%	0.663	78%	0.775	S	S	*	*			trans	4.5	130.2	157.5	53	0	0	0	0	123
415	E	26.6	Very low	29.9	Very low	170 Å²	170	144.3 Å²	144.3	79%	0.794	77%	0.774	S	S	*	*				52.4	122.2	129.6	-55.6	-163.7	133.2	0	0	122.3
416	K	31.1	Very low	29.6	Very low	213 Å²	213	147 Å²	147	93%	0.926	79%	0.788	S	S	*	*				-156.6	141.6	109.5	-110.2	158.4	-171.8	169.3	0	113
417	K	26	Very low	29.7	Very low	181 Å²	181	143.1 Å²	143.1	79%	0.787	79%	0.789	S	S	*	*			trans	-76.2	141.9	172.6	-64.5	165.9	-179.6	165	0	109.7
418	F	31.2	Very low	29.6	Very low	202 Å²	202	143.5 Å²	143.5	89%	0.886	79%	0.792	S	S	*	*			trans	-142.8	115.8	149.3	-113.7	-81.5	0	0	0	110
419	N	24.1	Very low	29.4	Very low	156 Å²	156	147.6 Å²	147.6	83%	0.834	80%	0.798	S	S	*	*			trans	-81.8	137.6	164.3	-73.2	-8.4	0	0	0	108
420	S	31.1	Very low	29.3	Very low	116 Å²	116	149.7 Å²	149.7	81%	0.811	80%	0.798	S	S	*	*			trans	-143.7	117.3	153.8	-169.1	0	0	0	0	108.9
421	S	25.6	Very low	29.1	Very low	104 Å²	104	146.7 Å²	146.7	73%	0.727	79%	0.789	S	S	*	*			trans	-90.3	132.9	178.6	51.1	0	0	0	0	110.4
422	Y	31.6	Very low	29.3	Very low	228 Å²	228	149.7 Å²	149.7	89%	0.894	80%	0.797	S	S	*	*			trans	-136.5	147.4	152.3	-112.2	-86.6	0	0	0	109.6
423	T	28.2	Very low	29.4	Very low	102 Å²	102	149.4 Å²	149.4	63%	0.626	79%	0.791	S	S	*	*			trans	-107.4	177.9	-165.4	52	0	0	0	0	112.5
424	D	28	Very low	29.6	Very low	136 Å²	136	150 Å²	150	73%	0.727	79%	0.789	S	S	*	*			trans	74.4	137.5	152.2	-64.4	-48.8	0	0	0	118.6
425	L	29.5	Very low	29.7	Very low	156 Å²	156	152 Å²	152	82%	0.817	79%	0.791	S	S	*	*			cis	-132.5	164	-2.4	-75.3	101.6	0	0	0	111.7
426	T	25.9	Very low	30.1	Very low	133 Å²	133	152.8 Å²	152.8	82%	0.816	79%	0.792	S	S	*	*			trans	-118.9	135.3	167.7	58.9	0	0	0	0	112.2
427	P	33.8	Very low	30	Very low	133 Å²	133	150.1 Å²	150.1	86%	0.864	78%	0.782	S	S	*	*			trans	-82.1	117.6	171.4	-17.1	33	0	0	0	113.2
428	S	29.6	Very low	30.4	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	78%	0.78	S	S	*	*			trans	-27.6	135.5	175.6	-50.6	0	0	0	0	119.1
429	K	30.2	Very low	30.4	Very low	204 Å²	204	145 Å²	145	89%	0.887	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-89.5	140.6	148.6	-75.5	-178.4	179.2	174.2	0	109.8
430	I	32	Very low	30.8	Very low	155 Å²	155	142.1 Å²	142.1	80%	0.795	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-90.6	122.4	172.1	-57.9	170.6	0	0	0	109
431	P	27.7	Very low	31	Very low	98 Å²	98	144.7 Å²	144.7	64%	0.636	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-91	152.6	166.6	35.6	-31.5	0	0	0	111.6
432	I	35.2	Very low	31.4	Very low	169 Å²	169	146.1 Å²	146.1	87%	0.867	77%	0.768	S	S	*	*			trans	-127.7	134.5	163.1	-61.8	178.9	0	0	0	106.8
433	T	27.7	Very low	31.4	Very low	104 Å²	104	139.2 Å²	139.2	64%	0.638	77%	0.766	S	S	*	*			trans	-138.4	123.2	-161.9	-46.4	0	0	0	0	112.5
434	H	36.4	Very low	31.4	Very low	167 Å²	167	140 Å²	140	77%	0.773	78%	0.775	S	S	*	*			trans	-158.8	123.7	152.6	-80.6	-65.1	0	0	0	106.4
435	Q	32.7	Very low	31.8	Very low	152 Å²	152	144.5 Å²	144.5	71%	0.71	78%	0.782	S	S	*	*				66.1	125.1	71.6	-72.3	178.4	-16.5	0	0	112.1
436	K	33.9	Very low	31.7	Very low	186 Å²	186	141.3 Å²	141.3	81%	0.809	77%	0.773	S	S	*	*			cis	-141.1	146.7	10.8	-84.2	147	178.8	179.7	0	108.6
437	H	29.2	Very low	31.9	Very low	156 Å²	156	141.8 Å²	141.8	72%	0.722	77%	0.771	S	S	*	*				84.2	145.1	68.4	-150.9	-75	0	0	0	114.9
438	L	33.9	Very low	31.5	Very low	140 Å²	140	143.2 Å²	143.2	73%	0.733	77%	0.77	S	S	*	*			trans	80.4	143.6	179.6	-49.5	171.8	0	0	0	116.8
439	D	32.2	Very low	31.4	Very low	135 Å²	135	143.3 Å²	143.3	72%	0.722	77%	0.771	S	S	*	*			cis	-165.1	-166.9	-38.8	-103.4	-1.6	0	0	0	110.1
440	S	32.2	Very low	31.5	Very low	97 Å²	97	139.3 Å²	139.3	68%	0.678	76%	0.763	S	S	*	*			trans	-49.5	166.5	-178.2	-131.4	0	0	0	0	116.1
441	E	34.9	Very low	31.3	Very low	169 Å²	169	137 Å²	137	79%	0.79	77%	0.767	S	S	*	*			cis	-158.3	-171.8	24.4	-154	133.7	-94.1	0	0	114.5
442	T	33.5	Very low	31.4	Very low	135 Å²	135	137.4 Å²	137.4	83%	0.828	77%	0.772	S	S	*	*			trans	-60.4	150.5	-170	56.7	0	0	0	0	118.4
443	G	31.6	Very low	31	Very low	82 Å²	82	133.5 Å²	133.5	85%	0.845	77%	0.774	S	S	*	*			trans	-180	123.8	162.2	0	0	0	0	0	114.9
444	S	30.1	Very low	31	Very low	118 Å²	118	132.4 Å²	132.4	83%	0.825	78%	0.775	S	S	*	*			trans	-94.6	127.4	-175.5	177.9	0	0	0	0	113.8
445	R	34.5	Very low	30.6	Very low	231 Å²	231	128.4 Å²	128.4	87%	0.872	77%	0.766	S	S	*	*			trans	-179.5	131.7	131.6	-105.2	166.5	159.3	170.9	-6.8	115.8
446	S	29.1	Very low	30.5	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	78%	0.776	S	S	*	*			trans	24.2	132.8	146.4	61.2	0	0	0	0	123.3
447	N	28.5	Very low	30.3	Very low	144 Å²	144	125.2 Å²	125.2	77%	0.77	77%	0.765	S	S	*	*			trans	85.5	124.4	142.9	-63.4	-17.9	0	0	0	121.7
448	L	26.3	Very low	30.4	Very low	163 Å²	163	121.5 Å²	121.5	85%	0.853	76%	0.757	S	S	*	*			trans	73.4	152.5	149.4	-63.6	164.9	0	0	0	119.4
449	S	26.9	Very low	30.4	Very low	116 Å²	116	119 Å²	119	81%	0.811	75%	0.752	S	S	*	*			trans	66.2	157.3	-172.9	84.5	0	0	0	0	114.8
450	V	33.6	Very low	30.4	Very low	120 Å²	120	119.2 Å²	119.2	73%	0.727	75%	0.752	S	S	*	*			cis	-117.8	131	1.1	176.9	0	0	0	0	110.6	S452	V450-S452 PolarHBondContact O-N 2.73Å
451	A	26.9	Very low	30.4	Very low	106 Å²	106	117.1 Å²	117.1	88%	0.876	74%	0.737	S	S	*	*			trans	-88.3	81.4	174.7	0	0	0	0	0	111.7	G453	A451-G453 PolarHBondContact O-N 2.84Å
452	S	29.7	Very low	30.3	Very low	106 Å²	106	112.2 Å²	112.2	74%	0.741	72%	0.719	S	S	*	*			trans	-77.4	107.8	174.8	-66.9	0	0	0	0	111.2	V450 A454	V450-S452 PolarHBondContact O-N 2.73Å; S452-A454 PolarHBondContact O-N 2.84Å
453	G	26.8	Very low	30.8	Very low	87 Å²	87	107.5 Å²	107.5	90%	0.897	69%	0.686	S	S	*	*			trans	-73.3	109.9	-169.6	0	0	0	0	0	114.9	A451	A451-G453 PolarHBondContact O-N 2.84Å
454	A	27.5	Very low	31.6	Very low	81 Å²	81	106.3 Å²	106.3	67%	0.669	67%	0.665	S	S	*	*			trans	-131.3	136.6	167.8	0	0	0	0	0	112.3	S452	S452-A454 PolarHBondContact O-N 2.84Å
455	S	28	Very low	32.9	Very low	83 Å²	83	103.7 Å²	103.7	58%	0.58	64%	0.639	S	S	*	*			trans	47.4	68.8	157.8	59.6	0	0	0	0	119	A457 S458	S455-A457 PolarHBondContact O-N 3.05Å; S455-S458 VanDerWaalsContact CB-OG 3.3Å; S455-S458 WeakPolarHBondContact CB-OG 3.42Å; S455-S458 PolarHBondContact O-N 3.43Å
456	H	30.6	Very low	34.2	Very low	201 Å²	201	99.3 Å²	99.3	93%	0.931	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	23.1	170	-118.2	-93.1	0	0	0	115.2
457	A	31.3	Very low	36.1	Very low	70 Å²	70	98.3 Å²	98.3	58%	0.579	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	-9.8	-179.3	0	0	0	0	0	114.5	S455 S459	S455-A457 PolarHBondContact O-N 3.05Å; A457-S459 PolarHBondContact O-N 3.07Å
458	S	29.5	Very low	38.2	Very low	78 Å²	78	94 Å²	94	55%	0.545	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	43.4	-166.6	-67.6	0	0	0	0	115.3	S455	S455-S458 VanDerWaalsContact CB-OG 3.3Å; S455-S458 WeakPolarHBondContact CB-OG 3.42Å; S455-S458 PolarHBondContact O-N 3.43Å
459	S	34.4	Very low	40.8	Very low	89 Å²	89	86.7 Å²	86.7	62%	0.622	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	11.4	168.8	78.1	0	0	0	0	114.7	A457	A457-S459 PolarHBondContact O-N 3.07Å
460	L	33	Very low	43.4	Very low	138 Å²	138	83.5 Å²	83.5	72%	0.723	52%	0.522	S	S	*	.	S	Bend	trans	-139.3	33.2	178.9	-65.5	174.6	0	0	0	111.3
461	S	32.4	Very low	45.5	Very low	54 Å²	54	79.5 Å²	79.5	38%	0.378	50%	0.502	S	S	.	.	S	Bend	trans	-150.6	30.3	-173	73	0	0	0	0	114.1
462	V	33.2	Very low	48.1	Very low	66 Å²	66	76.9 Å²	76.9	40%	0.4	47%	0.472	S	S	.	.	S	Bend	trans	-120.4	-17.3	-177.8	178.8	0	0	0	0	112.2
463	Y	43.8	Very low	50.7	Low	36 Å²	36	74.6 Å²	74.6	14%	0.141	47%	0.465	C	S	.	.	S	Bend	trans	-125.7	-63.6	-171.6	-63.5	-79.1	0	0	0	110.1	K527 W715 N723 D724 F725 N773	Y463-K527 HydrophobicContact CE1-CG 3.95Å; Y463-K527 WeakPolarHBondContact OH-CE 3.15Å; Y463-K527 PolarHBondContact OH-NZ 3.02Å; Y463-W715 HydrophobicContact CD2-CH2 4.34Å; Y463-W715 HydrophobicContact CD2-CZ3 4.38Å; Y463-W715 HydrophobicContact CE2-CH2 4.03Å; Y463-W715 AromaticContact CE2-CZ3 3.63Å; Y463-W715 HydrophobicContact CE2-CZ3 3.63Å; Y463-N723 PolarHBondContact OH-O 3.46Å; Y463-D724 WeakPolarHBondContact OH-CA 3.36Å; Y463-F725 HydrophobicContact CE1-CB 4.26Å; Y463-N773 WeakPolarHBondContact CB-ND2 3.27Å; Y463-N773 VanDerWaalsContact CD1-ND2 3.34Å; Y463-N773 WeakPolarHBondContact CD1-ND2 3.12Å; Y463-N773 VanDerWaalsContact CD2-ND2 3.27Å; Y463-N773 WeakPolarHBondContact CD2-ND2 3.35Å
464	S	47.3	Very low	53.6	Low	57 Å²	57	71.2 Å²	71.2	40%	0.399	43%	0.427	S	S	.	.	S	Bend	trans	-71.4	123.7	163.1	15.6	0	0	0	0	110.6	N773	S464-N773 PolarHBondContact OG-OXT 3.46Å
465	E	58.9	Low	56.6	Low	62 Å²	62	74.7 Å²	74.7	29%	0.29	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-76.5	142.4	172.5	-77.9	158.4	176.2	0	0	109.5	Y470 K518 W567	E465-Y470 HydrophobicContact CB-CE2 4.25Å; E465-Y470 WeakPolarHBondContact CB-OH 3.48Å; E465-Y470 PolarHBondContact OE2-OH 3.47Å; E465-Y470 VanDerWaalsContact OE2-OH 3.08Å; E465-K518 VanDerWaalsContact CD-NZ 3.35Å; E465-K518 IonicContact OE1-NZ 3.73Å; E465-K518 PolarHBondContact OE1-NZ 2.9Å; E465-K518 IonicContact OE2-NZ 3.61Å; E465-W567 WeakPolarHBondContact OE2-CH2 3.22Å; E465-W567 WeakPolarHBondContact OE2-CZ2 3.39Å
466	R	61	Low	59.8	Low	139 Å²	139	72.4 Å²	72.4	53%	0.525	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-73.3	143.3	-171.9	-53.3	179.5	74.6	-177.1	2.5	109.4	S468 C469	R466-S468 PolarHBondContact O-N 3.43Å; R466-C469 WeakPolarHBondContact O-CA 3.1Å; R466-C469 WeakPolarHBondContact O-CB 3.5Å; R466-C469 PolarHBondContact O-N 3.04Å; R466-C469 PolarHBondContact O-SG 3.41Å; R466-C469 VanDerWaalsContact O-SG 3.4Å
467	E	69	Low	62.8	Low	69 Å²	69	65.2 Å²	65.2	32%	0.322	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-48	-40.8	178.7	-160	74.5	168	0	0	113.6	N298 N302 C469 Y470 A471	N298-E467 WeakPolarHBondContact OD1-CG 3.46Å; N302-E467 PolarHBondContact ND2-OE1 3.38Å; E467-C469 PolarHBondContact O-N 3Å; E467-Y470 PolarHBondContact O-N 2.87Å; E467-A471 WeakPolarHBondContact O-CB 3.44Å; E467-A471 PolarHBondContact O-N 3.15Å
468	S	73.1	Confident	65.9	Low	53 Å²	53	62.4 Å²	62.4	37%	0.371	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-63.1	-8.6	175.9	59	0	0	0	0	115.5	R466 L574	R466-S468 PolarHBondContact O-N 3.43Å; S468-L574 WeakPolarHBondContact OG-CD1 3.47Å
469	C	79.2	Confident	69.2	Low	10 Å²	10	60.7 Å²	60.7	7%	0.068	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-84.5	-17	172.1	-58.9	0	0	0	0	112.4	R466 E467 H472 W567 F577	R466-C469 WeakPolarHBondContact O-CA 3.1Å; R466-C469 WeakPolarHBondContact O-CB 3.5Å; R466-C469 PolarHBondContact O-N 3.04Å; R466-C469 PolarHBondContact O-SG 3.41Å; R466-C469 VanDerWaalsContact O-SG 3.4Å; E467-C469 PolarHBondContact O-N 3Å; C469-H472 PolarHBondContact O-CD2 3.42Å; C469-W567 HydrophobicContact CB-CZ3 4.18Å; C469-F577 WeakPolarHBondContact O-CB 3.26Å; C469-F577 PolarHBondContact O-N 2.92Å
470	Y	83	Confident	72.2	Confident	48 Å²	48	56.4 Å²	56.4	19%	0.188	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-36.7	172.9	-49.5	-71.4	0	0	0	111.1	E465 E467 H472 W567 F577 H602	E465-Y470 HydrophobicContact CB-CE2 4.25Å; E465-Y470 WeakPolarHBondContact CB-OH 3.48Å; E465-Y470 PolarHBondContact OE2-OH 3.47Å; E465-Y470 VanDerWaalsContact OE2-OH 3.08Å; E467-Y470 PolarHBondContact O-N 2.87Å; Y470-H472 VanDerWaalsContact C-N 3.34Å; Y470-H472 PolarHBondContact O-N 2.99Å; Y470-W567 HydrophobicContact CD1-CH2 4.27Å; Y470-W567 AromaticContact CE1-CH2 3.58Å; Y470-W567 HydrophobicContact CE1-CH2 3.58Å; Y470-W567 HydrophobicContact CE1-CZ2 4.11Å; Y470-F577 HydrophobicContact CD1-CB 3.74Å; Y470-F577 HydrophobicContact CD1-CD1 4.27Å; Y470-F577 AromaticContact CD1-CD2 3.83Å; Y470-F577 HydrophobicContact CD1-CD2 3.83Å; Y470-F577 HydrophobicContact CD1-CE2 4.45Å; Y470-F577 AromaticContact CD1-CG 3.71Å; Y470-F577 HydrophobicContact CD1-CG 3.71Å; Y470-F577 HydrophobicContact CE1-CB 4.38Å; Y470-F577 AromaticContact CE1-CD2 3.85Å; Y470-F577 HydrophobicContact CE1-CD2 3.85Å; Y470-F577 HydrophobicContact CE1-CE2 4.35Å; Y470-F577 HydrophobicContact CE1-CG 4.22Å; Y470-H602 HydrophobicContact CD1-CB 3.88Å; Y470-H602 AromaticContact CD1-CD2 3.58Å; Y470-H602 AromaticContact CD1-CG 3.64Å; Y470-H602 AromaticContact CD2-CD2 3.84Å; Y470-H602 HydrophobicContact CE1-CB 4.32Å; Y470-H602 AromaticContact CE1-CD2 3.55Å; Y470-H602 AromaticContact CE1-CE1 3.91Å; Y470-H602 AromaticContact CE1-CG 3.65Å; Y470-H602 AromaticContact CE1-ND1 3.86Å; Y470-H602 AromaticContact CE1-NE2 3.74Å; Y470-H602 AromaticContact CE2-CD2 3.8Å; Y470-H602 AromaticContact CE2-NE2 3.77Å; Y470-H602 HydrophobicContact CG-CB 4.41Å; Y470-H602 AromaticContact CG-CD2 3.74Å; Y470-H602 AromaticContact CZ-CD2 3.66Å; Y470-H602 AromaticContact CZ-CE1 3.9Å; Y470-H602 AromaticContact CZ-NE2 3.47Å
471	A	77.9	Confident	75.3	Confident	37 Å²	37	50.9 Å²	50.9	31%	0.306	29%	0.285	S	S	.	.			trans	-87.3	64.6	-176.1	0	0	0	0	0	113.4	N298 E467	N298-A471 WeakPolarHBondContact ND2-CB 3.46Å; N298-A471 WeakPolarHBondContact OD1-CB 3.27Å; E467-A471 WeakPolarHBondContact O-CB 3.44Å; E467-A471 PolarHBondContact O-N 3.15Å
472	H	81.2	Confident	78.4	Confident	50 Å²	50	48.3 Å²	48.3	23%	0.231	27%	0.267	C	S	.	.	S	Bend	trans	-119.3	3.9	-179.4	48.3	56.7	0	0	0	114.4	C469 Y470 I474 L576 F577	C469-H472 PolarHBondContact O-CD2 3.42Å; Y470-H472 VanDerWaalsContact C-N 3.34Å; Y470-H472 PolarHBondContact O-N 2.99Å; H472-I474 VanDerWaalsContact C-N 3.28Å; H472-I474 WeakPolarHBondContact CE1-CA 3.34Å; H472-I474 WeakPolarHBondContact CE1-CB 3.38Å; H472-I474 WeakPolarHBondContact CE1-CD1 3.44Å; H472-I474 WeakPolarHBondContact CE1-CG1 3.26Å; H472-I474 PolarHBondContact CE1-N 3.47Å; H472-I474 WeakPolarHBondContact ND1-CB 3.36Å; H472-I474 WeakPolarHBondContact ND1-CD1 3.11Å; H472-I474 VanDerWaalsContact ND1-CG1 3.33Å; H472-I474 WeakPolarHBondContact ND1-CG1 3.24Å; H472-I474 PolarHBondContact ND1-N 3.45Å; H472-I474 WeakPolarHBondContact NE2-CB 3.31Å; H472-I474 PolarHBondContact O-N 3.15Å; H472-L576 HydrophobicContact CB-CD2 4.23Å; H472-F577 PolarHBondContact NE2-O 2.93Å
473	G	83.3	Confident	81.4	Confident	59 Å²	59	45.3 Å²	45.3	61%	0.608	25%	0.249	S	C	*	.			trans	68.2	20.6	176	0	0	0	0	0	115.3
474	I	88.4	Confident	83.9	Confident	16 Å²	16	43.7 Å²	43.7	8%	0.082	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-86.4	119.8	169.8	-57.3	165.4	0	0	0	106.1	H472 A504 A506 L576 L578	H472-I474 VanDerWaalsContact C-N 3.28Å; H472-I474 WeakPolarHBondContact CE1-CA 3.34Å; H472-I474 WeakPolarHBondContact CE1-CB 3.38Å; H472-I474 WeakPolarHBondContact CE1-CD1 3.44Å; H472-I474 WeakPolarHBondContact CE1-CG1 3.26Å; H472-I474 PolarHBondContact CE1-N 3.47Å; H472-I474 WeakPolarHBondContact ND1-CB 3.36Å; H472-I474 WeakPolarHBondContact ND1-CD1 3.11Å; H472-I474 VanDerWaalsContact ND1-CG1 3.33Å; H472-I474 WeakPolarHBondContact ND1-CG1 3.24Å; H472-I474 PolarHBondContact ND1-N 3.45Å; H472-I474 WeakPolarHBondContact NE2-CB 3.31Å; H472-I474 PolarHBondContact O-N 3.15Å; I474-A504 HydrophobicContact CG2-CB 3.46Å; I474-A504 VanDerWaalsContact CG2-CB 3.46Å; I474-A506 HydrophobicContact CD1-CB 3.75Å; I474-L576 HydrophobicContact CD1-CB 4.18Å; I474-L576 HydrophobicContact CD1-CD1 3.89Å; I474-L578 HydrophobicContact CD1-CD2 4.4Å
475	Q	91	Very high	86.1	Confident	153 Å²	153	42 Å²	42	72%	0.715	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-67.6	130.6	170	-69	168.8	-69.8	0	0	108.5	A504	Q475-A504 VanDerWaalsContact O-CB 3.22Å; Q475-A504 WeakPolarHBondContact O-CB 3.4Å
476	I	93.8	Very high	87.9	Confident	36 Å²	36	39.8 Å²	39.8	19%	0.185	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-74.5	135.4	-177.6	-56	-48.8	0	0	0	109.8	F577 L599 E601	I476-F577 HydrophobicContact CD1-CD1 3.92Å; I476-F577 HydrophobicContact CD1-CE1 4.09Å; I476-F577 HydrophobicContact CG1-CE1 4.35Å; I476-L599 HydrophobicContact CG2-CB 4.08Å; I476-E601 HydrophobicContact CG1-CG 4.04Å
477	S	95.1	Very high	89.3	Confident	49 Å²	49	35 Å²	35	34%	0.343	20%	0.203	S	C	.	.			trans	-150.6	155.9	177.3	73.2	0	0	0	0	111.1	N502 A504	S477-N502 CarbonylContact C-O 3.22Å; S477-N502 PolarHBondContact OG-O 3.03Å; S477-A504 WeakPolarHBondContact OG-CA 3.45Å; S477-A504 PolarHBondContact OG-N 2.83Å; S477-A504 VanDerWaalsContact OG-N 3.14Å
478	G	96.6	Very high	90.4	Very high	12 Å²	12	36 Å²	36	12%	0.124	21%	0.211	C	C	.	.			trans	105.3	176.9	171.7	0	0	0	0	0	114.7	R501 N502 L599	G478-R501 CarbonylContact C-O 3.46Å; G478-R501 WeakPolarHBondContact CA-O 3.48Å; G478-N502 WeakPolarHBondContact CA-O 3.23Å; G478-N502 PolarHBondContact N-O 3.21Å; G478-L599 WeakPolarHBondContact O-CB 3.3Å; G478-L599 PolarHBondContact O-N 3.16Å
479	E	98	Very high	91.2	Very high	41 Å²	41	37.4 Å²	37.4	19%	0.192	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	150.7	-174	-61.5	153.9	87.5	0	0	110.2	A500 R501 W596 Y597	E479-A500 CarbonylContact O-C 3.52Å; E479-A500 WeakPolarHBondContact O-CA 3.38Å; E479-A500 WeakPolarHBondContact O-CB 3.37Å; E479-R501 HydrophobicContact CB-CG 4.28Å; E479-R501 VanDerWaalsContact CD-NH2 3.28Å; E479-R501 PolarHBondContact N-O 3.34Å; E479-R501 PolarHBondContact O-N 2.9Å; E479-R501 IonicContact OE1-CZ 2.72Å; E479-R501 IonicContact OE1-NE 2.73Å; E479-R501 IonicContact OE1-NH2 3.68Å; E479-R501 PolarHBondContact OE1-NH2 3.34Å; E479-R501 IonicContact OE2-CZ 3.47Å; E479-R501 IonicContact OE2-NE 3.87Å; E479-R501 PolarHBondContact OE2-NE 3.24Å; E479-R501 IonicContact OE2-NH2 2.73Å; E479-R501 PolarHBondContact OE2-NH2 3.48Å; E479-R501 VanDerWaalsContact OE2-NH2 3.13Å; E479-W596 HydrophobicContact CB-CE3 3.72Å; E479-W596 HydrophobicContact CB-CZ3 4.34Å; E479-Y597 CarbonylContact C-O 3.53Å; E479-Y597 VanDerWaalsContact CA-O 3.26Å; E479-Y597 WeakPolarHBondContact CA-O 3.4Å
480	M	98	Very high	91.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.6	174.8	-173.8	65.2	63.1	0	0	110.4	M482 I497 Q499 A500 V517 Y544 V566 I581 W596 Y597	M480-M482 HydrophobicContact CG-CB 4.4Å; M480-M482 HydrophobicContact CG-CG 4.13Å; M480-M482 HydrophobicContact CG-SD 4.17Å; M480-I497 HydrophobicContact SD-CG2 3.99Å; M480-Q499 VanDerWaalsContact SD-O 3.42Å; M480-A500 HydrophobicContact CE-CB 3.77Å; M480-A500 HydrophobicContact SD-CB 3.97Å; M480-V517 HydrophobicContact CE-CG1 4.46Å; M480-V517 HydrophobicContact CE-CG2 3.45Å; M480-V517 VanDerWaalsContact CE-CG2 3.45Å; M480-V517 HydrophobicContact SD-CG2 4.32Å; M480-Y544 HydrophobicContact CE-CE2 4.26Å; M480-Y544 HydrophobicContact SD-CE2 4.38Å; M480-V566 HydrophobicContact CE-CG2 3.44Å; M480-V566 VanDerWaalsContact CE-CG2 3.44Å; M480-I581 HydrophobicContact CB-CD1 3.71Å; M480-I581 HydrophobicContact CG-CD1 4.49Å; M480-W596 CarbonylContact O-C 3.57Å; M480-W596 WeakPolarHBondContact O-CA 3.29Å; M480-Y597 PolarHBondContact N-O 3.03Å; M480-Y597 PolarHBondContact O-N 3.46Å
481	L	98	Very high	92.1	Very high	22 Å²	22	46 Å²	46	12%	0.115	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.8	166.8	-176.8	61.3	0	0	0	109.3	K498 Q499 S594 H595 W596	L481-K498 HydrophobicContact CD2-CB 4.37Å; L481-K498 HydrophobicContact CG-CB 4.28Å; L481-K498 PolarHBondContact O-N 3.27Å; L481-K498 VanDerWaalsContact O-N 3.1Å; L481-Q499 HydrophobicContact CB-CG 3.84Å; L481-Q499 HydrophobicContact CD2-CG 3.93Å; L481-Q499 HydrophobicContact CG-CG 4.48Å; L481-Q499 PolarHBondContact N-O 3.31Å; L481-Q499 PolarHBondContact O-N 2.98Å; L481-S594 WeakPolarHBondContact CD1-O 3.37Å; L481-H595 WeakPolarHBondContact CA-O 3.25Å; L481-W596 HydrophobicContact CB-CD2 3.89Å; L481-W596 HydrophobicContact CB-CE3 3.76Å; L481-W596 HydrophobicContact CB-CH2 3.83Å; L481-W596 HydrophobicContact CB-CZ2 3.94Å; L481-W596 HydrophobicContact CB-CZ3 3.73Å; L481-W596 HydrophobicContact CD1-CD2 4.16Å; L481-W596 HydrophobicContact CD1-CG 4.19Å; L481-W596 HydrophobicContact CD2-CZ2 4.04Å; L481-W596 HydrophobicContact CG-CZ2 4.43Å
482	M	97	Very high	92.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	156	178.9	49.2	177.5	-86	0	0	112.6	M480 V484 I495 S496 I497 L562 V564 S594 H595 Y597	M480-M482 HydrophobicContact CG-CB 4.4Å; M480-M482 HydrophobicContact CG-CG 4.13Å; M480-M482 HydrophobicContact CG-SD 4.17Å; M482-V484 HydrophobicContact CE-CG2 3.32Å; M482-I495 HydrophobicContact CE-CG2 4.15Å; M482-S496 CarbonylContact C-O 3.18Å; M482-S496 WeakPolarHBondContact CA-O 2.85Å; M482-S496 WeakPolarHBondContact CB-O 3.47Å; M482-I497 HydrophobicContact CB-CD1 4.22Å; M482-I497 HydrophobicContact SD-CD1 4.33Å; M482-L562 HydrophobicContact CE-CD2 3.87Å; M482-V564 HydrophobicContact CE-CG2 3.99Å; M482-V564 HydrophobicContact SD-CB 4.42Å; M482-V564 HydrophobicContact SD-CG1 4.2Å; M482-V564 HydrophobicContact SD-CG2 3.98Å; M482-S594 WeakPolarHBondContact O-CA 3.49Å; M482-H595 PolarHBondContact N-O 2.73Å; M482-H595 PolarHBondContact O-N 2.89Å; M482-Y597 HydrophobicContact CE-CE2 4.36Å; M482-Y597 HydrophobicContact CG-CD2 3.48Å; M482-Y597 VanDerWaalsContact CG-CD2 3.48Å; M482-Y597 HydrophobicContact CG-CE2 3.61Å; M482-Y597 HydrophobicContact SD-CD2 4.11Å; M482-Y597 HydrophobicContact SD-CE2 4.37Å
483	A	96.2	Very high	93.5	Very high	3 Å²	3	42.1 Å²	42.1	3%	0.025	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	145.2	170.2	0	0	0	0	0	109.9	I485 I495 S496 A593	A483-I485 HydrophobicContact CB-CD1 4.37Å; A483-I485 HydrophobicContact CB-CG1 4.21Å; A483-I495 WeakPolarHBondContact O-CA 3.19Å; A483-S496 PolarHBondContact N-O 2.93Å; A483-S496 PolarHBondContact O-N 3.46Å; A483-A593 WeakPolarHBondContact CB-O 3.47Å
484	V	96	Very high	94	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	90.4	-176.2	178.1	0	0	0	0	107.6	M482 L493 I495 L562 L583 L585 H588 F590	M482-V484 HydrophobicContact CE-CG2 3.32Å; V484-L493 HydrophobicContact CG1-CD1 3.93Å; V484-I495 HydrophobicContact CB-CD1 4.34Å; V484-I495 HydrophobicContact CG1-CD1 3.83Å; V484-I495 HydrophobicContact CG2-CD1 4.15Å; V484-L562 HydrophobicContact CG2-CD2 4.1Å; V484-L583 HydrophobicContact CB-CD2 4.44Å; V484-L583 HydrophobicContact CG1-CD2 4.35Å; V484-L583 HydrophobicContact CG2-CD2 3.9Å; V484-L585 HydrophobicContact CG1-CD2 4.2Å; V484-H588 WeakPolarHBondContact CB-NE2 3.23Å; V484-F590 HydrophobicContact CG1-CD1 4.28Å; V484-F590 HydrophobicContact CG1-CE1 4.13Å; V484-F590 WeakPolarHBondContact O-CD1 3.34Å
485	I	94.7	Very high	94.4	Very high	22 Å²	22	41.1 Å²	41.1	11%	0.113	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.2	-168.8	-46.9	178.8	0	0	0	107.9	A483 R494 Q592	A483-I485 HydrophobicContact CB-CD1 4.37Å; A483-I485 HydrophobicContact CB-CG1 4.21Å; I485-R494 HydrophobicContact CB-CB 4.46Å; I485-R494 PolarHBondContact N-O 3.27Å; I485-R494 PolarHBondContact O-N 3.48Å; I485-Q592 HydrophobicContact CD1-CB 4.49Å; I485-Q592 HydrophobicContact CD1-CG 4.5Å; I485-Q592 HydrophobicContact CG2-CG 4.49Å
486	Y	94.7	Very high	94.7	Very high	15 Å²	15	34.9 Å²	34.9	6%	0.059	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.4	167.8	-174	-104.5	0	0	0	110.4	D488 N491 L493 I552 K554 L557	Y486-D488 HydrophobicContact CE1-CB 4.32Å; Y486-D488 WeakPolarHBondContact CE1-OD1 3.24Å; Y486-N491 VanDerWaalsContact OH-CA 3.3Å; Y486-N491 WeakPolarHBondContact OH-CA 3.46Å; Y486-N491 PolarHBondContact OH-OD1 2.82Å; Y486-L493 HydrophobicContact CD2-CB 4.27Å; Y486-I552 WeakPolarHBondContact CE2-O 3.49Å; Y486-I552 PolarHBondContact OH-O 3.45Å; Y486-K554 HydrophobicContact CD1-CB 4.47Å; Y486-K554 HydrophobicContact CD1-CD 4.16Å; Y486-K554 HydrophobicContact CD1-CG 4Å; Y486-K554 HydrophobicContact CE1-CB 3.67Å; Y486-K554 HydrophobicContact CE1-CD 3.94Å; Y486-K554 HydrophobicContact CE1-CG 3.68Å; Y486-K554 PolarHBondContact OH-N 3.19Å; Y486-L557 HydrophobicContact CD2-CD1 3.57Å; Y486-L557 HydrophobicContact CE2-CD1 3.8Å; Y486-L557 HydrophobicContact CG-CD1 4Å
487	D	92.4	Very high	94.9	Very high	38 Å²	38	33.2 Å²	33.2	20%	0.203	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	99.3	177.9	-158.5	-47.5	0	0	0	109.4	A489 Y490 N491 T492 R494	D487-A489 VanDerWaalsContact C-N 3.29Å; D487-A489 PolarHBondContact O-N 3.42Å; D487-A489 PolarHBondContact OD1-N 3.32Å; D487-Y490 PolarHBondContact O-N 3.47Å; D487-Y490 WeakPolarHBondContact OD1-CD2 3.02Å; D487-N491 WeakPolarHBondContact O-CA 3.47Å; D487-N491 PolarHBondContact O-N 2.93Å; D487-T492 WeakPolarHBondContact CB-O 3.46Å; D487-T492 PolarHBondContact N-O 3.24Å; D487-T492 PolarHBondContact O-N 2.96Å; D487-R494 IonicContact OD2-NE 2.79Å; D487-R494 PolarHBondContact OD2-NE 3.31Å; D487-R494 IonicContact OD2-NH2 2.68Å
488	D	90.4	Very high	95	Very high	91 Å²	91	34.1 Å²	34.1	49%	0.487	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-32.6	-178.7	-79.4	-77.3	0	0	0	113.2	Y486 Y490 K554	Y486-D488 HydrophobicContact CE1-CB 4.32Å; Y486-D488 WeakPolarHBondContact CE1-OD1 3.24Å; D488-Y490 VanDerWaalsContact C-N 3.34Å; D488-Y490 PolarHBondContact O-N 3.36Å; D488-K554 VanDerWaalsContact OD1-CD 3.31Å; D488-K554 WeakPolarHBondContact OD1-CD 3.33Å; D488-K554 WeakPolarHBondContact OD1-CE 3.43Å; D488-K554 IonicContact OD1-NZ 3.12Å; D488-K554 PolarHBondContact OD1-NZ 2.86Å; D488-K554 IonicContact OD2-NZ 2.73Å; D488-K554 PolarHBondContact OD2-NZ 3.15Å
489	A	91.1	Very high	95.1	Very high	82 Å²	82	36.8 Å²	36.8	68%	0.678	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-30.7	-177.2	0	0	0	0	0	112.6	D487	D487-A489 VanDerWaalsContact C-N 3.29Å; D487-A489 PolarHBondContact O-N 3.42Å; D487-A489 PolarHBondContact OD1-N 3.32Å
490	Y	89.7	Confident	95.1	Very high	175 Å²	175	34.9 Å²	34.9	69%	0.686	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.1	10.4	-177.4	-59.8	-75.4	0	0	0	113.5	D487 D488 T492	D487-Y490 PolarHBondContact O-N 3.47Å; D487-Y490 WeakPolarHBondContact OD1-CD2 3.02Å; D488-Y490 VanDerWaalsContact C-N 3.34Å; D488-Y490 PolarHBondContact O-N 3.36Å; Y490-T492 PolarHBondContact O-N 2.68Å; Y490-T492 PolarHBondContact O-OG1 3.48Å
