A0A024R7L5_HUMAN Loading...

Regulator of nonsense transcripts 1

AlphaFold DB (A0A2K5RK90), UniProt , Accession A0A024R7L5, Species HUMAN (Homo sapiens, Human), Gene UPF1, Length 1,118 aa.

						>A0A024R7L5_HUMAN|A0A024R7L5|UPF1
MSVEAYGPSSQTLTFLDTEEAELLGADTQGSEFEFTDFTLPSQTQTPPGGPGGPGGGGAGGPGGAGAGAAAGQLDAQVGPEGILQNGAVDDSVAKTSQLLAELNFEEDEEDTYYTKDLPIHACSYCGIHDPACVVYCNTSKKWFCNGRGNTSGSHIVNHLVRAKCKEVTLHKDGPLGETVLECYNCGCRNVFLLGFIPAKADSVVVLLCRQPCASQSSLKDINWDSSQWQPLIQDRCFLSWLVKIPSEQEQLRARQITAQQINKLEELWKENPSATLEDLEKPGVDEEPQHVLLRYEDAYQYQNIFGPLVKLEADYDKKLKESQTQDNITVRWDLGLNKKRIAYFTLPKTDSDMRLMQGDEICLRYKGDLAPLWKGIGHVIKVPDNYGDEIAIELRSSVGAPVEVTHNFQVDFVWKSTSFDRMQSALKTFAVDETSVSGYIYHKLLGHEVEDVIIKCQLPKRFTAQGLPDLNHSQVYAVKTVLQRPLSLIQGPPGTGKTVTSATIVYHLARQGNGPVLVCAPSNIAVDQLTEKIHQTGLKVVRLCAKSREAIDSPVSFLALHNQIRNMDSMPELQKLQQLKDETGELSSADEKRYRALKRTAERELLMNADVICCTCVGAGDPRLAKMQFRSILIDESTQATEPECMVPVVLGAKQLILVGDHCQLGPVVMCKKAAKAGLSQSLFERLVVLGIRPIRLQVQYRMHPALSAFPSNIFYEGSLQNGVTAADRVKKGFDFQWPQPDKPMFFYVTQGQEEIASSGTSYLNRTEAANVEKITTKLLKAGAKPDQIGIITPYEGQRSYLVQYMQFSGSLHTKLYQEVEIASVDAFQGREKDFIILSCVRANEHQGIGFLNDPRRLNVALTRARYGVIIVGNPKALSKQPLWNHLLNYYKEQKVLVEGPLNNLRESLMQFSKPRKLVNTINPGARFMTTAMYDAREAIIPGSVYDRSSQGRPSSMYFQTHDQIGMISAGPSHVAAMNIPIPFNLVMPPMPPPGYFGQANGPAAGRGTPKGKTGRGGRQKNRFGLPGPSQTNLPNSQASQDVASQPFSQGALTQGYISMSQPSQMSQPGLSQPELSQDSYLGDEFKSQIDVALSQDSTYQGERAYQHGGVTGLSQY
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	30.3	Very low	234 Å²	234	145 Å²	145	100%	1.153	83%	0.833	S	S	*	*				0	103.9	0	-57.4	-177.4	-129.9	0	0	105.7
2	S	26.7	Very low	30	Very low	98 Å²	98	143 Å²	143	69%	0.685	83%	0.826	S	S	*	*				79.1	99.5	61.3	66.8	0	0	0	0	111.7
3	V	29.3	Very low	29.6	Very low	131 Å²	131	143.3 Å²	143.3	79%	0.794	82%	0.821	S	S	*	*				59.1	134.3	110.9	-129	0	0	0	0	112.4	A5	V3-A5 HydrophobicContact CG1-CB 4.46Å
4	E	28.4	Very low	29.3	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	81%	0.806	S	S	*	*			cis	-142.3	158.7	33.2	-71.2	157.6	165.1	0	0	111.4
5	A	30.1	Very low	28.9	Very low	80 Å²	80	143.1 Å²	143.1	66%	0.661	81%	0.806	S	S	*	*			cis	98.2	115.9	19.7	0	0	0	0	0	115.8	V3	V3-A5 HydrophobicContact CG1-CB 4.46Å
6	Y	29	Very low	28.8	Very low	245 Å²	245	143 Å²	143	96%	0.961	80%	0.802	S	S	*	*			trans	-153.4	140.7	162.4	-109.7	-81.5	0	0	0	110.9
7	G	26.7	Very low	29	Very low	62 Å²	62	143.9 Å²	143.9	64%	0.639	81%	0.805	S	S	*	*			trans	-140	-142.9	163.8	0	0	0	0	0	107.3
8	P	47.4	Very low	28.9	Very low	132 Å²	132	143 Å²	143	86%	0.857	80%	0.803	S	S	*	*			cis	-134	173.4	-17.2	41.5	-26.9	0	0	0	113.2
9	S	26.4	Very low	29	Very low	126 Å²	126	145.7 Å²	145.7	88%	0.881	81%	0.809	S	S	*	*			trans	-157	153.9	148.6	60.5	0	0	0	0	110.5
10	S	29.8	Very low	29.1	Very low	111 Å²	111	148.4 Å²	148.4	78%	0.776	82%	0.815	S	S	*	*			trans	-141.3	148.7	-166.4	57.1	0	0	0	0	113.2
11	Q	27.9	Very low	29.1	Very low	195 Å²	195	145.7 Å²	145.7	91%	0.911	81%	0.813	S	S	*	*			trans	-165.5	154.8	130.1	-106.9	168	24.8	0	0	112.2
12	T	27.1	Very low	29.1	Very low	121 Å²	121	143.8 Å²	143.8	74%	0.742	80%	0.801	S	S	*	*			trans	-108.2	161.1	-178.2	42.1	0	0	0	0	109.8
13	L	25.4	Very low	29.1	Very low	147 Å²	147	147.4 Å²	147.4	77%	0.77	81%	0.812	S	S	*	*				-178.9	134.5	82.6	-89.6	170.7	0	0	0	113.5
14	T	25.3	Very low	29.2	Very low	98 Å²	98	149.3 Å²	149.3	60%	0.601	82%	0.817	S	S	*	*			trans	31.3	159.4	135.6	55.6	0	0	0	0	125.3
15	F	23.2	Very low	29.1	Very low	185 Å²	185	144.3 Å²	144.3	81%	0.811	81%	0.814	S	S	*	*			trans	87.2	141.1	167.4	-55.5	-66.5	0	0	0	115.6
16	L	26.3	Very low	28.9	Very low	142 Å²	142	145.3 Å²	145.3	74%	0.743	82%	0.822	S	S	*	*			cis	-148.6	156.4	-0.7	-121.5	167.5	0	0	0	110.7
17	D	32.8	Very low	28.8	Very low	158 Å²	158	141.3 Å²	141.3	85%	0.845	82%	0.817	S	S	*	*			trans	-77.5	140.4	155.6	-78.5	-61.6	0	0	0	109.1
18	T	27.8	Very low	29	Very low	128 Å²	128	145.1 Å²	145.1	79%	0.785	83%	0.828	S	S	*	*			trans	-137.9	137.8	164.6	44.3	0	0	0	0	111.1
19	E	29.9	Very low	28.1	Very low	194 Å²	194	148.3 Å²	148.3	91%	0.907	83%	0.831	S	S	*	*			trans	-81.7	146.9	179.2	-56.6	170.7	121.3	0	0	110.5
20	E	30.7	Very low	28.3	Very low	199 Å²	199	146 Å²	146	93%	0.93	83%	0.827	S	S	*	*			trans	-124.8	107.2	165.6	-76.9	-164.2	151.2	0	0	111
21	A	29.3	Very low	28.2	Very low	93 Å²	93	146.7 Å²	146.7	77%	0.769	83%	0.833	S	S	*	*			trans	-149.6	133.8	159.9	0	0	0	0	0	108.6
22	E	31.4	Very low	28.2	Very low	193 Å²	193	146.2 Å²	146.2	90%	0.902	83%	0.83	S	S	*	*			trans	57.4	108.5	168.4	-58.6	-175.6	169.1	0	0	118.2
23	L	26.7	Very low	28.2	Very low	174 Å²	174	149.1 Å²	149.1	91%	0.911	83%	0.833	S	S	*	*			trans	-143.1	144.2	131	-142.6	91.9	0	0	0	110.9
24	L	31.2	Very low	28.3	Very low	172 Å²	172	148.9 Å²	148.9	90%	0.901	83%	0.828	S	S	*	*			trans	-121.7	135.3	176.4	-103.4	167.1	0	0	0	109.2
25	G	26.1	Very low	28.4	Very low	76 Å²	76	151.9 Å²	151.9	78%	0.784	83%	0.833	S	S	*	*			trans	81.8	120.8	156.6	0	0	0	0	0	117.6