491	N	91	Very high	95.1	Very high	63 Å²	63	39.2 Å²	39.2	34%	0.337	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	40.8	51.2	-171.2	-69.5	-74.5	0	0	0	113.1	Y486 D487 H551 I552 L553	Y486-N491 VanDerWaalsContact OH-CA 3.3Å; Y486-N491 WeakPolarHBondContact OH-CA 3.46Å; Y486-N491 PolarHBondContact OH-OD1 2.82Å; D487-N491 WeakPolarHBondContact O-CA 3.47Å; D487-N491 PolarHBondContact O-N 2.93Å; N491-H551 WeakPolarHBondContact O-CA 3.34Å; N491-I552 CarbonylContact C-O 3.52Å; N491-I552 PolarHBondContact O-N 2.92Å; N491-I552 VanDerWaalsContact O-O 3.05Å; N491-L553 HydrophobicContact CB-CD2 4.2Å
492	T	93	Very high	95	Very high	6 Å²	6	42.9 Å²	42.9	4%	0.037	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	117.3	-168.6	-61.4	0	0	0	0	111.6	D487 Y490 R494 K549 Y550 H551	D487-T492 WeakPolarHBondContact CB-O 3.46Å; D487-T492 PolarHBondContact N-O 3.24Å; D487-T492 PolarHBondContact O-N 2.96Å; Y490-T492 PolarHBondContact O-N 2.68Å; Y490-T492 PolarHBondContact O-OG1 3.48Å; T492-R494 HydrophobicContact CG2-CG 3.88Å; T492-K549 HydrophobicContact CG2-CB 3.89Å; T492-K549 HydrophobicContact CG2-CD 4.29Å; T492-K549 HydrophobicContact CG2-CG 4.23Å; T492-Y550 CarbonylContact C-O 3.57Å; T492-Y550 WeakPolarHBondContact CA-O 3.22Å; T492-H551 PolarHBondContact OG1-CE1 3.08Å; T492-H551 VanDerWaalsContact OG1-CE1 3.31Å; T492-H551 PolarHBondContact OG1-ND1 2.96Å
493	L	94.5	Very high	95.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	116.8	168.1	177.2	70.4	0	0	0	109.4	V484 Y486 I495 L521 K549 Y550 I552 L557 L585 F590	V484-L493 HydrophobicContact CG1-CD1 3.93Å; Y486-L493 HydrophobicContact CD2-CB 4.27Å; L493-I495 HydrophobicContact CD1-CD1 4.08Å; L493-I495 HydrophobicContact CD2-CD1 4.07Å; L493-I495 HydrophobicContact CG-CD1 3.77Å; L493-L521 HydrophobicContact CD2-CD1 3.89Å; L493-L521 HydrophobicContact CD2-CD2 4.42Å; L493-K549 WeakPolarHBondContact O-CA 3.26Å; L493-Y550 HydrophobicContact CD2-CD2 4.48Å; L493-Y550 PolarHBondContact N-O 3.26Å; L493-Y550 PolarHBondContact O-N 2.82Å; L493-I552 HydrophobicContact CB-CG2 4.08Å; L493-L557 HydrophobicContact CB-CD2 4.32Å; L493-L557 HydrophobicContact CD1-CD2 4.49Å; L493-L557 HydrophobicContact CD2-CD2 4.04Å; L493-L585 HydrophobicContact CD2-CD1 3.62Å; L493-F590 HydrophobicContact CD1-CD1 4.14Å; L493-F590 HydrophobicContact CD1-CE1 3.62Å
494	R	95.3	Very high	95	Very high	53 Å²	53	43.3 Å²	43.3	20%	0.2	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.4	-178.8	-59.5	-164.8	-77.1	109.6	-4.8	110.7	I485 D487 T492 E547 F548 K549	I485-R494 HydrophobicContact CB-CB 4.46Å; I485-R494 PolarHBondContact N-O 3.27Å; I485-R494 PolarHBondContact O-N 3.48Å; D487-R494 IonicContact OD2-NE 2.79Å; D487-R494 PolarHBondContact OD2-NE 3.31Å; D487-R494 IonicContact OD2-NH2 2.68Å; T492-R494 HydrophobicContact CG2-CG 3.88Å; R494-E547 HydrophobicContact CB-CG 4.38Å; R494-E547 WeakPolarHBondContact CD-OE2 3.39Å; R494-E547 IonicContact CZ-OE2 3.55Å; R494-E547 IonicContact NH1-OE2 3.13Å; R494-E547 PolarHBondContact NH1-OE2 3.19Å; R494-F548 CarbonylContact C-O 3.46Å; R494-F548 WeakPolarHBondContact CA-O 3.36Å; R494-K549 HydrophobicContact CG-CG 4.29Å
495	I	96.3	Very high	94.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	105.6	-179.9	-45.2	-55.5	0	0	0	108.5	M482 A483 V484 L493 I497 E547 F548 Y550 L562	M482-I495 HydrophobicContact CE-CG2 4.15Å; A483-I495 WeakPolarHBondContact O-CA 3.19Å; V484-I495 HydrophobicContact CB-CD1 4.34Å; V484-I495 HydrophobicContact CG1-CD1 3.83Å; V484-I495 HydrophobicContact CG2-CD1 4.15Å; L493-I495 HydrophobicContact CD1-CD1 4.08Å; L493-I495 HydrophobicContact CD2-CD1 4.07Å; L493-I495 HydrophobicContact CG-CD1 3.77Å; I495-I497 HydrophobicContact CG2-CD1 3.77Å; I495-I497 HydrophobicContact CG2-CG1 4.39Å; I495-E547 CarbonylContact O-C 3.41Å; I495-E547 WeakPolarHBondContact O-CA 3.47Å; I495-F548 HydrophobicContact CB-CB 4.33Å; I495-F548 PolarHBondContact N-O 3.07Å; I495-F548 PolarHBondContact O-N 3.18Å; I495-Y550 HydrophobicContact CG1-CD2 4.26Å; I495-Y550 HydrophobicContact CG1-CE2 4.17Å; I495-L562 HydrophobicContact CD1-CD1 4.2Å; I495-L562 HydrophobicContact CD1-CD2 3.57Å; I495-L562 HydrophobicContact CG1-CD1 4.13Å; I495-L562 HydrophobicContact CG1-CD2 4.11Å; I495-L562 HydrophobicContact CG2-CD2 4.17Å
496	S	97.1	Very high	94.7	Very high	23 Å²	23	45.8 Å²	45.8	16%	0.161	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	109.3	175.5	-177.7	0	0	0	0	109.3	M482 A483	M482-S496 CarbonylContact C-O 3.18Å; M482-S496 WeakPolarHBondContact CA-O 2.85Å; M482-S496 WeakPolarHBondContact CB-O 3.47Å; A483-S496 PolarHBondContact N-O 2.93Å; A483-S496 PolarHBondContact O-N 3.46Å
497	I	97.8	Very high	94.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	101.7	174.2	-56.6	-59.8	0	0	0	107.5	M480 M482 I495 V517 T533 Y544 D545 E546 F548 V564	M480-I497 HydrophobicContact SD-CG2 3.99Å; M482-I497 HydrophobicContact CB-CD1 4.22Å; M482-I497 HydrophobicContact SD-CD1 4.33Å; I495-I497 HydrophobicContact CG2-CD1 3.77Å; I495-I497 HydrophobicContact CG2-CG1 4.39Å; I497-V517 HydrophobicContact CD1-CG1 4.45Å; I497-V517 HydrophobicContact CG2-CB 4.34Å; I497-V517 HydrophobicContact CG2-CG2 3.86Å; I497-T533 HydrophobicContact CB-CG2 4.36Å; I497-T533 HydrophobicContact CG2-CG2 4.03Å; I497-Y544 HydrophobicContact CG2-CD2 3.77Å; I497-Y544 HydrophobicContact CG2-CE2 4.46Å; I497-Y544 HydrophobicContact CG2-CG 4.04Å; I497-Y544 WeakPolarHBondContact O-CB 3.22Å; I497-D545 WeakPolarHBondContact O-CA 3.17Å; I497-D545 PolarHBondContact O-N 3.2Å; I497-D545 VanDerWaalsContact O-N 3.16Å; I497-E546 PolarHBondContact N-O 2.98Å; I497-E546 PolarHBondContact O-N 3.4Å; I497-F548 HydrophobicContact CG1-CD2 4.06Å; I497-F548 HydrophobicContact CG1-CE2 3.73Å; I497-F548 HydrophobicContact CG1-CZ 4.38Å; I497-V564 HydrophobicContact CD1-CG1 4.24Å
498	K	97.6	Very high	94	Very high	68 Å²	68	52.7 Å²	52.7	30%	0.296	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-68.5	-173.7	-64.6	-172.6	172.2	179.8	0	111.6	L481 Y544 D545 S594	L481-K498 HydrophobicContact CD2-CB 4.37Å; L481-K498 HydrophobicContact CG-CB 4.28Å; L481-K498 PolarHBondContact O-N 3.27Å; L481-K498 VanDerWaalsContact O-N 3.1Å; K498-Y544 WeakPolarHBondContact O-CA 3.3Å; K498-Y544 PolarHBondContact O-N 2.73Å; K498-D545 PolarHBondContact O-N 3.24Å; K498-S594 WeakPolarHBondContact CE-OG 3.4Å; K498-S594 PolarHBondContact NZ-OG 2.91Å
499	Q	98.1	Very high	93.7	Very high	69 Å²	69	58.2 Å²	58.2	32%	0.322	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	161.3	-178	57.8	176.3	-12.3	0	0	111.8	M480 L481 P542 V543 W596	M480-Q499 VanDerWaalsContact SD-O 3.42Å; L481-Q499 HydrophobicContact CB-CG 3.84Å; L481-Q499 HydrophobicContact CD2-CG 3.93Å; L481-Q499 HydrophobicContact CG-CG 4.48Å; L481-Q499 PolarHBondContact N-O 3.31Å; L481-Q499 PolarHBondContact O-N 2.98Å; Q499-P542 CarbonylContact C-O 3.57Å; Q499-P542 WeakPolarHBondContact CA-O 3.46Å; Q499-P542 WeakPolarHBondContact CB-O 3.23Å; Q499-V543 HydrophobicContact CB-CB 4.48Å; Q499-V543 HydrophobicContact CB-CG2 4.16Å; Q499-W596 HydrophobicContact CG-CH2 3.85Å; Q499-W596 HydrophobicContact CG-CZ2 4.45Å
500	A	98.4	Very high	93.5	Very high	1 Å²	1	63 Å²	63	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	157	164.7	0	0	0	0	0	110.8	E479 M480 L503 N541 P542 Y544	E479-A500 CarbonylContact O-C 3.52Å; E479-A500 WeakPolarHBondContact O-CA 3.38Å; E479-A500 WeakPolarHBondContact O-CB 3.37Å; M480-A500 HydrophobicContact CE-CB 3.77Å; M480-A500 HydrophobicContact SD-CB 3.97Å; A500-L503 HydrophobicContact CB-CD1 4.04Å; A500-L503 HydrophobicContact CB-CD2 3.96Å; A500-L503 HydrophobicContact CB-CG 4.05Å; A500-N541 CarbonylContact O-C 3.55Å; A500-N541 VanDerWaalsContact O-CA 3.25Å; A500-N541 WeakPolarHBondContact O-CA 3.15Å; A500-P542 HydrophobicContact CB-CG 3.86Å; A500-P542 PolarHBondContact N-O 2.72Å; A500-P542 WeakPolarHBondContact O-CD 3.47Å; A500-Y544 HydrophobicContact CB-CE2 4.48Å
501	R	97.8	Very high	93.5	Very high	90 Å²	90	60 Å²	60	34%	0.34	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.6	174.4	70.9	-175.5	-179.4	-162.8	-3	112.1	G478 E479 L503 N541 W596	G478-R501 CarbonylContact C-O 3.46Å; G478-R501 WeakPolarHBondContact CA-O 3.48Å; E479-R501 HydrophobicContact CB-CG 4.28Å; E479-R501 VanDerWaalsContact CD-NH2 3.28Å; E479-R501 PolarHBondContact N-O 3.34Å; E479-R501 PolarHBondContact O-N 2.9Å; E479-R501 IonicContact OE1-CZ 2.72Å; E479-R501 IonicContact OE1-NE 2.73Å; E479-R501 IonicContact OE1-NH2 3.68Å; E479-R501 PolarHBondContact OE1-NH2 3.34Å; E479-R501 IonicContact OE2-CZ 3.47Å; E479-R501 IonicContact OE2-NE 3.87Å; E479-R501 PolarHBondContact OE2-NE 3.24Å; E479-R501 IonicContact OE2-NH2 2.73Å; E479-R501 PolarHBondContact OE2-NH2 3.48Å; E479-R501 VanDerWaalsContact OE2-NH2 3.13Å; R501-L503 PolarHBondContact O-N 3.08Å; R501-N541 VanDerWaalsContact CA-OD1 3.26Å; R501-N541 WeakPolarHBondContact CA-OD1 3.5Å; R501-W596 HydrophobicContact CB-CH2 4.1Å; R501-W596 HydrophobicContact CB-CZ3 4.08Å; R501-W596 HydrophobicContact CG-CE3 4.2Å; R501-W596 HydrophobicContact CG-CH2 3.88Å; R501-W596 HydrophobicContact CG-CZ3 3.57Å
502	N	96.9	Very high	93.5	Very high	99 Å²	99	59.1 Å²	59.1	53%	0.529	27%	0.268	S	S	.	.	S	Bend	trans	56.8	30.9	172.8	-56.9	-30.4	0	0	0	114.8	S477 G478 C540 N541	S477-N502 CarbonylContact C-O 3.22Å; S477-N502 PolarHBondContact OG-O 3.03Å; G478-N502 WeakPolarHBondContact CA-O 3.23Å; G478-N502 PolarHBondContact N-O 3.21Å; N502-C540 PolarHBondContact N-O 3.34Å; N502-N541 PolarHBondContact N-OD1 3.37Å
503	L	97.5	Very high	93.6	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.026	27%	0.266	C	S	.	.			trans	-63.5	145.3	178	-62.2	-177.6	0	0	0	112.1	A500 R501 P515 C540 P542 V566 L599	A500-L503 HydrophobicContact CB-CD1 4.04Å; A500-L503 HydrophobicContact CB-CD2 3.96Å; A500-L503 HydrophobicContact CB-CG 4.05Å; R501-L503 PolarHBondContact O-N 3.08Å; L503-P515 HydrophobicContact CD1-CB 3.56Å; L503-P515 HydrophobicContact CD1-CG 3.98Å; L503-C540 HydrophobicContact CB-CB 4.25Å; L503-C540 WeakPolarHBondContact CB-O 3.46Å; L503-C540 WeakPolarHBondContact CG-O 3.45Å; L503-C540 PolarHBondContact N-O 3.01Å; L503-C540 VanDerWaalsContact O-CB 3.25Å; L503-C540 WeakPolarHBondContact O-CB 3.25Å; L503-C540 PolarHBondContact O-SG 3.32Å; L503-P542 HydrophobicContact CD1-CG 3.71Å; L503-V566 HydrophobicContact CD1-CG1 4Å; L503-V566 HydrophobicContact CD2-CG1 4.23Å; L503-L599 HydrophobicContact CD2-CD1 3.3Å
504	A	95.3	Very high	93.7	Very high	8 Å²	8	60.1 Å²	60.1	7%	0.066	27%	0.273	C	S	.	.			trans	-62	147.5	180	0	0	0	0	0	113.5	I474 Q475 S477 A506 T513	I474-A504 HydrophobicContact CG2-CB 3.46Å; I474-A504 VanDerWaalsContact CG2-CB 3.46Å; Q475-A504 VanDerWaalsContact O-CB 3.22Å; Q475-A504 WeakPolarHBondContact O-CB 3.4Å; S477-A504 WeakPolarHBondContact OG-CA 3.45Å; S477-A504 PolarHBondContact OG-N 2.83Å; S477-A504 VanDerWaalsContact OG-N 3.14Å; A504-A506 PolarHBondContact O-N 3.12Å; A504-T513 PolarHBondContact O-OG1 3.41Å
505	I	94.1	Very high	93.8	Very high	64 Å²	64	57.6 Å²	57.6	33%	0.328	26%	0.264	S	S	.	.			trans	-82.8	115	177.1	-56.4	-176.8	0	0	0	109.6	N511 T513	I505-N511 WeakPolarHBondContact CD1-OD1 3.4Å; I505-T513 WeakPolarHBondContact CA-OG1 3.45Å
506	A	89.9	Confident	93.9	Very high	12 Å²	12	58 Å²	58	10%	0.099	27%	0.265	C	S	.	.	S	Bend	trans	-93.4	-51.2	-168.3	0	0	0	0	0	113.7	I474 A504 R508 T513 H568 L578	I474-A506 HydrophobicContact CD1-CB 3.75Å; A504-A506 PolarHBondContact O-N 3.12Å; A506-R508 PolarHBondContact O-N 3.38Å; A506-T513 PolarHBondContact N-OG1 2.83Å; A506-H568 HydrophobicContact CB-CB 3.87Å; A506-H568 VanDerWaalsContact CB-ND1 3.3Å; A506-H568 WeakPolarHBondContact CB-ND1 3.42Å; A506-L578 HydrophobicContact CB-CD2 3.96Å
507	D	87.1	Confident	93.9	Very high	30 Å²	30	56.9 Å²	56.9	16%	0.16	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-88.5	85.1	168.8	-178.5	-10.5	0	0	0	108.1	K509 R510 N511 I512	D507-K509 PolarHBondContact O-N 3.4Å; D507-K509 WeakPolarHBondContact OD1-CB 3.49Å; D507-K509 PolarHBondContact OD1-N 3.22Å; D507-R510 PolarHBondContact O-N 3.4Å; D507-R510 PolarHBondContact OD1-N 2.77Å; D507-R510 VanDerWaalsContact OD2-CD 3.31Å; D507-R510 WeakPolarHBondContact OD2-CD 3.44Å; D507-R510 WeakPolarHBondContact OD2-CG 3.32Å; D507-R510 IonicContact OD2-CZ 3.82Å; D507-R510 IonicContact OD2-NE 2.79Å; D507-R510 IonicContact OD2-NH1 3.53Å; D507-R510 PolarHBondContact OD2-NH1 3.06Å; D507-N511 VanDerWaalsContact O-CA 3.31Å; D507-N511 WeakPolarHBondContact O-CA 3.46Å; D507-N511 PolarHBondContact O-N 3.04Å; D507-I512 HydrophobicContact CB-CG1 3.84Å; D507-I512 PolarHBondContact N-O 2.72Å; D507-I512 PolarHBondContact O-N 2.68Å; D507-I512 VanDerWaalsContact O-N 3.13Å
508	R	84.9	Confident	93.9	Very high	167 Å²	167	57.4 Å²	57.4	63%	0.63	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.2	176.7	-65.6	-170.6	-177	-167.7	2.4	113.4	A506	A506-R508 PolarHBondContact O-N 3.38Å
509	K	85.2	Confident	93.8	Very high	208 Å²	208	54.2 Å²	54.2	90%	0.904	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-31	-179.9	-66.1	-172.6	176.6	-173.8	0	112.4	D507	D507-K509 PolarHBondContact O-N 3.4Å; D507-K509 WeakPolarHBondContact OD1-CB 3.49Å; D507-K509 PolarHBondContact OD1-N 3.22Å
510	R	86.5	Confident	93.5	Very high	181 Å²	181	51.8 Å²	51.8	68%	0.683	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-7.9	173.2	-64.5	-173.2	-177.4	103.6	-8.7	113.8	D507 I512	D507-R510 PolarHBondContact O-N 3.4Å; D507-R510 PolarHBondContact OD1-N 2.77Å; D507-R510 VanDerWaalsContact OD2-CD 3.31Å; D507-R510 WeakPolarHBondContact OD2-CD 3.44Å; D507-R510 WeakPolarHBondContact OD2-CG 3.32Å; D507-R510 IonicContact OD2-CZ 3.82Å; D507-R510 IonicContact OD2-NE 2.79Å; D507-R510 IonicContact OD2-NH1 3.53Å; D507-R510 PolarHBondContact OD2-NH1 3.06Å; R510-I512 HydrophobicContact CB-CD1 4.07Å; R510-I512 HydrophobicContact CB-CG1 3.92Å; R510-I512 HydrophobicContact CB-CG2 4.28Å
511	N	88.8	Confident	93.1	Very high	114 Å²	114	52.1 Å²	52.1	61%	0.61	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	43.3	-171	-156.8	59.5	0	0	0	113.4	I505 D507	I505-N511 WeakPolarHBondContact CD1-OD1 3.4Å; D507-N511 VanDerWaalsContact O-CA 3.31Å; D507-N511 WeakPolarHBondContact O-CA 3.46Å; D507-N511 PolarHBondContact O-N 3.04Å
512	I	91.6	Very high	92.6	Very high	43 Å²	43	48.6 Å²	48.6	22%	0.221	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-126.7	150	-177.6	68	179.6	0	0	0	114.2	D507 R510 A538	D507-I512 HydrophobicContact CB-CG1 3.84Å; D507-I512 PolarHBondContact N-O 2.72Å; D507-I512 PolarHBondContact O-N 2.68Å; D507-I512 VanDerWaalsContact O-N 3.13Å; R510-I512 HydrophobicContact CB-CD1 4.07Å; R510-I512 HydrophobicContact CB-CG1 3.92Å; R510-I512 HydrophobicContact CB-CG2 4.28Å; I512-A538 HydrophobicContact CB-CB 4.32Å; I512-A538 HydrophobicContact CG2-CB 4Å
513	T	95.4	Very high	91.9	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	20%	0.201	C	C	.	.			trans	-126.8	138.9	164	-71.5	0	0	0	0	109.8	A504 I505 A506 P515 A538 T539 L578	A504-T513 PolarHBondContact O-OG1 3.41Å; I505-T513 WeakPolarHBondContact CA-OG1 3.45Å; A506-T513 PolarHBondContact N-OG1 2.83Å; T513-P515 HydrophobicContact CG2-CB 4.07Å; T513-P515 HydrophobicContact CG2-CG 4.36Å; T513-P515 WeakPolarHBondContact O-CD 3.28Å; T513-A538 CarbonylContact O-C 3.36Å; T513-A538 WeakPolarHBondContact O-CA 3.24Å; T513-A538 PolarHBondContact O-N 2.72Å; T513-A538 VanDerWaalsContact O-N 3.1Å; T513-T539 PolarHBondContact O-N 2.8Å; T513-L578 HydrophobicContact CG2-CD1 3.51Å
514	N	96.3	Very high	91	Very high	27 Å²	27	44.2 Å²	44.2	14%	0.144	20%	0.2	C	C	.	.			trans	-117.7	70.8	179.6	-63.7	-48.3	0	0	0	109.4	Y535 K536 A538 H568 H569	N514-Y535 HydrophobicContact CB-CD2 4.29Å; N514-K536 CarbonylContact C-O 3.51Å; N514-K536 VanDerWaalsContact C-O 3.26Å; N514-K536 WeakPolarHBondContact CA-O 3.46Å; N514-A538 PolarHBondContact OD1-N 3.33Å; N514-H568 PolarHBondContact N-ND1 3.13Å; N514-H569 HydrophobicContact CB-CB 4.22Å; N514-H569 PolarHBondContact ND2-O 3.35Å; N514-H569 PolarHBondContact O-N 2.95Å
515	P	97.8	Very high	90.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	146.3	-160.9	34.7	-37.6	0	0	0	112.3	L503 T513 Y535 K536 T539 P542 Y544 V566 W567 L578	L503-P515 HydrophobicContact CD1-CB 3.56Å; L503-P515 HydrophobicContact CD1-CG 3.98Å; T513-P515 HydrophobicContact CG2-CB 4.07Å; T513-P515 HydrophobicContact CG2-CG 4.36Å; T513-P515 WeakPolarHBondContact O-CD 3.28Å; P515-Y535 WeakPolarHBondContact O-CA 3.49Å; P515-K536 WeakPolarHBondContact CD-O 3.25Å; P515-K536 PolarHBondContact O-N 2.83Å; P515-T539 VanDerWaalsContact CD-O 3.29Å; P515-T539 WeakPolarHBondContact CD-O 3.3Å; P515-T539 HydrophobicContact CG-CG2 4.17Å; P515-T539 WeakPolarHBondContact CG-O 3.32Å; P515-P542 HydrophobicContact CB-CG 4.14Å; P515-P542 HydrophobicContact CG-CB 3.62Å; P515-P542 HydrophobicContact CG-CG 3.52Å; P515-Y544 WeakPolarHBondContact CB-OH 3.14Å; P515-Y544 PolarHBondContact O-OH 3.33Å; P515-V566 HydrophobicContact CB-CG1 4.35Å; P515-W567 CarbonylContact C-O 3.57Å; P515-W567 VanDerWaalsContact CA-O 3.29Å; P515-W567 WeakPolarHBondContact CA-O 3.26Å; P515-L578 HydrophobicContact CB-CD1 4.35Å
516	Y	98	Very high	89.4	Confident	7 Å²	7	45.8 Å²	45.8	3%	0.027	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	158.2	166	71.9	-88.4	0	0	0	110.7	K518 K532 Y544 V566 W567 H569 N575	Y516-K518 HydrophobicContact CD2-CG 4.29Å; Y516-K518 HydrophobicContact CE2-CD 4.29Å; Y516-K518 HydrophobicContact CE2-CG 3.76Å; Y516-K518 WeakPolarHBondContact OH-CE 3.45Å; Y516-K532 HydrophobicContact CD2-CD 3.61Å; Y516-K532 HydrophobicContact CD2-CG 3.59Å; Y516-K532 HydrophobicContact CE2-CD 3.59Å; Y516-K532 HydrophobicContact CE2-CG 3.86Å; Y516-Y544 PolarHBondContact N-OH 2.73Å; Y516-V566 CarbonylContact O-C 3.58Å; Y516-V566 WeakPolarHBondContact O-CA 3.31Å; Y516-W567 HydrophobicContact CD1-CB 3.85Å; Y516-W567 VanDerWaalsContact CD1-O 3.22Å; Y516-W567 WeakPolarHBondContact CD1-O 3.44Å; Y516-W567 HydrophobicContact CD2-CB 4.2Å; Y516-W567 HydrophobicContact CE1-CB 3.43Å; Y516-W567 VanDerWaalsContact CE1-CB 3.43Å; Y516-W567 HydrophobicContact CE1-CG 4.48Å; Y516-W567 HydrophobicContact CE2-CB 3.82Å; Y516-W567 HydrophobicContact CE2-CG 4.17Å; Y516-W567 HydrophobicContact CG-CB 4.23Å; Y516-W567 VanDerWaalsContact CZ-CB 3.41Å; Y516-W567 PolarHBondContact N-O 3.19Å; Y516-W567 PolarHBondContact O-N 3.16Å; Y516-H569 HydrophobicContact CD1-CB 3.83Å; Y516-H569 HydrophobicContact CE1-CB 3.95Å; Y516-N575 HydrophobicContact CE1-CB 4.5Å; Y516-N575 PolarHBondContact OH-ND2 3.45Å
517	V	97.9	Very high	88.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145.2	179.9	-168.2	0	0	0	0	110.3	M480 I497 K532 T533 Y544 V564 S565 V566	M480-V517 HydrophobicContact CE-CG1 4.46Å; M480-V517 HydrophobicContact CE-CG2 3.45Å; M480-V517 VanDerWaalsContact CE-CG2 3.45Å; M480-V517 HydrophobicContact SD-CG2 4.32Å; I497-V517 HydrophobicContact CD1-CG1 4.45Å; I497-V517 HydrophobicContact CG2-CB 4.34Å; I497-V517 HydrophobicContact CG2-CG2 3.86Å; V517-K532 VanDerWaalsContact O-CA 3.28Å; V517-K532 WeakPolarHBondContact O-CA 3.3Å; V517-K532 VanDerWaalsContact O-CG 3.22Å; V517-K532 WeakPolarHBondContact O-CG 3.43Å; V517-T533 HydrophobicContact CB-CG2 3.93Å; V517-T533 HydrophobicContact CG2-CG2 4.25Å; V517-T533 PolarHBondContact N-OG1 2.92Å; V517-T533 PolarHBondContact O-N 2.76Å; V517-Y544 HydrophobicContact CG2-CD2 4.26Å; V517-Y544 HydrophobicContact CG2-CE1 4.26Å; V517-Y544 HydrophobicContact CG2-CE2 3.67Å; V517-V564 HydrophobicContact CG1-CG1 3.42Å; V517-V564 VanDerWaalsContact CG1-CG1 3.42Å; V517-S565 CarbonylContact C-O 3.44Å; V517-S565 WeakPolarHBondContact CA-O 3.33Å; V517-V566 HydrophobicContact CG2-CG2 4.5Å
518	K	96.2	Very high	88.3	Confident	12 Å²	12	47.3 Å²	47.3	5%	0.052	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.5	163.4	-54.1	171.2	-160.8	157.9	0	108.9	E465 Y516 R531 K532 S565 W567	E465-K518 VanDerWaalsContact CD-NZ 3.35Å; E465-K518 IonicContact OE1-NZ 3.73Å; E465-K518 PolarHBondContact OE1-NZ 2.9Å; E465-K518 IonicContact OE2-NZ 3.61Å; Y516-K518 HydrophobicContact CD2-CG 4.29Å; Y516-K518 HydrophobicContact CE2-CD 4.29Å; Y516-K518 HydrophobicContact CE2-CG 3.76Å; Y516-K518 WeakPolarHBondContact OH-CE 3.45Å; K518-R531 CarbonylContact C-O 3.5Å; K518-R531 VanDerWaalsContact CA-O 3.31Å; K518-R531 WeakPolarHBondContact CA-O 3.41Å; K518-K532 HydrophobicContact CG-CG 4.21Å; K518-S565 PolarHBondContact N-O 3.29Å; K518-S565 PolarHBondContact O-N 2.83Å; K518-S565 PolarHBondContact O-OG 2.56Å; K518-W567 HydrophobicContact CD-CG 4.35Å
519	C	95.3	Very high	88.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.5	168.9	-61.1	0	0	0	0	111.2	K530 R531 F548 Y550 L562 Q563	C519-K530 WeakPolarHBondContact O-CA 3.25Å; C519-R531 HydrophobicContact CB-CB 4.28Å; C519-R531 PolarHBondContact N-O 3.38Å; C519-R531 PolarHBondContact O-N 2.79Å; C519-F548 HydrophobicContact CB-CD2 3.97Å; C519-F548 HydrophobicContact CB-CE2 4.14Å; C519-F548 VanDerWaalsContact SG-CE2 3.55Å; C519-Y550 VanDerWaalsContact C-OH 3.32Å; C519-Y550 PolarHBondContact O-OH 3.25Å; C519-L562 HydrophobicContact CB-CD1 4.41Å; C519-Q563 CarbonylContact C-O 3.49Å; C519-Q563 VanDerWaalsContact CA-O 3.27Å; C519-Q563 WeakPolarHBondContact CA-O 3.15Å
520	Y	91.9	Very high	88.5	Confident	19 Å²	19	33.2 Å²	33.2	8%	0.075	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143	168.3	-66.1	-87.3	0	0	0	109.2	K530 Q563	Y520-K530 HydrophobicContact CD1-CB 4.09Å; Y520-K530 HydrophobicContact CE1-CB 3.58Å; Y520-K530 HydrophobicContact CE1-CD 4.16Å; Y520-K530 HydrophobicContact CE1-CG 3.86Å; Y520-K530 WeakPolarHBondContact OH-CD 3.44Å; Y520-Q563 PolarHBondContact N-O 2.6Å; Y520-Q563 PolarHBondContact O-N 2.98Å
521	L	90.9	Very high	88.9	Confident	7 Å²	7	27 Å²	27	4%	0.037	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	94.7	171	-168.5	62.5	0	0	0	108.9	L493 D524 S529 Y550 I552 R560 L585	L493-L521 HydrophobicContact CD2-CD1 3.89Å; L493-L521 HydrophobicContact CD2-CD2 4.42Å; L521-D524 WeakPolarHBondContact O-CB 2.79Å; L521-D524 PolarHBondContact O-N 3.08Å; L521-D524 VanDerWaalsContact O-N 3.09Å; L521-S529 PolarHBondContact N-OG 3.34Å; L521-Y550 HydrophobicContact CB-CD1 3.95Å; L521-Y550 HydrophobicContact CB-CE1 3.76Å; L521-Y550 HydrophobicContact CB-CG 4.47Å; L521-Y550 HydrophobicContact CD2-CD1 4.1Å; L521-Y550 HydrophobicContact CD2-CG 4.13Å; L521-I552 HydrophobicContact CD2-CD1 3.82Å; L521-I552 HydrophobicContact CD2-CG2 4.24Å; L521-R560 HydrophobicContact CD1-CB 3.8Å; L521-R560 HydrophobicContact CD1-CG 4.19Å; L521-R560 HydrophobicContact CD2-CG 4.41Å; L521-R560 HydrophobicContact CG-CB 4.2Å; L521-R560 HydrophobicContact CG-CG 4.1Å; L521-L585 HydrophobicContact CD1-CD1 3.8Å
522	L	87.9	Confident	89.2	Confident	17 Å²	17	26 Å²	26	9%	0.089	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	146.4	-171.1	-63.5	-174.9	0	0	0	112.3	R525 R560 T561 Q563 F582	L522-R525 HydrophobicContact CD2-CG 3.54Å; L522-R560 WeakPolarHBondContact O-CA 3.2Å; L522-R560 WeakPolarHBondContact O-CD 3.42Å; L522-T561 VanDerWaalsContact CB-O 3.25Å; L522-T561 WeakPolarHBondContact CB-O 3.44Å; L522-T561 PolarHBondContact N-O 2.93Å; L522-T561 PolarHBondContact O-N 3.31Å; L522-Q563 HydrophobicContact CD1-CB 3.84Å; L522-Q563 HydrophobicContact CD2-CB 4.46Å; L522-Q563 HydrophobicContact CG-CB 3.94Å; L522-F582 HydrophobicContact CD1-CD1 4.11Å; L522-F582 HydrophobicContact CD1-CE1 3.87Å
523	P	82.3	Confident	89.5	Confident	11 Å²	11	24.1 Å²	24.1	7%	0.071	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	cis	-87.6	13.6	9.5	33.8	-35.4	0	0	0	116.6	R525 T607 L611 I613	P523-R525 PolarHBondContact O-N 3.47Å; P523-T607 HydrophobicContact CB-CG2 3.8Å; P523-L611 HydrophobicContact CG-CB 4.25Å; P523-L611 WeakPolarHBondContact CG-O 3.28Å; P523-I613 HydrophobicContact CG-CD1 4.19Å; P523-I613 HydrophobicContact CG-CG1 4.25Å
524	D	78.6	Confident	89.5	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.13	C	C	.	.			trans	-75.3	107.4	174.1	-163.3	-35.3	0	0	0	111.1	L521 T526 S529 I613 R615 T650	L521-D524 WeakPolarHBondContact O-CB 2.79Å; L521-D524 PolarHBondContact O-N 3.08Å; L521-D524 VanDerWaalsContact O-N 3.09Å; D524-T526 VanDerWaalsContact OD1-CB 3.24Å; D524-T526 WeakPolarHBondContact OD1-CB 3.13Å; D524-T526 VanDerWaalsContact OD1-CG2 3.31Å; D524-T526 WeakPolarHBondContact OD1-CG2 3.46Å; D524-T526 PolarHBondContact OD1-N 3.11Å; D524-T526 PolarHBondContact OD1-OG1 2.87Å; D524-S529 VanDerWaalsContact CG-CB 3.41Å; D524-S529 WeakPolarHBondContact O-CB 3.33Å; D524-S529 PolarHBondContact O-OG 2.85Å; D524-S529 VanDerWaalsContact OD1-CB 3.26Å; D524-S529 WeakPolarHBondContact OD1-CB 3.47Å; D524-I613 HydrophobicContact CB-CD1 3.78Å; D524-R615 IonicContact OD1-NH2 2.69Å; D524-R615 IonicContact OD2-CZ 2.94Å; D524-R615 IonicContact OD2-NE 2.63Å; D524-R615 IonicContact OD2-NH2 2.68Å; D524-R615 PolarHBondContact OD2-NH2 2.9Å; D524-T650 HydrophobicContact CB-CG2 4.25Å; D524-T650 VanDerWaalsContact OD2-CG2 3.24Å; D524-T650 WeakPolarHBondContact OD2-CG2 3.48Å; D524-T650 PolarHBondContact OD2-OG1 3.12Å
525	R	80.1	Confident	89.5	Confident	98 Å²	98	29.9 Å²	29.9	37%	0.37	14%	0.14	S	C	.	.			trans	-104.6	11.3	173.6	-72.4	-172.6	160.7	-176	-5.3	113.4	L522 P523	L522-R525 HydrophobicContact CD2-CG 3.54Å; P523-R525 PolarHBondContact O-N 3.47Å
526	T	75.1	Confident	89.5	Confident	7 Å²	7	32.5 Å²	32.5	4%	0.043	15%	0.152	C	C	.	.	S	Bend	trans	-71.6	171.8	178	72.5	0	0	0	0	111.8	D524 G528 S529 K530 R615 F725	D524-T526 VanDerWaalsContact OD1-CB 3.24Å; D524-T526 WeakPolarHBondContact OD1-CB 3.13Å; D524-T526 VanDerWaalsContact OD1-CG2 3.31Å; D524-T526 WeakPolarHBondContact OD1-CG2 3.46Å; D524-T526 PolarHBondContact OD1-N 3.11Å; D524-T526 PolarHBondContact OD1-OG1 2.87Å; T526-G528 PolarHBondContact O-N 3.44Å; T526-G528 PolarHBondContact OG1-N 2.83Å; T526-S529 PolarHBondContact O-N 2.87Å; T526-K530 PolarHBondContact O-N 3.13Å; T526-R615 PolarHBondContact OG1-NH2 3.11Å; T526-F725 HydrophobicContact CG2-CD1 4.22Å
527	K	76.8	Confident	89.4	Confident	50 Å²	50	39.5 Å²	39.5	22%	0.217	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.8	173.2	-57.2	-163.5	-152.3	111.1	0	112.9	Y463 K530 S722 D724	Y463-K527 HydrophobicContact CE1-CG 3.95Å; Y463-K527 WeakPolarHBondContact OH-CE 3.15Å; Y463-K527 PolarHBondContact OH-NZ 3.02Å; K527-K530 PolarHBondContact O-N 2.92Å; K527-S722 PolarHBondContact NZ-O 2.97Å; K527-D724 VanDerWaalsContact CD-OD1 3.27Å; K527-D724 WeakPolarHBondContact CD-OD1 3.22Å; K527-D724 WeakPolarHBondContact CE-OD1 3.35Å; K527-D724 WeakPolarHBondContact CG-OD1 3.25Å; K527-D724 IonicContact NZ-OD1 2.65Å; K527-D724 PolarHBondContact NZ-OD1 2.88Å; K527-D724 IonicContact NZ-OD2 2.68Å
528	G	77.3	Confident	89.3	Confident	24 Å²	24	42.6 Å²	42.6	25%	0.247	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-36.8	179.1	0	0	0	0	0	113.4	T526 R531	T526-G528 PolarHBondContact O-N 3.44Å; T526-G528 PolarHBondContact OG1-N 2.83Å; G528-R531 PolarHBondContact O-NH1 2.88Å
529	S	84.2	Confident	89.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-23	173.9	171.1	0	0	0	0	113.3	L521 D524 T526 R531 Y550 T650	L521-S529 PolarHBondContact N-OG 3.34Å; D524-S529 VanDerWaalsContact CG-CB 3.41Å; D524-S529 WeakPolarHBondContact O-CB 3.33Å; D524-S529 PolarHBondContact O-OG 2.85Å; D524-S529 VanDerWaalsContact OD1-CB 3.26Å; D524-S529 WeakPolarHBondContact OD1-CB 3.47Å; T526-S529 PolarHBondContact O-N 2.87Å; S529-R531 PolarHBondContact O-N 2.82Å; S529-Y550 WeakPolarHBondContact O-CE1 3.47Å; S529-Y550 PolarHBondContact O-OH 2.81Å; S529-T650 PolarHBondContact N-OG1 2.97Å
530	K	90.2	Very high	89.4	Confident	79 Å²	79	45.3 Å²	45.3	34%	0.343	23%	0.226	S	C	.	.			trans	-68.9	123.5	-176.3	-170.4	173	64.6	-159.4	0	111.6	C519 Y520 T526 K527	C519-K530 WeakPolarHBondContact O-CA 3.25Å; Y520-K530 HydrophobicContact CD1-CB 4.09Å; Y520-K530 HydrophobicContact CE1-CB 3.58Å; Y520-K530 HydrophobicContact CE1-CD 4.16Å; Y520-K530 HydrophobicContact CE1-CG 3.86Å; Y520-K530 WeakPolarHBondContact OH-CD 3.44Å; T526-K530 PolarHBondContact O-N 3.13Å; K527-K530 PolarHBondContact O-N 2.92Å
531	R	94	Very high	89.7	Confident	51 Å²	51	48.7 Å²	48.7	19%	0.192	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150.9	164.2	-53.6	-72.5	-175.6	-95.9	-1.9	108.7	K518 C519 G528 S529 F548 K549 Y550 D651	K518-R531 CarbonylContact C-O 3.5Å; K518-R531 VanDerWaalsContact CA-O 3.31Å; K518-R531 WeakPolarHBondContact CA-O 3.41Å; C519-R531 HydrophobicContact CB-CB 4.28Å; C519-R531 PolarHBondContact N-O 3.38Å; C519-R531 PolarHBondContact O-N 2.79Å; G528-R531 PolarHBondContact O-NH1 2.88Å; S529-R531 PolarHBondContact O-N 2.82Å; R531-F548 HydrophobicContact CB-CB 3.94Å; R531-F548 HydrophobicContact CB-CD1 3.82Å; R531-F548 HydrophobicContact CB-CD2 3.58Å; R531-F548 HydrophobicContact CB-CE1 4.18Å; R531-F548 HydrophobicContact CB-CE2 3.96Å; R531-F548 HydrophobicContact CB-CG 3.5Å; R531-F548 HydrophobicContact CB-CZ 4.24Å; R531-F548 HydrophobicContact CG-CB 3.92Å; R531-F548 HydrophobicContact CG-CD2 4.42Å; R531-F548 HydrophobicContact CG-CG 4.08Å; R531-K549 VanDerWaalsContact CZ-O 3.28Å; R531-K549 PolarHBondContact NE-O 2.91Å; R531-K549 PolarHBondContact NH2-O 2.99Å; R531-Y550 HydrophobicContact CG-CE1 4.05Å; R531-Y550 HydrophobicContact CG-CE2 4Å; R531-Y550 WeakPolarHBondContact CG-OH 3.37Å; R531-D651 IonicContact CZ-OD2 2.72Å; R531-D651 IonicContact NH1-OD2 3.69Å; R531-D651 VanDerWaalsContact NH2-CG 3.27Å; R531-D651 IonicContact NH2-OD1 3.47Å; R531-D651 PolarHBondContact NH2-OD1 3.47Å; R531-D651 VanDerWaalsContact NH2-OD1 3.12Å; R531-D651 IonicContact NH2-OD2 2.67Å; R531-D651 PolarHBondContact NH2-OD2 2.88Å
532	K	95.4	Very high	90	Very high	92 Å²	92	48.4 Å²	48.4	40%	0.4	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	138.2	-177.2	-166.9	-157.8	128.4	136.5	0	111.1	Y516 V517 K518 F548	Y516-K532 HydrophobicContact CD2-CD 3.61Å; Y516-K532 HydrophobicContact CD2-CG 3.59Å; Y516-K532 HydrophobicContact CE2-CD 3.59Å; Y516-K532 HydrophobicContact CE2-CG 3.86Å; V517-K532 VanDerWaalsContact O-CA 3.28Å; V517-K532 WeakPolarHBondContact O-CA 3.3Å; V517-K532 VanDerWaalsContact O-CG 3.22Å; V517-K532 WeakPolarHBondContact O-CG 3.43Å; K518-K532 HydrophobicContact CG-CG 4.21Å; K532-F548 VanDerWaalsContact C-CZ 3.41Å
533	T	97.9	Very high	90.5	Very high	4 Å²	4	51 Å²	51	3%	0.025	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-76.7	168.8	174.8	62.8	0	0	0	0	112.6	I497 V517 Y544 E546 F548	I497-T533 HydrophobicContact CB-CG2 4.36Å; I497-T533 HydrophobicContact CG2-CG2 4.03Å; V517-T533 HydrophobicContact CB-CG2 3.93Å; V517-T533 HydrophobicContact CG2-CG2 4.25Å; V517-T533 PolarHBondContact N-OG1 2.92Å; V517-T533 PolarHBondContact O-N 2.76Å; T533-Y544 HydrophobicContact CG2-CD1 3.92Å; T533-Y544 HydrophobicContact CG2-CE1 4.46Å; T533-Y544 HydrophobicContact CG2-CG 4.22Å; T533-E546 WeakPolarHBondContact CA-OE2 3.45Å; T533-E546 WeakPolarHBondContact CB-OE2 3.36Å; T533-E546 HydrophobicContact CG2-CB 4.26Å; T533-F548 HydrophobicContact CG2-CE1 4.35Å; T533-F548 HydrophobicContact CG2-CE2 4.38Å; T533-F548 HydrophobicContact CG2-CZ 3.6Å
534	S	95.9	Very high	91.2	Very high	55 Å²	55	50.9 Å²	50.9	39%	0.385	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-54.2	156.6	151	74.5	0	0	0	0	111.3	K536 E546	S534-K536 VanDerWaalsContact OG-CE 3.26Å; S534-K536 WeakPolarHBondContact OG-CE 3.48Å; S534-E546 WeakPolarHBondContact CB-OE1 3.39Å; S534-E546 PolarHBondContact N-OE1 2.82Å; S534-E546 VanDerWaalsContact N-OE1 3.11Å; S534-E546 PolarHBondContact N-OE2 3.24Å; S534-E546 PolarHBondContact OG-OE1 2.99Å
535	Y	96	Very high	92.1	Very high	94 Å²	94	56.1 Å²	56.1	37%	0.369	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-97.5	133.6	170.5	78.1	-84.5	0	0	0	109.9	N514 P515 K537 H569	N514-Y535 HydrophobicContact CB-CD2 4.29Å; P515-Y535 WeakPolarHBondContact O-CA 3.49Å; Y535-K537 HydrophobicContact CD2-CG 4.42Å; Y535-K537 HydrophobicContact CE2-CG 3.86Å; Y535-H569 AromaticContact CD1-ND1 3.73Å; Y535-H569 HydrophobicContact CD2-CB 3.99Å; Y535-H569 AromaticContact CD2-ND1 3.63Å; Y535-H569 AromaticContact CE1-CE1 3.87Å; Y535-H569 AromaticContact CE1-ND1 3.62Å; Y535-H569 AromaticContact CE2-ND1 3.5Å; Y535-H569 HydrophobicContact CG-CB 3.94Å; Y535-H569 AromaticContact CG-CG 3.99Å; Y535-H569 AromaticContact CG-ND1 3.75Å; Y535-H569 AromaticContact CZ-CE1 3.94Å; Y535-H569 AromaticContact CZ-ND1 3.52Å
536	K	97.7	Very high	92.9	Very high	55 Å²	55	53.7 Å²	53.7	24%	0.239	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-88.3	152.4	172.7	-48.5	-64.2	164.5	147.4	0	108.2	N514 P515 S534 T539 P542 V543 Y544	N514-K536 CarbonylContact C-O 3.51Å; N514-K536 VanDerWaalsContact C-O 3.26Å; N514-K536 WeakPolarHBondContact CA-O 3.46Å; P515-K536 WeakPolarHBondContact CD-O 3.25Å; P515-K536 PolarHBondContact O-N 2.83Å; S534-K536 VanDerWaalsContact OG-CE 3.26Å; S534-K536 WeakPolarHBondContact OG-CE 3.48Å; K536-T539 HydrophobicContact CB-CG2 3.86Å; K536-P542 HydrophobicContact CB-CB 3.99Å; K536-P542 HydrophobicContact CG-CB 3.8Å; K536-V543 WeakPolarHBondContact CD-O 3.49Å; K536-V543 WeakPolarHBondContact CE-O 3.39Å; K536-V543 PolarHBondContact NZ-O 3.34Å; K536-Y544 HydrophobicContact CG-CD1 4.08Å; K536-Y544 HydrophobicContact CG-CE1 3.94Å; K536-Y544 PolarHBondContact NZ-O 3.07Å; K536-Y544 VanDerWaalsContact NZ-O 3.15Å
537	K	95.7	Very high	93.9	Very high	154 Å²	154	57.2 Å²	57.2	67%	0.67	30%	0.295	S	S	*	.	S	Bend	trans	-101.2	139.2	-174.8	-66.9	178	-178.1	174.2	0	110.7	Y535 T539	Y535-K537 HydrophobicContact CD2-CG 4.42Å; Y535-K537 HydrophobicContact CE2-CG 3.86Å; K537-T539 VanDerWaalsContact C-N 3.33Å; K537-T539 PolarHBondContact O-N 3.13Å; K537-T539 VanDerWaalsContact O-N 3.17Å
538	A	95	Very high	94.9	Very high	65 Å²	65	55.6 Å²	55.6	54%	0.537	29%	0.289	S	S	.	.	S	Bend	trans	44.1	48.8	169.4	0	0	0	0	0	115.1	I512 T513 N514	I512-A538 HydrophobicContact CB-CB 4.32Å; I512-A538 HydrophobicContact CG2-CB 4Å; T513-A538 CarbonylContact O-C 3.36Å; T513-A538 WeakPolarHBondContact O-CA 3.24Å; T513-A538 PolarHBondContact O-N 2.72Å; T513-A538 VanDerWaalsContact O-N 3.1Å; N514-A538 PolarHBondContact OD1-N 3.33Å
539	T	97.1	Very high	95.7	Very high	39 Å²	39	59.3 Å²	59.3	24%	0.239	30%	0.298	C	S	.	.			trans	-141.9	141.9	178.9	-178.6	0	0	0	0	112.2	T513 P515 K536 K537 N541 P542	T513-T539 PolarHBondContact O-N 2.8Å; P515-T539 VanDerWaalsContact CD-O 3.29Å; P515-T539 WeakPolarHBondContact CD-O 3.3Å; P515-T539 HydrophobicContact CG-CG2 4.17Å; P515-T539 WeakPolarHBondContact CG-O 3.32Å; K536-T539 HydrophobicContact CB-CG2 3.86Å; K537-T539 VanDerWaalsContact C-N 3.33Å; K537-T539 PolarHBondContact O-N 3.13Å; K537-T539 VanDerWaalsContact O-N 3.17Å; T539-N541 VanDerWaalsContact OG1-C 3.26Å; T539-N541 PolarHBondContact OG1-N 3.18Å; T539-N541 PolarHBondContact OG1-O 3.22Å; T539-P542 HydrophobicContact CG2-CB 3.96Å
540	C	96.8	Very high	96	Very high	29 Å²	29	59.4 Å²	59.4	20%	0.196	30%	0.298	C	S	.	.	S	Bend	trans	-98.7	-3	167.4	-68.6	0	0	0	0	112.9	N502 L503 P542	N502-C540 PolarHBondContact N-O 3.34Å; L503-C540 HydrophobicContact CB-CB 4.25Å; L503-C540 WeakPolarHBondContact CB-O 3.46Å; L503-C540 WeakPolarHBondContact CG-O 3.45Å; L503-C540 PolarHBondContact N-O 3.01Å; L503-C540 VanDerWaalsContact O-CB 3.25Å; L503-C540 WeakPolarHBondContact O-CB 3.25Å; L503-C540 PolarHBondContact O-SG 3.32Å; C540-P542 VanDerWaalsContact C-CD 3.45Å
541	N	97.8	Very high	95.9	Very high	90 Å²	90	59 Å²	59	48%	0.481	30%	0.298	S	S	.	.	S	Bend	trans	-126.7	68.3	176.8	-57.6	-52.4	0	0	0	109.5	A500 R501 N502 T539	A500-N541 CarbonylContact O-C 3.55Å; A500-N541 VanDerWaalsContact O-CA 3.25Å; A500-N541 WeakPolarHBondContact O-CA 3.15Å; R501-N541 VanDerWaalsContact CA-OD1 3.26Å; R501-N541 WeakPolarHBondContact CA-OD1 3.5Å; N502-N541 PolarHBondContact N-OD1 3.37Å; T539-N541 VanDerWaalsContact OG1-C 3.26Å; T539-N541 PolarHBondContact OG1-N 3.18Å; T539-N541 PolarHBondContact OG1-O 3.22Å
542	P	97.8	Very high	95.6	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.006	29%	0.293	C	S	.	.			trans	-76	131.1	-178.1	30.8	-36.6	0	0	0	112.4	Q499 A500 L503 P515 K536 T539 C540 Y544	Q499-P542 CarbonylContact C-O 3.57Å; Q499-P542 WeakPolarHBondContact CA-O 3.46Å; Q499-P542 WeakPolarHBondContact CB-O 3.23Å; A500-P542 HydrophobicContact CB-CG 3.86Å; A500-P542 PolarHBondContact N-O 2.72Å; A500-P542 WeakPolarHBondContact O-CD 3.47Å; L503-P542 HydrophobicContact CD1-CG 3.71Å; P515-P542 HydrophobicContact CB-CG 4.14Å; P515-P542 HydrophobicContact CG-CB 3.62Å; P515-P542 HydrophobicContact CG-CG 3.52Å; K536-P542 HydrophobicContact CB-CB 3.99Å; K536-P542 HydrophobicContact CG-CB 3.8Å; T539-P542 HydrophobicContact CG2-CB 3.96Å; C540-P542 VanDerWaalsContact C-CD 3.45Å; P542-Y544 HydrophobicContact CB-CD2 4.47Å; P542-Y544 HydrophobicContact CB-CE1 4.23Å; P542-Y544 HydrophobicContact CB-CE2 3.84Å; P542-Y544 HydrophobicContact CG-CE2 3.58Å; P542-Y544 WeakPolarHBondContact CG-OH 3.47Å
543	V	98.2	Very high	95.2	Very high	71 Å²	71	56.8 Å²	56.8	43%	0.43	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.2	161.9	-176.6	0	0	0	0	108.4	Q499 K536 D545	Q499-V543 HydrophobicContact CB-CB 4.48Å; Q499-V543 HydrophobicContact CB-CG2 4.16Å; K536-V543 WeakPolarHBondContact CD-O 3.49Å; K536-V543 WeakPolarHBondContact CE-O 3.39Å; K536-V543 PolarHBondContact NZ-O 3.34Å; V543-D545 WeakPolarHBondContact CG1-OD2 3.34Å
544	Y	97.9	Very high	94.7	Very high	9 Å²	9	61.2 Å²	61.2	4%	0.035	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-61.8	-179.7	-63.1	-75.8	0	0	0	111.5	M480 I497 K498 A500 P515 Y516 V517 T533 K536 P542	M480-Y544 HydrophobicContact CE-CE2 4.26Å; M480-Y544 HydrophobicContact SD-CE2 4.38Å; I497-Y544 HydrophobicContact CG2-CD2 3.77Å; I497-Y544 HydrophobicContact CG2-CE2 4.46Å; I497-Y544 HydrophobicContact CG2-CG 4.04Å; I497-Y544 WeakPolarHBondContact O-CB 3.22Å; K498-Y544 WeakPolarHBondContact O-CA 3.3Å; K498-Y544 PolarHBondContact O-N 2.73Å; A500-Y544 HydrophobicContact CB-CE2 4.48Å; P515-Y544 WeakPolarHBondContact CB-OH 3.14Å; P515-Y544 PolarHBondContact O-OH 3.33Å; Y516-Y544 PolarHBondContact N-OH 2.73Å; V517-Y544 HydrophobicContact CG2-CD2 4.26Å; V517-Y544 HydrophobicContact CG2-CE1 4.26Å; V517-Y544 HydrophobicContact CG2-CE2 3.67Å; T533-Y544 HydrophobicContact CG2-CD1 3.92Å; T533-Y544 HydrophobicContact CG2-CE1 4.46Å; T533-Y544 HydrophobicContact CG2-CG 4.22Å; K536-Y544 HydrophobicContact CG-CD1 4.08Å; K536-Y544 HydrophobicContact CG-CE1 3.94Å; K536-Y544 PolarHBondContact NZ-O 3.07Å; K536-Y544 VanDerWaalsContact NZ-O 3.15Å; P542-Y544 HydrophobicContact CB-CD2 4.47Å; P542-Y544 HydrophobicContact CB-CE1 4.23Å; P542-Y544 HydrophobicContact CB-CE2 3.84Å; P542-Y544 HydrophobicContact CG-CE2 3.58Å; P542-Y544 WeakPolarHBondContact CG-OH 3.47Å
545	D	97.1	Very high	94.2	Very high	112 Å²	112	65.1 Å²	65.1	60%	0.599	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.8	51.2	-169.9	-61.2	-39.8	0	0	0	113.4	I497 K498 V543	I497-D545 WeakPolarHBondContact O-CA 3.17Å; I497-D545 PolarHBondContact O-N 3.2Å; I497-D545 VanDerWaalsContact O-N 3.16Å; K498-D545 PolarHBondContact O-N 3.24Å; V543-D545 WeakPolarHBondContact CG1-OD2 3.34Å
546	E	97.8	Very high	93.7	Very high	47 Å²	47	63.1 Å²	63.1	22%	0.22	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.1	-179.2	-65.4	176.7	-126.5	0	0	110.3	I497 T533 S534	I497-E546 PolarHBondContact N-O 2.98Å; I497-E546 PolarHBondContact O-N 3.4Å; T533-E546 WeakPolarHBondContact CA-OE2 3.45Å; T533-E546 WeakPolarHBondContact CB-OE2 3.36Å; T533-E546 HydrophobicContact CG2-CB 4.26Å; S534-E546 WeakPolarHBondContact CB-OE1 3.39Å; S534-E546 PolarHBondContact N-OE1 2.82Å; S534-E546 VanDerWaalsContact N-OE1 3.11Å; S534-E546 PolarHBondContact N-OE2 3.24Å; S534-E546 PolarHBondContact OG-OE1 2.99Å
547	E	96.3	Very high	93.2	Very high	80 Å²	80	60.6 Å²	60.6	37%	0.374	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.2	175.9	-169	-173.1	67	0	0	111.3	R494 I495 K549	R494-E547 HydrophobicContact CB-CG 4.38Å; R494-E547 WeakPolarHBondContact CD-OE2 3.39Å; R494-E547 IonicContact CZ-OE2 3.55Å; R494-E547 IonicContact NH1-OE2 3.13Å; R494-E547 PolarHBondContact NH1-OE2 3.19Å; I495-E547 CarbonylContact O-C 3.41Å; I495-E547 WeakPolarHBondContact O-CA 3.47Å; E547-K549 WeakPolarHBondContact OE1-CE 3.32Å; E547-K549 IonicContact OE1-NZ 2.64Å; E547-K549 PolarHBondContact OE1-NZ 3Å
548	F	95.9	Very high	92.7	Very high	17 Å²	17	56.3 Å²	56.3	8%	0.075	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	148.2	169.1	-54.4	-36.4	0	0	0	111.5	R494 I495 I497 C519 R531 K532 T533	R494-F548 CarbonylContact C-O 3.46Å; R494-F548 WeakPolarHBondContact CA-O 3.36Å; I495-F548 HydrophobicContact CB-CB 4.33Å; I495-F548 PolarHBondContact N-O 3.07Å; I495-F548 PolarHBondContact O-N 3.18Å; I497-F548 HydrophobicContact CG1-CD2 4.06Å; I497-F548 HydrophobicContact CG1-CE2 3.73Å; I497-F548 HydrophobicContact CG1-CZ 4.38Å; C519-F548 HydrophobicContact CB-CD2 3.97Å; C519-F548 HydrophobicContact CB-CE2 4.14Å; C519-F548 VanDerWaalsContact SG-CE2 3.55Å; R531-F548 HydrophobicContact CB-CB 3.94Å; R531-F548 HydrophobicContact CB-CD1 3.82Å; R531-F548 HydrophobicContact CB-CD2 3.58Å; R531-F548 HydrophobicContact CB-CE1 4.18Å; R531-F548 HydrophobicContact CB-CE2 3.96Å; R531-F548 HydrophobicContact CB-CG 3.5Å; R531-F548 HydrophobicContact CB-CZ 4.24Å; R531-F548 HydrophobicContact CG-CB 3.92Å; R531-F548 HydrophobicContact CG-CD2 4.42Å; R531-F548 HydrophobicContact CG-CG 4.08Å; K532-F548 VanDerWaalsContact C-CZ 3.41Å; T533-F548 HydrophobicContact CG2-CE1 4.35Å; T533-F548 HydrophobicContact CG2-CE2 4.38Å; T533-F548 HydrophobicContact CG2-CZ 3.6Å
549	K	94.3	Very high	92.2	Very high	102 Å²	102	57.3 Å²	57.3	44%	0.443	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	141.7	178.1	-58.7	-171.7	178.1	-177.7	0	111.2	T492 L493 R494 R531 E547	T492-K549 HydrophobicContact CG2-CB 3.89Å; T492-K549 HydrophobicContact CG2-CD 4.29Å; T492-K549 HydrophobicContact CG2-CG 4.23Å; L493-K549 WeakPolarHBondContact O-CA 3.26Å; R494-K549 HydrophobicContact CG-CG 4.29Å; R531-K549 VanDerWaalsContact CZ-O 3.28Å; R531-K549 PolarHBondContact NE-O 2.91Å; R531-K549 PolarHBondContact NH2-O 2.99Å; E547-K549 WeakPolarHBondContact OE1-CE 3.32Å; E547-K549 IonicContact OE1-NZ 2.64Å; E547-K549 PolarHBondContact OE1-NZ 3Å
550	Y	92	Very high	91.7	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128	171.9	-68.2	-85.2	0	0	0	108.8	T492 L493 I495 C519 L521 S529 R531 L562 D651	T492-Y550 CarbonylContact C-O 3.57Å; T492-Y550 WeakPolarHBondContact CA-O 3.22Å; L493-Y550 HydrophobicContact CD2-CD2 4.48Å; L493-Y550 PolarHBondContact N-O 3.26Å; L493-Y550 PolarHBondContact O-N 2.82Å; I495-Y550 HydrophobicContact CG1-CD2 4.26Å; I495-Y550 HydrophobicContact CG1-CE2 4.17Å; C519-Y550 VanDerWaalsContact C-OH 3.32Å; C519-Y550 PolarHBondContact O-OH 3.25Å; L521-Y550 HydrophobicContact CB-CD1 3.95Å; L521-Y550 HydrophobicContact CB-CE1 3.76Å; L521-Y550 HydrophobicContact CB-CG 4.47Å; L521-Y550 HydrophobicContact CD2-CD1 4.1Å; L521-Y550 HydrophobicContact CD2-CG 4.13Å; S529-Y550 WeakPolarHBondContact O-CE1 3.47Å; S529-Y550 PolarHBondContact O-OH 2.81Å; R531-Y550 HydrophobicContact CG-CE1 4.05Å; R531-Y550 HydrophobicContact CG-CE2 4Å; R531-Y550 WeakPolarHBondContact CG-OH 3.37Å; Y550-L562 HydrophobicContact CE2-CD1 4.29Å; Y550-D651 WeakPolarHBondContact CA-OD1 3.31Å
551	H	88.1	Confident	91.5	Very high	71 Å²	71	57.2 Å²	57.2	33%	0.329	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	108.8	177.8	-59.4	-76.8	0	0	0	110.1	N491 T492 D651 G652	N491-H551 WeakPolarHBondContact O-CA 3.34Å; T492-H551 PolarHBondContact OG1-CE1 3.08Å; T492-H551 VanDerWaalsContact OG1-CE1 3.31Å; T492-H551 PolarHBondContact OG1-ND1 2.96Å; H551-D651 HydrophobicContact CB-CB 4.06Å; H551-D651 IonicContact CD2-OD1 3.44Å; H551-D651 PolarHBondContact N-OD1 3.23Å; H551-G652 PolarHBondContact O-N 3.2Å
552	I	86.6	Confident	91.3	Very high	19 Å²	19	52.9 Å²	52.9	10%	0.097	26%	0.263	C	S	.	.			trans	-156.1	140.7	-170.3	-178.5	166.2	0	0	0	109.8	Y486 N491 L493 L521 D556 L557 R560	Y486-I552 WeakPolarHBondContact CE2-O 3.49Å; Y486-I552 PolarHBondContact OH-O 3.45Å; N491-I552 CarbonylContact C-O 3.52Å; N491-I552 PolarHBondContact O-N 2.92Å; N491-I552 VanDerWaalsContact O-O 3.05Å; L493-I552 HydrophobicContact CB-CG2 4.08Å; L521-I552 HydrophobicContact CD2-CD1 3.82Å; L521-I552 HydrophobicContact CD2-CG2 4.24Å; I552-D556 HydrophobicContact CD1-CB 3.89Å; I552-D556 HydrophobicContact CG1-CB 3.77Å; I552-L557 HydrophobicContact CD1-CD2 4.29Å; I552-L557 HydrophobicContact CG1-CD2 4.45Å; I552-L557 HydrophobicContact CG2-CD2 3.63Å; I552-R560 HydrophobicContact CD1-CG 3.74Å
553	L	87.2	Confident	91.1	Very high	78 Å²	78	53.3 Å²	53.3	41%	0.408	27%	0.265	S	S	.	.			trans	-72.6	146.1	178.7	-59.1	175.9	0	0	0	111.4	N491 Q555 D556 L557	N491-L553 HydrophobicContact CB-CD2 4.2Å; L553-Q555 HydrophobicContact CB-CG 4.13Å; L553-Q555 PolarHBondContact O-N 3.06Å; L553-Q555 VanDerWaalsContact O-N 3.15Å; L553-D556 WeakPolarHBondContact O-CB 3.04Å; L553-D556 PolarHBondContact O-N 2.96Å; L553-L557 PolarHBondContact O-N 3.03Å
554	K	87.7	Confident	91	Very high	97 Å²	97	49.9 Å²	49.9	42%	0.422	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-37.6	-176.5	-157.8	179.1	-152.4	157.8	0	113.5	Y486 D488 D556 L557	Y486-K554 HydrophobicContact CD1-CB 4.47Å; Y486-K554 HydrophobicContact CD1-CD 4.16Å; Y486-K554 HydrophobicContact CD1-CG 4Å; Y486-K554 HydrophobicContact CE1-CB 3.67Å; Y486-K554 HydrophobicContact CE1-CD 3.94Å; Y486-K554 HydrophobicContact CE1-CG 3.68Å; Y486-K554 PolarHBondContact OH-N 3.19Å; D488-K554 VanDerWaalsContact OD1-CD 3.31Å; D488-K554 WeakPolarHBondContact OD1-CD 3.33Å; D488-K554 WeakPolarHBondContact OD1-CE 3.43Å; D488-K554 IonicContact OD1-NZ 3.12Å; D488-K554 PolarHBondContact OD1-NZ 2.86Å; D488-K554 IonicContact OD2-NZ 2.73Å; D488-K554 PolarHBondContact OD2-NZ 3.15Å; K554-D556 VanDerWaalsContact C-N 3.33Å; K554-D556 PolarHBondContact O-N 2.81Å; K554-L557 HydrophobicContact CG-CD1 4.16Å; K554-L557 WeakPolarHBondContact O-CB 3.06Å; K554-L557 PolarHBondContact O-N 3.5Å
555	Q	84.7	Confident	90.9	Very high	136 Å²	136	49.6 Å²	49.6	64%	0.636	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-39.2	176.5	71.5	-169.6	18	0	0	112.3	L553 L557 T558	L553-Q555 HydrophobicContact CB-CG 4.13Å; L553-Q555 PolarHBondContact O-N 3.06Å; L553-Q555 VanDerWaalsContact O-N 3.15Å; Q555-L557 VanDerWaalsContact C-N 3.33Å; Q555-L557 PolarHBondContact O-N 2.87Å; Q555-T558 WeakPolarHBondContact O-CG2 3.4Å; Q555-T558 PolarHBondContact O-N 2.83Å; Q555-T558 PolarHBondContact O-OG1 3.26Å
556	D	85.7	Confident	91	Very high	52 Å²	52	44.2 Å²	44.2	28%	0.278	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-75.3	-25.2	-173.9	-58.9	-29.2	0	0	0	111.7	I552 L553 K554 T558 L559 R560	I552-D556 HydrophobicContact CD1-CB 3.89Å; I552-D556 HydrophobicContact CG1-CB 3.77Å; L553-D556 WeakPolarHBondContact O-CB 3.04Å; L553-D556 PolarHBondContact O-N 2.96Å; K554-D556 VanDerWaalsContact C-N 3.33Å; K554-D556 PolarHBondContact O-N 2.81Å; D556-T558 PolarHBondContact O-N 2.95Å; D556-T558 VanDerWaalsContact O-N 3.16Å; D556-L559 PolarHBondContact O-N 3.49Å; D556-R560 WeakPolarHBondContact O-CG 3.48Å
557	L	88.4	Confident	90.9	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-52.9	-33.2	173.6	-62.4	172	0	0	0	111.8	Y486 L493 I552 L553 K554 Q555 L559 R560 L585 F590	Y486-L557 HydrophobicContact CD2-CD1 3.57Å; Y486-L557 HydrophobicContact CE2-CD1 3.8Å; Y486-L557 HydrophobicContact CG-CD1 4Å; L493-L557 HydrophobicContact CB-CD2 4.32Å; L493-L557 HydrophobicContact CD1-CD2 4.49Å; L493-L557 HydrophobicContact CD2-CD2 4.04Å; I552-L557 HydrophobicContact CD1-CD2 4.29Å; I552-L557 HydrophobicContact CG1-CD2 4.45Å; I552-L557 HydrophobicContact CG2-CD2 3.63Å; L553-L557 PolarHBondContact O-N 3.03Å; K554-L557 HydrophobicContact CG-CD1 4.16Å; K554-L557 WeakPolarHBondContact O-CB 3.06Å; K554-L557 PolarHBondContact O-N 3.5Å; Q555-L557 VanDerWaalsContact C-N 3.33Å; Q555-L557 PolarHBondContact O-N 2.87Å; L557-L559 PolarHBondContact O-N 2.83Å; L557-R560 PolarHBondContact O-N 2.85Å; L557-L585 HydrophobicContact CB-CB 4.39Å; L557-L585 HydrophobicContact CD2-CD1 4.07Å; L557-L585 WeakPolarHBondContact O-CB 3.26Å; L557-F590 HydrophobicContact CD1-CE1 4.39Å; L557-F590 HydrophobicContact CD1-CE2 4.01Å; L557-F590 HydrophobicContact CD1-CZ 3.71Å
558	T	84.9	Confident	90.8	Very high	65 Å²	65	38.7 Å²	38.7	40%	0.399	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-59.5	-24.1	-179.4	64.2	0	0	0	0	113.2	Q555 D556 T586	Q555-T558 WeakPolarHBondContact O-CG2 3.4Å; Q555-T558 PolarHBondContact O-N 2.83Å; Q555-T558 PolarHBondContact O-OG1 3.26Å; D556-T558 PolarHBondContact O-N 2.95Å; D556-T558 VanDerWaalsContact O-N 3.16Å; T558-T586 PolarHBondContact O-OG1 2.77Å
559	L	84.1	Confident	90.8	Very high	86 Å²	86	40.2 Å²	40.2	45%	0.45	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-104.2	22.4	-180	-53.7	-178.7	0	0	0	112.7	D556 L557 L611	D556-L559 PolarHBondContact O-N 3.49Å; L557-L559 PolarHBondContact O-N 2.83Å; L559-L611 HydrophobicContact CB-CD2 3.96Å; L559-L611 HydrophobicContact CD2-CD2 3.91Å; L559-L611 HydrophobicContact CG-CD2 4.48Å
560	R	87.2	Confident	90.4	Very high	35 Å²	35	38 Å²	38	13%	0.132	19%	0.189	C	C	.	.			trans	-124.9	149.5	-178.8	-58.7	-61.6	176.2	-112.8	-4.1	113.2	L521 L522 I552 D556 L557 L585	L521-R560 HydrophobicContact CD1-CB 3.8Å; L521-R560 HydrophobicContact CD1-CG 4.19Å; L521-R560 HydrophobicContact CD2-CG 4.41Å; L521-R560 HydrophobicContact CG-CB 4.2Å; L521-R560 HydrophobicContact CG-CG 4.1Å; L522-R560 WeakPolarHBondContact O-CA 3.2Å; L522-R560 WeakPolarHBondContact O-CD 3.42Å; I552-R560 HydrophobicContact CD1-CG 3.74Å; D556-R560 WeakPolarHBondContact O-CG 3.48Å; L557-R560 PolarHBondContact O-N 2.85Å; R560-L585 HydrophobicContact CB-CD1 4.23Å; R560-L585 PolarHBondContact O-N 3.29Å
561	T	91	Very high	90	Very high	30 Å²	30	42 Å²	42	18%	0.184	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.2	166.7	-61.3	0	0	0	0	108.5	L522 Q563 F582 L583	L522-T561 VanDerWaalsContact CB-O 3.25Å; L522-T561 WeakPolarHBondContact CB-O 3.44Å; L522-T561 PolarHBondContact N-O 2.93Å; L522-T561 PolarHBondContact O-N 3.31Å; T561-Q563 PolarHBondContact O-N 3.29Å; T561-F582 HydrophobicContact CG2-CB 3.91Å; T561-F582 HydrophobicContact CG2-CD1 4.07Å; T561-L583 WeakPolarHBondContact CA-O 3.33Å
562	L	94	Very high	89.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	117.3	170.4	179.7	70.4	0	0	0	108.6	M482 V484 I495 C519 Y550 V564 L583 L585	M482-L562 HydrophobicContact CE-CD2 3.87Å; V484-L562 HydrophobicContact CG2-CD2 4.1Å; I495-L562 HydrophobicContact CD1-CD1 4.2Å; I495-L562 HydrophobicContact CD1-CD2 3.57Å; I495-L562 HydrophobicContact CG1-CD1 4.13Å; I495-L562 HydrophobicContact CG1-CD2 4.11Å; I495-L562 HydrophobicContact CG2-CD2 4.17Å; C519-L562 HydrophobicContact CB-CD1 4.41Å; Y550-L562 HydrophobicContact CE2-CD1 4.29Å; L562-V564 HydrophobicContact CD1-CG2 4.45Å; L562-V564 HydrophobicContact CD2-CG2 3.88Å; L562-V564 HydrophobicContact CG-CG2 3.78Å; L562-L583 HydrophobicContact CB-CB 4.37Å; L562-L583 PolarHBondContact N-O 3.4Å; L562-L583 PolarHBondContact O-N 2.89Å; L562-L585 HydrophobicContact CB-CD2 4.39Å
563	Q	94.4	Very high	89.1	Confident	9 Å²	9	48.2 Å²	48.2	4%	0.042	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.7	171.2	-178.7	-179.8	3.9	0	0	108.5	C519 Y520 L522 T561 E580 I581 F582	C519-Q563 CarbonylContact C-O 3.49Å; C519-Q563 VanDerWaalsContact CA-O 3.27Å; C519-Q563 WeakPolarHBondContact CA-O 3.15Å; Y520-Q563 PolarHBondContact N-O 2.6Å; Y520-Q563 PolarHBondContact O-N 2.98Å; L522-Q563 HydrophobicContact CD1-CB 3.84Å; L522-Q563 HydrophobicContact CD2-CB 4.46Å; L522-Q563 HydrophobicContact CG-CB 3.94Å; T561-Q563 PolarHBondContact O-N 3.29Å; Q563-E580 PolarHBondContact NE2-OE2 3.05Å; Q563-I581 WeakPolarHBondContact CA-O 3.11Å; Q563-F582 HydrophobicContact CB-CD1 3.98Å; Q563-F582 HydrophobicContact CB-CE1 3.91Å; Q563-F582 VanDerWaalsContact CD-CE1 3.49Å; Q563-F582 HydrophobicContact CG-CD1 3.95Å; Q563-F582 HydrophobicContact CG-CE1 3.49Å; Q563-F582 VanDerWaalsContact CG-CE1 3.49Å; Q563-F582 HydrophobicContact CG-CZ 4.08Å