26	A	26.5	Very low	28.5	Very low	101 Å²	101	147.8 Å²	147.8	84%	0.835	82%	0.823	S	S	*	*			trans	-151.2	121.2	151.7	0	0	0	0	0	108.5
27	D	28.1	Very low	28.7	Very low	161 Å²	161	146.9 Å²	146.9	86%	0.861	82%	0.819	S	S	*	*			trans	-82	147.8	175.3	-71	-69.3	0	0	0	111.7
28	T	30.8	Very low	28.4	Very low	142 Å²	142	147.9 Å²	147.9	87%	0.871	82%	0.816	S	S	*	*			trans	-138	90.1	160.1	58.2	0	0	0	0	111.6
29	Q	28.3	Very low	28.5	Very low	198 Å²	198	147.5 Å²	147.5	93%	0.925	81%	0.814	S	S	*	*			trans	-78.6	153.7	144.2	-60.5	176.3	-1.8	0	0	107.1
30	G	29.6	Very low	28.6	Very low	77 Å²	77	145.9 Å²	145.9	79%	0.794	81%	0.811	S	S	*	*			cis	161	157.7	0.9	0	0	0	0	0	108.3
31	S	27.6	Very low	29.5	Very low	127 Å²	127	141.9 Å²	141.9	89%	0.888	80%	0.802	S	S	*	*			trans	-150.9	125.7	175.5	59.1	0	0	0	0	111.9
32	E	28	Very low	29.6	Very low	184 Å²	184	141.8 Å²	141.8	86%	0.86	80%	0.796	S	S	*	*			trans	-98.3	166.1	-174.9	-56.8	169.1	118.8	0	0	112.2
33	F	27	Very low	29.7	Very low	183 Å²	183	140.7 Å²	140.7	80%	0.803	79%	0.791	S	S	*	*			trans	-172.5	103.7	142.7	-97.3	-67.9	0	0	0	107
34	E	26.9	Very low	29.9	Very low	141 Å²	141	137.4 Å²	137.4	66%	0.659	78%	0.778	S	S	*	*				70.4	139.7	103.1	-71.4	-173.1	173.6	0	0	115
35	F	27.3	Very low	29.9	Very low	162 Å²	162	137.9 Å²	137.9	71%	0.711	78%	0.775	S	S	*	*			cis	-160.3	-176.2	3.1	-113.7	-43.9	0	0	0	108.1
36	T	26.6	Very low	30.1	Very low	98 Å²	98	140.5 Å²	140.5	60%	0.601	78%	0.777	S	S	*	*			cis	-163.2	149.7	5.8	3.7	0	0	0	0	109.5
37	D	29.7	Very low	31.2	Very low	123 Å²	123	141.1 Å²	141.1	66%	0.658	77%	0.772	S	S	*	*			trans	52.6	166.6	139.8	-59.9	-12.2	0	0	0	123.7
38	F	26.7	Very low	32.5	Very low	179 Å²	179	139.4 Å²	139.4	79%	0.785	77%	0.77	S	S	*	*			cis	-141.9	-158.8	3.4	-128	-60.2	0	0	0	111.8
39	T	30.7	Very low	32.5	Very low	121 Å²	121	136.7 Å²	136.7	74%	0.742	77%	0.77	S	S	*	*			trans	-111.7	170.1	-155	55.4	0	0	0	0	119.3
40	L	32.3	Very low	32.6	Very low	160 Å²	160	130.9 Å²	130.9	84%	0.838	76%	0.763	S	S	*	*			trans	-49.4	173.4	159.9	-70.9	167.8	0	0	0	114.6
41	P	47.8	Very low	33.7	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	77%	0.768	S	S	*	*			cis	-153.4	179.1	26.2	44.6	-23.1	0	0	0	121.7
42	S	32.5	Very low	33.8	Very low	91 Å²	91	131.7 Å²	131.7	64%	0.636	77%	0.766	S	S	*	*			trans	94.6	124.3	136.4	-145.1	0	0	0	0	124.8
43	Q	32.6	Very low	33.8	Very low	170 Å²	170	126.4 Å²	126.4	79%	0.794	76%	0.761	S	S	*	*			trans	54.4	155.5	137.1	-67.3	-175.8	42.5	0	0	121.8
44	T	32.2	Very low	35.1	Very low	105 Å²	105	124 Å²	124	64%	0.644	76%	0.764	S	S	*	*			cis	-162	164.8	9.3	-3.7	0	0	0	0	114.3
45	Q	30.1	Very low	35.3	Very low	181 Å²	181	121.3 Å²	121.3	85%	0.846	77%	0.774	S	S	*	*			trans	81.5	161.7	149.4	-74.2	177	42.1	0	0	123.3
46	T	30.3	Very low	35.5	Very low	132 Å²	132	117.3 Å²	117.3	81%	0.81	78%	0.778	S	S	*	*			trans	-126.5	-167.6	-164.3	56.7	0	0	0	0	110.5
47	P	50.9	Low	35.6	Very low	113 Å²	113	116.9 Å²	116.9	73%	0.734	79%	0.794	S	S	*	*			cis	-137.8	-141.2	0.9	42.6	-19.4	0	0	0	112.6
48	P	55.4	Low	35.6	Very low	126 Å²	126	114.6 Å²	114.6	82%	0.818	80%	0.799	S	S	*	*				-123.7	171.4	-50.8	30.2	-12.1	0	0	0	114.6
49	G	30.6	Very low	35.9	Very low	85 Å²	85	111.7 Å²	111.7	88%	0.876	81%	0.808	S	S	*	*			trans	144.3	138.6	151.4	0	0	0	0	0	118.3
50	G	29.3	Very low	36	Very low	75 Å²	75	109.8 Å²	109.8	77%	0.773	81%	0.812	S	S	*	*			trans	-144.9	-156.8	167.5	0	0	0	0	0	109.4
51	P	52.4	Low	35.8	Very low	139 Å²	139	105.7 Å²	105.7	90%	0.903	81%	0.808	S	S	*	*			cis	-133	-175.4	-4	43	-27	0	0	0	114
52	G	30.6	Very low	36	Very low	82 Å²	82	106.7 Å²	106.7	85%	0.845	82%	0.815	S	S	*	*			trans	143	146	155.4	0	0	0	0	0	118.3
53	G	28.8	Very low	36	Very low	74 Å²	74	106.3 Å²	106.3	76%	0.763	83%	0.825	S	S	*	*			trans	-137.2	-150.9	160.1	0	0	0	0	0	108.2
54	P	54.2	Low	35.9	Very low	133 Å²	133	101.7 Å²	101.7	86%	0.864	82%	0.824	S	S	*	*			cis	-136.6	177.8	-11.5	42.5	-26.4	0	0	0	114.4
55	G	30.1	Very low	36	Very low	83 Å²	83	102.2 Å²	102.2	86%	0.856	84%	0.839	S	S	*	*			trans	76.6	171.3	163.6	0	0	0	0	0	116.7
56	G	31.1	Very low	35.9	Very low	79 Å²	79	96.9 Å²	96.9	81%	0.814	83%	0.832	S	S	*	*			cis	167.2	131.1	-9.2	0	0	0	0	0	113.5
57	G	30.3	Very low	36.1	Very low	89 Å²	89	96 Å²	96	92%	0.918	84%	0.839	S	S	*	*			trans	76	167.1	179	0	0	0	0	0	115.2
58	G	30	Very low	35	Very low	74 Å²	74	94.2 Å²	94.2	76%	0.763	84%	0.84	S	S	*	*			cis	163.1	126.1	-10.7	0	0	0	0	0	114.4
59	A	32.8	Very low	33.9	Very low	118 Å²	118	93.2 Å²	93.2	98%	0.975	84%	0.842	S	S	*	*			trans	64.7	149	168.8	0	0	0	0	0	119.3
60	G	31.5	Very low	33.9	Very low	81 Å²	81	93.9 Å²	93.9	84%	0.835	84%	0.84	S	S	*	*			trans	142.7	95.8	168.2	0	0	0	0	0	116.1
61	G	29.5	Very low	34.1	Very low	74 Å²	74	95.5 Å²	95.5	76%	0.763	85%	0.846	S	S	*	*			trans	-108.6	-154.2	152	0	0	0	0	0	109.4