564	V	96.5	Very high	88.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.2	177	-174.7	0	0	0	0	108.2	M482 I497 V517 L562 E580 I581	M482-V564 HydrophobicContact CE-CG2 3.99Å; M482-V564 HydrophobicContact SD-CB 4.42Å; M482-V564 HydrophobicContact SD-CG1 4.2Å; M482-V564 HydrophobicContact SD-CG2 3.98Å; I497-V564 HydrophobicContact CD1-CG1 4.24Å; V517-V564 HydrophobicContact CG1-CG1 3.42Å; V517-V564 VanDerWaalsContact CG1-CG1 3.42Å; L562-V564 HydrophobicContact CD1-CG2 4.45Å; L562-V564 HydrophobicContact CD2-CG2 3.88Å; L562-V564 HydrophobicContact CG-CG2 3.78Å; V564-E580 CarbonylContact O-C 3.52Å; V564-E580 WeakPolarHBondContact O-CA 3.47Å; V564-E580 WeakPolarHBondContact O-CB 3.25Å; V564-I581 HydrophobicContact CB-CB 4.36Å; V564-I581 PolarHBondContact N-O 3.1Å; V564-I581 PolarHBondContact O-N 3.44Å
565	S	96.1	Very high	89	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.014	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.1	-174.1	57.4	0	0	0	0	111.9	V517 K518 W567	V517-S565 CarbonylContact C-O 3.44Å; V517-S565 WeakPolarHBondContact CA-O 3.33Å; K518-S565 PolarHBondContact N-O 3.29Å; K518-S565 PolarHBondContact O-N 2.83Å; K518-S565 PolarHBondContact O-OG 2.56Å; S565-W567 VanDerWaalsContact O-CD1 3.28Å; S565-W567 PolarHBondContact OG-NE1 2.74Å
566	V	97.6	Very high	89.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	141.2	-176.4	-169.4	0	0	0	0	110	M480 L503 P515 Y516 V517 L578 G579 L599	M480-V566 HydrophobicContact CE-CG2 3.44Å; M480-V566 VanDerWaalsContact CE-CG2 3.44Å; L503-V566 HydrophobicContact CD1-CG1 4Å; L503-V566 HydrophobicContact CD2-CG1 4.23Å; P515-V566 HydrophobicContact CB-CG1 4.35Å; Y516-V566 CarbonylContact O-C 3.58Å; Y516-V566 WeakPolarHBondContact O-CA 3.31Å; V517-V566 HydrophobicContact CG2-CG2 4.5Å; V566-L578 HydrophobicContact CB-CB 4.14Å; V566-L578 HydrophobicContact CG1-CB 4.09Å; V566-L578 HydrophobicContact CG1-CD1 4.23Å; V566-L578 PolarHBondContact O-N 3.06Å; V566-G579 PolarHBondContact N-O 2.87Å; V566-L599 HydrophobicContact CB-CD1 4.41Å; V566-L599 HydrophobicContact CG2-CD1 3.97Å; V566-L599 HydrophobicContact CG2-CD2 3.66Å
567	W	96.3	Very high	89.7	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	136.1	-166.8	-67.1	87.5	0	0	0	112.6	E465 C469 Y470 P515 Y516 K518 S565 N575 L576 F577	E465-W567 WeakPolarHBondContact OE2-CH2 3.22Å; E465-W567 WeakPolarHBondContact OE2-CZ2 3.39Å; C469-W567 HydrophobicContact CB-CZ3 4.18Å; Y470-W567 HydrophobicContact CD1-CH2 4.27Å; Y470-W567 AromaticContact CE1-CH2 3.58Å; Y470-W567 HydrophobicContact CE1-CH2 3.58Å; Y470-W567 HydrophobicContact CE1-CZ2 4.11Å; P515-W567 CarbonylContact C-O 3.57Å; P515-W567 VanDerWaalsContact CA-O 3.29Å; P515-W567 WeakPolarHBondContact CA-O 3.26Å; Y516-W567 HydrophobicContact CD1-CB 3.85Å; Y516-W567 VanDerWaalsContact CD1-O 3.22Å; Y516-W567 WeakPolarHBondContact CD1-O 3.44Å; Y516-W567 HydrophobicContact CD2-CB 4.2Å; Y516-W567 HydrophobicContact CE1-CB 3.43Å; Y516-W567 VanDerWaalsContact CE1-CB 3.43Å; Y516-W567 HydrophobicContact CE1-CG 4.48Å; Y516-W567 HydrophobicContact CE2-CB 3.82Å; Y516-W567 HydrophobicContact CE2-CG 4.17Å; Y516-W567 HydrophobicContact CG-CB 4.23Å; Y516-W567 VanDerWaalsContact CZ-CB 3.41Å; Y516-W567 PolarHBondContact N-O 3.19Å; Y516-W567 PolarHBondContact O-N 3.16Å; K518-W567 HydrophobicContact CD-CG 4.35Å; S565-W567 VanDerWaalsContact O-CD1 3.28Å; S565-W567 PolarHBondContact OG-NE1 2.74Å; W567-N575 HydrophobicContact CE3-CB 4.32Å; W567-L576 CarbonylContact C-O 3.54Å; W567-L576 WeakPolarHBondContact CA-O 3.36Å; W567-F577 HydrophobicContact CE3-CB 4.28Å; W567-F577 HydrophobicContact CH2-CB 4.1Å; W567-F577 AromaticContact CH2-CD2 3.94Å; W567-F577 HydrophobicContact CH2-CD2 3.94Å; W567-F577 AromaticContact CZ2-CD2 3.72Å; W567-F577 HydrophobicContact CZ2-CD2 3.72Å; W567-F577 HydrophobicContact CZ2-CE2 4.49Å; W567-F577 HydrophobicContact CZ3-CB 3.9Å; W567-F577 HydrophobicContact CZ3-CD2 4.47Å
568	H	95.1	Very high	90.1	Very high	7 Å²	7	38.1 Å²	38.1	3%	0.032	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	122.2	166.5	179.6	102.7	0	0	0	109.9	A506 N514 N570 N575 L576 L578	A506-H568 HydrophobicContact CB-CB 3.87Å; A506-H568 VanDerWaalsContact CB-ND1 3.3Å; A506-H568 WeakPolarHBondContact CB-ND1 3.42Å; N514-H568 PolarHBondContact N-ND1 3.13Å; H568-N570 PolarHBondContact O-N 2.72Å; H568-N575 WeakPolarHBondContact O-CA 3.38Å; H568-N575 VanDerWaalsContact O-CB 3.3Å; H568-N575 WeakPolarHBondContact O-CB 3.25Å; H568-N575 PolarHBondContact O-OD1 3.15Å; H568-L576 HydrophobicContact CB-CB 4.16Å; H568-L576 PolarHBondContact N-O 2.85Å; H568-L576 PolarHBondContact O-N 2.99Å; H568-L578 HydrophobicContact CB-CD1 4.04Å; H568-L578 HydrophobicContact CB-CD2 4.33Å; H568-L578 HydrophobicContact CB-CG 4.3Å
569	H	94.4	Very high	90.6	Very high	48 Å²	48	35 Å²	35	22%	0.222	20%	0.204	C	C	.	.			trans	-77.2	116.3	170.5	179.8	-121.2	0	0	0	111.8	N514 Y516 Y535 N575	N514-H569 HydrophobicContact CB-CB 4.22Å; N514-H569 PolarHBondContact ND2-O 3.35Å; N514-H569 PolarHBondContact O-N 2.95Å; Y516-H569 HydrophobicContact CD1-CB 3.83Å; Y516-H569 HydrophobicContact CE1-CB 3.95Å; Y535-H569 AromaticContact CD1-ND1 3.73Å; Y535-H569 HydrophobicContact CD2-CB 3.99Å; Y535-H569 AromaticContact CD2-ND1 3.63Å; Y535-H569 AromaticContact CE1-CE1 3.87Å; Y535-H569 AromaticContact CE1-ND1 3.62Å; Y535-H569 AromaticContact CE2-ND1 3.5Å; Y535-H569 HydrophobicContact CG-CB 3.94Å; Y535-H569 AromaticContact CG-CG 3.99Å; Y535-H569 AromaticContact CG-ND1 3.75Å; Y535-H569 AromaticContact CZ-CE1 3.94Å; Y535-H569 AromaticContact CZ-ND1 3.52Å; H569-N575 WeakPolarHBondContact CA-OD1 3.48Å
570	N	87	Confident	91.1	Very high	56 Å²	56	31.1 Å²	31.1	30%	0.299	18%	0.183	S	C	.	.			trans	-114.4	112.1	179.7	-168.8	-8.8	0	0	0	111	H568 L572 L574 N575	H568-N570 PolarHBondContact O-N 2.72Å; N570-L572 VanDerWaalsContact C-N 3.29Å; N570-L572 PolarHBondContact O-N 3.24Å; N570-L572 PolarHBondContact OD1-N 3.4Å; N570-L574 VanDerWaalsContact CB-O 3.25Å; N570-L574 WeakPolarHBondContact CB-O 3.27Å; N570-L574 PolarHBondContact ND2-O 3Å; N570-N575 PolarHBondContact N-OD1 2.71Å
571	A	83.8	Confident	91.5	Very high	85 Å²	85	30 Å²	30	70%	0.702	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.2	-172.5	0	0	0	0	0	114.8
572	L	77.5	Confident	91.6	Very high	175 Å²	175	30.8 Å²	30.8	92%	0.916	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127	21.4	-175.5	-63.5	176.6	0	0	0	112.7	N570	N570-L572 VanDerWaalsContact C-N 3.29Å; N570-L572 PolarHBondContact O-N 3.24Å; N570-L572 PolarHBondContact OD1-N 3.4Å
573	G	77.3	Confident	91.5	Very high	45 Å²	45	31.8 Å²	31.8	46%	0.464	19%	0.186	S	C	.	.	S	Bend	trans	-160.5	-163.1	-174.6	0	0	0	0	0	113.5
574	L	81.7	Confident	91.4	Very high	66 Å²	66	34.9 Å²	34.9	35%	0.346	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-76.6	142.7	170.6	-62.1	176.2	0	0	0	109.9	S468 N570	S468-L574 WeakPolarHBondContact OG-CD1 3.47Å; N570-L574 VanDerWaalsContact CB-O 3.25Å; N570-L574 WeakPolarHBondContact CB-O 3.27Å; N570-L574 PolarHBondContact ND2-O 3Å
575	N	90.4	Very high	91.2	Very high	50 Å²	50	35 Å²	35	27%	0.267	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-69	135.1	166.6	-60.3	-53.6	0	0	0	108.6	Y516 W567 H568 H569 N570	Y516-N575 HydrophobicContact CE1-CB 4.5Å; Y516-N575 PolarHBondContact OH-ND2 3.45Å; W567-N575 HydrophobicContact CE3-CB 4.32Å; H568-N575 WeakPolarHBondContact O-CA 3.38Å; H568-N575 VanDerWaalsContact O-CB 3.3Å; H568-N575 WeakPolarHBondContact O-CB 3.25Å; H568-N575 PolarHBondContact O-OD1 3.15Å; H569-N575 WeakPolarHBondContact CA-OD1 3.48Å; N570-N575 PolarHBondContact N-OD1 2.71Å
576	L	92	Very high	90.6	Very high	33 Å²	33	37.8 Å²	37.8	17%	0.173	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	143	-176.5	-50.7	-179.9	0	0	0	110	H472 I474 W567 H568	H472-L576 HydrophobicContact CB-CD2 4.23Å; I474-L576 HydrophobicContact CD1-CB 4.18Å; I474-L576 HydrophobicContact CD1-CD1 3.89Å; W567-L576 CarbonylContact C-O 3.54Å; W567-L576 WeakPolarHBondContact CA-O 3.36Å; H568-L576 HydrophobicContact CB-CB 4.16Å; H568-L576 PolarHBondContact N-O 2.85Å; H568-L576 PolarHBondContact O-N 2.99Å
577	F	94	Very high	89.7	Confident	4 Å²	4	47 Å²	47	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	139.5	178.5	178.1	-98.9	0	0	0	111.1	C469 Y470 H472 I476 W567 G579 E580 H602	C469-F577 WeakPolarHBondContact O-CB 3.26Å; C469-F577 PolarHBondContact O-N 2.92Å; Y470-F577 HydrophobicContact CD1-CB 3.74Å; Y470-F577 HydrophobicContact CD1-CD1 4.27Å; Y470-F577 AromaticContact CD1-CD2 3.83Å; Y470-F577 HydrophobicContact CD1-CD2 3.83Å; Y470-F577 HydrophobicContact CD1-CE2 4.45Å; Y470-F577 AromaticContact CD1-CG 3.71Å; Y470-F577 HydrophobicContact CD1-CG 3.71Å; Y470-F577 HydrophobicContact CE1-CB 4.38Å; Y470-F577 AromaticContact CE1-CD2 3.85Å; Y470-F577 HydrophobicContact CE1-CD2 3.85Å; Y470-F577 HydrophobicContact CE1-CE2 4.35Å; Y470-F577 HydrophobicContact CE1-CG 4.22Å; H472-F577 PolarHBondContact NE2-O 2.93Å; I476-F577 HydrophobicContact CD1-CD1 3.92Å; I476-F577 HydrophobicContact CD1-CE1 4.09Å; I476-F577 HydrophobicContact CG1-CE1 4.35Å; W567-F577 HydrophobicContact CE3-CB 4.28Å; W567-F577 HydrophobicContact CH2-CB 4.1Å; W567-F577 AromaticContact CH2-CD2 3.94Å; W567-F577 HydrophobicContact CH2-CD2 3.94Å; W567-F577 AromaticContact CZ2-CD2 3.72Å; W567-F577 HydrophobicContact CZ2-CD2 3.72Å; W567-F577 HydrophobicContact CZ2-CE2 4.49Å; W567-F577 HydrophobicContact CZ3-CB 3.9Å; W567-F577 HydrophobicContact CZ3-CD2 4.47Å; F577-G579 VanDerWaalsContact CE1-N 3.33Å; F577-E580 HydrophobicContact CE2-CB 3.91Å; F577-E580 HydrophobicContact CE2-CG 4.17Å; F577-E580 HydrophobicContact CZ-CB 3.86Å; F577-E580 HydrophobicContact CZ-CG 3.83Å; F577-H602 HydrophobicContact CD1-CB 4.33Å; F577-H602 HydrophobicContact CE1-CB 3.76Å; F577-H602 HydrophobicContact CE2-CB 4.25Å; F577-H602 HydrophobicContact CZ-CB 3.7Å
578	L	95.7	Very high	89	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	13.6	-178.6	-56.6	176.6	0	0	0	113	I474 A506 T513 P515 V566 H568	I474-L578 HydrophobicContact CD1-CD2 4.4Å; A506-L578 HydrophobicContact CB-CD2 3.96Å; T513-L578 HydrophobicContact CG2-CD1 3.51Å; P515-L578 HydrophobicContact CB-CD1 4.35Å; V566-L578 HydrophobicContact CB-CB 4.14Å; V566-L578 HydrophobicContact CG1-CB 4.09Å; V566-L578 HydrophobicContact CG1-CD1 4.23Å; V566-L578 PolarHBondContact O-N 3.06Å; H568-L578 HydrophobicContact CB-CD1 4.04Å; H568-L578 HydrophobicContact CB-CD2 4.33Å; H568-L578 HydrophobicContact CB-CG 4.3Å
579	G	95.5	Very high	88.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	113.6	161.6	177.8	0	0	0	0	0	113.8	V566 F577 G600	V566-G579 PolarHBondContact N-O 2.87Å; F577-G579 VanDerWaalsContact CE1-N 3.33Å; G579-G600 CarbonylContact C-O 3.59Å; G579-G600 WeakPolarHBondContact CA-O 3.35Å
580	E	96.1	Very high	88.1	Confident	5 Å²	5	56.1 Å²	56.1	2%	0.023	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	163.9	178.5	73.9	-169.6	162.7	0	0	114.3	Q563 V564 F577 F582 G600 H602 R603	Q563-E580 PolarHBondContact NE2-OE2 3.05Å; V564-E580 CarbonylContact O-C 3.52Å; V564-E580 WeakPolarHBondContact O-CA 3.47Å; V564-E580 WeakPolarHBondContact O-CB 3.25Å; F577-E580 HydrophobicContact CE2-CB 3.91Å; F577-E580 HydrophobicContact CE2-CG 4.17Å; F577-E580 HydrophobicContact CZ-CB 3.86Å; F577-E580 HydrophobicContact CZ-CG 3.83Å; E580-F582 VanDerWaalsContact CD-CZ 3.47Å; E580-F582 HydrophobicContact CG-CD2 4.25Å; E580-F582 HydrophobicContact CG-CE2 3.66Å; E580-F582 HydrophobicContact CG-CZ 4.19Å; E580-F582 WeakPolarHBondContact OE1-CE2 3.47Å; E580-F582 VanDerWaalsContact OE1-CZ 3.27Å; E580-F582 WeakPolarHBondContact OE1-CZ 3.39Å; E580-G600 PolarHBondContact N-O 3.42Å; E580-G600 PolarHBondContact O-N 2.8Å; E580-H602 VanDerWaalsContact OE1-CA 3.3Å; E580-H602 WeakPolarHBondContact OE1-CA 3.32Å; E580-H602 IonicContact OE1-CE1 3.35Å; E580-H602 IonicContact OE1-CG 3.47Å; E580-H602 IonicContact OE1-ND1 3.91Å; E580-H602 PolarHBondContact OE1-ND1 3.34Å; E580-H602 IonicContact OE2-ND1 3.43Å; E580-R603 PolarHBondContact OE1-N 3.2Å
581	I	95.4	Very high	88	Confident	12 Å²	12	56.5 Å²	56.5	6%	0.062	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.5	177.3	-63.1	144.2	0	0	0	106.9	M480 Q563 V564 Y597 L599	M480-I581 HydrophobicContact CB-CD1 3.71Å; M480-I581 HydrophobicContact CG-CD1 4.49Å; Q563-I581 WeakPolarHBondContact CA-O 3.11Å; V564-I581 HydrophobicContact CB-CB 4.36Å; V564-I581 PolarHBondContact N-O 3.1Å; V564-I581 PolarHBondContact O-N 3.44Å; I581-Y597 HydrophobicContact CD1-CG 4.49Å; I581-Y597 HydrophobicContact CG2-CD1 4.17Å; I581-Y597 HydrophobicContact CG2-CG 4.33Å; I581-L599 HydrophobicContact CD1-CD2 3.72Å; I581-L599 HydrophobicContact CG1-CD2 4.04Å
582	F	92.9	Very high	88	Confident	45 Å²	45	60.1 Å²	60.1	20%	0.197	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.7	166.7	-66.7	-82.7	0	0	0	108.3	L522 T561 Q563 E580 R603 L605	L522-F582 HydrophobicContact CD1-CD1 4.11Å; L522-F582 HydrophobicContact CD1-CE1 3.87Å; T561-F582 HydrophobicContact CG2-CB 3.91Å; T561-F582 HydrophobicContact CG2-CD1 4.07Å; Q563-F582 HydrophobicContact CB-CD1 3.98Å; Q563-F582 HydrophobicContact CB-CE1 3.91Å; Q563-F582 VanDerWaalsContact CD-CE1 3.49Å; Q563-F582 HydrophobicContact CG-CD1 3.95Å; Q563-F582 HydrophobicContact CG-CE1 3.49Å; Q563-F582 VanDerWaalsContact CG-CE1 3.49Å; Q563-F582 HydrophobicContact CG-CZ 4.08Å; E580-F582 VanDerWaalsContact CD-CZ 3.47Å; E580-F582 HydrophobicContact CG-CD2 4.25Å; E580-F582 HydrophobicContact CG-CE2 3.66Å; E580-F582 HydrophobicContact CG-CZ 4.19Å; E580-F582 WeakPolarHBondContact OE1-CE2 3.47Å; E580-F582 VanDerWaalsContact OE1-CZ 3.27Å; E580-F582 WeakPolarHBondContact OE1-CZ 3.39Å; F582-R603 HydrophobicContact CE2-CB 3.95Å; F582-L605 HydrophobicContact CD1-CD1 3.45Å; F582-L605 VanDerWaalsContact CD1-CD1 3.45Å; F582-L605 HydrophobicContact CD1-CG 4.46Å; F582-L605 HydrophobicContact CD2-CD1 4.25Å; F582-L605 HydrophobicContact CE1-CD1 3.48Å; F582-L605 VanDerWaalsContact CE1-CD1 3.48Å; F582-L605 HydrophobicContact CE1-CG 4.12Å; F582-L605 HydrophobicContact CE2-CD1 4.28Å; F582-L605 HydrophobicContact CE2-CG 4.39Å; F582-L605 HydrophobicContact CG-CD1 3.84Å; F582-L605 HydrophobicContact CZ-CD1 3.92Å; F582-L605 HydrophobicContact CZ-CG 4.08Å
583	L	92.4	Very high	88.6	Confident	22 Å²	22	53.9 Å²	53.9	12%	0.115	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	98	178.9	-178.4	65.3	0	0	0	109.3	V484 T561 L562 L585 Y597	V484-L583 HydrophobicContact CB-CD2 4.44Å; V484-L583 HydrophobicContact CG1-CD2 4.35Å; V484-L583 HydrophobicContact CG2-CD2 3.9Å; T561-L583 WeakPolarHBondContact CA-O 3.33Å; L562-L583 HydrophobicContact CB-CB 4.37Å; L562-L583 PolarHBondContact N-O 3.4Å; L562-L583 PolarHBondContact O-N 2.89Å; L583-L585 HydrophobicContact CD2-CD2 4.23Å; L583-L585 HydrophobicContact CG-CD2 4.17Å; L583-L585 PolarHBondContact O-N 2.79Å; L583-Y597 HydrophobicContact CD1-CE1 4.13Å; L583-Y597 HydrophobicContact CD2-CE1 4.41Å
584	P	91.8	Very high	89.4	Confident	73 Å²	73	53.5 Å²	53.5	47%	0.474	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	128.2	170.5	-20.8	33.4	0	0	0	109.8	T586	P584-T586 VanDerWaalsContact C-N 3.35Å
585	L	91.6	Very high	90	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	28%	0.277	C	S	.	.			trans	-89.5	-2.6	-174.9	-59.7	-178.3	0	0	0	113.1	V484 L493 L521 L557 R560 L562 L583 F587 H588 F590	V484-L585 HydrophobicContact CG1-CD2 4.2Å; L493-L585 HydrophobicContact CD2-CD1 3.62Å; L521-L585 HydrophobicContact CD1-CD1 3.8Å; L557-L585 HydrophobicContact CB-CB 4.39Å; L557-L585 HydrophobicContact CD2-CD1 4.07Å; L557-L585 WeakPolarHBondContact O-CB 3.26Å; R560-L585 HydrophobicContact CB-CD1 4.23Å; R560-L585 PolarHBondContact O-N 3.29Å; L562-L585 HydrophobicContact CB-CD2 4.39Å; L583-L585 HydrophobicContact CD2-CD2 4.23Å; L583-L585 HydrophobicContact CG-CD2 4.17Å; L583-L585 PolarHBondContact O-N 2.79Å; L585-F587 VanDerWaalsContact C-N 3.27Å; L585-F587 PolarHBondContact O-N 2.88Å; L585-H588 HydrophobicContact CD2-CB 4.18Å; L585-H588 PolarHBondContact O-N 3.34Å; L585-F590 HydrophobicContact CB-CZ 4.33Å; L585-F590 HydrophobicContact CD2-CE1 4.36Å; L585-F590 HydrophobicContact CD2-CZ 4.5Å
586	T	85	Confident	90.3	Very high	60 Å²	60	56 Å²	56	37%	0.368	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-36.7	-179	-41.2	0	0	0	0	114.8	T558 P584	T558-T586 PolarHBondContact O-OG1 2.77Å; P584-T586 VanDerWaalsContact C-N 3.35Å
587	F	77	Confident	90.6	Very high	192 Å²	192	56.4 Å²	56.4	84%	0.842	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.5	21.7	-179.4	-52.5	-65	0	0	0	112	L585 Q589	L585-F587 VanDerWaalsContact C-N 3.27Å; L585-F587 PolarHBondContact O-N 2.88Å; F587-Q589 PolarHBondContact O-N 3.5Å
588	H	83.1	Confident	90.7	Very high	35 Å²	35	61.4 Å²	61.4	16%	0.162	31%	0.311	C	S	.	.			trans	-75.9	126.1	-175.9	-169.5	58.5	0	0	0	111	V484 L585 F590	V484-H588 WeakPolarHBondContact CB-NE2 3.23Å; L585-H588 HydrophobicContact CD2-CB 4.18Å; L585-H588 PolarHBondContact O-N 3.34Å; H588-F590 HydrophobicContact CB-CE1 4.49Å; H588-F590 HydrophobicContact CB-CE2 4.5Å; H588-F590 HydrophobicContact CB-CZ 4.22Å; H588-F590 AromaticContact CD2-CD1 3.74Å; H588-F590 AromaticContact CD2-CE1 3.75Å; H588-F590 VanDerWaalsContact O-CD2 3.24Å; H588-F590 WeakPolarHBondContact O-CD2 3.39Å; H588-F590 WeakPolarHBondContact O-CE2 3.49Å; H588-F590 PolarHBondContact O-N 3.37Å
589	Q	83.9	Confident	90.8	Very high	161 Å²	161	61.9 Å²	61.9	75%	0.752	31%	0.313	S	S	*	.			trans	-79.8	102.1	173.7	-69	-179.6	-21.1	0	0	108.5	F587 D591	F587-Q589 PolarHBondContact O-N 3.5Å; Q589-D591 PolarHBondContact O-N 2.86Å
590	F	86.3	Confident	90.7	Very high	56 Å²	56	63.1 Å²	63.1	25%	0.246	33%	0.326	C	S	.	.			trans	-74	68.3	179.5	-60.7	-79.1	0	0	0	111.6	V484 L493 L557 L585 H588	V484-F590 HydrophobicContact CG1-CD1 4.28Å; V484-F590 HydrophobicContact CG1-CE1 4.13Å; V484-F590 WeakPolarHBondContact O-CD1 3.34Å; L493-F590 HydrophobicContact CD1-CD1 4.14Å; L493-F590 HydrophobicContact CD1-CE1 3.62Å; L557-F590 HydrophobicContact CD1-CE1 4.39Å; L557-F590 HydrophobicContact CD1-CE2 4.01Å; L557-F590 HydrophobicContact CD1-CZ 3.71Å; L585-F590 HydrophobicContact CB-CZ 4.33Å; L585-F590 HydrophobicContact CD2-CE1 4.36Å; L585-F590 HydrophobicContact CD2-CZ 4.5Å; H588-F590 HydrophobicContact CB-CE1 4.49Å; H588-F590 HydrophobicContact CB-CE2 4.5Å; H588-F590 HydrophobicContact CB-CZ 4.22Å; H588-F590 AromaticContact CD2-CD1 3.74Å; H588-F590 AromaticContact CD2-CE1 3.75Å; H588-F590 VanDerWaalsContact O-CD2 3.24Å; H588-F590 WeakPolarHBondContact O-CD2 3.39Å; H588-F590 WeakPolarHBondContact O-CE2 3.49Å; H588-F590 PolarHBondContact O-N 3.37Å
591	D	85.3	Confident	90.5	Very high	63 Å²	63	67.6 Å²	67.6	34%	0.337	35%	0.347	S	S	.	.			trans	-81.2	-178.7	169.7	69.7	31.8	0	0	0	112	Q589 A593 H595	Q589-D591 PolarHBondContact O-N 2.86Å; D591-A593 WeakPolarHBondContact OD1-CA 3.39Å; D591-A593 VanDerWaalsContact OD1-CB 3.28Å; D591-A593 WeakPolarHBondContact OD1-CB 3.31Å; D591-A593 PolarHBondContact OD1-N 3.04Å; D591-H595 IonicContact OD1-CE1 3.86Å; D591-H595 IonicContact OD2-CE1 3.67Å; D591-H595 PolarHBondContact OD2-CE1 2.9Å
592	Q	82.6	Confident	90.1	Very high	161 Å²	161	68.8 Å²	68.8	75%	0.752	35%	0.352	S	S	*	.	S	Bend	trans	-98.5	4.3	173.8	-59.2	-173	13.1	0	0	112.7	I485	I485-Q592 HydrophobicContact CD1-CB 4.49Å; I485-Q592 HydrophobicContact CD1-CG 4.5Å; I485-Q592 HydrophobicContact CG2-CG 4.49Å
593	A	90.5	Very high	89.2	Confident	44 Å²	44	74.5 Å²	74.5	36%	0.364	37%	0.372	S	S	.	.			trans	-74.6	168.3	-178.5	0	0	0	0	0	110.8	A483 D591	A483-A593 WeakPolarHBondContact CB-O 3.47Å; D591-A593 WeakPolarHBondContact OD1-CA 3.39Å; D591-A593 VanDerWaalsContact OD1-CB 3.28Å; D591-A593 WeakPolarHBondContact OD1-CB 3.31Å; D591-A593 PolarHBondContact OD1-N 3.04Å
594	S	94.5	Very high	87.9	Confident	38 Å²	38	79.3 Å²	79.3	27%	0.266	39%	0.392	S	S	.	.			trans	-124.2	117.2	-178.3	-56.8	0	0	0	0	108.9	L481 M482 K498	L481-S594 WeakPolarHBondContact CD1-O 3.37Å; M482-S594 WeakPolarHBondContact O-CA 3.49Å; K498-S594 WeakPolarHBondContact CE-OG 3.4Å; K498-S594 PolarHBondContact NZ-OG 2.91Å
595	H	94.5	Very high	86.6	Confident	82 Å²	82	79.6 Å²	79.6	38%	0.38	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	143.9	-171.5	-66.5	104.7	0	0	0	110.5	L481 M482 D591 Y597	L481-H595 WeakPolarHBondContact CA-O 3.25Å; M482-H595 PolarHBondContact N-O 2.73Å; M482-H595 PolarHBondContact O-N 2.89Å; D591-H595 IonicContact OD1-CE1 3.86Å; D591-H595 IonicContact OD2-CE1 3.67Å; D591-H595 PolarHBondContact OD2-CE1 2.9Å; H595-Y597 HydrophobicContact CB-CD2 4.34Å; H595-Y597 HydrophobicContact CB-CE2 3.63Å; H595-Y597 VanDerWaalsContact O-CD2 3.26Å; H595-Y597 WeakPolarHBondContact O-CD2 3.35Å; H595-Y597 WeakPolarHBondContact O-CE2 3.21Å
596	W	97.1	Very high	84.7	Confident	87 Å²	87	84.8 Å²	84.8	33%	0.33	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.6	171	-72.9	101	0	0	0	109.2	E479 M480 L481 Q499 R501	E479-W596 HydrophobicContact CB-CE3 3.72Å; E479-W596 HydrophobicContact CB-CZ3 4.34Å; M480-W596 CarbonylContact O-C 3.57Å; M480-W596 WeakPolarHBondContact O-CA 3.29Å; L481-W596 HydrophobicContact CB-CD2 3.89Å; L481-W596 HydrophobicContact CB-CE3 3.76Å; L481-W596 HydrophobicContact CB-CH2 3.83Å; L481-W596 HydrophobicContact CB-CZ2 3.94Å; L481-W596 HydrophobicContact CB-CZ3 3.73Å; L481-W596 HydrophobicContact CD1-CD2 4.16Å; L481-W596 HydrophobicContact CD1-CG 4.19Å; L481-W596 HydrophobicContact CD2-CZ2 4.04Å; L481-W596 HydrophobicContact CG-CZ2 4.43Å; Q499-W596 HydrophobicContact CG-CH2 3.85Å; Q499-W596 HydrophobicContact CG-CZ2 4.45Å; R501-W596 HydrophobicContact CB-CH2 4.1Å; R501-W596 HydrophobicContact CB-CZ3 4.08Å; R501-W596 HydrophobicContact CG-CE3 4.2Å; R501-W596 HydrophobicContact CG-CH2 3.88Å; R501-W596 HydrophobicContact CG-CZ3 3.57Å
597	Y	96.6	Very high	83.2	Confident	40 Å²	40	84.7 Å²	84.7	16%	0.157	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.9	177.8	-63.5	-92.4	0	0	0	109.7	E479 M480 M482 I581 L583 H595	E479-Y597 CarbonylContact C-O 3.53Å; E479-Y597 VanDerWaalsContact CA-O 3.26Å; E479-Y597 WeakPolarHBondContact CA-O 3.4Å; M480-Y597 PolarHBondContact N-O 3.03Å; M480-Y597 PolarHBondContact O-N 3.46Å; M482-Y597 HydrophobicContact CE-CE2 4.36Å; M482-Y597 HydrophobicContact CG-CD2 3.48Å; M482-Y597 VanDerWaalsContact CG-CD2 3.48Å; M482-Y597 HydrophobicContact CG-CE2 3.61Å; M482-Y597 HydrophobicContact SD-CD2 4.11Å; M482-Y597 HydrophobicContact SD-CE2 4.37Å; I581-Y597 HydrophobicContact CD1-CG 4.49Å; I581-Y597 HydrophobicContact CG2-CD1 4.17Å; I581-Y597 HydrophobicContact CG2-CG 4.33Å; L583-Y597 HydrophobicContact CD1-CE1 4.13Å; L583-Y597 HydrophobicContact CD2-CE1 4.41Å; H595-Y597 HydrophobicContact CB-CD2 4.34Å; H595-Y597 HydrophobicContact CB-CE2 3.63Å; H595-Y597 VanDerWaalsContact O-CD2 3.26Å; H595-Y597 WeakPolarHBondContact O-CD2 3.35Å; H595-Y597 WeakPolarHBondContact O-CE2 3.21Å
598	T	97.3	Very high	82	Confident	110 Å²	110	79.7 Å²	79.7	68%	0.675	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	136.1	176.1	-47.2	0	0	0	0	111.2
599	L	97.3	Very high	80.5	Confident	10 Å²	10	79.2 Å²	79.2	5%	0.052	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-79.8	122.9	177.3	-64.1	173.3	0	0	0	110.9	I476 G478 L503 V566 I581	I476-L599 HydrophobicContact CG2-CB 4.08Å; G478-L599 WeakPolarHBondContact O-CB 3.3Å; G478-L599 PolarHBondContact O-N 3.16Å; L503-L599 HydrophobicContact CD2-CD1 3.3Å; V566-L599 HydrophobicContact CB-CD1 4.41Å; V566-L599 HydrophobicContact CG2-CD1 3.97Å; V566-L599 HydrophobicContact CG2-CD2 3.66Å; I581-L599 HydrophobicContact CD1-CD2 3.72Å; I581-L599 HydrophobicContact CG1-CD2 4.04Å
600	G	93.6	Very high	79	Confident	26 Å²	26	79.3 Å²	79.3	27%	0.268	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-93.8	164.7	175.5	0	0	0	0	0	113.6	G579 E580	G579-G600 CarbonylContact C-O 3.59Å; G579-G600 WeakPolarHBondContact CA-O 3.35Å; E580-G600 PolarHBondContact N-O 3.42Å; E580-G600 PolarHBondContact O-N 2.8Å
601	E	91.4	Very high	77.6	Confident	99 Å²	99	79.1 Å²	79.1	46%	0.463	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-60.4	159.4	166.1	-72.4	-148.2	170.1	0	0	112.4	K301 I476 R603	K301-E601 IonicContact NZ-OE1 3.6Å; K301-E601 PolarHBondContact NZ-OE1 2.9Å; K301-E601 IonicContact NZ-OE2 2.73Å; K301-E601 PolarHBondContact NZ-OE2 3.25Å; I476-E601 HydrophobicContact CG1-CG 4.04Å; E601-R603 PolarHBondContact O-N 2.99Å
602	H	86.6	Confident	76.4	Confident	36 Å²	36	79.2 Å²	79.2	17%	0.167	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-62.5	127.4	179	-174.8	43.3	0	0	0	111.2	Y470 F577 E580 F604	Y470-H602 HydrophobicContact CD1-CB 3.88Å; Y470-H602 AromaticContact CD1-CD2 3.58Å; Y470-H602 AromaticContact CD1-CG 3.64Å; Y470-H602 AromaticContact CD2-CD2 3.84Å; Y470-H602 HydrophobicContact CE1-CB 4.32Å; Y470-H602 AromaticContact CE1-CD2 3.55Å; Y470-H602 AromaticContact CE1-CE1 3.91Å; Y470-H602 AromaticContact CE1-CG 3.65Å; Y470-H602 AromaticContact CE1-ND1 3.86Å; Y470-H602 AromaticContact CE1-NE2 3.74Å; Y470-H602 AromaticContact CE2-CD2 3.8Å; Y470-H602 AromaticContact CE2-NE2 3.77Å; Y470-H602 HydrophobicContact CG-CB 4.41Å; Y470-H602 AromaticContact CG-CD2 3.74Å; Y470-H602 AromaticContact CZ-CD2 3.66Å; Y470-H602 AromaticContact CZ-CE1 3.9Å; Y470-H602 AromaticContact CZ-NE2 3.47Å; F577-H602 HydrophobicContact CD1-CB 4.33Å; F577-H602 HydrophobicContact CE1-CB 3.76Å; F577-H602 HydrophobicContact CE2-CB 4.25Å; F577-H602 HydrophobicContact CZ-CB 3.7Å; E580-H602 VanDerWaalsContact OE1-CA 3.3Å; E580-H602 WeakPolarHBondContact OE1-CA 3.32Å; E580-H602 IonicContact OE1-CE1 3.35Å; E580-H602 IonicContact OE1-CG 3.47Å; E580-H602 IonicContact OE1-ND1 3.91Å; E580-H602 PolarHBondContact OE1-ND1 3.34Å; E580-H602 IonicContact OE2-ND1 3.43Å; H602-F604 AromaticContact NE2-CE1 3.99Å