62	P	52	Low	33	Very low	136 Å²	136	92.5 Å²	92.5	88%	0.883	84%	0.841	S	S	*	*			cis	-139.2	-179.3	-4.7	42.6	-25.7	0	0	0	115.1
63	G	31.2	Very low	33.2	Very low	83 Å²	83	97 Å²	97	86%	0.856	84%	0.84	S	S	*	*			trans	88.1	158	158.6	0	0	0	0	0	117.2
64	G	31.5	Very low	33.3	Very low	74 Å²	74	99.8 Å²	99.8	76%	0.763	84%	0.836	S	S	*	*			cis	168.7	140.5	-10	0	0	0	0	0	114.3
65	A	32.7	Very low	32.1	Very low	116 Å²	116	99.7 Å²	99.7	96%	0.959	83%	0.829	S	S	*	*			trans	62.3	154.6	177.5	0	0	0	0	0	117.2
66	G	30	Very low	32.2	Very low	69 Å²	69	99.4 Å²	99.4	71%	0.711	82%	0.818	S	S	*	*			cis	161.9	135.3	-12.7	0	0	0	0	0	113.7
67	A	33.3	Very low	32.1	Very low	114 Å²	114	104.8 Å²	104.8	94%	0.942	82%	0.822	S	S	*	*			trans	58.9	157.9	177	0	0	0	0	0	116.9
68	G	28.7	Very low	32.1	Very low	74 Å²	74	106.9 Å²	106.9	76%	0.763	82%	0.817	S	S	*	*			cis	163	164.7	-5.4	0	0	0	0	0	111.3
69	A	31.1	Very low	31.9	Very low	105 Å²	105	106.4 Å²	106.4	87%	0.868	81%	0.812	S	S	*	*			trans	82.1	90.1	171.3	0	0	0	0	0	121.1
70	A	31.3	Very low	33	Very low	99 Å²	99	106.7 Å²	106.7	82%	0.818	80%	0.804	S	S	*	*				28.5	126.9	125.8	0	0	0	0	0	125.1
71	A	34.1	Very low	32.9	Very low	109 Å²	109	112.2 Å²	112.2	90%	0.901	81%	0.808	S	S	*	*				90.4	130.6	119.5	0	0	0	0	0	124.5
72	G	28.7	Very low	32.8	Very low	77 Å²	77	112.3 Å²	112.3	79%	0.794	81%	0.808	S	S	*	*			trans	108.6	149.5	151.1	0	0	0	0	0	117.3
73	Q	34.6	Very low	31.7	Very low	177 Å²	177	113.4 Å²	113.4	83%	0.827	81%	0.805	S	S	*	*			cis	-171.9	172.6	-18.3	-160.9	174.7	-12.1	0	0	109.8
74	L	31.6	Very low	31.6	Very low	131 Å²	131	116.5 Å²	116.5	69%	0.686	80%	0.801	S	S	*	*			trans	74.1	156.1	163.8	-50.8	177.5	0	0	0	116.6
75	D	28.5	Very low	31.5	Very low	132 Å²	132	119.8 Å²	119.8	71%	0.706	80%	0.797	S	S	*	*			cis	-157.9	156.2	-16.5	-100	-19.7	0	0	0	106.7
76	A	33	Very low	31.3	Very low	76 Å²	76	121.3 Å²	121.3	63%	0.628	79%	0.789	S	S	*	*			cis	95.6	109.4	30.4	0	0	0	0	0	115.9
77	Q	28.6	Very low	31.1	Very low	192 Å²	192	121.6 Å²	121.6	90%	0.897	79%	0.792	S	S	*	*			trans	168.9	156.1	158.3	-98.6	159.8	61	0	0	109.6
78	V	30	Very low	30.9	Very low	134 Å²	134	121 Å²	121	81%	0.812	79%	0.786	S	S	*	*			cis	179.7	154.4	-22.7	134	0	0	0	0	105.7
79	G	25.3	Very low	31.1	Very low	64 Å²	64	123.8 Å²	123.8	66%	0.66	79%	0.789	S	S	*	*			trans	-92	-149.3	179.3	0	0	0	0	0	114.7
80	P	55.1	Low	31.2	Very low	124 Å²	124	126.2 Å²	126.2	81%	0.805	79%	0.787	S	S	*	*			cis	-142.7	-162.8	2.8	41.2	-19.4	0	0	0	116.3
81	E	30	Very low	31.2	Very low	197 Å²	197	125.8 Å²	125.8	92%	0.921	77%	0.771	S	S	*	*			trans	78.1	144.4	162.1	-69.4	-170	178.8	0	0	122.9
82	G	27.1	Very low	31.1	Very low	75 Å²	75	125.4 Å²	125.4	77%	0.773	76%	0.762	S	S	*	*			trans	154.2	132.8	172.4	0	0	0	0	0	114
83	I	29.5	Very low	31.7	Very low	159 Å²	159	127.6 Å²	127.6	82%	0.815	76%	0.76	S	S	*	*			trans	-134.1	162.9	-171.9	-38.2	175.9	0	0	0	111.3
84	L	28.4	Very low	31.8	Very low	148 Å²	148	121.5 Å²	121.5	78%	0.775	74%	0.739	S	S	*	*			trans	86.4	155.5	161.8	-55.8	175.1	0	0	0	117.8
85	Q	29.3	Very low	32	Very low	144 Å²	144	121.9 Å²	121.9	67%	0.673	74%	0.735	S	S	*	*			cis	-171.9	163.1	-33.4	-158.3	179.1	25.4	0	0	109.1
86	N	28.5	Very low	32.4	Very low	147 Å²	147	122 Å²	122	79%	0.786	74%	0.741	S	S	*	*			trans	72.7	149.2	168	-54.8	-42.9	0	0	0	117
87	G	27.2	Very low	32.8	Very low	75 Å²	75	123.1 Å²	123.1	77%	0.773	74%	0.744	S	S	*	*			cis	-162.4	174.6	-0.1	0	0	0	0	0	112.4
88	A	29.4	Very low	33.1	Very low	101 Å²	101	120.7 Å²	120.7	84%	0.835	73%	0.733	S	S	*	*			trans	-133.2	154.2	-168.1	0	0	0	0	0	114.3
89	V	31.1	Very low	33.3	Very low	134 Å²	134	122.1 Å²	122.1	81%	0.812	74%	0.735	S	S	*	*			trans	-149.4	133.3	162.5	-160	0	0	0	0	103.7
90	D	34.5	Very low	33.8	Very low	156 Å²	156	127.7 Å²	127.7	83%	0.834	75%	0.749	S	S	*	*			cis	-146.8	156.2	37.6	-142.9	-30	0	0	0	112.5
91	D	31.2	Very low	32.6	Very low	89 Å²	89	125.9 Å²	125.9	48%	0.476	74%	0.744	S	S	.	*			trans	-122.9	113.8	-172.1	176.3	31.5	0	0	0	113.2	K95	D91-K95 IonicContact OD2-NZ 2.68Å; D91-K95 PolarHBondContact OD2-NZ 3.05Å
92	S	32.5	Very low	32.7	Very low	101 Å²	101	125 Å²	125	71%	0.706	74%	0.74	S	S	*	*	S	Bend	trans	-159.3	-24.5	165.4	53.1	0	0	0	0	115.1
93	V	41	Very low	32.8	Very low	124 Å²	124	129.3 Å²	129.3	75%	0.752	74%	0.744	S	S	*	*	S	Bend	trans	-82.2	-16.5	-179.9	-174.7	0	0	0	0	112.7	K95	V93-K95 PolarHBondContact O-N 2.86Å
94	A	36.7	Very low	32.7	Very low	48 Å²	48	127.6 Å²	127.6	40%	0.397	74%	0.737	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-23.6	-169.3	0	0	0	0	0	115.6
95	K	34.9	Very low	32.7	Very low	140 Å²	140	128.1 Å²	128.1	61%	0.609	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-7.2	-164.4	-79.4	170.4	178.2	118	0	116.5	D91 V93	D91-K95 IonicContact OD2-NZ 2.68Å; D91-K95 PolarHBondContact OD2-NZ 3.05Å; V93-K95 PolarHBondContact O-N 2.86Å
96	T	37.3	Very low	32.6	Very low	134 Å²	134	129 Å²	129	82%	0.822	74%	0.737	S	S	*	*	S	Bend	trans	-96.6	-18	176.1	-40.2	0	0	0	0	112.6
97	S	40.2	Very low	32.8	Very low	99 Å²	99	131.5 Å²	131.5	69%	0.692	74%	0.744	S	S	*	*	S	Bend	trans	-90.1	2	-178	-52.5	0	0	0	0	114.2
98	Q	35	Very low	32.8	Very low	141 Å²	141	135.4 Å²	135.4	66%	0.659	75%	0.747	S	S	*	*	S	Bend	trans	-106.6	15.9	-168	-79.6	-172.7	-37.6	0	0	115.4
99	L	35.7	Very low	33.1	Very low	164 Å²	164	139.6 Å²	139.6	86%	0.859	75%	0.75	S	S	*	*	S	Bend	trans	-120	10.6	-177.8	-86.2	168.7	0	0	0	115.5
100	L	35.2	Very low	33.3	Very low	182 Å²	182	140.4 Å²	140.4	95%	0.953	75%	0.745	S	S	*	*	S	Bend	trans	-134.2	29.8	172.4	-89.6	168.5	0	0	0	112.1
101	A	29.6	Very low	33.1	Very low	85 Å²	85	141.4 Å²	141.4	70%	0.702	75%	0.75	S	S	*	*			trans	-132.4	57.1	177.9	0	0	0	0	0	110.8
102	E	31.7	Very low	33.1	Very low	180 Å²	180	143.5 Å²	143.5	84%	0.841	77%	0.766	S	S	*	*			trans	-128.7	146.2	163.6	-71.6	-166	148	0	0	109.3
103	L	30.8	Very low	33.3	Very low	164 Å²	164	144.1 Å²	144.1	86%	0.859	75%	0.754	S	S	*	*			trans	75.9	127.3	-174.6	-48.9	175.2	0	0	0	117.1
104	N	27.4	Very low	33.1	Very low	123 Å²	123	148.7 Å²	148.7	66%	0.658	76%	0.759	S	S	*	*				-165.9	157.1	-51.2	-123.8	-3.8	0	0	0	110
105	F	27.8	Very low	33	Very low	159 Å²	159	153.2 Å²	153.2	70%	0.697	78%	0.782	S	S	*	*			trans	73.1	131	158.2	-65.8	-57.5	0	0	0	122.3
106	E	27.5	Very low	33.4	Very low	163 Å²	163	153.2 Å²	153.2	76%	0.762	78%	0.782	S	S	*	*			trans	77.4	88.6	139.9	-73.5	148.9	-153.6	0	0	118.5
107	E	31.4	Very low	34.4	Very low	200 Å²	200	154.5 Å²	154.5	94%	0.935	78%	0.784	S	S	*	*			trans	-58	132.7	144.3	-57.8	171.1	133.1	0	0	109.3
108	D	27.8	Very low	36.2	Very low	156 Å²	156	155 Å²	155	83%	0.834	78%	0.778	S	S	*	*			trans	-136.6	151	167.8	-120.5	-21.1	0	0	0	109.4	E110	D108-E110 PolarHBondContact O-N 3.32Å
109	E	36.5	Very low	38.5	Very low	190 Å²	190	150.7 Å²	150.7	89%	0.888	76%	0.762	S	S	*	*			trans	-69.4	118.6	-161.7	-51.1	173.6	135.7	0	0	114.7
110	E	34.7	Very low	40.9	Very low	151 Å²	151	150.3 Å²	150.3	71%	0.706	76%	0.76	S	S	*	*			trans	-154.8	27.1	154.2	-132.2	177.6	-154.8	0	0	117.7	D108 T112	D108-E110 PolarHBondContact O-N 3.32Å; E110-T112 PolarHBondContact O-N 3.17Å
111	D	30.7	Very low	43.4	Very low	177 Å²	177	143.3 Å²	143.3	95%	0.947	72%	0.722	S	S	*	*			trans	-75.9	44.7	177.6	-136.1	-0.4	0	0	0	112.8
112	T	30.6	Very low	46.2	Very low	132 Å²	132	139.8 Å²	139.8	81%	0.81	69%	0.693	S	S	*	*			trans	-140.5	33.3	-175.9	-42.9	0	0	0	0	112.1	E110	E110-T112 PolarHBondContact O-N 3.17Å
113	Y	37.1	Very low	48.9	Very low	115 Å²	115	131.4 Å²	131.4	45%	0.451	65%	0.654	S	S	.	*			trans	-141.1	91	-175	-140.1	-72.7	0	0	0	112.2	K116	Y113-K116 HydrophobicContact CE1-CD 3.93Å; Y113-K116 HydrophobicContact CE2-CD 4.21Å; Y113-K116 VanDerWaalsContact CE2-CE 3.47Å; Y113-K116 VanDerWaalsContact CZ-CE 3.47Å; Y113-K116 PolarHBondContact OH-NZ 2.75Å
114	Y	36.1	Very low	51.7	Low	219 Å²	219	125.6 Å²	125.6	86%	0.859	63%	0.627	S	S	*	*	S	Bend	trans	-171.1	34.9	144.3	-97.8	-54.7	0	0	0	116.5
115	T	35	Very low	54.5	Low	144 Å²	144	119.9 Å²	119.9	88%	0.883	60%	0.596	S	S	*	*			trans	-135	47.9	160.1	27.6	0	0	0	0	111.7
116	K	43	Very low	57.1	Low	140 Å²	140	112.6 Å²	112.6	61%	0.609	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-78.3	116.7	158.2	-67.8	-169.9	-177.2	-179.7	0	107.9	Y113	Y113-K116 HydrophobicContact CE1-CD 3.93Å; Y113-K116 HydrophobicContact CE2-CD 4.21Å; Y113-K116 VanDerWaalsContact CE2-CE 3.47Å; Y113-K116 VanDerWaalsContact CZ-CE 3.47Å; Y113-K116 PolarHBondContact OH-NZ 2.75Å
117	D	59.1	Low	59.7	Low	160 Å²	160	105.6 Å²	105.6	86%	0.856	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-52.4	143.2	171.3	-77.9	-52.8	0	0	0	110.6
118	L	78.3	Confident	62.4	Low	111 Å²	111	96.7 Å²	96.7	58%	0.581	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-56.9	140.7	176	-79.6	168	0	0	0	110	A122	L118-A122 HydrophobicContact CB-CB 3.87Å; L118-A122 HydrophobicContact CD2-CB 4.45Å
119	P	81.9	Confident	65.3	Low	49 Å²	49	93.6 Å²	93.6	32%	0.318	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-51.5	145.8	177.4	-27.9	35.1	0	0	0	112	H121 A122 H129	P119-H121 VanDerWaalsContact CB-NE2 3.31Å; P119-H121 WeakPolarHBondContact CB-NE2 3.42Å; P119-H121 PolarHBondContact O-N 3.02Å; P119-A122 WeakPolarHBondContact O-CB 3.27Å; P119-A122 PolarHBondContact O-N 3.14Å; P119-H129 HydrophobicContact CB-CB 4.43Å; P119-H129 HydrophobicContact CG-CB 4.2Å
120	I	86	Confident	67.9	Low	157 Å²	157	86.8 Å²	86.8	81%	0.805	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-22.1	-176.3	-165.6	168.6	0	0	0	113.9