603	R	75.6	Confident	75.6	Confident	165 Å²	165	73 Å²	73	62%	0.623	38%	0.38	S	S	*	.			trans	-114.1	120.9	177.5	-62.1	-176.2	-179.7	-177.5	-1.6	111.3	E580 F582 E601 L605	E580-R603 PolarHBondContact OE1-N 3.2Å; F582-R603 HydrophobicContact CE2-CB 3.95Å; E601-R603 PolarHBondContact O-N 2.99Å; R603-L605 HydrophobicContact CB-CD2 4.29Å; R603-L605 PolarHBondContact O-N 3.38Å
604	F	65.5	Low	74.6	Confident	124 Å²	124	73.6 Å²	73.6	54%	0.544	38%	0.381	S	S	.	.			trans	-71.4	78.6	166.1	-73	-69.2	0	0	0	110.4	H602 P606	H602-F604 AromaticContact NE2-CE1 3.99Å; F604-P606 VanDerWaalsContact O-CD 3.24Å; F604-P606 WeakPolarHBondContact O-CD 3.48Å
605	L	62.6	Low	73.8	Confident	78 Å²	78	72 Å²	72	41%	0.408	37%	0.369	S	S	.	.			trans	-65.3	116.1	172.4	-63.4	-174	0	0	0	110	F582 R603 T607	F582-L605 HydrophobicContact CD1-CD1 3.45Å; F582-L605 VanDerWaalsContact CD1-CD1 3.45Å; F582-L605 HydrophobicContact CD1-CG 4.46Å; F582-L605 HydrophobicContact CD2-CD1 4.25Å; F582-L605 HydrophobicContact CE1-CD1 3.48Å; F582-L605 VanDerWaalsContact CE1-CD1 3.48Å; F582-L605 HydrophobicContact CE1-CG 4.12Å; F582-L605 HydrophobicContact CE2-CD1 4.28Å; F582-L605 HydrophobicContact CE2-CG 4.39Å; F582-L605 HydrophobicContact CG-CD1 3.84Å; F582-L605 HydrophobicContact CZ-CD1 3.92Å; F582-L605 HydrophobicContact CZ-CG 4.08Å; R603-L605 HydrophobicContact CB-CD2 4.29Å; R603-L605 PolarHBondContact O-N 3.38Å; L605-T607 PolarHBondContact O-N 2.9Å
606	P	53.2	Low	73.4	Confident	114 Å²	114	68.7 Å²	68.7	74%	0.74	36%	0.357	S	S	*	.			trans	-64.9	128	172.5	27.9	-33.4	0	0	0	108.6	F604 V608	F604-P606 VanDerWaalsContact O-CD 3.24Å; F604-P606 WeakPolarHBondContact O-CD 3.48Å; P606-V608 PolarHBondContact O-N 3.39Å
607	T	52.1	Low	73.3	Confident	57 Å²	57	66.5 Å²	66.5	35%	0.35	35%	0.351	S	S	.	.			trans	-69.5	107	-177.6	-47.4	0	0	0	0	110.3	P523 L605 S609 N771	P523-T607 HydrophobicContact CB-CG2 3.8Å; L605-T607 PolarHBondContact O-N 2.9Å; T607-S609 PolarHBondContact O-N 3.36Å; T607-S609 VanDerWaalsContact O-N 3.1Å; T607-N771 VanDerWaalsContact CB-ND2 3.28Å; T607-N771 WeakPolarHBondContact CB-ND2 3.45Å; T607-N771 WeakPolarHBondContact CG2-ND2 3.49Å; T607-N771 PolarHBondContact OG1-ND2 3.02Å; T607-N771 VanDerWaalsContact OG1-ND2 3.1Å
608	V	52.9	Low	73.3	Confident	88 Å²	88	64.6 Å²	64.6	53%	0.533	34%	0.343	S	S	.	.			trans	-57.4	116.5	174.6	-177.5	0	0	0	0	108.6	P606 H610 L611	P606-V608 PolarHBondContact O-N 3.39Å; V608-H610 PolarHBondContact O-N 3.45Å; V608-L611 HydrophobicContact CB-CD1 4.09Å; V608-L611 HydrophobicContact CB-CG 4.3Å; V608-L611 PolarHBondContact O-N 3.06Å
609	S	50.5	Low	73.3	Confident	24 Å²	24	60.2 Å²	60.2	17%	0.168	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-68	-17.3	-160.9	-42.9	0	0	0	0	114.1	T607 L611 Q612 R736 M744	T607-S609 PolarHBondContact O-N 3.36Å; T607-S609 VanDerWaalsContact O-N 3.1Å; S609-L611 VanDerWaalsContact C-N 3.32Å; S609-Q612 WeakPolarHBondContact O-CG 3.38Å; S609-R736 PolarHBondContact OG-NH2 3.06Å; S609-R736 VanDerWaalsContact OG-NH2 3.15Å; S609-M744 WeakPolarHBondContact CB-SD 2.97Å; S609-M744 PolarHBondContact OG-SD 3.11Å; S609-M744 VanDerWaalsContact OG-SD 3.42Å
610	H	53.4	Low	73.3	Confident	163 Å²	163	59.8 Å²	59.8	76%	0.755	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-76.3	-13.6	176.1	-60.2	-83.4	0	0	0	114	V608	V608-H610 PolarHBondContact O-N 3.45Å
611	L	56.7	Low	73.5	Confident	53 Å²	53	58.5 Å²	58.5	28%	0.277	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-90.5	1.9	-178.2	-56.4	178.3	0	0	0	113.5	P523 L559 V608 S609 I613	P523-L611 HydrophobicContact CG-CB 4.25Å; P523-L611 WeakPolarHBondContact CG-O 3.28Å; L559-L611 HydrophobicContact CB-CD2 3.96Å; L559-L611 HydrophobicContact CD2-CD2 3.91Å; L559-L611 HydrophobicContact CG-CD2 4.48Å; V608-L611 HydrophobicContact CB-CD1 4.09Å; V608-L611 HydrophobicContact CB-CG 4.3Å; V608-L611 PolarHBondContact O-N 3.06Å; S609-L611 VanDerWaalsContact C-N 3.32Å; L611-I613 PolarHBondContact O-N 3.33Å
612	Q	60.3	Low	73.8	Confident	64 Å²	64	53.8 Å²	53.8	30%	0.299	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-57.9	129.5	-172	-75.9	176.8	2.2	0	0	112.6	S609	S609-Q612 WeakPolarHBondContact O-CG 3.38Å
613	I	66.1	Low	74.4	Confident	30 Å²	30	53.5 Å²	53.5	15%	0.154	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-86.3	119.4	172.9	-62.6	163.5	0	0	0	107.3	P523 D524 L611	P523-I613 HydrophobicContact CG-CD1 4.19Å; P523-I613 HydrophobicContact CG-CG1 4.25Å; D524-I613 HydrophobicContact CB-CD1 3.78Å; L611-I613 PolarHBondContact O-N 3.33Å
614	S	68.2	Low	75.4	Confident	57 Å²	57	46 Å²	46	40%	0.399	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	134.8	169.5	173.7	0	0	0	0	110.1	G616 Q767	S614-G616 PolarHBondContact OG-N 2.78Å; S614-G616 PolarHBondContact OG-O 3.11Å; S614-Q767 PolarHBondContact OG-OE1 2.99Å
615	R	77.6	Confident	76.9	Confident	5 Å²	5	41.5 Å²	41.5	2%	0.019	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	36.6	171.6	-72.5	-70	-159.5	112.1	0.5	111.3	D524 T526 N647 T650 L726 L768	D524-R615 IonicContact OD1-NH2 2.69Å; D524-R615 IonicContact OD2-CZ 2.94Å; D524-R615 IonicContact OD2-NE 2.63Å; D524-R615 IonicContact OD2-NH2 2.68Å; D524-R615 PolarHBondContact OD2-NH2 2.9Å; T526-R615 PolarHBondContact OG1-NH2 3.11Å; R615-N647 WeakPolarHBondContact CD-OD1 3.24Å; R615-N647 PolarHBondContact NH1-O 2.66Å; R615-T650 PolarHBondContact NH2-OG1 3.42Å; R615-T650 VanDerWaalsContact NH2-OG1 3.08Å; R615-L726 WeakPolarHBondContact CB-O 3.34Å; R615-L726 WeakPolarHBondContact CG-O 3.31Å; R615-L768 HydrophobicContact CB-CB 4.27Å; R615-L768 PolarHBondContact N-O 3.27Å; R615-L768 VanDerWaalsContact N-O 3.08Å
616	G	87.7	Confident	78.3	Confident	12 Å²	12	40.1 Å²	40.1	12%	0.124	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	86.9	-173.7	-164.9	0	0	0	0	0	112.1	S614 K644 L768	S614-G616 PolarHBondContact OG-N 2.78Å; S614-G616 PolarHBondContact OG-O 3.11Å; G616-K644 CarbonylContact C-O 3.17Å; G616-K644 WeakPolarHBondContact CA-O 3.47Å; G616-L768 WeakPolarHBondContact O-CB 3.44Å; G616-L768 PolarHBondContact O-N 3.17Å
617	E	93.6	Very high	80	Confident	41 Å²	41	36.4 Å²	36.4	19%	0.192	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	151.1	-177.5	58.4	177.6	-143.3	0	0	111.6	A643 K644 T765 I766 Q767	E617-A643 CarbonylContact O-C 3.59Å; E617-A643 WeakPolarHBondContact O-CA 3.21Å; E617-A643 VanDerWaalsContact O-CB 3.25Å; E617-A643 WeakPolarHBondContact O-CB 3.13Å; E617-K644 HydrophobicContact CG-CB 3.95Å; E617-K644 HydrophobicContact CG-CG 4.36Å; E617-K644 PolarHBondContact N-O 2.97Å; E617-K644 PolarHBondContact O-N 3.1Å; E617-K644 WeakPolarHBondContact OE1-CD 3.46Å; E617-K644 WeakPolarHBondContact OE1-CE 3.34Å; E617-K644 IonicContact OE1-NZ 2.8Å; E617-K644 PolarHBondContact OE1-NZ 2.79Å; E617-T765 HydrophobicContact CB-CG2 3.95Å; E617-T765 HydrophobicContact CG-CG2 4.04Å; E617-T765 WeakPolarHBondContact OE1-CG2 2.99Å; E617-T765 VanDerWaalsContact OE2-CG2 3.28Å; E617-T765 WeakPolarHBondContact OE2-CG2 3.28Å; E617-I766 CarbonylContact C-O 3.47Å; E617-I766 WeakPolarHBondContact CA-O 3.17Å; E617-Q767 PolarHBondContact OE2-NE2 3.12Å
618	I	96.3	Very high	81.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.9	169.9	-169	172.2	0	0	0	109.9	L620 I640 S642 V664 I712 V714 T765 I766 L768	I618-L620 HydrophobicContact CG2-CD2 4.24Å; I618-I640 HydrophobicContact CD1-CG2 4.44Å; I618-S642 WeakPolarHBondContact CG1-O 3.11Å; I618-V664 HydrophobicContact CD1-CG2 4.37Å; I618-I712 HydrophobicContact CD1-CG2 3.84Å; I618-V714 HydrophobicContact CD1-CG2 4.17Å; I618-T765 WeakPolarHBondContact O-CA 3.34Å; I618-I766 HydrophobicContact CG2-CB 4.14Å; I618-I766 PolarHBondContact N-O 3.28Å; I618-I766 PolarHBondContact O-N 3.03Å; I618-L768 HydrophobicContact CB-CD2 3.98Å; I618-L768 HydrophobicContact CB-CG 4.37Å; I618-L768 HydrophobicContact CG2-CD2 3.73Å; I618-L768 HydrophobicContact CG2-CG 4.39Å
619	V	97.7	Very high	82.6	Confident	19 Å²	19	45 Å²	45	12%	0.115	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.5	176.2	-172.4	0	0	0	0	108.4	K641 S642 T765	V619-K641 HydrophobicContact CG1-CD 4.38Å; V619-K641 WeakPolarHBondContact O-CB 3.44Å; V619-K641 PolarHBondContact O-N 2.81Å; V619-K641 VanDerWaalsContact O-N 3.13Å; V619-S642 PolarHBondContact N-O 2.87Å; V619-S642 PolarHBondContact O-N 3.17Å; V619-T765 HydrophobicContact CG2-CG2 4.3Å
620	L	98.1	Very high	83.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	168.2	-176.5	57	84.1	0	0	0	111.6	I618 W639 I640 I712 I731 E763 A764 I766	I618-L620 HydrophobicContact CG2-CD2 4.24Å; L620-W639 CarbonylContact C-O 3.56Å; L620-W639 WeakPolarHBondContact CA-O 3.31Å; L620-W639 VanDerWaalsContact CB-O 3.26Å; L620-W639 WeakPolarHBondContact CB-O 3.4Å; L620-I640 HydrophobicContact CB-CD1 4.44Å; L620-I640 HydrophobicContact CD2-CD1 4.48Å; L620-I712 HydrophobicContact CD2-CD1 3.46Å; L620-I712 VanDerWaalsContact CD2-CD1 3.46Å; L620-I731 HydrophobicContact CD1-CD1 3.79Å; L620-I731 HydrophobicContact CD2-CD1 3.9Å; L620-E763 WeakPolarHBondContact O-CA 3.45Å; L620-A764 HydrophobicContact CD1-CB 4.06Å; L620-A764 PolarHBondContact N-O 3.29Å; L620-A764 PolarHBondContact O-N 3.04Å; L620-I766 HydrophobicContact CD2-CD1 4.39Å
621	A	98.1	Very high	84.9	Confident	0 Å²	0	43 Å²	43	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.2	164	0	0	0	0	0	111	W639 W761 I762 E763	A621-W639 HydrophobicContact CB-CB 4.29Å; A621-W639 PolarHBondContact N-O 3.34Å; A621-W639 PolarHBondContact O-N 2.78Å; A621-W761 HydrophobicContact CB-CB 4.44Å; A621-W761 HydrophobicContact CB-CD2 4.41Å; A621-W761 HydrophobicContact CB-CE3 3.73Å; A621-W761 HydrophobicContact CB-CZ3 4.34Å; A621-I762 CarbonylContact C-O 3.56Å; A621-I762 WeakPolarHBondContact CA-O 3.46Å; A621-E763 HydrophobicContact CB-CG 4.19Å
622	I	97.9	Very high	86.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145	178.3	-166.6	-179.5	0	0	0	110	I636 H637 I710 I731 W751 M754 I762	I622-I636 HydrophobicContact CD1-CG2 4.1Å; I622-I636 HydrophobicContact CG1-CG2 4.03Å; I622-H637 CarbonylContact C-O 3.27Å; I622-H637 WeakPolarHBondContact CA-O 3.46Å; I622-I710 HydrophobicContact CD1-CD1 3.59Å; I622-I710 HydrophobicContact CG1-CD1 4.42Å; I622-I731 HydrophobicContact CD1-CG2 4.17Å; I622-W751 HydrophobicContact CD1-CE3 3.97Å; I622-W751 HydrophobicContact CD1-CZ3 4.13Å; I622-M754 HydrophobicContact CD1-SD 3.49Å; I622-M754 WeakPolarHBondContact CD1-SD 3.3Å; I622-M754 HydrophobicContact CG1-CG 4.29Å; I622-M754 HydrophobicContact CG1-SD 3.55Å; I622-M754 VanDerWaalsContact CG1-SD 3.55Å; I622-M754 HydrophobicContact CG2-CB 4.19Å; I622-M754 HydrophobicContact CG2-CG 4.39Å; I622-I762 HydrophobicContact CG2-CB 3.98Å; I622-I762 HydrophobicContact CG2-CG1 4.49Å; I622-I762 PolarHBondContact N-O 2.97Å; I622-I762 WeakPolarHBondContact O-CB 3.29Å; I622-I762 WeakPolarHBondContact O-CG1 3.39Å; I622-I762 PolarHBondContact O-N 2.86Å
623	K	97.9	Very high	87.9	Confident	30 Å²	30	47.5 Å²	47.5	13%	0.13	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	132.3	-179.4	171.5	-172.1	61.8	154.5	0	110.3	V625 H637 N759 I760 W761	K623-V625 HydrophobicContact CD-CG2 3.94Å; K623-V625 HydrophobicContact CG-CG2 4.1Å; K623-H637 HydrophobicContact CB-CB 4.25Å; K623-H637 VanDerWaalsContact CE-ND1 3.28Å; K623-H637 WeakPolarHBondContact CE-ND1 3.24Å; K623-H637 PolarHBondContact N-O 3.26Å; K623-H637 PolarHBondContact NZ-ND1 3.28Å; K623-H637 PolarHBondContact O-N 2.99Å; K623-N759 WeakPolarHBondContact CD-O 3.45Å; K623-I760 WeakPolarHBondContact CB-O 3.47Å; K623-I760 WeakPolarHBondContact CG-O 3.43Å; K623-W761 HydrophobicContact CB-CD2 3.85Å; K623-W761 HydrophobicContact CB-CE3 3.61Å; K623-W761 HydrophobicContact CB-CG 4.38Å; K623-W761 HydrophobicContact CB-CZ3 4.04Å; K623-W761 HydrophobicContact CD-CD2 4.28Å; K623-W761 HydrophobicContact CD-CG 4.47Å
624	L	96.9	Very high	89.2	Confident	8 Å²	8	46.3 Å²	46.3	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131.4	167.3	178.9	65.9	0	0	0	109.1	I636 L702 L705 M754 N759	L624-I636 HydrophobicContact CD1-CG1 3.92Å; L624-L702 HydrophobicContact CD1-CD2 3.9Å; L624-L705 HydrophobicContact CD1-CD1 4.43Å; L624-L705 HydrophobicContact CD1-CD2 4.33Å; L624-L705 HydrophobicContact CD2-CD1 3.74Å; L624-M754 HydrophobicContact CB-CE 4.22Å; L624-M754 HydrophobicContact CB-CG 3.77Å; L624-M754 HydrophobicContact CB-SD 4Å; L624-M754 VanDerWaalsContact N-CG 3.28Å; L624-N759 PolarHBondContact O-N 3.3Å
625	V	96.3	Very high	90.4	Very high	29 Å²	29	45.3 Å²	45.3	18%	0.176	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	102.7	172	179.8	0	0	0	0	107.5	K623 G634 E635	K623-V625 HydrophobicContact CD-CG2 3.94Å; K623-V625 HydrophobicContact CG-CG2 4.1Å; V625-G634 CarbonylContact O-C 3.51Å; V625-G634 WeakPolarHBondContact O-CA 3.3Å; V625-E635 HydrophobicContact CB-CB 4.35Å; V625-E635 PolarHBondContact N-O 3.13Å; V625-E635 PolarHBondContact O-N 2.67Å
626	P	93.1	Very high	91.3	Very high	48 Å²	48	45 Å²	45	31%	0.312	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	149	171.7	-22.3	34.1	0	0	0	111.1	L702 P758	P626-L702 HydrophobicContact CB-CD1 4.28Å; P626-P758 HydrophobicContact CG-CB 3.77Å
627	G	87.9	Confident	91.7	Very high	36 Å²	36	45.6 Å²	45.6	37%	0.371	27%	0.268	S	S	.	.			trans	-73.7	-174.7	172.3	0	0	0	0	0	112.9	R633	G627-R633 VanDerWaalsContact CA-O 3.24Å; G627-R633 WeakPolarHBondContact CA-O 3.44Å; G627-R633 PolarHBondContact N-O 3.19Å
628	E	83.9	Confident	91.9	Very high	172 Å²	172	43.7 Å²	43.7	80%	0.804	26%	0.259	S	S	*	.	S	Bend	trans	-55.7	151.7	177	-64.8	172.2	-178.1	0	0	112.4	G630 S631	E628-G630 PolarHBondContact O-N 3Å; E628-G630 VanDerWaalsContact O-N 3.1Å; E628-S631 WeakPolarHBondContact O-CB 3.34Å; E628-S631 PolarHBondContact O-N 3.21Å
629	T	75.3	Confident	92	Very high	155 Å²	155	47.7 Å²	47.7	95%	0.951	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	114.4	-175.2	45.1	0	0	0	0	112.1
630	G	70.7	Confident	92	Very high	89 Å²	89	46.8 Å²	46.8	92%	0.918	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.8	-14.7	-174.8	0	0	0	0	0	114.2	E628	E628-G630 PolarHBondContact O-N 3Å; E628-G630 VanDerWaalsContact O-N 3.1Å
631	S	81.6	Confident	92	Very high	54 Å²	54	48.3 Å²	48.3	38%	0.378	28%	0.275	S	S	.	.			trans	-81.2	125.1	175.5	-171.8	0	0	0	0	112.1	E628 R633	E628-S631 WeakPolarHBondContact O-CB 3.34Å; E628-S631 PolarHBondContact O-N 3.21Å; S631-R633 PolarHBondContact O-N 3.17Å; S631-R633 PolarHBondContact OG-N 3.23Å
632	N	88.5	Confident	92	Very high	73 Å²	73	49.2 Å²	49.2	39%	0.39	28%	0.282	S	S	.	.	S	Bend	trans	-81.8	18.8	167.1	-165.6	4.2	0	0	0	112.3	I701 L702 N703	N632-I701 WeakPolarHBondContact O-CA 3.46Å; N632-L702 PolarHBondContact O-N 2.9Å; N632-N703 PolarHBondContact ND2-ND2 3.37Å; N632-N703 PolarHBondContact OD1-N 3.33Å; N632-N703 PolarHBondContact OD1-OD1 3Å
633	R	91.8	Very high	91.9	Very high	140 Å²	140	49.3 Å²	49.3	53%	0.528	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	152.7	172.7	-66.5	-173.8	179	91.9	-0.6	110.4	G627 S631 I700	G627-R633 VanDerWaalsContact CA-O 3.24Å; G627-R633 WeakPolarHBondContact CA-O 3.44Å; G627-R633 PolarHBondContact N-O 3.19Å; S631-R633 PolarHBondContact O-N 3.17Å; S631-R633 PolarHBondContact OG-N 3.23Å; R633-I700 CarbonylContact C-O 3.53Å; R633-I700 VanDerWaalsContact CA-O 3.28Å; R633-I700 WeakPolarHBondContact CA-O 3.38Å
634	G	93.1	Very high	91.7	Very high	4 Å²	4	52.4 Å²	52.4	4%	0.041	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	-162.4	167.9	0	0	0	0	0	111.5	V625 D699 I700	V625-G634 CarbonylContact O-C 3.51Å; V625-G634 WeakPolarHBondContact O-CA 3.3Å; G634-D699 PolarHBondContact O-N 3.41Å; G634-I700 PolarHBondContact N-O 2.82Å; G634-I700 WeakPolarHBondContact O-CB 3.27Å; G634-I700 PolarHBondContact O-N 3.43Å
635	E	95.1	Very high	91.3	Very high	36 Å²	36	54 Å²	54	17%	0.168	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144.6	178.6	-46.8	-168.9	146.7	0	0	111	V625 H637 I696 Y697 R698	V625-E635 HydrophobicContact CB-CB 4.35Å; V625-E635 PolarHBondContact N-O 3.13Å; V625-E635 PolarHBondContact O-N 2.67Å; E635-H637 IonicContact OE2-CD2 3.72Å; E635-H637 IonicContact OE2-CE1 3.69Å; E635-H637 IonicContact OE2-NE2 2.75Å; E635-H637 PolarHBondContact OE2-NE2 3.3Å; E635-I696 HydrophobicContact CB-CG2 4.17Å; E635-I696 WeakPolarHBondContact OE2-CG2 3.17Å; E635-Y697 CarbonylContact C-O 3.52Å; E635-Y697 WeakPolarHBondContact CA-O 3.21Å; E635-Y697 WeakPolarHBondContact CB-O 3.16Å; E635-R698 HydrophobicContact CG-CB 4.49Å; E635-R698 HydrophobicContact CG-CG 4.32Å; E635-R698 WeakPolarHBondContact OE1-CD 3.49Å; E635-R698 WeakPolarHBondContact OE1-CG 3.22Å; E635-R698 IonicContact OE1-CZ 3.29Å; E635-R698 VanDerWaalsContact OE1-CZ 3.29Å; E635-R698 IonicContact OE1-NE 3.54Å; E635-R698 IonicContact OE1-NH1 2.63Å; E635-R698 PolarHBondContact OE1-NH1 3.43Å
636	I	95.6	Very high	90.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	117	165.6	-64.5	170.5	0	0	0	108.4	I622 L624 V638 M668 Y697 I700 L705 I708 I710 W751 M754	I622-I636 HydrophobicContact CD1-CG2 4.1Å; I622-I636 HydrophobicContact CG1-CG2 4.03Å; L624-I636 HydrophobicContact CD1-CG1 3.92Å; I636-V638 HydrophobicContact CG2-CG2 4.15Å; I636-M668 HydrophobicContact CB-CE 4.42Å; I636-M668 HydrophobicContact CD1-CE 4.24Å; I636-Y697 PolarHBondContact N-O 2.93Å; I636-Y697 PolarHBondContact O-N 3.01Å; I636-I700 HydrophobicContact CB-CG1 4.46Å; I636-I700 HydrophobicContact CD1-CG1 4.24Å; I636-I700 HydrophobicContact CD1-CG2 3.9Å; I636-I700 HydrophobicContact CG1-CG1 4.11Å; I636-I700 HydrophobicContact CG1-CG2 4.24Å; I636-L705 HydrophobicContact CD1-CD2 3.93Å; I636-I708 HydrophobicContact CD1-CD1 4.13Å; I636-I710 HydrophobicContact CG2-CD1 3.92Å; I636-W751 HydrophobicContact CD1-CH2 3.67Å; I636-W751 HydrophobicContact CD1-CZ3 4.14Å; I636-M754 HydrophobicContact CD1-CE 4.31Å; I636-M754 HydrophobicContact CG1-CE 4.48Å; I636-M754 HydrophobicContact CG1-SD 4.37Å; I636-M754 HydrophobicContact CG2-SD 3.99Å
637	H	97	Very high	90.2	Very high	24 Å²	24	53.9 Å²	53.9	11%	0.111	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.6	177.4	-67.5	-150.1	0	0	0	108.4	I622 K623 E635 W761	I622-H637 CarbonylContact C-O 3.27Å; I622-H637 WeakPolarHBondContact CA-O 3.46Å; K623-H637 HydrophobicContact CB-CB 4.25Å; K623-H637 VanDerWaalsContact CE-ND1 3.28Å; K623-H637 WeakPolarHBondContact CE-ND1 3.24Å; K623-H637 PolarHBondContact N-O 3.26Å; K623-H637 PolarHBondContact NZ-ND1 3.28Å; K623-H637 PolarHBondContact O-N 2.99Å; E635-H637 IonicContact OE2-CD2 3.72Å; E635-H637 IonicContact OE2-CE1 3.69Å; E635-H637 IonicContact OE2-NE2 2.75Å; E635-H637 PolarHBondContact OE2-NE2 3.3Å; H637-W761 HydrophobicContact CB-CH2 3.61Å; H637-W761 HydrophobicContact CB-CZ2 4.29Å; H637-W761 HydrophobicContact CB-CZ3 3.98Å
638	V	97.2	Very high	89.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.3	-179.3	-163.9	0	0	0	0	108.9	I636 I640 I666 A694 I695 Y697 I710	I636-V638 HydrophobicContact CG2-CG2 4.15Å; V638-I640 HydrophobicContact CG1-CD1 4.13Å; V638-I666 HydrophobicContact CB-CD1 4.15Å; V638-I666 HydrophobicContact CG1-CD1 3.82Å; V638-I666 HydrophobicContact CG2-CD1 4.23Å; V638-A694 CarbonylContact O-C 3.58Å; V638-A694 WeakPolarHBondContact O-CA 3.36Å; V638-I695 PolarHBondContact N-O 2.84Å; V638-I695 PolarHBondContact O-N 2.96Å; V638-Y697 HydrophobicContact CG2-CD2 4.29Å; V638-Y697 HydrophobicContact CG2-CE2 4.33Å; V638-I710 HydrophobicContact CG2-CD1 3.56Å
639	W	97.8	Very high	88.2	Confident	84 Å²	84	47.2 Å²	47.2	32%	0.318	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	106.1	178.2	-172.8	0.9	0	0	0	109.3	L620 A621 K641 W761	L620-W639 CarbonylContact C-O 3.56Å; L620-W639 WeakPolarHBondContact CA-O 3.31Å; L620-W639 VanDerWaalsContact CB-O 3.26Å; L620-W639 WeakPolarHBondContact CB-O 3.4Å; A621-W639 HydrophobicContact CB-CB 4.29Å; A621-W639 PolarHBondContact N-O 3.34Å; A621-W639 PolarHBondContact O-N 2.78Å; W639-K641 HydrophobicContact CD2-CG 4.25Å; W639-K641 HydrophobicContact CG-CG 4.18Å; W639-K641 PolarHBondContact O-N 3Å; W639-W761 HydrophobicContact CB-CH2 3.96Å; W639-W761 HydrophobicContact CB-CZ3 3.85Å
640	I	97.9	Very high	87.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	103.2	173.1	-56.3	-57.6	0	0	0	107.3	I618 L620 V638 V664 I666 T680 W691 N692 Q693 I695 I712	I618-I640 HydrophobicContact CD1-CG2 4.44Å; L620-I640 HydrophobicContact CB-CD1 4.44Å; L620-I640 HydrophobicContact CD2-CD1 4.48Å; V638-I640 HydrophobicContact CG1-CD1 4.13Å; I640-V664 HydrophobicContact CG2-CB 4.46Å; I640-V664 HydrophobicContact CG2-CG2 3.94Å; I640-I666 HydrophobicContact CD1-CD1 4.46Å; I640-T680 HydrophobicContact CB-CG2 4.22Å; I640-T680 HydrophobicContact CG2-CG2 3.97Å; I640-W691 HydrophobicContact CG2-CB 4.45Å; I640-W691 HydrophobicContact CG2-CD2 4.29Å; I640-W691 HydrophobicContact CG2-CE3 3.66Å; I640-W691 HydrophobicContact CG2-CZ3 4.27Å; I640-N692 CarbonylContact O-C 3.54Å; I640-N692 WeakPolarHBondContact O-CA 3.17Å; I640-N692 PolarHBondContact O-N 3.22Å; I640-N692 VanDerWaalsContact O-N 3.15Å; I640-Q693 PolarHBondContact N-O 2.58Å; I640-Q693 PolarHBondContact O-N 3.33Å; I640-I695 HydrophobicContact CG1-CD1 4.38Å; I640-I712 HydrophobicContact CD1-CD1 4.09Å; I640-I712 HydrophobicContact CD1-CG2 4.29Å
641	K	97.8	Very high	86.4	Confident	33 Å²	33	38 Å²	38	14%	0.143	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-71	-177.7	-62.4	-172.2	174.7	-169.3	0	110.5	V619 W639 W691 N692 E763	V619-K641 HydrophobicContact CG1-CD 4.38Å; V619-K641 WeakPolarHBondContact O-CB 3.44Å; V619-K641 PolarHBondContact O-N 2.81Å; V619-K641 VanDerWaalsContact O-N 3.13Å; W639-K641 HydrophobicContact CD2-CG 4.25Å; W639-K641 HydrophobicContact CG-CG 4.18Å; W639-K641 PolarHBondContact O-N 3Å; K641-W691 PolarHBondContact O-N 3.01Å; K641-N692 PolarHBondContact O-N 3.14Å; K641-E763 IonicContact NZ-OE1 2.9Å; K641-E763 PolarHBondContact NZ-OE1 3.36Å; K641-E763 IonicContact NZ-OE2 2.73Å; K641-E763 PolarHBondContact NZ-OE2 3.03Å
642	S	97.7	Very high	84.8	Confident	19 Å²	19	38.9 Å²	38.9	13%	0.133	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	175	-172.6	58.4	0	0	0	0	112.2	I618 V619 P689	I618-S642 WeakPolarHBondContact CG1-O 3.11Å; V619-S642 PolarHBondContact N-O 2.87Å; V619-S642 PolarHBondContact O-N 3.17Å; S642-P689 CarbonylContact C-O 3.55Å; S642-P689 WeakPolarHBondContact CA-O 3.38Å; S642-P689 WeakPolarHBondContact CB-O 3.36Å
643	A	96.7	Very high	82.8	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	161.9	164	0	0	0	0	0	110	E617 L646 N688 P689 W691	E617-A643 CarbonylContact O-C 3.59Å; E617-A643 WeakPolarHBondContact O-CA 3.21Å; E617-A643 VanDerWaalsContact O-CB 3.25Å; E617-A643 WeakPolarHBondContact O-CB 3.13Å; A643-L646 HydrophobicContact CB-CD1 4.01Å; A643-L646 HydrophobicContact CB-CD2 4.03Å; A643-L646 HydrophobicContact CB-CG 4.08Å; A643-N688 CarbonylContact O-C 3.32Å; A643-N688 VanDerWaalsContact O-C 3.27Å; A643-N688 WeakPolarHBondContact O-CA 3.01Å; A643-P689 HydrophobicContact CB-CG 4.04Å; A643-P689 PolarHBondContact N-O 2.86Å; A643-P689 WeakPolarHBondContact O-CD 3.11Å; A643-W691 HydrophobicContact CB-CH2 3.83Å; A643-W691 HydrophobicContact CB-CZ3 3.73Å
644	K	93.1	Very high	80.6	Confident	96 Å²	96	38.9 Å²	38.9	42%	0.417	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	150	178.3	-48.1	-174.8	-155.1	130.1	0	111.5	G616 E617 L646 N688	G616-K644 CarbonylContact C-O 3.17Å; G616-K644 WeakPolarHBondContact CA-O 3.47Å; E617-K644 HydrophobicContact CG-CB 3.95Å; E617-K644 HydrophobicContact CG-CG 4.36Å; E617-K644 PolarHBondContact N-O 2.97Å; E617-K644 PolarHBondContact O-N 3.1Å; E617-K644 WeakPolarHBondContact OE1-CD 3.46Å; E617-K644 WeakPolarHBondContact OE1-CE 3.34Å; E617-K644 IonicContact OE1-NZ 2.8Å; E617-K644 PolarHBondContact OE1-NZ 2.79Å; K644-L646 VanDerWaalsContact C-N 3.29Å; K644-L646 PolarHBondContact O-N 2.74Å; K644-N688 VanDerWaalsContact CA-OD1 3.24Å; K644-N688 WeakPolarHBondContact CA-OD1 3.39Å
645	G	88.5	Confident	78	Confident	42 Å²	42	44.8 Å²	44.8	43%	0.433	27%	0.27	S	S	.	.	S	Bend	trans	66	25.4	173.6	0	0	0	0	0	114.7	N647 N687 N688	G645-N647 PolarHBondContact O-N 3.48Å; G645-N687 PolarHBondContact N-O 3.47Å; G645-N688 PolarHBondContact N-OD1 3.13Å
646	L	88.9	Confident	75.8	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.016	29%	0.291	C	S	.	.			trans	-66	129.2	-179.7	-62.3	-178.1	0	0	0	111	A643 K644 V660 P662 N687 P689 V714 L726 L768	A643-L646 HydrophobicContact CB-CD1 4.01Å; A643-L646 HydrophobicContact CB-CD2 4.03Å; A643-L646 HydrophobicContact CB-CG 4.08Å; K644-L646 VanDerWaalsContact C-N 3.29Å; K644-L646 PolarHBondContact O-N 2.74Å; L646-V660 HydrophobicContact CB-CG2 4.06Å; L646-P662 HydrophobicContact CD1-CB 3.61Å; L646-P662 HydrophobicContact CD1-CG 3.94Å; L646-N687 WeakPolarHBondContact CB-O 3.41Å; L646-N687 PolarHBondContact N-O 2.95Å; L646-N687 WeakPolarHBondContact O-CB 2.69Å; L646-P689 HydrophobicContact CD1-CG 3.68Å; L646-V714 HydrophobicContact CD1-CG1 3.83Å; L646-V714 HydrophobicContact CD2-CG1 4.13Å; L646-L726 HydrophobicContact CB-CD1 4.47Å; L646-L726 HydrophobicContact CD1-CD1 4.31Å; L646-L768 HydrophobicContact CD2-CD1 3.43Å; L646-L768 VanDerWaalsContact CD2-CD1 3.43Å
647	N	77.9	Confident	73.8	Confident	70 Å²	70	54.1 Å²	54.1	37%	0.374	31%	0.312	S	S	.	.			trans	-134.2	140.2	177.1	57.2	16.5	0	0	0	113.1	R615 G645 L726	R615-N647 WeakPolarHBondContact CD-OD1 3.24Å; R615-N647 PolarHBondContact NH1-O 2.66Å; G645-N647 PolarHBondContact O-N 3.48Å; N647-L726 WeakPolarHBondContact O-CD2 3.05Å