121	H	89.4	Confident	70.5	Confident	35 Å²	35	81.3 Å²	81.3	16%	0.162	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	5.6	174.9	53.1	-122	0	0	0	115.2	P119 H129 V134 W143 H171	P119-H121 VanDerWaalsContact CB-NE2 3.31Å; P119-H121 WeakPolarHBondContact CB-NE2 3.42Å; P119-H121 PolarHBondContact O-N 3.02Å; H121-H129 PolarHBondContact CD2-O 3.23Å; H121-H129 PolarHBondContact NE2-O 2.77Å; H121-V134 HydrophobicContact CB-CG2 4.26Å; H121-W143 HydrophobicContact CB-CD2 3.82Å; H121-W143 HydrophobicContact CB-CE3 4.13Å; H121-W143 HydrophobicContact CB-CG 4.15Å; H121-W143 HydrophobicContact CB-CZ2 4.37Å; H121-W143 WeakPolarHBondContact O-CB 3.23Å; H121-H171 AromaticContact CE1-NE2 3.78Å; H121-H171 AromaticContact CG-CD2 3.95Å; H121-H171 AromaticContact CG-NE2 3.54Å; H121-H171 AromaticContact ND1-CD2 3.81Å; H121-H171 AromaticContact ND1-CE1 3.61Å; H121-H171 AromaticContact ND1-NE2 2.93Å; H121-H171 PolarHBondContact ND1-NE2 3.16Å
122	A	87.8	Confident	73.4	Confident	11 Å²	11	73.4 Å²	73.4	9%	0.091	38%	0.382	C	S	.	.	S	Bend	trans	-67.1	141.7	179.5	0	0	0	0	0	112.4	L118 P119 S124 H129	L118-A122 HydrophobicContact CB-CB 3.87Å; L118-A122 HydrophobicContact CD2-CB 4.45Å; P119-A122 WeakPolarHBondContact O-CB 3.27Å; P119-A122 PolarHBondContact O-N 3.14Å; A122-S124 PolarHBondContact O-N 3.34Å; A122-S124 VanDerWaalsContact O-N 3.15Å; A122-H129 HydrophobicContact CB-CB 3.81Å
123	C	88.9	Confident	76.4	Confident	4 Å²	4	67.2 Å²	67.2	3%	0.027	34%	0.344	C	S	.	.			trans	-63	116.1	-179.2	175	0	0	0	0	111.7	Y125 C126 G127 I128 W143 C145	C123-Y125 PolarHBondContact O-N 3.46Å; C123-C126 PolarHBondContact O-N 3.15Å; C123-C126 VanDerWaalsContact O-N 3.1Å; C123-G127 PolarHBondContact O-N 3.41Å; C123-I128 HydrophobicContact CB-CB 4.48Å; C123-I128 WeakPolarHBondContact CB-O 3.17Å; C123-I128 PolarHBondContact N-O 3.5Å; C123-W143 CarbonylContact C-O 3.54Å; C123-W143 VanDerWaalsContact CA-O 3.31Å; C123-W143 WeakPolarHBondContact CA-O 3.4Å; C123-C145 HydrophobicContact CB-CB 3.99Å; C123-C145 PolarHBondContact SG-N 3.1Å; C123-C145 VanDerWaalsContact SG-N 3.42Å
124	S	88.2	Confident	79.1	Confident	42 Å²	42	61.8 Å²	61.8	29%	0.294	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	4.1	-175.7	-49.2	0	0	0	0	115.8	A122 W143 W269	A122-S124 PolarHBondContact O-N 3.34Å; A122-S124 VanDerWaalsContact O-N 3.15Å; S124-W143 PolarHBondContact N-O 3.03Å; S124-W143 PolarHBondContact OG-O 3.37Å; S124-W269 WeakPolarHBondContact O-CH2 3.3Å
125	Y	85.9	Confident	82	Confident	3 Å²	3	51.4 Å²	51.4	1%	0.012	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-42.3	169.4	-68.5	-23	0	0	0	113.1	C123 F144 H155 H159 I257 I262 L265 E266 W269	C123-Y125 PolarHBondContact O-N 3.46Å; Y125-F144 HydrophobicContact CD1-CD1 4.43Å; Y125-F144 AromaticContact CD1-CE1 3.94Å; Y125-F144 HydrophobicContact CD1-CE1 3.94Å; Y125-F144 AromaticContact CD2-CD1 3.97Å; Y125-F144 HydrophobicContact CD2-CD1 3.97Å; Y125-F144 HydrophobicContact CD2-CE1 4.22Å; Y125-F144 HydrophobicContact CE1-CD1 4.45Å; Y125-F144 AromaticContact CE1-CE1 3.77Å; Y125-F144 HydrophobicContact CE1-CE1 3.77Å; Y125-F144 AromaticContact CE2-CD1 3.98Å; Y125-F144 HydrophobicContact CE2-CD1 3.98Å; Y125-F144 HydrophobicContact CE2-CE1 4.05Å; Y125-F144 HydrophobicContact CG-CD1 4.19Å; Y125-F144 HydrophobicContact CG-CE1 4.17Å; Y125-F144 AromaticContact CZ-CE1 3.83Å; Y125-H155 HydrophobicContact CD2-CB 3.77Å; Y125-H155 AromaticContact CD2-CD2 3.75Å; Y125-H155 AromaticContact CD2-CG 3.87Å; Y125-H155 HydrophobicContact CE2-CB 4.37Å; Y125-H159 HydrophobicContact CE2-CB 4.12Å; Y125-H159 AromaticContact CZ-CE1 3.84Å; Y125-H159 WeakPolarHBondContact OH-CA 3.42Å; Y125-H159 WeakPolarHBondContact OH-CB 3.34Å; Y125-H159 PolarHBondContact OH-CE1 3.13Å; Y125-I257 HydrophobicContact CG-CD1 4.5Å; Y125-I257 WeakPolarHBondContact O-CD1 3.38Å; Y125-I262 HydrophobicContact CD1-CG1 4.26Å; Y125-I262 HydrophobicContact CD2-CD1 3.79Å; Y125-I262 HydrophobicContact CD2-CG1 4.2Å; Y125-I262 HydrophobicContact CE1-CG1 4.38Å; Y125-I262 HydrophobicContact CE1-CG2 3.92Å; Y125-I262 HydrophobicContact CE2-CD1 4.04Å; Y125-I262 HydrophobicContact CE2-CG1 4.35Å; Y125-I262 HydrophobicContact CE2-CG2 3.93Å; Y125-I262 HydrophobicContact CG-CD1 4.15Å; Y125-I262 HydrophobicContact CG-CG1 4.16Å; Y125-L265 HydrophobicContact CD1-CD2 4.1Å; Y125-L265 HydrophobicContact CE1-CD2 4.46Å; Y125-E266 WeakPolarHBondContact CE1-OE2 3.39Å; Y125-E266 PolarHBondContact OH-OE2 2.94Å; Y125-W269 AromaticContact CD1-CH2 3.87Å; Y125-W269 HydrophobicContact CD1-CH2 3.87Å; Y125-W269 HydrophobicContact CD1-CZ3 4.15Å; Y125-W269 AromaticContact CE1-CH2 3.79Å; Y125-W269 HydrophobicContact CE1-CH2 3.79Å; Y125-W269 AromaticContact CE1-CZ3 3.58Å; Y125-W269 HydrophobicContact CE1-CZ3 3.58Å
126	C	84.4	Confident	84.9	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.034	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	-8.1	-165.7	68.4	0	0	0	0	115.6	C123 I128 C145 H155 A254 R255 I257	C123-C126 PolarHBondContact O-N 3.15Å; C123-C126 VanDerWaalsContact O-N 3.1Å; C126-I128 PolarHBondContact O-N 3.01Å; C126-C145 VanDerWaalsContact SG-SG 3.66Å; C126-H155 PolarHBondContact SG-CE1 3.43Å; C126-H155 PolarHBondContact SG-ND1 3.33Å; C126-A254 HydrophobicContact CB-CB 4.14Å; C126-A254 WeakPolarHBondContact O-CB 3.49Å; C126-R255 PolarHBondContact O-N 3.08Å; C126-I257 HydrophobicContact CB-CG2 4.27Å
127	G	81.1	Confident	87.2	Confident	16 Å²	16	40.9 Å²	40.9	17%	0.165	22%	0.223	C	C	.	.			trans	85.7	-9.7	179.2	0	0	0	0	0	116.3	C123 H129	C123-G127 PolarHBondContact O-N 3.41Å; G127-H129 PolarHBondContact O-CD2 3.1Å; G127-H129 PolarHBondContact O-N 2.7Å
128	I	87.3	Confident	88.6	Confident	14 Å²	14	35 Å²	35	7%	0.072	19%	0.191	C	C	.	.			trans	-56.4	127.8	178	-65.1	178.4	0	0	0	110.6	C123 C126 C145 P246 Q251 A254	C123-I128 HydrophobicContact CB-CB 4.48Å; C123-I128 WeakPolarHBondContact CB-O 3.17Å; C123-I128 PolarHBondContact N-O 3.5Å; C126-I128 PolarHBondContact O-N 3.01Å; I128-C145 HydrophobicContact CB-CB 4.11Å; I128-C145 HydrophobicContact CG2-CB 3.97Å; I128-P246 HydrophobicContact CD1-CB 4.13Å; I128-P246 HydrophobicContact CD1-CG 4.03Å; I128-P246 HydrophobicContact CG2-CB 4.24Å; I128-P246 HydrophobicContact CG2-CG 3.86Å; I128-Q251 HydrophobicContact CD1-CG 3.95Å; I128-A254 HydrophobicContact CD1-CB 3.91Å; I128-A254 HydrophobicContact CG1-CB 3.61Å
129	H	89.7	Confident	88.7	Confident	90 Å²	90	34.3 Å²	34.3	42%	0.417	19%	0.192	S	C	.	.			trans	-135.9	23.8	-168.2	65.1	69.2	0	0	0	113.9	P119 H121 A122 G127 P131	P119-H129 HydrophobicContact CB-CB 4.43Å; P119-H129 HydrophobicContact CG-CB 4.2Å; H121-H129 PolarHBondContact CD2-O 3.23Å; H121-H129 PolarHBondContact NE2-O 2.77Å; A122-H129 HydrophobicContact CB-CB 3.81Å; G127-H129 PolarHBondContact O-CD2 3.1Å; G127-H129 PolarHBondContact O-N 2.7Å; H129-P131 VanDerWaalsContact O-CD 3.3Å; H129-P131 WeakPolarHBondContact O-CD 3.34Å
130	D	89.9	Confident	88.8	Confident	47 Å²	47	33.5 Å²	33.5	25%	0.251	19%	0.188	S	C	.	.			trans	-67.5	119.8	167.5	165.5	25.9	0	0	0	109.8	A132 C133 V134	D130-A132 PolarHBondContact O-N 2.57Å; D130-A132 VanDerWaalsContact O-N 3.11Å; D130-A132 PolarHBondContact OD1-N 3.39Å; D130-C133 HydrophobicContact CB-CB 4.09Å; D130-C133 PolarHBondContact O-N 3.37Å; D130-C133 PolarHBondContact OD2-N 3.4Å; D130-C133 PolarHBondContact OD2-SG 3.48Å; D130-V134 WeakPolarHBondContact O-CG2 3.28Å; D130-V134 PolarHBondContact O-N 3.15Å
131	P	90.6	Very high	89	Confident	36 Å²	36	33.7 Å²	33.7	23%	0.234	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44	-38.5	172.5	-35.6	41	0	0	0	115.9	H129 C133 H171 D173	H129-P131 VanDerWaalsContact O-CD 3.3Å; H129-P131 WeakPolarHBondContact O-CD 3.34Å; P131-C133 VanDerWaalsContact C-N 3.29Å; P131-C133 PolarHBondContact O-N 2.78Å; P131-H171 WeakPolarHBondContact CB-ND1 3.45Å; P131-H171 WeakPolarHBondContact O-CB 3.3Å; P131-D173 HydrophobicContact CB-CB 4.01Å
132	A	91.8	Very high	89.1	Confident	11 Å²	11	34 Å²	34	9%	0.091	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-11.5	-177	0	0	0	0	0	113.6	D130 K244	D130-A132 PolarHBondContact O-N 2.57Å; D130-A132 VanDerWaalsContact O-N 3.11Å; D130-A132 PolarHBondContact OD1-N 3.39Å; A132-K244 HydrophobicContact CB-CB 4.45Å; A132-K244 HydrophobicContact CB-CD 3.71Å; A132-K244 HydrophobicContact CB-CG 4.13Å; A132-K244 WeakPolarHBondContact O-CB 3.41Å; A132-K244 PolarHBondContact O-N 3.09Å
133	C	93.5	Very high	89.4	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.014	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-5.5	-178.4	-73.6	0	0	0	0	114.6	D130 P131 C145 N146 K244 P246	D130-C133 HydrophobicContact CB-CB 4.09Å; D130-C133 PolarHBondContact O-N 3.37Å; D130-C133 PolarHBondContact OD2-N 3.4Å; D130-C133 PolarHBondContact OD2-SG 3.48Å; P131-C133 VanDerWaalsContact C-N 3.29Å; P131-C133 PolarHBondContact O-N 2.78Å; C133-C145 CarbonylContact O-C 3.58Å; C133-C145 WeakPolarHBondContact O-CA 3.26Å; C133-N146 PolarHBondContact O-N 3.21Å; C133-K244 WeakPolarHBondContact CA-O 3.33Å; C133-K244 VanDerWaalsContact SG-C 3.58Å; C133-K244 VanDerWaalsContact SG-CB 3.58Å; C133-K244 PolarHBondContact SG-O 3.15Å; C133-P246 HydrophobicContact CB-CG 3.76Å; C133-P246 VanDerWaalsContact SG-N 3.39Å
134	V	93.9	Very high	89.7	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	147.6	-173.8	-63.4	0	0	0	0	113.7	H121 D130 W143 C145 H171	H121-V134 HydrophobicContact CB-CG2 4.26Å; D130-V134 WeakPolarHBondContact O-CG2 3.28Å; D130-V134 PolarHBondContact O-N 3.15Å; V134-W143 HydrophobicContact CB-CE3 4.07Å; V134-W143 HydrophobicContact CG2-CE3 3.85Å; V134-W143 HydrophobicContact CG2-CZ3 4.11Å; V134-C145 HydrophobicContact CG1-CB 4.16Å; V134-H171 HydrophobicContact CG2-CB 4.27Å