648	A	66.8	Low	72.3	Confident	26 Å²	26	58.4 Å²	58.4	22%	0.215	34%	0.336	C	S	.	.	S	Bend	trans	-87.3	-29.1	171.8	0	0	0	0	0	112.4	K657 V660 L726	A648-K657 HydrophobicContact CB-CD 4.29Å; A648-V660 HydrophobicContact CB-CG1 3.9Å; A648-L726 HydrophobicContact CB-CD2 4.13Å
649	S	62.5	Low	71.4	Confident	42 Å²	42	61.5 Å²	61.5	29%	0.294	35%	0.352	S	S	.	.			trans	-76.2	130.7	177.3	-169.2	0	0	0	0	111.5	D651	S649-D651 PolarHBondContact OG-N 2.38Å; S649-D651 VanDerWaalsContact OG-N 3.11Å; S649-D651 PolarHBondContact OG-O 3.32Å
650	T	56.7	Low	70.9	Confident	36 Å²	36	57.5 Å²	57.5	22%	0.221	34%	0.338	C	S	.	.	S	Bend	trans	-78	-30.6	163.4	-59.7	0	0	0	0	111.1	D524 S529 R615	D524-T650 HydrophobicContact CB-CG2 4.25Å; D524-T650 VanDerWaalsContact OD2-CG2 3.24Å; D524-T650 WeakPolarHBondContact OD2-CG2 3.48Å; D524-T650 PolarHBondContact OD2-OG1 3.12Å; S529-T650 PolarHBondContact N-OG1 2.97Å; R615-T650 PolarHBondContact NH2-OG1 3.42Å; R615-T650 VanDerWaalsContact NH2-OG1 3.08Å
651	D	52.6	Low	70.6	Confident	16 Å²	16	59 Å²	59	9%	0.086	35%	0.345	C	S	.	.	S	Bend	trans	-85.9	111.6	-173.2	-65.9	-79.2	0	0	0	110.2	R531 Y550 H551 S649 M653 A654	R531-D651 IonicContact CZ-OD2 2.72Å; R531-D651 IonicContact NH1-OD2 3.69Å; R531-D651 VanDerWaalsContact NH2-CG 3.27Å; R531-D651 IonicContact NH2-OD1 3.47Å; R531-D651 PolarHBondContact NH2-OD1 3.47Å; R531-D651 VanDerWaalsContact NH2-OD1 3.12Å; R531-D651 IonicContact NH2-OD2 2.67Å; R531-D651 PolarHBondContact NH2-OD2 2.88Å; Y550-D651 WeakPolarHBondContact CA-OD1 3.31Å; H551-D651 HydrophobicContact CB-CB 4.06Å; H551-D651 IonicContact CD2-OD1 3.44Å; H551-D651 PolarHBondContact N-OD1 3.23Å; S649-D651 PolarHBondContact OG-N 2.38Å; S649-D651 VanDerWaalsContact OG-N 3.11Å; S649-D651 PolarHBondContact OG-O 3.32Å; D651-M653 PolarHBondContact O-N 3.18Å; D651-A654 HydrophobicContact CB-CB 3.81Å; D651-A654 PolarHBondContact O-N 2.97Å; D651-A654 VanDerWaalsContact O-N 3.14Å
652	G	48.4	Very low	70.4	Confident	72 Å²	72	57.4 Å²	57.4	74%	0.742	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-3.2	-165.4	0	0	0	0	0	117.1	H551	H551-G652 PolarHBondContact O-N 3.2Å
653	M	46.2	Very low	70.4	Confident	177 Å²	177	56.8 Å²	56.8	87%	0.872	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.5	11.2	173.6	-74.5	-167.9	167.9	0	0	113.5	D651	D651-M653 PolarHBondContact O-N 3.18Å
654	A	44.3	Very low	70.4	Confident	35 Å²	35	56.8 Å²	56.8	29%	0.289	33%	0.333	S	S	.	.	S	Bend	trans	-64.8	142.2	168.7	0	0	0	0	0	109.4	D651 Q656	D651-A654 HydrophobicContact CB-CB 3.81Å; D651-A654 PolarHBondContact O-N 2.97Å; D651-A654 VanDerWaalsContact O-N 3.14Å; A654-Q656 PolarHBondContact O-N 2.58Å
655	P	39.4	Very low	70.4	Confident	129 Å²	129	53.4 Å²	53.4	84%	0.838	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-55	127.6	-175.8	22.3	-33.6	0	0	0	110	K657	P655-K657 PolarHBondContact O-N 3.48Å
656	Q	49.7	Very low	70.7	Confident	130 Å²	130	51.4 Å²	51.4	61%	0.607	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-54.9	123	-170.7	-157.5	174.4	-40.7	0	0	109.4	A654 D658	A654-Q656 PolarHBondContact O-N 2.58Å; Q656-D658 PolarHBondContact NE2-O 2.86Å; Q656-D658 PolarHBondContact O-N 2.97Å
657	K	53	Low	70.9	Confident	102 Å²	102	52.6 Å²	52.6	44%	0.443	30%	0.303	S	S	.	.			trans	-65.9	86.8	157.3	-178.2	-170.4	-177.2	-173.3	0	103.6	A648 P655 N659 D716 D718	A648-K657 HydrophobicContact CB-CD 4.29Å; P655-K657 PolarHBondContact O-N 3.48Å; K657-N659 CarbonylContact O-C 3.6Å; K657-N659 WeakPolarHBondContact O-CA 3.1Å; K657-N659 PolarHBondContact O-N 3.31Å; K657-D716 IonicContact NZ-OD2 2.67Å; K657-D716 PolarHBondContact NZ-OD2 2.89Å; K657-D718 IonicContact NZ-OD1 3.8Å; K657-D718 PolarHBondContact NZ-OD1 3.01Å
658	D	64.9	Low	71.5	Confident	113 Å²	113	50.2 Å²	50.2	60%	0.604	29%	0.289	S	S	*	.			trans	-43	-43.3	-146.5	-75.6	-54.8	0	0	0	113.7	Q656 N687	Q656-D658 PolarHBondContact NE2-O 2.86Å; Q656-D658 PolarHBondContact O-N 2.97Å; D658-N687 PolarHBondContact O-ND2 3.2Å
659	N	77.9	Confident	72.6	Confident	65 Å²	65	49.1 Å²	49.1	35%	0.348	28%	0.28	S	S	.	.			trans	-136.6	150.7	168.3	-61.9	-94.5	0	0	0	112.9	K657 K685 N687	K657-N659 CarbonylContact O-C 3.6Å; K657-N659 WeakPolarHBondContact O-CA 3.1Å; K657-N659 PolarHBondContact O-N 3.31Å; N659-K685 HydrophobicContact CB-CB 3.74Å; N659-K685 HydrophobicContact CB-CG 4.37Å; N659-K685 PolarHBondContact OD1-O 2.81Å; N659-N687 VanDerWaalsContact CA-OD1 3.24Å; N659-N687 WeakPolarHBondContact CA-OD1 3.31Å
660	V	87.8	Confident	73.6	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	29%	0.29	C	S	.	.			trans	-83.6	161.3	164.5	-70.1	0	0	0	0	112	L646 A648 P662 K685 N686 N687 D716 L726	L646-V660 HydrophobicContact CB-CG2 4.06Å; A648-V660 HydrophobicContact CB-CG1 3.9Å; V660-P662 HydrophobicContact CG2-CB 4.32Å; V660-P662 HydrophobicContact CG2-CG 4.17Å; V660-P662 WeakPolarHBondContact O-CD 3.31Å; V660-K685 CarbonylContact O-C 3.54Å; V660-K685 VanDerWaalsContact O-CA 3.24Å; V660-K685 WeakPolarHBondContact O-CA 3.33Å; V660-K685 PolarHBondContact O-N 2.73Å; V660-N686 PolarHBondContact O-N 3.21Å; V660-N687 VanDerWaalsContact CG2-OD1 3.29Å; V660-N687 WeakPolarHBondContact CG2-OD1 3.36Å; V660-N687 PolarHBondContact N-OD1 3.42Å; V660-D716 HydrophobicContact CG1-CB 4.49Å; V660-L726 HydrophobicContact CB-CD1 4.19Å; V660-L726 HydrophobicContact CG1-CD1 4.23Å; V660-L726 HydrophobicContact CG1-CD2 3.94Å; V660-L726 HydrophobicContact CG2-CD1 4.09Å
661	D	91.6	Very high	74.2	Confident	30 Å²	30	50.8 Å²	50.8	16%	0.16	30%	0.296	C	S	.	.			trans	-105.1	70.4	169.5	-87.6	14.5	0	0	0	110	V682 V683 R684 K685 D716 Y717	D661-V682 HydrophobicContact CB-CG1 3.91Å; D661-V683 CarbonylContact C-O 3.56Å; D661-V683 VanDerWaalsContact CA-O 3.24Å; D661-V683 WeakPolarHBondContact CA-O 3.45Å; D661-R684 VanDerWaalsContact OD1-CA 3.24Å; D661-R684 WeakPolarHBondContact OD1-CA 3.34Å; D661-K685 PolarHBondContact OD1-N 2.78Å; D661-D716 PolarHBondContact N-OD1 3.02Å; D661-Y717 WeakPolarHBondContact O-CB 3.35Å; D661-Y717 PolarHBondContact O-N 3.44Å
662	P	94.9	Very high	74.7	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	143.7	-164.8	33.6	-40.6	0	0	0	115.2	L646 V660 V683 N686 P689 W691 V714 W715 L726	L646-P662 HydrophobicContact CD1-CB 3.61Å; L646-P662 HydrophobicContact CD1-CG 3.94Å; V660-P662 HydrophobicContact CG2-CB 4.32Å; V660-P662 HydrophobicContact CG2-CG 4.17Å; V660-P662 WeakPolarHBondContact O-CD 3.31Å; P662-V683 WeakPolarHBondContact CD-O 2.63Å; P662-V683 VanDerWaalsContact N-O 3.14Å; P662-V683 PolarHBondContact O-N 3.16Å; P662-N686 WeakPolarHBondContact CD-O 3.37Å; P662-N686 VanDerWaalsContact CG-O 3.23Å; P662-N686 WeakPolarHBondContact CG-O 3.18Å; P662-P689 HydrophobicContact CB-CG 4.15Å; P662-P689 HydrophobicContact CG-CB 3.64Å; P662-P689 HydrophobicContact CG-CG 3.52Å; P662-W691 HydrophobicContact CB-CZ2 4.07Å; P662-W691 HydrophobicContact CG-CZ2 4.4Å; P662-W691 PolarHBondContact O-NE1 3.48Å; P662-V714 HydrophobicContact CB-CG1 4.31Å; P662-W715 CarbonylContact C-O 3.54Å; P662-W715 VanDerWaalsContact CA-O 3.26Å; P662-W715 WeakPolarHBondContact CA-O 3.28Å; P662-L726 HydrophobicContact CB-CD1 4.17Å
663	Y	96.1	Very high	75.3	Confident	7 Å²	7	57.7 Å²	57.7	3%	0.027	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	157.5	166.9	69.4	-73.6	0	0	0	111.3	K665 K679 V682 W715 N723	Y663-K665 HydrophobicContact CD2-CG 4.33Å; Y663-K665 HydrophobicContact CE2-CD 4.26Å; Y663-K665 VanDerWaalsContact CE2-CE 3.49Å; Y663-K665 HydrophobicContact CE2-CG 3.74Å; Y663-K665 WeakPolarHBondContact OH-CE 3.19Å; Y663-K665 PolarHBondContact OH-NZ 2.91Å; Y663-K679 HydrophobicContact CD2-CD 4.45Å; Y663-K679 HydrophobicContact CE2-CD 4.48Å; Y663-V682 HydrophobicContact CD1-CG2 3.96Å; Y663-V682 HydrophobicContact CG-CG2 4.07Å; Y663-W715 HydrophobicContact CD1-CB 4.09Å; Y663-W715 VanDerWaalsContact CD1-O 3.23Å; Y663-W715 WeakPolarHBondContact CD1-O 3.41Å; Y663-W715 HydrophobicContact CE1-CB 3.42Å; Y663-W715 VanDerWaalsContact CE1-CB 3.42Å; Y663-W715 HydrophobicContact CE1-CG 4.45Å; Y663-W715 WeakPolarHBondContact CE1-O 3.35Å; Y663-W715 HydrophobicContact CE2-CB 4.13Å; Y663-W715 HydrophobicContact CE2-CG 4.45Å; Y663-W715 VanDerWaalsContact CZ-CB 3.4Å; Y663-W715 AromaticContact CZ-CG 3.99Å; Y663-W715 PolarHBondContact N-O 3.46Å; Y663-W715 PolarHBondContact O-N 3.25Å; Y663-W715 WeakPolarHBondContact OH-CB 3.39Å; Y663-N723 PolarHBondContact OH-ND2 3.33Å
664	V	96.6	Very high	75.8	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142	179	-175.2	0	0	0	0	110.4	I618 I640 K679 T680 W691 I712 S713 V714	I618-V664 HydrophobicContact CD1-CG2 4.37Å; I640-V664 HydrophobicContact CG2-CB 4.46Å; I640-V664 HydrophobicContact CG2-CG2 3.94Å; V664-K679 VanDerWaalsContact O-CA 3.23Å; V664-K679 WeakPolarHBondContact O-CA 3.42Å; V664-T680 HydrophobicContact CB-CG2 4.01Å; V664-T680 HydrophobicContact CG2-CG2 4.37Å; V664-T680 PolarHBondContact N-OG1 2.81Å; V664-T680 PolarHBondContact O-N 3.42Å; V664-T680 VanDerWaalsContact O-N 3.08Å; V664-W691 HydrophobicContact CG2-CD2 4.05Å; V664-W691 HydrophobicContact CG2-CE3 3.87Å; V664-W691 HydrophobicContact CG2-CH2 3.46Å; V664-W691 VanDerWaalsContact CG2-CH2 3.46Å; V664-W691 HydrophobicContact CG2-CZ2 3.66Å; V664-W691 HydrophobicContact CG2-CZ3 3.57Å; V664-I712 HydrophobicContact CG1-CG2 3.44Å; V664-I712 VanDerWaalsContact CG1-CG2 3.44Å; V664-S713 CarbonylContact C-O 3.54Å; V664-S713 WeakPolarHBondContact CA-O 3.44Å; V664-V714 HydrophobicContact CG2-CG2 4.33Å
665	K	94.5	Very high	76.5	Confident	24 Å²	24	65.2 Å²	65.2	10%	0.104	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.6	160.5	-47.8	170.2	-162.6	163.5	0	107.4	Y663 Y667 K679 S713 W715	Y663-K665 HydrophobicContact CD2-CG 4.33Å; Y663-K665 HydrophobicContact CE2-CD 4.26Å; Y663-K665 VanDerWaalsContact CE2-CE 3.49Å; Y663-K665 HydrophobicContact CE2-CG 3.74Å; Y663-K665 WeakPolarHBondContact OH-CE 3.19Å; Y663-K665 PolarHBondContact OH-NZ 2.91Å; K665-Y667 HydrophobicContact CB-CE2 4.22Å; K665-K679 HydrophobicContact CG-CG 4.43Å; K665-S713 PolarHBondContact N-O 3.01Å; K665-S713 PolarHBondContact O-N 3.38Å; K665-S713 PolarHBondContact O-OG 2.85Å; K665-S713 VanDerWaalsContact O-OG 3.09Å; K665-W715 HydrophobicContact CD-CD2 4.31Å; K665-W715 HydrophobicContact CD-CG 4.29Å; K665-W715 HydrophobicContact CD-CZ2 4.28Å; K665-W715 VanDerWaalsContact CE-CD1 3.44Å; K665-W715 VanDerWaalsContact CE-CD2 3.48Å; K665-W715 VanDerWaalsContact CE-CE2 3.44Å
666	I	94.3	Very high	78	Confident	1 Å²	1	60 Å²	60	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.6	177.5	-177.9	174	0	0	0	109.7	V638 I640 K677 Q678 I695 Y697 I710 E711 I712	V638-I666 HydrophobicContact CB-CD1 4.15Å; V638-I666 HydrophobicContact CG1-CD1 3.82Å; V638-I666 HydrophobicContact CG2-CD1 4.23Å; I640-I666 HydrophobicContact CD1-CD1 4.46Å; I666-K677 WeakPolarHBondContact O-CA 3.42Å; I666-Q678 HydrophobicContact CG2-CB 3.66Å; I666-Q678 PolarHBondContact N-O 3.19Å; I666-Q678 PolarHBondContact O-N 2.93Å; I666-I695 HydrophobicContact CG2-CD1 3.66Å; I666-Y697 HydrophobicContact CD1-CE2 4.29Å; I666-I710 HydrophobicContact CD1-CG2 3.54Å; I666-I710 HydrophobicContact CG1-CG2 3.59Å; I666-E711 CarbonylContact C-O 3.46Å; I666-E711 VanDerWaalsContact CA-O 3.31Å; I666-E711 WeakPolarHBondContact CA-O 3.41Å; I666-I712 HydrophobicContact CD1-CD1 4.35Å; I666-I712 HydrophobicContact CD1-CG1 4.15Å; I666-I712 HydrophobicContact CG1-CG1 4.12Å
667	Y	92.4	Very high	79.7	Confident	28 Å²	28	56.8 Å²	56.8	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.8	177.1	-51.5	-99.1	0	0	0	110.3	K665 K677 I710 E711	K665-Y667 HydrophobicContact CB-CE2 4.22Å; Y667-K677 HydrophobicContact CD1-CB 3.82Å; Y667-K677 HydrophobicContact CD1-CD 4.47Å; Y667-K677 HydrophobicContact CD1-CG 3.95Å; Y667-K677 HydrophobicContact CE1-CB 3.76Å; Y667-K677 HydrophobicContact CE1-CD 3.59Å; Y667-K677 HydrophobicContact CE1-CG 3.5Å; Y667-K677 VanDerWaalsContact OH-CE 3.29Å; Y667-K677 WeakPolarHBondContact OH-CE 3.14Å; Y667-K677 PolarHBondContact OH-NZ 3.07Å; Y667-I710 WeakPolarHBondContact O-CA 3.26Å; Y667-E711 PolarHBondContact N-O 3.44Å; Y667-E711 PolarHBondContact O-N 2.69Å
668	M	90.8	Very high	81.5	Confident	20 Å²	20	56 Å²	56	10%	0.099	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	135.4	160.4	-170.7	60.3	66.9	0	0	109.5	I636 G671 Y697 I700 I708 I710	I636-M668 HydrophobicContact CB-CE 4.42Å; I636-M668 HydrophobicContact CD1-CE 4.24Å; M668-G671 CarbonylContact O-C 3.54Å; M668-G671 PolarHBondContact O-N 3.44Å; M668-Y697 HydrophobicContact CB-CD1 3.99Å; M668-Y697 HydrophobicContact CB-CE1 3.86Å; M668-Y697 HydrophobicContact CE-CD1 4.15Å; M668-Y697 HydrophobicContact CE-CD2 3.59Å; M668-Y697 HydrophobicContact CE-CE2 4.21Å; M668-Y697 HydrophobicContact CE-CG 3.54Å; M668-I700 HydrophobicContact CE-CD1 4.03Å; M668-I708 HydrophobicContact SD-CD1 4.39Å; M668-I710 HydrophobicContact CE-CD1 4.49Å; M668-I710 HydrophobicContact CE-CG1 3.95Å; M668-I710 HydrophobicContact SD-CG1 4.21Å
669	L	89.9	Confident	82.9	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.4	178.1	-60.7	169.3	0	0	0	109.5	K672 I708 G709 E711 R730 W740	L669-K672 HydrophobicContact CD2-CD 4.38Å; L669-K672 VanDerWaalsContact CD2-CE 3.46Å; L669-K672 HydrophobicContact CD2-CG 4.01Å; L669-I708 WeakPolarHBondContact O-CA 3.41Å; L669-I708 VanDerWaalsContact O-CB 3.3Å; L669-I708 WeakPolarHBondContact O-CB 3.46Å; L669-G709 WeakPolarHBondContact CB-O 3.29Å; L669-G709 PolarHBondContact N-O 2.76Å; L669-G709 PolarHBondContact O-N 2.91Å; L669-E711 HydrophobicContact CD1-CB 3.87Å; L669-E711 HydrophobicContact CD2-CB 4.04Å; L669-E711 HydrophobicContact CG-CB 4.02Å; L669-R730 HydrophobicContact CD1-CG 4.49Å; L669-W740 HydrophobicContact CB-CG 4.39Å; L669-W740 HydrophobicContact CD1-CB 3.86Å; L669-W740 HydrophobicContact CD1-CG 4.13Å
670	P	83.1	Confident	83.7	Confident	79 Å²	79	53.2 Å²	53.2	51%	0.513	25%	0.254	S	S	.	.	S	Bend	cis	-76.2	-12.7	3.9	29.5	-36	0	0	0	115.2	K672 W740	P670-K672 PolarHBondContact O-N 2.85Å; P670-W740 HydrophobicContact CB-CH2 4.31Å; P670-W740 HydrophobicContact CB-CZ2 3.72Å
671	G	69.2	Low	84.1	Confident	34 Å²	34	61.3 Å²	61.3	35%	0.351	29%	0.289	S	S	.	.			trans	-74.1	76.4	-170.5	0	0	0	0	0	115.7	M668 E673 S676	M668-G671 CarbonylContact O-C 3.54Å; M668-G671 PolarHBondContact O-N 3.44Å; G671-E673 PolarHBondContact O-N 3.16Å; G671-S676 WeakPolarHBondContact O-CB 3.38Å; G671-S676 PolarHBondContact O-OG 2.81Å
672	K	63.4	Low	84.3	Confident	106 Å²	106	62.6 Å²	62.6	46%	0.461	30%	0.297	S	S	.	.			trans	-68.9	31.9	172.4	-59.2	-159.6	-178	-157.7	0	114.7	L669 P670 E711	L669-K672 HydrophobicContact CD2-CD 4.38Å; L669-K672 VanDerWaalsContact CD2-CE 3.46Å; L669-K672 HydrophobicContact CD2-CG 4.01Å; P670-K672 PolarHBondContact O-N 2.85Å; K672-E711 WeakPolarHBondContact CE-OE1 3.43Å; K672-E711 IonicContact NZ-OE1 2.85Å; K672-E711 PolarHBondContact NZ-OE1 2.86Å; K672-E711 IonicContact NZ-OE2 3.35Å; K672-E711 PolarHBondContact NZ-OE2 3.03Å
673	E	61.8	Low	84.3	Confident	128 Å²	128	64.3 Å²	64.3	60%	0.598	31%	0.308	S	S	*	.			trans	-72.9	164.9	-178.8	-61.7	-155.3	165	0	0	113.2	G671 Y675 S676	G671-E673 PolarHBondContact O-N 3.16Å; E673-Y675 PolarHBondContact O-N 3.45Å; E673-S676 PolarHBondContact O-N 3.4Å; E673-S676 PolarHBondContact O-OG 2.9Å
674	K	57.1	Low	84.1	Confident	176 Å²	176	73 Å²	73	77%	0.765	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.8	-179.7	-169.1	-179.9	174.7	-170.7	0	112.8
675	Y	57.9	Low	83.8	Confident	193 Å²	193	80.5 Å²	80.5	76%	0.757	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-30.1	-175.4	-52.2	-69.2	0	0	0	114	E673 K677	E673-Y675 PolarHBondContact O-N 3.45Å; Y675-K677 VanDerWaalsContact C-N 3.27Å
676	S	72.3	Confident	83.6	Confident	21 Å²	21	81.9 Å²	81.9	15%	0.147	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-16.6	174.1	68.3	0	0	0	0	112.6	G671 E673 Q678 Y697	G671-S676 WeakPolarHBondContact O-CB 3.38Å; G671-S676 PolarHBondContact O-OG 2.81Å; E673-S676 PolarHBondContact O-N 3.4Å; E673-S676 PolarHBondContact O-OG 2.9Å; S676-Q678 PolarHBondContact O-N 2.93Å; S676-Y697 VanDerWaalsContact O-CE1 3.28Å; S676-Y697 WeakPolarHBondContact O-CE1 3.44Å; S676-Y697 PolarHBondContact O-OH 3Å
677	K	84.9	Confident	83.5	Confident	61 Å²	61	83 Å²	83	27%	0.265	39%	0.388	S	S	.	.			trans	-74.7	108.6	-177	-176.1	179.9	-166.8	144.7	0	112	I666 Y667 Y675	I666-K677 WeakPolarHBondContact O-CA 3.42Å; Y667-K677 HydrophobicContact CD1-CB 3.82Å; Y667-K677 HydrophobicContact CD1-CD 4.47Å; Y667-K677 HydrophobicContact CD1-CG 3.95Å; Y667-K677 HydrophobicContact CE1-CB 3.76Å; Y667-K677 HydrophobicContact CE1-CD 3.59Å; Y667-K677 HydrophobicContact CE1-CG 3.5Å; Y667-K677 VanDerWaalsContact OH-CE 3.29Å; Y667-K677 WeakPolarHBondContact OH-CE 3.14Å; Y667-K677 PolarHBondContact OH-NZ 3.07Å; Y675-K677 VanDerWaalsContact C-N 3.27Å
678	Q	90.6	Very high	83.5	Confident	85 Å²	85	85.9 Å²	85.9	40%	0.397	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	162.5	170.2	-58.8	-70.6	-10.4	0	0	110.8	I666 S676 I695	I666-Q678 HydrophobicContact CG2-CB 3.66Å; I666-Q678 PolarHBondContact N-O 3.19Å; I666-Q678 PolarHBondContact O-N 2.93Å; S676-Q678 PolarHBondContact O-N 2.93Å; Q678-I695 HydrophobicContact CB-CD1 3.97Å; Q678-I695 HydrophobicContact CB-CG2 3.96Å; Q678-I695 HydrophobicContact CG-CG2 3.77Å
679	K	93.4	Very high	83.8	Confident	110 Å²	110	85 Å²	85	48%	0.478	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	153.8	179.7	-70.4	-170.9	-176.7	-178.8	0	111.9	Y663 V664 K665 Q693	Y663-K679 HydrophobicContact CD2-CD 4.45Å; Y663-K679 HydrophobicContact CE2-CD 4.48Å; V664-K679 VanDerWaalsContact O-CA 3.23Å; V664-K679 WeakPolarHBondContact O-CA 3.42Å; K665-K679 HydrophobicContact CG-CG 4.43Å; K679-Q693 PolarHBondContact O-NE2 2.96Å
680	T	96.1	Very high	84.1	Confident	11 Å²	11	90.8 Å²	90.8	7%	0.067	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-89.3	168.8	163	64.4	0	0	0	0	112.4	I640 V664 W691 Q693	I640-T680 HydrophobicContact CB-CG2 4.22Å; I640-T680 HydrophobicContact CG2-CG2 3.97Å; V664-T680 HydrophobicContact CB-CG2 4.01Å; V664-T680 HydrophobicContact CG2-CG2 4.37Å; V664-T680 PolarHBondContact N-OG1 2.81Å; V664-T680 PolarHBondContact O-N 3.42Å; V664-T680 VanDerWaalsContact O-N 3.08Å; T680-W691 VanDerWaalsContact CB-CD1 3.43Å; T680-W691 HydrophobicContact CG2-CB 3.8Å; T680-W691 HydrophobicContact CG2-CD2 4.34Å; T680-W691 HydrophobicContact CG2-CG 3.81Å; T680-W691 PolarHBondContact OG1-NE1 2.87Å; T680-W691 VanDerWaalsContact OG1-NE1 3.17Å; T680-Q693 HydrophobicContact CG2-CB 4.2Å
681	K	95.6	Very high	84.8	Confident	171 Å²	171	88.4 Å²	88.4	74%	0.743	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-63.9	151.2	167.1	-63.1	179	-177.6	172.8	0	110.4	V683 W691	K681-V683 PolarHBondContact O-N 3.31Å; K681-W691 PolarHBondContact O-NE1 3.44Å; K681-W691 VanDerWaalsContact O-NE1 3.09Å
682	V	95.8	Very high	86.1	Confident	56 Å²	56	90.8 Å²	90.8	34%	0.339	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-71.6	117.1	165.6	177.5	0	0	0	0	108.2	D661 Y663 R684 Y717	D661-V682 HydrophobicContact CB-CG1 3.91Å; Y663-V682 HydrophobicContact CD1-CG2 3.96Å; Y663-V682 HydrophobicContact CG-CG2 4.07Å; V682-R684 HydrophobicContact CG1-CG 4.36Å; V682-Y717 HydrophobicContact CG1-CD1 4.34Å; V682-Y717 HydrophobicContact CG1-CG 4.27Å; V682-Y717 HydrophobicContact CG2-CD1 4.5Å; V682-Y717 HydrophobicContact CG2-CD2 4.24Å; V682-Y717 HydrophobicContact CG2-CG 3.92Å
683	V	95	Very high	87.7	Confident	36 Å²	36	88.2 Å²	88.2	22%	0.218	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-83	129.6	162.1	-179.1	0	0	0	0	105.7	D661 P662 K681 N686 P689 E690	D661-V683 CarbonylContact C-O 3.56Å; D661-V683 VanDerWaalsContact CA-O 3.24Å; D661-V683 WeakPolarHBondContact CA-O 3.45Å; P662-V683 WeakPolarHBondContact CD-O 2.63Å; P662-V683 VanDerWaalsContact N-O 3.14Å; P662-V683 PolarHBondContact O-N 3.16Å; K681-V683 PolarHBondContact O-N 3.31Å; V683-N686 HydrophobicContact CG1-CB 3.77Å; V683-P689 HydrophobicContact CB-CB 3.91Å; V683-P689 HydrophobicContact CG1-CB 4.13Å; V683-P689 HydrophobicContact CG2-CB 3.94Å; V683-E690 WeakPolarHBondContact CG2-O 3.36Å
684	R	92.5	Very high	89.3	Confident	191 Å²	191	85.3 Å²	85.3	72%	0.721	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-90.9	145.1	179.6	-68.5	-168	179.9	137.8	2.3	111.3	D661 V682 N686	D661-R684 VanDerWaalsContact OD1-CA 3.24Å; D661-R684 WeakPolarHBondContact OD1-CA 3.34Å; V682-R684 HydrophobicContact CG1-CG 4.36Å; R684-N686 PolarHBondContact O-N 3.37Å
685	K	89.2	Confident	91.1	Very high	158 Å²	158	77.4 Å²	77.4	69%	0.687	37%	0.367	S	S	*	.	S	Bend	trans	42.2	57.3	173.8	-64.1	-171.4	175.5	-169.8	0	113	N659 V660 D661	N659-K685 HydrophobicContact CB-CB 3.74Å; N659-K685 HydrophobicContact CB-CG 4.37Å; N659-K685 PolarHBondContact OD1-O 2.81Å; V660-K685 CarbonylContact O-C 3.54Å; V660-K685 VanDerWaalsContact O-CA 3.24Å; V660-K685 WeakPolarHBondContact O-CA 3.33Å; V660-K685 PolarHBondContact O-N 2.73Å; D661-K685 PolarHBondContact OD1-N 2.78Å
686	N	90.9	Very high	92.8	Very high	52 Å²	52	71.7 Å²	71.7	28%	0.278	35%	0.348	S	S	.	.			trans	-148	119.1	176.7	-172.4	-1.4	0	0	0	112.1	V660 P662 V683 R684 N688	V660-N686 PolarHBondContact O-N 3.21Å; P662-N686 WeakPolarHBondContact CD-O 3.37Å; P662-N686 VanDerWaalsContact CG-O 3.23Å; P662-N686 WeakPolarHBondContact CG-O 3.18Å; V683-N686 HydrophobicContact CG1-CB 3.77Å; R684-N686 PolarHBondContact O-N 3.37Å; N686-N688 VanDerWaalsContact C-N 3.29Å; N686-N688 PolarHBondContact ND2-O 2.98Å; N686-N688 VanDerWaalsContact OD1-C 3.23Å; N686-N688 WeakPolarHBondContact OD1-CA 3.37Å; N686-N688 PolarHBondContact OD1-N 2.93Å; N686-N688 PolarHBondContact OD1-O 3.49Å
687	N	90.8	Very high	93.8	Very high	26 Å²	26	71.7 Å²	71.7	14%	0.139	35%	0.345	C	S	.	.	S	Bend	trans	-81.6	-8.3	176.9	-57.4	-24.4	0	0	0	113.3	G645 L646 D658 N659 V660	G645-N687 PolarHBondContact N-O 3.47Å; L646-N687 WeakPolarHBondContact CB-O 3.41Å; L646-N687 PolarHBondContact N-O 2.95Å; L646-N687 WeakPolarHBondContact O-CB 2.69Å; D658-N687 PolarHBondContact O-ND2 3.2Å; N659-N687 VanDerWaalsContact CA-OD1 3.24Å; N659-N687 WeakPolarHBondContact CA-OD1 3.31Å; V660-N687 VanDerWaalsContact CG2-OD1 3.29Å; V660-N687 WeakPolarHBondContact CG2-OD1 3.36Å; V660-N687 PolarHBondContact N-OD1 3.42Å
688	N	93.8	Very high	94.1	Very high	88 Å²	88	76.4 Å²	76.4	47%	0.471	36%	0.361	S	S	.	.	S	Bend	trans	-128.3	65	176.2	-52.7	-73.2	0	0	0	110.3	A643 K644 G645 N686	A643-N688 CarbonylContact O-C 3.32Å; A643-N688 VanDerWaalsContact O-C 3.27Å; A643-N688 WeakPolarHBondContact O-CA 3.01Å; K644-N688 VanDerWaalsContact CA-OD1 3.24Å; K644-N688 WeakPolarHBondContact CA-OD1 3.39Å; G645-N688 PolarHBondContact N-OD1 3.13Å; N686-N688 VanDerWaalsContact C-N 3.29Å; N686-N688 PolarHBondContact ND2-O 2.98Å; N686-N688 VanDerWaalsContact OD1-C 3.23Å; N686-N688 WeakPolarHBondContact OD1-CA 3.37Å; N686-N688 PolarHBondContact OD1-N 2.93Å; N686-N688 PolarHBondContact OD1-O 3.49Å
689	P	95.7	Very high	94	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	37%	0.372	C	S	.	.			trans	-73.4	145.5	-172.3	32.5	-39.6	0	0	0	113.1	S642 A643 L646 P662 V683 W691	S642-P689 CarbonylContact C-O 3.55Å; S642-P689 WeakPolarHBondContact CA-O 3.38Å; S642-P689 WeakPolarHBondContact CB-O 3.36Å; A643-P689 HydrophobicContact CB-CG 4.04Å; A643-P689 PolarHBondContact N-O 2.86Å; A643-P689 WeakPolarHBondContact O-CD 3.11Å; L646-P689 HydrophobicContact CD1-CG 3.68Å; P662-P689 HydrophobicContact CB-CG 4.15Å; P662-P689 HydrophobicContact CG-CB 3.64Å; P662-P689 HydrophobicContact CG-CG 3.52Å; V683-P689 HydrophobicContact CB-CB 3.91Å; V683-P689 HydrophobicContact CG1-CB 4.13Å; V683-P689 HydrophobicContact CG2-CB 3.94Å; P689-W691 HydrophobicContact CB-CH2 4.18Å; P689-W691 HydrophobicContact CB-CZ2 3.86Å; P689-W691 HydrophobicContact CG-CH2 3.38Å; P689-W691 HydrophobicContact CG-CZ2 3.49Å; P689-W691 VanDerWaalsContact CG-CZ2 3.49Å; P689-W691 HydrophobicContact CG-CZ3 3.95Å
690	E	97.1	Very high	93.9	Very high	125 Å²	125	73.5 Å²	73.5	58%	0.584	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	135	162.8	-56.7	-156.9	165.6	0	0	110.6	V683 N692	V683-E690 WeakPolarHBondContact CG2-O 3.36Å; E690-N692 PolarHBondContact OE2-ND2 2.78Å; E690-N692 VanDerWaalsContact OE2-ND2 3.08Å
691	W	97.3	Very high	93.7	Very high	28 Å²	28	77.1 Å²	77.1	11%	0.106	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	-32.8	175.3	-60.4	-72.3	0	0	0	112.4	I640 K641 A643 P662 V664 T680 K681 P689 Q693 V714	I640-W691 HydrophobicContact CG2-CB 4.45Å; I640-W691 HydrophobicContact CG2-CD2 4.29Å; I640-W691 HydrophobicContact CG2-CE3 3.66Å; I640-W691 HydrophobicContact CG2-CZ3 4.27Å; K641-W691 PolarHBondContact O-N 3.01Å; A643-W691 HydrophobicContact CB-CH2 3.83Å; A643-W691 HydrophobicContact CB-CZ3 3.73Å; P662-W691 HydrophobicContact CB-CZ2 4.07Å; P662-W691 HydrophobicContact CG-CZ2 4.4Å; P662-W691 PolarHBondContact O-NE1 3.48Å; V664-W691 HydrophobicContact CG2-CD2 4.05Å; V664-W691 HydrophobicContact CG2-CE3 3.87Å; V664-W691 HydrophobicContact CG2-CH2 3.46Å; V664-W691 VanDerWaalsContact CG2-CH2 3.46Å; V664-W691 HydrophobicContact CG2-CZ2 3.66Å; V664-W691 HydrophobicContact CG2-CZ3 3.57Å; T680-W691 VanDerWaalsContact CB-CD1 3.43Å; T680-W691 HydrophobicContact CG2-CB 3.8Å; T680-W691 HydrophobicContact CG2-CD2 4.34Å; T680-W691 HydrophobicContact CG2-CG 3.81Å; T680-W691 PolarHBondContact OG1-NE1 2.87Å; T680-W691 VanDerWaalsContact OG1-NE1 3.17Å; K681-W691 PolarHBondContact O-NE1 3.44Å; K681-W691 VanDerWaalsContact O-NE1 3.09Å; P689-W691 HydrophobicContact CB-CH2 4.18Å; P689-W691 HydrophobicContact CB-CZ2 3.86Å; P689-W691 HydrophobicContact CG-CH2 3.38Å; P689-W691 HydrophobicContact CG-CZ2 3.49Å; P689-W691 VanDerWaalsContact CG-CZ2 3.49Å; P689-W691 HydrophobicContact CG-CZ3 3.95Å; W691-Q693 PolarHBondContact O-N 3.38Å; W691-Q693 VanDerWaalsContact O-N 3.09Å; W691-V714 HydrophobicContact CH2-CG1 4.04Å; W691-V714 HydrophobicContact CZ2-CG1 4.46Å