135	V	95.6	Very high	90	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133.9	-177.4	-175	0	0	0	0	109	W143 F144 I156 V168 V243	V135-W143 VanDerWaalsContact C-CE3 3.48Å; V135-W143 WeakPolarHBondContact O-CA 3.45Å; V135-F144 PolarHBondContact N-O 3.4Å; V135-F144 PolarHBondContact O-N 2.95Å; V135-I156 HydrophobicContact CB-CB 4.35Å; V135-I156 HydrophobicContact CB-CD1 4Å; V135-I156 HydrophobicContact CB-CG1 3.84Å; V135-I156 HydrophobicContact CG1-CD1 3.96Å; V135-I156 HydrophobicContact CG1-CG1 3.94Å; V135-I156 HydrophobicContact CG2-CG1 4.35Å; V135-I156 HydrophobicContact CG2-CG2 4.38Å; V135-V168 HydrophobicContact CG1-CB 3.57Å; V135-V168 HydrophobicContact CG1-CG1 3.75Å; V135-V168 HydrophobicContact CG1-CG2 4.15Å; V135-V243 HydrophobicContact CG2-CB 4.32Å; V135-V243 HydrophobicContact CG2-CG1 3.74Å; V135-V243 HydrophobicContact CG2-CG2 3.76Å
136	Y	95.8	Very high	90.4	Very high	63 Å²	63	33 Å²	33	25%	0.247	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.7	175.3	-173.6	-122.4	0	0	0	110.6	N138 K141 W143 V168 T169	Y136-N138 WeakPolarHBondContact CD1-OD1 3.5Å; Y136-K141 VanDerWaalsContact CE2-C 3.48Å; Y136-K141 WeakPolarHBondContact OH-CA 3.26Å; Y136-K141 WeakPolarHBondContact OH-CB 3.46Å; Y136-W143 AromaticContact CD2-CD1 3.69Å; Y136-W143 AromaticContact CD2-CD2 3.9Å; Y136-W143 HydrophobicContact CD2-CD2 3.9Å; Y136-W143 AromaticContact CD2-CE2 3.53Å; Y136-W143 AromaticContact CD2-CG 3.99Å; Y136-W143 HydrophobicContact CD2-CG 3.99Å; Y136-W143 HydrophobicContact CD2-CZ2 4.03Å; Y136-W143 AromaticContact CD2-NE1 3.4Å; Y136-W143 AromaticContact CE2-NE1 3.85Å; Y136-W143 HydrophobicContact CG-CD2 4.34Å; Y136-W143 AromaticContact CG-CE2 3.99Å; Y136-W143 HydrophobicContact CG-CH2 4.45Å; Y136-W143 HydrophobicContact CG-CZ2 4.07Å; Y136-V168 WeakPolarHBondContact O-CA 2.96Å; Y136-V168 WeakPolarHBondContact O-CB 3.25Å; Y136-T169 WeakPolarHBondContact CB-O 3.34Å; Y136-T169 PolarHBondContact N-O 3.43Å; Y136-T169 PolarHBondContact O-N 3.05Å
137	C	92.6	Very high	90.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	110.8	171.1	179.4	0	0	0	0	109.4	T139 S140 K141 K142 F144 C165	C137-T139 VanDerWaalsContact C-N 3.34Å; C137-T139 PolarHBondContact O-N 3.24Å; C137-S140 CarbonylContact O-C 3.59Å; C137-S140 WeakPolarHBondContact O-CA 3.34Å; C137-S140 PolarHBondContact O-N 3.36Å; C137-S140 PolarHBondContact SG-N 2.93Å; C137-S140 VanDerWaalsContact SG-N 3.41Å; C137-K141 PolarHBondContact O-N 3.08Å; C137-K142 PolarHBondContact N-O 3.47Å; C137-F144 HydrophobicContact CB-CD2 4.33Å; C137-F144 HydrophobicContact CB-CE2 4.22Å; C137-C165 WeakPolarHBondContact SG-CB 3.4Å; C137-C165 VanDerWaalsContact SG-SG 3.67Å
138	N	88.6	Confident	90.9	Very high	36 Å²	36	39.2 Å²	39.2	19%	0.193	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-37.8	-171.2	-64.4	-5.6	0	0	0	112.6	Y136 E167 T169	Y136-N138 WeakPolarHBondContact CD1-OD1 3.5Å; N138-E167 HydrophobicContact CB-CB 4.1Å; N138-E167 PolarHBondContact N-O 2.86Å; N138-T169 PolarHBondContact ND2-OG1 3.04Å; N138-T169 PolarHBondContact OD1-N 2.55Å; N138-T169 PolarHBondContact OD1-OG1 3.03Å
139	T	80.8	Confident	90.7	Very high	97 Å²	97	39.8 Å²	39.8	60%	0.595	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-44	176	-40.1	0	0	0	0	111.1	C137	C137-T139 VanDerWaalsContact C-N 3.34Å; C137-T139 PolarHBondContact O-N 3.24Å
140	S	82.4	Confident	90.1	Very high	32 Å²	32	39.9 Å²	39.9	22%	0.224	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-46.9	170.5	154.5	0	0	0	0	117.6	C137 K142 H159	C137-S140 CarbonylContact O-C 3.59Å; C137-S140 WeakPolarHBondContact O-CA 3.34Å; C137-S140 PolarHBondContact O-N 3.36Å; C137-S140 PolarHBondContact SG-N 2.93Å; C137-S140 VanDerWaalsContact SG-N 3.41Å; S140-K142 PolarHBondContact O-N 2.64Å; S140-H159 WeakPolarHBondContact CB-NE2 3.46Å; S140-H159 PolarHBondContact OG-NE2 3.24Å
141	K	90.4	Very high	89.7	Confident	162 Å²	162	38.6 Å²	38.6	70%	0.704	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	35.9	-154.7	-56.3	-168.9	179.2	-175.5	0	113.7	Y136 C137	Y136-K141 VanDerWaalsContact CE2-C 3.48Å; Y136-K141 WeakPolarHBondContact OH-CA 3.26Å; Y136-K141 WeakPolarHBondContact OH-CB 3.46Å; C137-K141 PolarHBondContact O-N 3.08Å
142	K	91.6	Very high	89	Confident	40 Å²	40	40.6 Å²	40.6	17%	0.174	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151.8	-178.8	-73.3	-178.5	-177.1	-179.2	0	110.8	C137 S140 F144 W269 P273	C137-K142 PolarHBondContact N-O 3.47Å; S140-K142 PolarHBondContact O-N 2.64Å; K142-F144 HydrophobicContact CB-CE2 3.54Å; K142-F144 HydrophobicContact CB-CZ 3.79Å; K142-F144 HydrophobicContact CD-CZ 4.39Å; K142-W269 HydrophobicContact CD-CE3 4.44Å; K142-W269 HydrophobicContact CD-CH2 4.17Å; K142-W269 HydrophobicContact CD-CZ2 4.4Å; K142-W269 HydrophobicContact CD-CZ3 4.18Å; K142-P273 PolarHBondContact NZ-O 3.01Å