692	N	96.9	Very high	93.5	Very high	84 Å²	84	70.7 Å²	70.7	45%	0.449	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	43.4	42.6	179.9	-68.6	-45.1	0	0	0	113.8	I640 K641 E690	I640-N692 CarbonylContact O-C 3.54Å; I640-N692 WeakPolarHBondContact O-CA 3.17Å; I640-N692 PolarHBondContact O-N 3.22Å; I640-N692 VanDerWaalsContact O-N 3.15Å; K641-N692 PolarHBondContact O-N 3.14Å; E690-N692 PolarHBondContact OE2-ND2 2.78Å; E690-N692 VanDerWaalsContact OE2-ND2 3.08Å
693	Q	96.8	Very high	93.3	Very high	53 Å²	53	74.1 Å²	74.1	25%	0.248	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.7	-171.6	-172.1	177	-43.1	0	0	111.6	I640 K679 T680 W691 I695	I640-Q693 PolarHBondContact N-O 2.58Å; I640-Q693 PolarHBondContact O-N 3.33Å; K679-Q693 PolarHBondContact O-NE2 2.96Å; T680-Q693 HydrophobicContact CG2-CB 4.2Å; W691-Q693 PolarHBondContact O-N 3.38Å; W691-Q693 VanDerWaalsContact O-N 3.09Å; Q693-I695 HydrophobicContact CG-CG1 4.42Å
694	A	95.8	Very high	93.1	Very high	67 Å²	67	73.6 Å²	73.6	55%	0.554	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	142.9	169.7	0	0	0	0	0	111.5	V638	V638-A694 CarbonylContact O-C 3.58Å; V638-A694 WeakPolarHBondContact O-CA 3.36Å
695	I	94.6	Very high	93.1	Very high	10 Å²	10	65.7 Å²	65.7	5%	0.051	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	132.1	-176.5	-63.7	174.7	0	0	0	107.3	V638 I640 I666 Q678 Q693 Y697	V638-I695 PolarHBondContact N-O 2.84Å; V638-I695 PolarHBondContact O-N 2.96Å; I640-I695 HydrophobicContact CG1-CD1 4.38Å; I666-I695 HydrophobicContact CG2-CD1 3.66Å; Q678-I695 HydrophobicContact CB-CD1 3.97Å; Q678-I695 HydrophobicContact CB-CG2 3.96Å; Q678-I695 HydrophobicContact CG-CG2 3.77Å; Q693-I695 HydrophobicContact CG-CG1 4.42Å; I695-Y697 HydrophobicContact CG2-CD2 4.49Å; I695-Y697 HydrophobicContact CG2-CE2 3.98Å
696	I	94.7	Very high	93.2	Very high	72 Å²	72	62.4 Å²	62.4	37%	0.369	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124	-176	-60.6	173.8	0	0	0	109.3	E635 R698	E635-I696 HydrophobicContact CB-CG2 4.17Å; E635-I696 WeakPolarHBondContact OE2-CG2 3.17Å; I696-R698 HydrophobicContact CG2-CG 4.02Å
697	Y	92.8	Very high	93.2	Very high	21 Å²	21	66 Å²	66	8%	0.082	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.6	167.6	-67.6	-79.9	0	0	0	109	E635 I636 V638 I666 M668 S676 I695	E635-Y697 CarbonylContact C-O 3.52Å; E635-Y697 WeakPolarHBondContact CA-O 3.21Å; E635-Y697 WeakPolarHBondContact CB-O 3.16Å; I636-Y697 PolarHBondContact N-O 2.93Å; I636-Y697 PolarHBondContact O-N 3.01Å; V638-Y697 HydrophobicContact CG2-CD2 4.29Å; V638-Y697 HydrophobicContact CG2-CE2 4.33Å; I666-Y697 HydrophobicContact CD1-CE2 4.29Å; M668-Y697 HydrophobicContact CB-CD1 3.99Å; M668-Y697 HydrophobicContact CB-CE1 3.86Å; M668-Y697 HydrophobicContact CE-CD1 4.15Å; M668-Y697 HydrophobicContact CE-CD2 3.59Å; M668-Y697 HydrophobicContact CE-CE2 4.21Å; M668-Y697 HydrophobicContact CE-CG 3.54Å; S676-Y697 VanDerWaalsContact O-CE1 3.28Å; S676-Y697 WeakPolarHBondContact O-CE1 3.44Å; S676-Y697 PolarHBondContact O-OH 3Å; I695-Y697 HydrophobicContact CG2-CD2 4.49Å; I695-Y697 HydrophobicContact CG2-CE2 3.98Å
698	R	91.3	Very high	93.3	Very high	160 Å²	160	65.7 Å²	65.7	60%	0.604	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	174.8	179.9	-53.1	-167.3	-177.7	-114.4	4.9	111.4	E635 I696 I700	E635-R698 HydrophobicContact CG-CB 4.49Å; E635-R698 HydrophobicContact CG-CG 4.32Å; E635-R698 WeakPolarHBondContact OE1-CD 3.49Å; E635-R698 WeakPolarHBondContact OE1-CG 3.22Å; E635-R698 IonicContact OE1-CZ 3.29Å; E635-R698 VanDerWaalsContact OE1-CZ 3.29Å; E635-R698 IonicContact OE1-NE 3.54Å; E635-R698 IonicContact OE1-NH1 2.63Å; E635-R698 PolarHBondContact OE1-NH1 3.43Å; I696-R698 HydrophobicContact CG2-CG 4.02Å; R698-I700 PolarHBondContact O-N 2.94Å; R698-I700 VanDerWaalsContact O-N 3.16Å
699	D	88.5	Confident	93.3	Very high	117 Å²	117	61.5 Å²	61.5	63%	0.626	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.5	25.4	174	-61.2	-67.8	0	0	0	115.3	G634 I701	G634-D699 PolarHBondContact O-N 3.41Å; D699-I701 PolarHBondContact O-N 2.92Å
700	I	91.4	Very high	93.2	Very high	17 Å²	17	61.5 Å²	61.5	9%	0.087	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	117.8	179.2	-58.7	-58.1	0	0	0	109.6	R633 G634 I636 M668 R698 L702 L705 I708	R633-I700 CarbonylContact C-O 3.53Å; R633-I700 VanDerWaalsContact CA-O 3.28Å; R633-I700 WeakPolarHBondContact CA-O 3.38Å; G634-I700 PolarHBondContact N-O 2.82Å; G634-I700 WeakPolarHBondContact O-CB 3.27Å; G634-I700 PolarHBondContact O-N 3.43Å; I636-I700 HydrophobicContact CB-CG1 4.46Å; I636-I700 HydrophobicContact CD1-CG1 4.24Å; I636-I700 HydrophobicContact CD1-CG2 3.9Å; I636-I700 HydrophobicContact CG1-CG1 4.11Å; I636-I700 HydrophobicContact CG1-CG2 4.24Å; M668-I700 HydrophobicContact CE-CD1 4.03Å; R698-I700 PolarHBondContact O-N 2.94Å; R698-I700 VanDerWaalsContact O-N 3.16Å; I700-L702 PolarHBondContact O-N 3.37Å; I700-L705 HydrophobicContact CG2-CD2 4.37Å; I700-I708 HydrophobicContact CD1-CD1 4.46Å; I700-I708 HydrophobicContact CG2-CD1 3.57Å
701	I	91.7	Very high	93.1	Very high	87 Å²	87	56.1 Å²	56.1	45%	0.446	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	115	175	-60.6	172.9	0	0	0	108.6	N632 D699 N703 S704	N632-I701 WeakPolarHBondContact O-CA 3.46Å; D699-I701 PolarHBondContact O-N 2.92Å; I701-N703 VanDerWaalsContact C-N 3.3Å; I701-N703 HydrophobicContact CG2-CB 4.41Å; I701-N703 PolarHBondContact O-N 2.95Å; I701-S704 PolarHBondContact O-N 3.21Å; I701-S704 PolarHBondContact O-OG 3.02Å
702	L	91.3	Very high	92.9	Very high	37 Å²	37	54.8 Å²	54.8	19%	0.194	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-63.1	-38.1	-171.2	-59.4	179.1	0	0	0	111.5	L624 P626 N632 I700 S704 L705	L624-L702 HydrophobicContact CD1-CD2 3.9Å; P626-L702 HydrophobicContact CB-CD1 4.28Å; N632-L702 PolarHBondContact O-N 2.9Å; I700-L702 PolarHBondContact O-N 3.37Å; L702-S704 PolarHBondContact O-N 2.76Å; L702-L705 WeakPolarHBondContact O-CD1 3.4Å; L702-L705 VanDerWaalsContact O-CG 3.23Å; L702-L705 WeakPolarHBondContact O-CG 3.45Å; L702-L705 PolarHBondContact O-N 3.43Å
703	N	90.7	Very high	92.8	Very high	128 Å²	128	51.2 Å²	51.2	68%	0.684	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-64.8	-6.2	174.4	-67.6	-2.2	0	0	0	115.1	N632 I701 N706	N632-N703 PolarHBondContact ND2-ND2 3.37Å; N632-N703 PolarHBondContact OD1-N 3.33Å; N632-N703 PolarHBondContact OD1-OD1 3Å; I701-N703 VanDerWaalsContact C-N 3.3Å; I701-N703 HydrophobicContact CG2-CB 4.41Å; I701-N703 PolarHBondContact O-N 2.95Å; N703-N706 PolarHBondContact O-OD1 3.43Å
704	S	90.8	Very high	92.7	Very high	24 Å²	24	48.7 Å²	48.7	17%	0.168	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-105.3	8.1	178	70.4	0	0	0	0	114.9	I701 L702 N706 E707 I708	I701-S704 PolarHBondContact O-N 3.21Å; I701-S704 PolarHBondContact O-OG 3.02Å; L702-S704 PolarHBondContact O-N 2.76Å; S704-N706 PolarHBondContact O-N 3.44Å; S704-E707 PolarHBondContact O-N 2.94Å; S704-I708 PolarHBondContact O-N 2.92Å; S704-I708 VanDerWaalsContact O-N 3.15Å
705	L	92.6	Very high	92.5	Very high	26 Å²	26	46.4 Å²	46.4	14%	0.136	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-8.5	178.9	-73	166.7	0	0	0	114.6	L624 I636 I700 L702 I708 W751 M754	L624-L705 HydrophobicContact CD1-CD1 4.43Å; L624-L705 HydrophobicContact CD1-CD2 4.33Å; L624-L705 HydrophobicContact CD2-CD1 3.74Å; I636-L705 HydrophobicContact CD1-CD2 3.93Å; I700-L705 HydrophobicContact CG2-CD2 4.37Å; L702-L705 WeakPolarHBondContact O-CD1 3.4Å; L702-L705 VanDerWaalsContact O-CG 3.23Å; L702-L705 WeakPolarHBondContact O-CG 3.45Å; L702-L705 PolarHBondContact O-N 3.43Å; L705-I708 HydrophobicContact CD2-CD1 4.28Å; L705-W751 HydrophobicContact CD2-CH2 4.46Å; L705-W751 HydrophobicContact CD2-CZ2 3.97Å; L705-W751 PolarHBondContact O-NE1 2.9Å; L705-M754 HydrophobicContact CD2-CE 4.19Å
706	N	92.3	Very high	92.3	Very high	89 Å²	89	46 Å²	46	48%	0.476	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-15.4	172.8	63.6	-28.2	0	0	0	114.4	N703 S704 C733	N703-N706 PolarHBondContact O-OD1 3.43Å; S704-N706 PolarHBondContact O-N 3.44Å; N706-C733 PolarHBondContact O-SG 3.04Å
707	E	90.3	Very high	92.1	Very high	127 Å²	127	46.9 Å²	46.9	59%	0.593	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-24.6	-176.7	-68.5	-178.3	-180	0	0	113.1	S704	S704-E707 PolarHBondContact O-N 2.94Å
708	I	92.6	Very high	91.6	Very high	19 Å²	19	47.1 Å²	47.1	10%	0.097	23%	0.229	C	C	.	.			trans	-92.4	172.8	177.2	72.2	178.1	0	0	0	112.7	I636 M668 L669 I700 S704 L705 W751	I636-I708 HydrophobicContact CD1-CD1 4.13Å; M668-I708 HydrophobicContact SD-CD1 4.39Å; L669-I708 WeakPolarHBondContact O-CA 3.41Å; L669-I708 VanDerWaalsContact O-CB 3.3Å; L669-I708 WeakPolarHBondContact O-CB 3.46Å; I700-I708 HydrophobicContact CD1-CD1 4.46Å; I700-I708 HydrophobicContact CG2-CD1 3.57Å; S704-I708 PolarHBondContact O-N 2.92Å; S704-I708 VanDerWaalsContact O-N 3.15Å; L705-I708 HydrophobicContact CD2-CD1 4.28Å; I708-W751 HydrophobicContact CD1-CH2 4.37Å; I708-W751 HydrophobicContact CD1-CZ2 4.49Å; I708-W751 HydrophobicContact CG1-CH2 3.96Å; I708-W751 HydrophobicContact CG1-CZ2 3.83Å
709	G	93.5	Very high	90.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.3	174.9	177.7	0	0	0	0	0	112.7	L669 I731	L669-G709 WeakPolarHBondContact CB-O 3.29Å; L669-G709 PolarHBondContact N-O 2.76Å; L669-G709 PolarHBondContact O-N 2.91Å; G709-I731 WeakPolarHBondContact CA-O 3.44Å
710	I	94.3	Very high	90.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.4	177.9	-65.4	163	0	0	0	109.5	I622 I636 V638 I666 Y667 M668 I712 R730 I731 W751	I622-I710 HydrophobicContact CD1-CD1 3.59Å; I622-I710 HydrophobicContact CG1-CD1 4.42Å; I636-I710 HydrophobicContact CG2-CD1 3.92Å; V638-I710 HydrophobicContact CG2-CD1 3.56Å; I666-I710 HydrophobicContact CD1-CG2 3.54Å; I666-I710 HydrophobicContact CG1-CG2 3.59Å; Y667-I710 WeakPolarHBondContact O-CA 3.26Å; M668-I710 HydrophobicContact CE-CD1 4.49Å; M668-I710 HydrophobicContact CE-CG1 3.95Å; M668-I710 HydrophobicContact SD-CG1 4.21Å; I710-I712 HydrophobicContact CG2-CD1 4.05Å; I710-I712 HydrophobicContact CG2-CG1 3.61Å; I710-R730 CarbonylContact O-C 3.6Å; I710-R730 VanDerWaalsContact O-CA 3.29Å; I710-R730 WeakPolarHBondContact O-CA 3.35Å; I710-I731 HydrophobicContact CB-CB 4.47Å; I710-I731 PolarHBondContact N-O 3.13Å; I710-I731 PolarHBondContact O-N 3.1Å; I710-W751 HydrophobicContact CD1-CZ3 3.98Å; I710-W751 HydrophobicContact CG1-CZ3 4.16Å
711	E	94	Very high	89.3	Confident	13 Å²	13	54.4 Å²	54.4	6%	0.061	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.8	169.3	-170.2	175.4	80.9	0	0	109.7	I666 Y667 L669 K672 R730	I666-E711 CarbonylContact C-O 3.46Å; I666-E711 VanDerWaalsContact CA-O 3.31Å; I666-E711 WeakPolarHBondContact CA-O 3.41Å; Y667-E711 PolarHBondContact N-O 3.44Å; Y667-E711 PolarHBondContact O-N 2.69Å; L669-E711 HydrophobicContact CD1-CB 3.87Å; L669-E711 HydrophobicContact CD2-CB 4.04Å; L669-E711 HydrophobicContact CG-CB 4.02Å; K672-E711 WeakPolarHBondContact CE-OE1 3.43Å; K672-E711 IonicContact NZ-OE1 2.85Å; K672-E711 PolarHBondContact NZ-OE1 2.86Å; K672-E711 IonicContact NZ-OE2 3.35Å; K672-E711 PolarHBondContact NZ-OE2 3.03Å; E711-R730 HydrophobicContact CB-CG 4.25Å; E711-R730 HydrophobicContact CG-CG 4.03Å; E711-R730 IonicContact OE2-CZ 2.79Å; E711-R730 IonicContact OE2-NE 2.58Å; E711-R730 PolarHBondContact OE2-NE 3.33Å; E711-R730 IonicContact OE2-NH2 2.67Å; E711-R730 PolarHBondContact OE2-NH2 3.22Å
712	I	95	Very high	88.6	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.1	179.4	-46.3	-177.7	0	0	0	108.3	I618 L620 I640 V664 I666 I710 G728 C729 I731	I618-I712 HydrophobicContact CD1-CG2 3.84Å; L620-I712 HydrophobicContact CD2-CD1 3.46Å; L620-I712 VanDerWaalsContact CD2-CD1 3.46Å; I640-I712 HydrophobicContact CD1-CD1 4.09Å; I640-I712 HydrophobicContact CD1-CG2 4.29Å; V664-I712 HydrophobicContact CG1-CG2 3.44Å; V664-I712 VanDerWaalsContact CG1-CG2 3.44Å; I666-I712 HydrophobicContact CD1-CD1 4.35Å; I666-I712 HydrophobicContact CD1-CG1 4.15Å; I666-I712 HydrophobicContact CG1-CG1 4.12Å; I710-I712 HydrophobicContact CG2-CD1 4.05Å; I710-I712 HydrophobicContact CG2-CG1 3.61Å; I712-G728 CarbonylContact O-C 3.48Å; I712-G728 WeakPolarHBondContact O-CA 3.27Å; I712-C729 PolarHBondContact N-O 3.3Å; I712-C729 PolarHBondContact O-N 2.96Å; I712-I731 HydrophobicContact CD1-CD1 3.8Å; I712-I731 HydrophobicContact CD1-CG1 4.47Å
713	S	93.8	Very high	88.4	Confident	9 Å²	9	53.2 Å²	53.2	6%	0.063	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	132.3	-178.7	55.7	0	0	0	0	111.2	V664 K665 W715 G727	V664-S713 CarbonylContact C-O 3.54Å; V664-S713 WeakPolarHBondContact CA-O 3.44Å; K665-S713 PolarHBondContact N-O 3.01Å; K665-S713 PolarHBondContact O-N 3.38Å; K665-S713 PolarHBondContact O-OG 2.85Å; K665-S713 VanDerWaalsContact O-OG 3.09Å; S713-W715 VanDerWaalsContact O-CD1 3.24Å; S713-W715 PolarHBondContact OG-NE1 3.19Å; S713-G727 CarbonylContact C-O 3.26Å; S713-G727 WeakPolarHBondContact CA-O 3.48Å
714	V	94.3	Very high	88	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	136.7	-179.7	-166.8	0	0	0	0	108.9	I618 L646 P662 V664 W691 L726 G727 L768	I618-V714 HydrophobicContact CD1-CG2 4.17Å; L646-V714 HydrophobicContact CD1-CG1 3.83Å; L646-V714 HydrophobicContact CD2-CG1 4.13Å; P662-V714 HydrophobicContact CB-CG1 4.31Å; V664-V714 HydrophobicContact CG2-CG2 4.33Å; W691-V714 HydrophobicContact CH2-CG1 4.04Å; W691-V714 HydrophobicContact CZ2-CG1 4.46Å; V714-L726 HydrophobicContact CB-CB 4.47Å; V714-L726 HydrophobicContact CG1-CD1 4.27Å; V714-L726 PolarHBondContact O-N 3.36Å; V714-G727 PolarHBondContact N-O 3.36Å; V714-G727 PolarHBondContact O-N 2.83Å; V714-L768 HydrophobicContact CB-CD1 4.32Å; V714-L768 HydrophobicContact CG2-CD1 3.81Å; V714-L768 HydrophobicContact CG2-CD2 3.8Å
715	W	92.5	Very high	87.8	Confident	18 Å²	18	48.2 Å²	48.2	7%	0.068	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	139.8	-169	-63.8	79.6	0	0	0	110.9	Y463 P662 Y663 K665 S713 D724 F725 N773	Y463-W715 HydrophobicContact CD2-CH2 4.34Å; Y463-W715 HydrophobicContact CD2-CZ3 4.38Å; Y463-W715 HydrophobicContact CE2-CH2 4.03Å; Y463-W715 AromaticContact CE2-CZ3 3.63Å; Y463-W715 HydrophobicContact CE2-CZ3 3.63Å; P662-W715 CarbonylContact C-O 3.54Å; P662-W715 VanDerWaalsContact CA-O 3.26Å; P662-W715 WeakPolarHBondContact CA-O 3.28Å; Y663-W715 HydrophobicContact CD1-CB 4.09Å; Y663-W715 VanDerWaalsContact CD1-O 3.23Å; Y663-W715 WeakPolarHBondContact CD1-O 3.41Å; Y663-W715 HydrophobicContact CE1-CB 3.42Å; Y663-W715 VanDerWaalsContact CE1-CB 3.42Å; Y663-W715 HydrophobicContact CE1-CG 4.45Å; Y663-W715 WeakPolarHBondContact CE1-O 3.35Å; Y663-W715 HydrophobicContact CE2-CB 4.13Å; Y663-W715 HydrophobicContact CE2-CG 4.45Å; Y663-W715 VanDerWaalsContact CZ-CB 3.4Å; Y663-W715 AromaticContact CZ-CG 3.99Å; Y663-W715 PolarHBondContact N-O 3.46Å; Y663-W715 PolarHBondContact O-N 3.25Å; Y663-W715 WeakPolarHBondContact OH-CB 3.39Å; K665-W715 HydrophobicContact CD-CD2 4.31Å; K665-W715 HydrophobicContact CD-CG 4.29Å; K665-W715 HydrophobicContact CD-CZ2 4.28Å; K665-W715 VanDerWaalsContact CE-CD1 3.44Å; K665-W715 VanDerWaalsContact CE-CD2 3.48Å; K665-W715 VanDerWaalsContact CE-CE2 3.44Å; S713-W715 VanDerWaalsContact O-CD1 3.24Å; S713-W715 PolarHBondContact OG-NE1 3.19Å; W715-D724 CarbonylContact C-O 3.53Å; W715-D724 VanDerWaalsContact CA-O 3.24Å; W715-D724 WeakPolarHBondContact CA-O 3.4Å; W715-F725 HydrophobicContact CD2-CB 4.41Å; W715-F725 HydrophobicContact CD2-CD2 4.16Å; W715-F725 AromaticContact CE2-CD2 3.71Å; W715-F725 HydrophobicContact CE3-CB 3.98Å; W715-F725 HydrophobicContact CE3-CD2 4.49Å; W715-F725 HydrophobicContact CH2-CB 4.12Å; W715-F725 HydrophobicContact CH2-CD2 4.03Å; W715-F725 AromaticContact CZ2-CD2 3.66Å; W715-F725 HydrophobicContact CZ2-CD2 3.66Å; W715-F725 HydrophobicContact CZ2-CE2 4.41Å; W715-F725 HydrophobicContact CZ3-CB 3.82Å; W715-F725 HydrophobicContact CZ3-CD2 4.43Å; W715-N773 WeakPolarHBondContact CH2-OD1 3.38Å
716	D	90.6	Very high	87.6	Confident	2 Å²	2	47 Å²	47	1%	0.011	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	145.2	165.1	-159	-0.5	0	0	0	109.3	K657 V660 D661 N723 D724 L726	K657-D716 IonicContact NZ-OD2 2.67Å; K657-D716 PolarHBondContact NZ-OD2 2.89Å; V660-D716 HydrophobicContact CG1-CB 4.49Å; D661-D716 PolarHBondContact N-OD1 3.02Å; D716-N723 WeakPolarHBondContact O-CA 3.49Å; D716-N723 WeakPolarHBondContact O-CB 3.39Å; D716-D724 HydrophobicContact CB-CB 4.08Å; D716-D724 PolarHBondContact N-O 3.49Å; D716-L726 HydrophobicContact CB-CD1 4.21Å; D716-L726 HydrophobicContact CB-CD2 4.2Å; D716-L726 HydrophobicContact CB-CG 4.21Å
717	Y	90.5	Very high	87.4	Confident	90 Å²	90	42.7 Å²	42.7	35%	0.353	21%	0.205	S	C	.	.			trans	-106.2	107.1	176.3	174.1	-95.3	0	0	0	110.2	D661 V682 R719	D661-Y717 WeakPolarHBondContact O-CB 3.35Å; D661-Y717 PolarHBondContact O-N 3.44Å; V682-Y717 HydrophobicContact CG1-CD1 4.34Å; V682-Y717 HydrophobicContact CG1-CG 4.27Å; V682-Y717 HydrophobicContact CG2-CD1 4.5Å; V682-Y717 HydrophobicContact CG2-CD2 4.24Å; V682-Y717 HydrophobicContact CG2-CG 3.92Å; Y717-R719 HydrophobicContact CE1-CB 4.29Å
718	D	81.9	Confident	87.5	Confident	27 Å²	27	36.7 Å²	36.7	14%	0.144	18%	0.176	C	C	.	.			trans	-102.2	125.5	174.4	-53	-84.9	0	0	0	110.3	K657 F720 S721 N723 D724	K657-D718 IonicContact NZ-OD1 3.8Å; K657-D718 PolarHBondContact NZ-OD1 3.01Å; D718-F720 VanDerWaalsContact C-N 3.31Å; D718-F720 PolarHBondContact O-N 3.34Å; D718-S721 WeakPolarHBondContact CB-OG 3.34Å; D718-N723 PolarHBondContact N-OD1 2.85Å; D718-N723 PolarHBondContact O-OD1 3.46Å; D718-D724 PolarHBondContact OD2-N 3.2Å
719	R	77.5	Confident	87.5	Confident	191 Å²	191	35.8 Å²	35.8	72%	0.721	17%	0.172	S	C	*	.	S	Bend	trans	-68.7	-27.5	-177.7	-175.6	176.8	176.2	-168.4	-0.4	113.9	Y717	Y717-R719 HydrophobicContact CE1-CB 4.29Å
720	F	72.3	Confident	87.5	Confident	180 Å²	180	37.2 Å²	37.2	79%	0.789	18%	0.177	S	C	*	.	S	Bend	trans	-125.2	2.3	-168.6	-55.8	-65.4	0	0	0	114.1	D718	D718-F720 VanDerWaalsContact C-N 3.31Å; D718-F720 PolarHBondContact O-N 3.34Å
721	S	72.7	Confident	87.6	Confident	75 Å²	75	37.2 Å²	37.2	52%	0.524	18%	0.177	S	C	.	.	S	Bend	trans	-136.1	-178.3	176	50.4	0	0	0	0	109.3	D718 N723	D718-S721 WeakPolarHBondContact CB-OG 3.34Å; S721-N723 PolarHBondContact O-N 3.17Å
722	S	77.6	Confident	87.6	Confident	61 Å²	61	36.6 Å²	36.6	43%	0.427	17%	0.174	S	C	.	.			trans	-84.1	110.2	177.4	45.2	0	0	0	0	110.5	K527 D724	K527-S722 PolarHBondContact NZ-O 2.97Å; S722-D724 PolarHBondContact O-N 2.89Å
723	N	85.8	Confident	87.6	Confident	39 Å²	39	37.4 Å²	37.4	21%	0.209	18%	0.18	C	C	.	.			trans	-23.5	115.3	172.1	-64.1	15.9	0	0	0	114.1	Y463 Y663 D716 D718 S721	Y463-N723 PolarHBondContact OH-O 3.46Å; Y663-N723 PolarHBondContact OH-ND2 3.33Å; D716-N723 WeakPolarHBondContact O-CA 3.49Å; D716-N723 WeakPolarHBondContact O-CB 3.39Å; D718-N723 PolarHBondContact N-OD1 2.85Å; D718-N723 PolarHBondContact O-OD1 3.46Å; S721-N723 PolarHBondContact O-N 3.17Å
724	D	83.4	Confident	87.4	Confident	39 Å²	39	37.5 Å²	37.5	21%	0.209	18%	0.182	C	C	.	.			trans	-70.1	145.4	178.6	-87.8	-47.6	0	0	0	113.5	Y463 K527 W715 D716 D718 S722	Y463-D724 WeakPolarHBondContact OH-CA 3.36Å; K527-D724 VanDerWaalsContact CD-OD1 3.27Å; K527-D724 WeakPolarHBondContact CD-OD1 3.22Å; K527-D724 WeakPolarHBondContact CE-OD1 3.35Å; K527-D724 WeakPolarHBondContact CG-OD1 3.25Å; K527-D724 IonicContact NZ-OD1 2.65Å; K527-D724 PolarHBondContact NZ-OD1 2.88Å; K527-D724 IonicContact NZ-OD2 2.68Å; W715-D724 CarbonylContact C-O 3.53Å; W715-D724 VanDerWaalsContact CA-O 3.24Å; W715-D724 WeakPolarHBondContact CA-O 3.4Å; D716-D724 HydrophobicContact CB-CB 4.08Å; D716-D724 PolarHBondContact N-O 3.49Å; D718-D724 PolarHBondContact OD2-N 3.2Å; S722-D724 PolarHBondContact O-N 2.89Å
725	F	86.7	Confident	87	Confident	7 Å²	7	39.5 Å²	39.5	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.4	173.7	175.1	-102.4	0	0	0	108.8	Y463 T526 W715 G727 L772 N773	Y463-F725 HydrophobicContact CE1-CB 4.26Å; T526-F725 HydrophobicContact CG2-CD1 4.22Å; W715-F725 HydrophobicContact CD2-CB 4.41Å; W715-F725 HydrophobicContact CD2-CD2 4.16Å; W715-F725 AromaticContact CE2-CD2 3.71Å; W715-F725 HydrophobicContact CE3-CB 3.98Å; W715-F725 HydrophobicContact CE3-CD2 4.49Å; W715-F725 HydrophobicContact CH2-CB 4.12Å; W715-F725 HydrophobicContact CH2-CD2 4.03Å; W715-F725 AromaticContact CZ2-CD2 3.66Å; W715-F725 HydrophobicContact CZ2-CD2 3.66Å; W715-F725 HydrophobicContact CZ2-CE2 4.41Å; W715-F725 HydrophobicContact CZ3-CB 3.82Å; W715-F725 HydrophobicContact CZ3-CD2 4.43Å; F725-G727 VanDerWaalsContact CE2-O 3.29Å; F725-G727 WeakPolarHBondContact CE2-O 3.26Å; F725-G727 VanDerWaalsContact CZ-CA 3.48Å; F725-L772 HydrophobicContact CZ-CB 4.15Å; F725-N773 WeakPolarHBondContact CB-ND2 3.42Å; F725-N773 HydrophobicContact CD1-CB 4.16Å; F725-N773 HydrophobicContact CD2-CB 3.98Å; F725-N773 HydrophobicContact CE1-CB 4.11Å; F725-N773 HydrophobicContact CE2-CB 3.92Å; F725-N773 HydrophobicContact CG-CB 4.09Å; F725-N773 WeakPolarHBondContact CG-ND2 3.25Å; F725-N773 HydrophobicContact CZ-CB 3.98Å
726	L	87.5	Confident	86.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-45.7	178.5	-62.2	173.6	0	0	0	110.2	R615 L646 N647 A648 V660 P662 V714 D716	R615-L726 WeakPolarHBondContact CB-O 3.34Å; R615-L726 WeakPolarHBondContact CG-O 3.31Å; L646-L726 HydrophobicContact CB-CD1 4.47Å; L646-L726 HydrophobicContact CD1-CD1 4.31Å; N647-L726 WeakPolarHBondContact O-CD2 3.05Å; A648-L726 HydrophobicContact CB-CD2 4.13Å; V660-L726 HydrophobicContact CB-CD1 4.19Å; V660-L726 HydrophobicContact CG1-CD1 4.23Å; V660-L726 HydrophobicContact CG1-CD2 3.94Å; V660-L726 HydrophobicContact CG2-CD1 4.09Å; P662-L726 HydrophobicContact CB-CD1 4.17Å; V714-L726 HydrophobicContact CB-CB 4.47Å; V714-L726 HydrophobicContact CG1-CD1 4.27Å; V714-L726 PolarHBondContact O-N 3.36Å; D716-L726 HydrophobicContact CB-CD1 4.21Å; D716-L726 HydrophobicContact CB-CD2 4.2Å; D716-L726 HydrophobicContact CB-CG 4.21Å
727	G	89	Confident	86	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.9	-174.3	175.7	0	0	0	0	0	112.3	S713 V714 F725 R769	S713-G727 CarbonylContact C-O 3.26Å; S713-G727 WeakPolarHBondContact CA-O 3.48Å; V714-G727 PolarHBondContact N-O 3.36Å; V714-G727 PolarHBondContact O-N 2.83Å; F725-G727 VanDerWaalsContact CE2-O 3.29Å; F725-G727 WeakPolarHBondContact CE2-O 3.26Å; F725-G727 VanDerWaalsContact CZ-CA 3.48Å; G727-R769 WeakPolarHBondContact CA-O 3.26Å
728	G	91.6	Very high	85.7	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	-178.4	175.7	0	0	0	0	0	114.4	I712 L768 R769 L772	I712-G728 CarbonylContact O-C 3.48Å; I712-G728 WeakPolarHBondContact O-CA 3.27Å; G728-L768 CarbonylContact O-C 3.49Å; G728-L768 WeakPolarHBondContact O-CA 3.39Å; G728-R769 PolarHBondContact N-O 2.86Å; G728-R769 PolarHBondContact O-N 3.28Å; G728-L772 WeakPolarHBondContact O-CD1 3.46Å
729	C	93.3	Very high	85.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	164.6	170.7	62.1	0	0	0	0	111.2	I712 E747 I766	I712-C729 PolarHBondContact N-O 3.3Å; I712-C729 PolarHBondContact O-N 2.96Å; C729-E747 WeakPolarHBondContact CA-OE1 3.5Å; C729-E747 HydrophobicContact CB-CG 4.19Å; C729-E747 WeakPolarHBondContact CB-OE1 3.45Å; C729-I766 HydrophobicContact CB-CG2 3.49Å; C729-I766 VanDerWaalsContact CB-CG2 3.49Å
730	R	94	Very high	86	Confident	30 Å²	30	48.8 Å²	48.8	11%	0.113	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	114.8	173.7	-78.1	-179.9	-179.1	149.5	6.1	110.7	L669 I710 E711 P739 D742 A743 E747 L772	L669-R730 HydrophobicContact CD1-CG 4.49Å; I710-R730 CarbonylContact O-C 3.6Å; I710-R730 VanDerWaalsContact O-CA 3.29Å; I710-R730 WeakPolarHBondContact O-CA 3.35Å; E711-R730 HydrophobicContact CB-CG 4.25Å; E711-R730 HydrophobicContact CG-CG 4.03Å; E711-R730 IonicContact OE2-CZ 2.79Å; E711-R730 IonicContact OE2-NE 2.58Å; E711-R730 PolarHBondContact OE2-NE 3.33Å; E711-R730 IonicContact OE2-NH2 2.67Å; E711-R730 PolarHBondContact OE2-NH2 3.22Å; R730-P739 PolarHBondContact NH1-O 3.14Å; R730-D742 WeakPolarHBondContact CD-OD1 3.37Å; R730-D742 IonicContact CZ-OD1 2.94Å; R730-D742 IonicContact NE-OD1 3.64Å; R730-D742 IonicContact NH1-OD1 3.47Å; R730-D742 PolarHBondContact NH1-OD1 3.38Å; R730-D742 IonicContact NH1-OD2 3.74Å; R730-A743 WeakPolarHBondContact O-CB 3.3Å; R730-E747 PolarHBondContact N-OE1 3.4Å; R730-E747 VanDerWaalsContact O-CB 3.29Å; R730-E747 WeakPolarHBondContact O-CB 3.48Å; R730-L772 HydrophobicContact CG-CD1 4.44Å; R730-L772 HydrophobicContact CG-CD2 4.01Å; R730-L772 VanDerWaalsContact CZ-CD2 3.41Å
731	I	95.7	Very high	86.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	111.5	-178.3	-50.9	-180	0	0	0	107.8	L620 I622 G709 I710 I712 E747 A750 W751 I766	L620-I731 HydrophobicContact CD1-CD1 3.79Å; L620-I731 HydrophobicContact CD2-CD1 3.9Å; I622-I731 HydrophobicContact CD1-CG2 4.17Å; G709-I731 WeakPolarHBondContact CA-O 3.44Å; I710-I731 HydrophobicContact CB-CB 4.47Å; I710-I731 PolarHBondContact N-O 3.13Å; I710-I731 PolarHBondContact O-N 3.1Å; I712-I731 HydrophobicContact CD1-CD1 3.8Å; I712-I731 HydrophobicContact CD1-CG1 4.47Å; I731-E747 WeakPolarHBondContact CG2-O 3.27Å; I731-A750 HydrophobicContact CG2-CB 4.24Å; I731-W751 HydrophobicContact CG2-CB 4.01Å; I731-W751 HydrophobicContact CG2-CE3 3.95Å; I731-I766 HydrophobicContact CD1-CD1 3.8Å; I731-I766 HydrophobicContact CG1-CD1 3.92Å
732	N	94.9	Very high	87.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	-178.2	178.9	59.5	73.8	0	0	0	111.5	G734 W740 L741 A743 W751	N732-G734 PolarHBondContact O-N 2.7Å; N732-G734 VanDerWaalsContact O-N 3.11Å; N732-G734 WeakPolarHBondContact OD1-CA 3.39Å; N732-G734 PolarHBondContact OD1-N 2.73Å; N732-W740 PolarHBondContact ND2-O 3.34Å; N732-L741 HydrophobicContact CB-CD2 3.89Å; N732-L741 VanDerWaalsContact OD1-CA 3.25Å; N732-L741 WeakPolarHBondContact OD1-CA 3.21Å; N732-A743 HydrophobicContact CB-CB 4.43Å; N732-A743 VanDerWaalsContact O-CB 3.31Å; N732-A743 WeakPolarHBondContact O-CB 3.4Å; N732-A743 VanDerWaalsContact OD1-CB 3.23Å; N732-A743 WeakPolarHBondContact OD1-CB 3.29Å; N732-A743 PolarHBondContact OD1-N 3.36Å; N732-W751 VanDerWaalsContact C-CD1 3.42Å; N732-W751 VanDerWaalsContact CA-CG 3.44Å; N732-W751 WeakPolarHBondContact O-CB 3.49Å
733	C	93.5	Very high	88.3	Confident	18 Å²	18	35.4 Å²	35.4	12%	0.122	18%	0.182	C	C	.	.			trans	-61.2	-15.2	-179.6	65.2	0	0	0	0	115.3	N706 S735 K748	N706-C733 PolarHBondContact O-SG 3.04Å; C733-S735 VanDerWaalsContact C-N 3.33Å; C733-S735 PolarHBondContact O-N 3.36Å; C733-S735 PolarHBondContact SG-OG 3.06Å; C733-K748 WeakPolarHBondContact O-CD 3.37Å; C733-K748 WeakPolarHBondContact O-CE 3.36Å; C733-K748 PolarHBondContact O-NZ 3.01Å
734	G	89.8	Confident	88.4	Confident	10 Å²	10	35.4 Å²	35.4	10%	0.103	18%	0.181	C	C	.	.			trans	59.7	40.9	-177.4	0	0	0	0	0	112.9	N732 L741 A743 K748	N732-G734 PolarHBondContact O-N 2.7Å; N732-G734 VanDerWaalsContact O-N 3.11Å; N732-G734 WeakPolarHBondContact OD1-CA 3.39Å; N732-G734 PolarHBondContact OD1-N 2.73Å; G734-L741 CarbonylContact C-O 3.47Å; G734-L741 VanDerWaalsContact C-O 3.32Å; G734-L741 VanDerWaalsContact CA-O 3.29Å; G734-L741 WeakPolarHBondContact CA-O 3.41Å; G734-A743 WeakPolarHBondContact CA-O 3.47Å; G734-K748 PolarHBondContact O-NZ 3.46Å
735	S	85.6	Confident	88.7	Confident	43 Å²	43	39.6 Å²	39.6	30%	0.301	20%	0.203	S	C	.	.			trans	-80.4	-16.7	-178.8	64.7	0	0	0	0	113.8	C733 N737 L741	C733-S735 VanDerWaalsContact C-N 3.33Å; C733-S735 PolarHBondContact O-N 3.36Å; C733-S735 PolarHBondContact SG-OG 3.06Å; S735-N737 PolarHBondContact O-N 2.93Å; S735-L741 PolarHBondContact N-O 3.4Å; S735-L741 WeakPolarHBondContact OG-CD1 3.47Å
736	R	79.9	Confident	89	Confident	145 Å²	145	41.3 Å²	41.3	55%	0.547	22%	0.219	S	C	.	.			trans	57.6	3.2	-179	-62.7	-178.6	168.8	-143.2	-7	116.4	S609 Q738 L741 M744	S609-R736 PolarHBondContact OG-NH2 3.06Å; S609-R736 VanDerWaalsContact OG-NH2 3.15Å; R736-Q738 PolarHBondContact O-N 3.24Å; R736-Q738 VanDerWaalsContact O-N 3.11Å; R736-L741 WeakPolarHBondContact CA-O 3.35Å; R736-L741 PolarHBondContact N-O 2.93Å; R736-M744 PolarHBondContact NH2-SD 3.09Å
737	N	83.1	Confident	89.4	Confident	132 Å²	132	41.8 Å²	41.8	71%	0.706	22%	0.221	S	C	*	.	S	Bend	trans	-63.4	-12.4	173.3	-68.3	-21.3	0	0	0	113.9	S735	S735-N737 PolarHBondContact O-N 2.93Å
738	Q	83.2	Confident	89.7	Confident	74 Å²	74	45.2 Å²	45.2	35%	0.346	24%	0.236	S	C	.	.	S	Bend	trans	-141.3	150.5	174.1	-67.5	-63.4	-30.4	0	0	109.6	R736 W740 L741	R736-Q738 PolarHBondContact O-N 3.24Å; R736-Q738 VanDerWaalsContact O-N 3.11Å; Q738-W740 HydrophobicContact CB-CD2 3.88Å; Q738-W740 HydrophobicContact CB-CE3 4.04Å; Q738-W740 HydrophobicContact CB-CH2 3.79Å; Q738-W740 HydrophobicContact CB-CZ2 3.61Å; Q738-W740 HydrophobicContact CB-CZ3 4Å; Q738-W740 HydrophobicContact CG-CH2 3.73Å; Q738-W740 HydrophobicContact CG-CZ2 3.56Å; Q738-W740 HydrophobicContact CG-CZ3 4.38Å; Q738-W740 PolarHBondContact O-N 2.79Å; Q738-L741 HydrophobicContact CB-CB 4.46Å; Q738-L741 HydrophobicContact CB-CD1 3.99Å; Q738-L741 HydrophobicContact CB-CG 4.09Å; Q738-L741 HydrophobicContact CG-CD1 4.19Å; Q738-L741 PolarHBondContact O-N 2.94Å
739	P	82.5	Confident	89.9	Confident	106 Å²	106	48.9 Å²	48.9	69%	0.688	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-6.4	-176.7	-24.5	35	0	0	0	116.4	R730	R730-P739 PolarHBondContact NH1-O 3.14Å
740	W	84.6	Confident	90.1	Very high	65 Å²	65	49 Å²	49	25%	0.246	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-2.8	175.4	66.5	79.2	0	0	0	113.8	L669 P670 N732 Q738 D742	L669-W740 HydrophobicContact CB-CG 4.39Å; L669-W740 HydrophobicContact CD1-CB 3.86Å; L669-W740 HydrophobicContact CD1-CG 4.13Å; P670-W740 HydrophobicContact CB-CH2 4.31Å; P670-W740 HydrophobicContact CB-CZ2 3.72Å; N732-W740 PolarHBondContact ND2-O 3.34Å; Q738-W740 HydrophobicContact CB-CD2 3.88Å; Q738-W740 HydrophobicContact CB-CE3 4.04Å; Q738-W740 HydrophobicContact CB-CH2 3.79Å; Q738-W740 HydrophobicContact CB-CZ2 3.61Å; Q738-W740 HydrophobicContact CB-CZ3 4Å; Q738-W740 HydrophobicContact CG-CH2 3.73Å; Q738-W740 HydrophobicContact CG-CZ2 3.56Å; Q738-W740 HydrophobicContact CG-CZ3 4.38Å; Q738-W740 PolarHBondContact O-N 2.79Å; W740-D742 VanDerWaalsContact C-OD1 3.24Å; W740-D742 WeakPolarHBondContact CA-OD1 3.47Å; W740-D742 PolarHBondContact O-N 3.32Å
741	L	89.8	Confident	90.3	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.021	26%	0.258	C	S	.	.			trans	-94.6	39.7	174.3	-63.8	176.7	0	0	0	110.7	N732 G734 S735 R736 Q738	N732-L741 HydrophobicContact CB-CD2 3.89Å; N732-L741 VanDerWaalsContact OD1-CA 3.25Å; N732-L741 WeakPolarHBondContact OD1-CA 3.21Å; G734-L741 CarbonylContact C-O 3.47Å; G734-L741 VanDerWaalsContact C-O 3.32Å; G734-L741 VanDerWaalsContact CA-O 3.29Å; G734-L741 WeakPolarHBondContact CA-O 3.41Å; S735-L741 PolarHBondContact N-O 3.4Å; S735-L741 WeakPolarHBondContact OG-CD1 3.47Å; R736-L741 WeakPolarHBondContact CA-O 3.35Å; R736-L741 PolarHBondContact N-O 2.93Å; Q738-L741 HydrophobicContact CB-CB 4.46Å; Q738-L741 HydrophobicContact CB-CD1 3.99Å; Q738-L741 HydrophobicContact CB-CG 4.09Å; Q738-L741 HydrophobicContact CG-CD1 4.19Å; Q738-L741 PolarHBondContact O-N 2.94Å
742	D	88.6	Confident	90.3	Very high	30 Å²	30	50.9 Å²	50.9	16%	0.16	28%	0.275	C	S	.	.			trans	-102.4	19.4	-171.1	66.6	-60.6	0	0	0	113.6	R730 W740 R769	R730-D742 WeakPolarHBondContact CD-OD1 3.37Å; R730-D742 IonicContact CZ-OD1 2.94Å; R730-D742 IonicContact NE-OD1 3.64Å; R730-D742 IonicContact NH1-OD1 3.47Å; R730-D742 PolarHBondContact NH1-OD1 3.38Å; R730-D742 IonicContact NH1-OD2 3.74Å; W740-D742 VanDerWaalsContact C-OD1 3.24Å; W740-D742 WeakPolarHBondContact CA-OD1 3.47Å; W740-D742 PolarHBondContact O-N 3.32Å; D742-R769 PolarHBondContact O-NH2 3.27Å; D742-R769 IonicContact OD2-CZ 2.96Å; D742-R769 IonicContact OD2-NH1 2.84Å; D742-R769 PolarHBondContact OD2-NH1 3.19Å; D742-R769 IonicContact OD2-NH2 3.34Å
743	A	91	Very high	90.4	Very high	2 Å²	2	51.7 Å²	51.7	2%	0.017	28%	0.281	C	S	.	.			trans	-57.7	142.8	176.9	0	0	0	0	0	112.5	R730 N732 G734 E747 K748	R730-A743 WeakPolarHBondContact O-CB 3.3Å; N732-A743 HydrophobicContact CB-CB 4.43Å; N732-A743 VanDerWaalsContact O-CB 3.31Å; N732-A743 WeakPolarHBondContact O-CB 3.4Å; N732-A743 VanDerWaalsContact OD1-CB 3.23Å; N732-A743 WeakPolarHBondContact OD1-CB 3.29Å; N732-A743 PolarHBondContact OD1-N 3.36Å; G734-A743 WeakPolarHBondContact CA-O 3.47Å; A743-E747 HydrophobicContact CB-CB 4Å; A743-K748 HydrophobicContact CB-CB 4.28Å
744	M	88.5	Confident	90.6	Very high	39 Å²	39	50.9 Å²	50.9	19%	0.192	28%	0.276	C	S	.	.			trans	-139.4	161.1	177.6	-74.9	-173.4	65	0	0	112.5	S609 R736 A746 E747 K748	S609-M744 WeakPolarHBondContact CB-SD 2.97Å; S609-M744 PolarHBondContact OG-SD 3.11Å; S609-M744 VanDerWaalsContact OG-SD 3.42Å; R736-M744 PolarHBondContact NH2-SD 3.09Å; M744-A746 PolarHBondContact O-N 3.49Å; M744-E747 PolarHBondContact N-OE2 3.05Å; M744-E747 VanDerWaalsContact O-CB 3.3Å; M744-E747 WeakPolarHBondContact O-CB 3.36Å; M744-E747 PolarHBondContact O-N 2.59Å; M744-K748 PolarHBondContact O-N 3.43Å
745	N	90.2	Very high	90.8	Very high	126 Å²	126	52.5 Å²	52.5	67%	0.674	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	-126.7	171.3	-53	-12.3	0	0	0	110.7	E747 K748 S749	N745-E747 PolarHBondContact O-N 2.93Å; N745-K748 PolarHBondContact O-N 3.38Å; N745-K748 VanDerWaalsContact O-N 3.07Å; N745-S749 PolarHBondContact O-N 2.87Å; N745-S749 PolarHBondContact O-OG 3.45Å
746	A	93.4	Very high	91.3	Very high	44 Å²	44	57 Å²	57	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-53.5	-34.1	178.5	0	0	0	0	0	114.5	M744 A750 I766	M744-A746 PolarHBondContact O-N 3.49Å; A746-A750 VanDerWaalsContact O-CB 3.23Å; A746-A750 WeakPolarHBondContact O-CB 3.28Å; A746-A750 PolarHBondContact O-N 2.93Å; A746-I766 HydrophobicContact CB-CG1 4.27Å
747	E	94.8	Very high	92.1	Very high	9 Å²	9	55.3 Å²	55.3	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-66	-41.2	177.7	-57.7	165.9	128.9	0	0	112.1	C729 R730 I731 A743 M744 N745 W751 I766 R769	C729-E747 WeakPolarHBondContact CA-OE1 3.5Å; C729-E747 HydrophobicContact CB-CG 4.19Å; C729-E747 WeakPolarHBondContact CB-OE1 3.45Å; R730-E747 PolarHBondContact N-OE1 3.4Å; R730-E747 VanDerWaalsContact O-CB 3.29Å; R730-E747 WeakPolarHBondContact O-CB 3.48Å; I731-E747 WeakPolarHBondContact CG2-O 3.27Å; A743-E747 HydrophobicContact CB-CB 4Å; M744-E747 PolarHBondContact N-OE2 3.05Å; M744-E747 VanDerWaalsContact O-CB 3.3Å; M744-E747 WeakPolarHBondContact O-CB 3.36Å; M744-E747 PolarHBondContact O-N 2.59Å; N745-E747 PolarHBondContact O-N 2.93Å; E747-W751 PolarHBondContact O-N 2.7Å; E747-I766 HydrophobicContact CG-CD1 4.25Å; E747-I766 HydrophobicContact CG-CG2 3.58Å; E747-R769 IonicContact OE1-CZ 3.48Å; E747-R769 IonicContact OE1-NE 3.53Å; E747-R769 PolarHBondContact OE1-NE 2.88Å; E747-R769 IonicContact OE1-NH2 3.53Å; E747-R769 PolarHBondContact OE1-NH2 3.3Å; E747-R769 IonicContact OE2-CZ 3.48Å; E747-R769 IonicContact OE2-NE 2.78Å; E747-R769 PolarHBondContact OE2-NE 3.42Å; E747-R769 IonicContact OE2-NH2 3.57Å; E747-R769 PolarHBondContact OE2-NH2 3.06Å
748	K	95.3	Very high	92.6	Very high	73 Å²	73	51.5 Å²	51.5	32%	0.317	28%	0.278	S	S	.	.	H	α-helix	trans	-75.1	-43.9	179	178.7	170.5	177.9	150.9	0	110.6	C733 G734 A743 M744 N745 A750 W751 L752	C733-K748 WeakPolarHBondContact O-CD 3.37Å; C733-K748 WeakPolarHBondContact O-CE 3.36Å; C733-K748 PolarHBondContact O-NZ 3.01Å; G734-K748 PolarHBondContact O-NZ 3.46Å; A743-K748 HydrophobicContact CB-CB 4.28Å; M744-K748 PolarHBondContact O-N 3.43Å; N745-K748 PolarHBondContact O-N 3.38Å; N745-K748 VanDerWaalsContact O-N 3.07Å; K748-A750 VanDerWaalsContact C-N 3.31Å; K748-A750 PolarHBondContact O-N 2.91Å; K748-W751 PolarHBondContact O-N 2.9Å; K748-L752 HydrophobicContact CG-CD1 3.93Å; K748-L752 HydrophobicContact CG-CG 4.28Å; K748-L752 WeakPolarHBondContact O-CG 3.39Å; K748-L752 PolarHBondContact O-N 2.91Å
749	S	96.7	Very high	93.2	Very high	76 Å²	76	52.8 Å²	52.8	53%	0.531	29%	0.287	S	S	.	.	H	α-helix	trans	-59.7	-40.3	176.9	-58.9	0	0	0	0	112.1	N745 W751 L752 A753	N745-S749 PolarHBondContact O-N 2.87Å; N745-S749 PolarHBondContact O-OG 3.45Å; S749-W751 PolarHBondContact O-N 3.28Å; S749-L752 PolarHBondContact O-N 2.99Å; S749-A753 VanDerWaalsContact O-CB 3.22Å; S749-A753 WeakPolarHBondContact O-CB 3.38Å; S749-A753 PolarHBondContact O-N 3.33Å
750	A	97.1	Very high	93.9	Very high	4 Å²	4	51.9 Å²	51.9	3%	0.033	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-38.4	176.2	0	0	0	0	0	112.8	I731 A746 K748 M754 A764	I731-A750 HydrophobicContact CG2-CB 4.24Å; A746-A750 VanDerWaalsContact O-CB 3.23Å; A746-A750 WeakPolarHBondContact O-CB 3.28Å; A746-A750 PolarHBondContact O-N 2.93Å; K748-A750 VanDerWaalsContact C-N 3.31Å; K748-A750 PolarHBondContact O-N 2.91Å; A750-M754 WeakPolarHBondContact O-CB 3.15Å; A750-M754 PolarHBondContact O-N 3.45Å; A750-A764 HydrophobicContact CB-CB 3.81Å
751	W	97.3	Very high	94.5	Very high	2 Å²	2	53 Å²	53	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-70.6	-46.4	176.4	-168.9	-99.7	0	0	0	112.6	I622 I636 L705 I708 I710 I731 N732 E747 K748 S749 M754 C755	I622-W751 HydrophobicContact CD1-CE3 3.97Å; I622-W751 HydrophobicContact CD1-CZ3 4.13Å; I636-W751 HydrophobicContact CD1-CH2 3.67Å; I636-W751 HydrophobicContact CD1-CZ3 4.14Å; L705-W751 HydrophobicContact CD2-CH2 4.46Å; L705-W751 HydrophobicContact CD2-CZ2 3.97Å; L705-W751 PolarHBondContact O-NE1 2.9Å; I708-W751 HydrophobicContact CD1-CH2 4.37Å; I708-W751 HydrophobicContact CD1-CZ2 4.49Å; I708-W751 HydrophobicContact CG1-CH2 3.96Å; I708-W751 HydrophobicContact CG1-CZ2 3.83Å; I710-W751 HydrophobicContact CD1-CZ3 3.98Å; I710-W751 HydrophobicContact CG1-CZ3 4.16Å; I731-W751 HydrophobicContact CG2-CB 4.01Å; I731-W751 HydrophobicContact CG2-CE3 3.95Å; N732-W751 VanDerWaalsContact C-CD1 3.42Å; N732-W751 VanDerWaalsContact CA-CG 3.44Å; N732-W751 WeakPolarHBondContact O-CB 3.49Å; E747-W751 PolarHBondContact O-N 2.7Å; K748-W751 PolarHBondContact O-N 2.9Å; S749-W751 PolarHBondContact O-N 3.28Å; W751-M754 HydrophobicContact CD2-CE 4.06Å; W751-M754 HydrophobicContact CE3-CE 3.93Å; W751-M754 HydrophobicContact CH2-CE 4.31Å; W751-M754 HydrophobicContact CZ2-CE 4.39Å; W751-M754 HydrophobicContact CZ3-CE 4.07Å; W751-M754 WeakPolarHBondContact O-CB 3.31Å; W751-M754 PolarHBondContact O-N 3.25Å; W751-C755 PolarHBondContact O-N 2.68Å; W751-C755 VanDerWaalsContact O-N 3.13Å; W751-C755 PolarHBondContact O-SG 3.3Å; W751-C755 VanDerWaalsContact O-SG 3.39Å
752	L	96.7	Very high	94.9	Very high	67 Å²	67	53.2 Å²	53.2	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-63.7	-48.5	-179.5	-66.7	177.7	0	0	0	111.1	K748 S749 M754 C755 E756	K748-L752 HydrophobicContact CG-CD1 3.93Å; K748-L752 HydrophobicContact CG-CG 4.28Å; K748-L752 WeakPolarHBondContact O-CG 3.39Å; K748-L752 PolarHBondContact O-N 2.91Å; S749-L752 PolarHBondContact O-N 2.99Å; L752-M754 PolarHBondContact O-N 3.06Å; L752-C755 PolarHBondContact O-N 2.97Å; L752-E756 WeakPolarHBondContact O-CB 3.47Å; L752-E756 VanDerWaalsContact O-CG 3.29Å; L752-E756 WeakPolarHBondContact O-CG 3.5Å; L752-E756 PolarHBondContact O-N 3.28Å
753	A	97.2	Very high	95.3	Very high	17 Å²	17	57.3 Å²	57.3	14%	0.14	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-26.1	177	0	0	0	0	0	113.3	S749 R757 I762	S749-A753 VanDerWaalsContact O-CB 3.22Å; S749-A753 WeakPolarHBondContact O-CB 3.38Å; S749-A753 PolarHBondContact O-N 3.33Å; A753-R757 WeakPolarHBondContact O-CB 3.49Å; A753-R757 PolarHBondContact O-N 3.01Å; A753-I762 HydrophobicContact CB-CD1 4.34Å; A753-I762 HydrophobicContact CB-CG2 3.86Å; A753-I762 VanDerWaalsContact O-CD1 3.32Å; A753-I762 WeakPolarHBondContact O-CD1 3.41Å
754	M	97.2	Very high	95.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-72	-41.6	173.2	-177.3	-151.8	60.9	0	0	111.9	I622 L624 I636 L705 A750 W751 L752 R757 I762	I622-M754 HydrophobicContact CD1-SD 3.49Å; I622-M754 WeakPolarHBondContact CD1-SD 3.3Å; I622-M754 HydrophobicContact CG1-CG 4.29Å; I622-M754 HydrophobicContact CG1-SD 3.55Å; I622-M754 VanDerWaalsContact CG1-SD 3.55Å; I622-M754 HydrophobicContact CG2-CB 4.19Å; I622-M754 HydrophobicContact CG2-CG 4.39Å; L624-M754 HydrophobicContact CB-CE 4.22Å; L624-M754 HydrophobicContact CB-CG 3.77Å; L624-M754 HydrophobicContact CB-SD 4Å; L624-M754 VanDerWaalsContact N-CG 3.28Å; I636-M754 HydrophobicContact CD1-CE 4.31Å; I636-M754 HydrophobicContact CG1-CE 4.48Å; I636-M754 HydrophobicContact CG1-SD 4.37Å; I636-M754 HydrophobicContact CG2-SD 3.99Å; L705-M754 HydrophobicContact CD2-CE 4.19Å; A750-M754 WeakPolarHBondContact O-CB 3.15Å; A750-M754 PolarHBondContact O-N 3.45Å; W751-M754 HydrophobicContact CD2-CE 4.06Å; W751-M754 HydrophobicContact CE3-CE 3.93Å; W751-M754 HydrophobicContact CH2-CE 4.31Å; W751-M754 HydrophobicContact CZ2-CE 4.39Å; W751-M754 HydrophobicContact CZ3-CE 4.07Å; W751-M754 WeakPolarHBondContact O-CB 3.31Å; W751-M754 PolarHBondContact O-N 3.25Å; L752-M754 PolarHBondContact O-N 3.06Å; M754-R757 CarbonylContact O-C 3.47Å; M754-I762 HydrophobicContact CB-CG1 3.95Å
755	C	94.7	Very high	95.9	Very high	45 Å²	45	59 Å²	59	30%	0.304	31%	0.313	S	S	.	.	H	α-helix	trans	-69.6	-37	176.2	-64.7	0	0	0	0	112	W751 L752	W751-C755 PolarHBondContact O-N 2.68Å; W751-C755 VanDerWaalsContact O-N 3.13Å; W751-C755 PolarHBondContact O-SG 3.3Å; W751-C755 VanDerWaalsContact O-SG 3.39Å; L752-C755 PolarHBondContact O-N 2.97Å
756	E	95.6	Very high	96.1	Very high	137 Å²	137	53.2 Å²	53.2	64%	0.64	28%	0.281	S	S	*	.	H	α-helix	trans	-71.3	-31.9	177.1	-70.2	159.9	-164.6	0	0	113	L752 P758	L752-E756 WeakPolarHBondContact O-CB 3.47Å; L752-E756 VanDerWaalsContact O-CG 3.29Å; L752-E756 WeakPolarHBondContact O-CG 3.5Å; L752-E756 PolarHBondContact O-N 3.28Å; E756-P758 VanDerWaalsContact C-CD 3.5Å; E756-P758 WeakPolarHBondContact O-CD 3.1Å
757	R	96	Very high	96.1	Very high	109 Å²	109	55.8 Å²	55.8	41%	0.411	29%	0.286	S	S	.	.	S	Bend	trans	-126	70	-174.4	-60.9	-171.5	-70.5	123.2	-9.6	111.8	A753 M754 I760 I762	A753-R757 WeakPolarHBondContact O-CB 3.49Å; A753-R757 PolarHBondContact O-N 3.01Å; M754-R757 CarbonylContact O-C 3.47Å; R757-I760 HydrophobicContact CB-CB 4.4Å; R757-I760 HydrophobicContact CB-CD1 4.29Å; R757-I760 PolarHBondContact O-N 3.22Å; R757-I762 HydrophobicContact CB-CD1 4.17Å; R757-I762 VanDerWaalsContact CZ-CD1 3.47Å
758	P	94.2	Very high	95.9	Very high	53 Å²	53	55.4 Å²	55.4	34%	0.344	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	156	175	25.7	-34.7	0	0	0	112.1	P626 E756 I760	P626-P758 HydrophobicContact CG-CB 3.77Å; E756-P758 VanDerWaalsContact C-CD 3.5Å; E756-P758 WeakPolarHBondContact O-CD 3.1Å; P758-I760 PolarHBondContact O-N 3.45Å
759	N	95.6	Very high	95.4	Very high	101 Å²	101	52.3 Å²	52.3	54%	0.54	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-6.7	-174.2	-61.2	-43.3	0	0	0	116.3	K623 L624	K623-N759 WeakPolarHBondContact CD-O 3.45Å; L624-N759 PolarHBondContact O-N 3.3Å
760	I	97.1	Very high	94.5	Very high	86 Å²	86	48.8 Å²	48.8	44%	0.441	25%	0.246	S	C	.	.	S	Bend	trans	-98.2	139.9	177.4	-62.8	170.5	0	0	0	110.4	K623 R757 P758 I762	K623-I760 WeakPolarHBondContact CB-O 3.47Å; K623-I760 WeakPolarHBondContact CG-O 3.43Å; R757-I760 HydrophobicContact CB-CB 4.4Å; R757-I760 HydrophobicContact CB-CD1 4.29Å; R757-I760 PolarHBondContact O-N 3.22Å; P758-I760 PolarHBondContact O-N 3.45Å; I760-I762 HydrophobicContact CG2-CD1 4.43Å
761	W	97.5	Very high	93.2	Very high	88 Å²	88	50.4 Å²	50.4	33%	0.333	25%	0.254	S	S	.	.			trans	-75.6	125	170.3	-73.3	109.7	0	0	0	110.9	A621 K623 H637 W639	A621-W761 HydrophobicContact CB-CB 4.44Å; A621-W761 HydrophobicContact CB-CD2 4.41Å; A621-W761 HydrophobicContact CB-CE3 3.73Å; A621-W761 HydrophobicContact CB-CZ3 4.34Å; K623-W761 HydrophobicContact CB-CD2 3.85Å; K623-W761 HydrophobicContact CB-CE3 3.61Å; K623-W761 HydrophobicContact CB-CG 4.38Å; K623-W761 HydrophobicContact CB-CZ3 4.04Å; K623-W761 HydrophobicContact CD-CD2 4.28Å; K623-W761 HydrophobicContact CD-CG 4.47Å; H637-W761 HydrophobicContact CB-CH2 3.61Å; H637-W761 HydrophobicContact CB-CZ2 4.29Å; H637-W761 HydrophobicContact CB-CZ3 3.98Å; W639-W761 HydrophobicContact CB-CH2 3.96Å; W639-W761 HydrophobicContact CB-CZ3 3.85Å
762	I	98	Very high	92.2	Very high	9 Å²	9	51.4 Å²	51.4	5%	0.046	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	109.7	174.8	-43	-58.3	0	0	0	107.6	A621 I622 A753 M754 R757 I760	A621-I762 CarbonylContact C-O 3.56Å; A621-I762 WeakPolarHBondContact CA-O 3.46Å; I622-I762 HydrophobicContact CG2-CB 3.98Å; I622-I762 HydrophobicContact CG2-CG1 4.49Å; I622-I762 PolarHBondContact N-O 2.97Å; I622-I762 WeakPolarHBondContact O-CB 3.29Å; I622-I762 WeakPolarHBondContact O-CG1 3.39Å; I622-I762 PolarHBondContact O-N 2.86Å; A753-I762 HydrophobicContact CB-CD1 4.34Å; A753-I762 HydrophobicContact CB-CG2 3.86Å; A753-I762 VanDerWaalsContact O-CD1 3.32Å; A753-I762 WeakPolarHBondContact O-CD1 3.41Å; M754-I762 HydrophobicContact CB-CG1 3.95Å; R757-I762 HydrophobicContact CB-CD1 4.17Å; R757-I762 VanDerWaalsContact CZ-CD1 3.47Å; I760-I762 HydrophobicContact CG2-CD1 4.43Å
763	E	97.3	Very high	90.2	Very high	117 Å²	117	51.2 Å²	51.2	55%	0.547	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	141.5	176.6	-53.2	-138.8	173	0	0	111	L620 A621 K641	L620-E763 WeakPolarHBondContact O-CA 3.45Å; A621-E763 HydrophobicContact CB-CG 4.19Å; K641-E763 IonicContact NZ-OE1 2.9Å; K641-E763 PolarHBondContact NZ-OE1 3.36Å; K641-E763 IonicContact NZ-OE2 2.73Å; K641-E763 PolarHBondContact NZ-OE2 3.03Å
764	A	96.4	Very high	89.9	Confident	11 Å²	11	52.9 Å²	52.9	9%	0.091	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	132.7	179.2	0	0	0	0	0	111.6	L620 A750 I766	L620-A764 HydrophobicContact CD1-CB 4.06Å; L620-A764 PolarHBondContact N-O 3.29Å; L620-A764 PolarHBondContact O-N 3.04Å; A750-A764 HydrophobicContact CB-CB 3.81Å; A764-I766 HydrophobicContact CB-CD1 4.14Å; A764-I766 HydrophobicContact CB-CG1 4.06Å
765	T	96.6	Very high	89.5	Confident	66 Å²	66	55.7 Å²	55.7	41%	0.405	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.7	164.3	-58.3	0	0	0	0	107.7	E617 I618 V619	E617-T765 HydrophobicContact CB-CG2 3.95Å; E617-T765 HydrophobicContact CG-CG2 4.04Å; E617-T765 WeakPolarHBondContact OE1-CG2 2.99Å; E617-T765 VanDerWaalsContact OE2-CG2 3.28Å; E617-T765 WeakPolarHBondContact OE2-CG2 3.28Å; I618-T765 WeakPolarHBondContact O-CA 3.34Å; V619-T765 HydrophobicContact CG2-CG2 4.3Å
766	I	94.7	Very high	89.2	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.9	-171.3	-58.5	178.5	0	0	0	109.7	E617 I618 L620 C729 I731 A746 E747 A764	E617-I766 CarbonylContact C-O 3.47Å; E617-I766 WeakPolarHBondContact CA-O 3.17Å; I618-I766 HydrophobicContact CG2-CB 4.14Å; I618-I766 PolarHBondContact N-O 3.28Å; I618-I766 PolarHBondContact O-N 3.03Å; L620-I766 HydrophobicContact CD2-CD1 4.39Å; C729-I766 HydrophobicContact CB-CG2 3.49Å; C729-I766 VanDerWaalsContact CB-CG2 3.49Å; I731-I766 HydrophobicContact CD1-CD1 3.8Å; I731-I766 HydrophobicContact CG1-CD1 3.92Å; A746-I766 HydrophobicContact CB-CG1 4.27Å; E747-I766 HydrophobicContact CG-CD1 4.25Å; E747-I766 HydrophobicContact CG-CG2 3.58Å; A764-I766 HydrophobicContact CB-CD1 4.14Å; A764-I766 HydrophobicContact CB-CG1 4.06Å
767	Q	91.8	Very high	88.8	Confident	98 Å²	98	51.5 Å²	51.5	46%	0.458	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	132.7	175.5	-66	-62.3	-33.2	0	0	110.8	S614 E617 R769	S614-Q767 PolarHBondContact OG-OE1 2.99Å; E617-Q767 PolarHBondContact OE2-NE2 3.12Å; Q767-R769 PolarHBondContact O-N 2.73Å
768	L	90.5	Very high	88.4	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.2	-176.1	-68.7	170.9	0	0	0	110.8	R615 G616 I618 L646 V714 G728	R615-L768 HydrophobicContact CB-CB 4.27Å; R615-L768 PolarHBondContact N-O 3.27Å; R615-L768 VanDerWaalsContact N-O 3.08Å; G616-L768 WeakPolarHBondContact O-CB 3.44Å; G616-L768 PolarHBondContact O-N 3.17Å; I618-L768 HydrophobicContact CB-CD2 3.98Å; I618-L768 HydrophobicContact CB-CG 4.37Å; I618-L768 HydrophobicContact CG2-CD2 3.73Å; I618-L768 HydrophobicContact CG2-CG 4.39Å; L646-L768 HydrophobicContact CD2-CD1 3.43Å; L646-L768 VanDerWaalsContact CD2-CD1 3.43Å; V714-L768 HydrophobicContact CB-CD1 4.32Å; V714-L768 HydrophobicContact CG2-CD1 3.81Å; V714-L768 HydrophobicContact CG2-CD2 3.8Å; G728-L768 CarbonylContact O-C 3.49Å; G728-L768 WeakPolarHBondContact O-CA 3.39Å
769	R	85.9	Confident	88	Confident	7 Å²	7	47.6 Å²	47.6	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	133.9	177.4	-45.6	-176.1	-175	-168.6	-1.7	111.3	G727 G728 D742 E747 Q767 N771 L772	G727-R769 WeakPolarHBondContact CA-O 3.26Å; G728-R769 PolarHBondContact N-O 2.86Å; G728-R769 PolarHBondContact O-N 3.28Å; D742-R769 PolarHBondContact O-NH2 3.27Å; D742-R769 IonicContact OD2-CZ 2.96Å; D742-R769 IonicContact OD2-NH1 2.84Å; D742-R769 PolarHBondContact OD2-NH1 3.19Å; D742-R769 IonicContact OD2-NH2 3.34Å; E747-R769 IonicContact OE1-CZ 3.48Å; E747-R769 IonicContact OE1-NE 3.53Å; E747-R769 PolarHBondContact OE1-NE 2.88Å; E747-R769 IonicContact OE1-NH2 3.53Å; E747-R769 PolarHBondContact OE1-NH2 3.3Å; E747-R769 IonicContact OE2-CZ 3.48Å; E747-R769 IonicContact OE2-NE 2.78Å; E747-R769 PolarHBondContact OE2-NE 3.42Å; E747-R769 IonicContact OE2-NH2 3.57Å; E747-R769 PolarHBondContact OE2-NH2 3.06Å; Q767-R769 PolarHBondContact O-N 2.73Å; R769-N771 VanDerWaalsContact C-N 3.33Å; R769-N771 PolarHBondContact O-N 3.2Å; R769-L772 HydrophobicContact CB-CD1 4.07Å; R769-L772 HydrophobicContact CB-CG 4.23Å; R769-L772 HydrophobicContact CG-CD1 4.19Å
770	S	77.5	Confident	87.4	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.021	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-9.3	177.2	62.1	0	0	0	0	115.6
771	N	70	Confident	86.7	Confident	38 Å²	38	40.5 Å²	40.5	20%	0.203	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	17.2	-162.6	75.1	-44.8	0	0	0	116	T607 R769 N773	T607-N771 VanDerWaalsContact CB-ND2 3.28Å; T607-N771 WeakPolarHBondContact CB-ND2 3.45Å; T607-N771 WeakPolarHBondContact CG2-ND2 3.49Å; T607-N771 PolarHBondContact OG1-ND2 3.02Å; T607-N771 VanDerWaalsContact OG1-ND2 3.1Å; R769-N771 VanDerWaalsContact C-N 3.33Å; R769-N771 PolarHBondContact O-N 3.2Å; N771-N773 PolarHBondContact O-N 3Å
772	L	75.2	Confident	85.8	Confident	22 Å²	22	36.6 Å²	36.6	12%	0.115	19%	0.19	C	C	.	.			trans	-88.7	15.4	-172.8	-85.8	173.4	0	0	0	116	F725 G728 R730 R769	F725-L772 HydrophobicContact CZ-CB 4.15Å; G728-L772 WeakPolarHBondContact O-CD1 3.46Å; R730-L772 HydrophobicContact CG-CD1 4.44Å; R730-L772 HydrophobicContact CG-CD2 4.01Å; R730-L772 VanDerWaalsContact CZ-CD2 3.41Å; R769-L772 HydrophobicContact CB-CD1 4.07Å; R769-L772 HydrophobicContact CB-CG 4.23Å; R769-L772 HydrophobicContact CG-CD1 4.19Å
773	N	55.5	Low	84.7	Confident	63 Å²	63	39.1 Å²	39.1	34%	0.337	20%	0.203	S	C	.	.			trans	-147.6	0	-161.1	174.1	53.8	0	0	0	112.7	Y463 S464 W715 F725 N771	Y463-N773 WeakPolarHBondContact CB-ND2 3.27Å; Y463-N773 VanDerWaalsContact CD1-ND2 3.34Å; Y463-N773 WeakPolarHBondContact CD1-ND2 3.12Å; Y463-N773 VanDerWaalsContact CD2-ND2 3.27Å; Y463-N773 WeakPolarHBondContact CD2-ND2 3.35Å; S464-N773 PolarHBondContact OG-OXT 3.46Å; W715-N773 WeakPolarHBondContact CH2-OD1 3.38Å; F725-N773 WeakPolarHBondContact CB-ND2 3.42Å; F725-N773 HydrophobicContact CD1-CB 4.16Å; F725-N773 HydrophobicContact CD2-CB 3.98Å; F725-N773 HydrophobicContact CE1-CB 4.11Å; F725-N773 HydrophobicContact CE2-CB 3.92Å; F725-N773 HydrophobicContact CG-CB 4.09Å; F725-N773 WeakPolarHBondContact CG-ND2 3.25Å; F725-N773 HydrophobicContact CZ-CB 3.98Å; N771-N773 PolarHBondContact O-N 3Å

Retrieved 773 of 773 residues in 933.8 ms (Link to these results)

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