143	W	94.3	Very high	88.6	Confident	39 Å²	39	40.6 Å²	40.6	15%	0.148	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.8	179.8	-69.1	87	0	0	0	111.4	H121 C123 S124 V134 V135 Y136 H171	H121-W143 HydrophobicContact CB-CD2 3.82Å; H121-W143 HydrophobicContact CB-CE3 4.13Å; H121-W143 HydrophobicContact CB-CG 4.15Å; H121-W143 HydrophobicContact CB-CZ2 4.37Å; H121-W143 WeakPolarHBondContact O-CB 3.23Å; C123-W143 CarbonylContact C-O 3.54Å; C123-W143 VanDerWaalsContact CA-O 3.31Å; C123-W143 WeakPolarHBondContact CA-O 3.4Å; S124-W143 PolarHBondContact N-O 3.03Å; S124-W143 PolarHBondContact OG-O 3.37Å; V134-W143 HydrophobicContact CB-CE3 4.07Å; V134-W143 HydrophobicContact CG2-CE3 3.85Å; V134-W143 HydrophobicContact CG2-CZ3 4.11Å; V135-W143 VanDerWaalsContact C-CE3 3.48Å; V135-W143 WeakPolarHBondContact O-CA 3.45Å; Y136-W143 AromaticContact CD2-CD1 3.69Å; Y136-W143 AromaticContact CD2-CD2 3.9Å; Y136-W143 HydrophobicContact CD2-CD2 3.9Å; Y136-W143 AromaticContact CD2-CE2 3.53Å; Y136-W143 AromaticContact CD2-CG 3.99Å; Y136-W143 HydrophobicContact CD2-CG 3.99Å; Y136-W143 HydrophobicContact CD2-CZ2 4.03Å; Y136-W143 AromaticContact CD2-NE1 3.4Å; Y136-W143 AromaticContact CE2-NE1 3.85Å; Y136-W143 HydrophobicContact CG-CD2 4.34Å; Y136-W143 AromaticContact CG-CE2 3.99Å; Y136-W143 HydrophobicContact CG-CH2 4.45Å; Y136-W143 HydrophobicContact CG-CZ2 4.07Å; W143-H171 HydrophobicContact CH2-CB 4.04Å; W143-H171 AromaticContact CH2-CD2 3.48Å; W143-H171 VanDerWaalsContact CH2-CD2 3.48Å; W143-H171 WeakPolarHBondContact CH2-CD2 3.46Å; W143-H171 HydrophobicContact CZ3-CB 3.83Å; W143-H171 AromaticContact CZ3-CD2 3.76Å
144	F	94.9	Very high	88.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	141.9	178.5	-57.9	-91	0	0	0	110.7	Y125 V135 C137 K142 I156 H159 W269	Y125-F144 HydrophobicContact CD1-CD1 4.43Å; Y125-F144 AromaticContact CD1-CE1 3.94Å; Y125-F144 HydrophobicContact CD1-CE1 3.94Å; Y125-F144 AromaticContact CD2-CD1 3.97Å; Y125-F144 HydrophobicContact CD2-CD1 3.97Å; Y125-F144 HydrophobicContact CD2-CE1 4.22Å; Y125-F144 HydrophobicContact CE1-CD1 4.45Å; Y125-F144 AromaticContact CE1-CE1 3.77Å; Y125-F144 HydrophobicContact CE1-CE1 3.77Å; Y125-F144 AromaticContact CE2-CD1 3.98Å; Y125-F144 HydrophobicContact CE2-CD1 3.98Å; Y125-F144 HydrophobicContact CE2-CE1 4.05Å; Y125-F144 HydrophobicContact CG-CD1 4.19Å; Y125-F144 HydrophobicContact CG-CE1 4.17Å; Y125-F144 AromaticContact CZ-CE1 3.83Å; V135-F144 PolarHBondContact N-O 3.4Å; V135-F144 PolarHBondContact O-N 2.95Å; C137-F144 HydrophobicContact CB-CD2 4.33Å; C137-F144 HydrophobicContact CB-CE2 4.22Å; K142-F144 HydrophobicContact CB-CE2 3.54Å; K142-F144 HydrophobicContact CB-CZ 3.79Å; K142-F144 HydrophobicContact CD-CZ 4.39Å; F144-I156 HydrophobicContact CB-CB 3.79Å; F144-I156 HydrophobicContact CB-CD1 3.99Å; F144-I156 HydrophobicContact CB-CG1 4.49Å; F144-I156 HydrophobicContact CD2-CD1 4.15Å; F144-I156 HydrophobicContact CG-CD1 4.45Å; F144-H159 HydrophobicContact CD1-CB 3.89Å; F144-H159 HydrophobicContact CD2-CB 4.19Å; F144-H159 AromaticContact CD2-CD2 3.64Å; F144-H159 AromaticContact CD2-CG 3.91Å; F144-H159 HydrophobicContact CE1-CB 3.84Å; F144-H159 AromaticContact CE1-CE1 3.99Å; F144-H159 AromaticContact CE1-CG 3.7Å; F144-H159 AromaticContact CE1-ND1 3.86Å; F144-H159 HydrophobicContact CE2-CB 4.15Å; F144-H159 AromaticContact CE2-CD2 3.17Å; F144-H159 WeakPolarHBondContact CE2-CD2 3.48Å; F144-H159 AromaticContact CE2-CG 3.43Å; F144-H159 VanDerWaalsContact CE2-CG 3.43Å; F144-H159 AromaticContact CE2-ND1 3.83Å; F144-H159 HydrophobicContact CG-CB 4.08Å; F144-H159 HydrophobicContact CZ-CB 3.98Å; F144-H159 AromaticContact CZ-CD2 3.57Å; F144-H159 AromaticContact CZ-CE1 3.72Å; F144-H159 AromaticContact CZ-CG 3.32Å; F144-H159 AromaticContact CZ-ND1 3.35Å; F144-H159 VanDerWaalsContact CZ-ND1 3.35Å; F144-H159 WeakPolarHBondContact CZ-ND1 3.39Å; F144-W269 HydrophobicContact CE1-CH2 4.25Å; F144-W269 HydrophobicContact CE1-CZ3 4.02Å; F144-W269 HydrophobicContact CZ-CH2 4.38Å; F144-W269 AromaticContact CZ-CZ3 3.93Å; F144-W269 HydrophobicContact CZ-CZ3 3.93Å
145	C	94.4	Very high	88.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	160.9	179.6	69.3	0	0	0	0	112.7	C123 C126 I128 C133 V134 G147 H155 I156 P246	C123-C145 HydrophobicContact CB-CB 3.99Å; C123-C145 PolarHBondContact SG-N 3.1Å; C123-C145 VanDerWaalsContact SG-N 3.42Å; C126-C145 VanDerWaalsContact SG-SG 3.66Å; I128-C145 HydrophobicContact CB-CB 4.11Å; I128-C145 HydrophobicContact CG2-CB 3.97Å; C133-C145 CarbonylContact O-C 3.58Å; C133-C145 WeakPolarHBondContact O-CA 3.26Å; V134-C145 HydrophobicContact CG1-CB 4.16Å; C145-G147 PolarHBondContact O-N 3.14Å; C145-H155 WeakPolarHBondContact O-CB 3.38Å; C145-H155 PolarHBondContact O-N 3.36Å; C145-H155 PolarHBondContact SG-ND1 2.78Å; C145-I156 PolarHBondContact O-N 3.36Å; C145-I156 VanDerWaalsContact O-N 3.07Å; C145-P246 HydrophobicContact CB-CG 4.48Å
146	N	95.2	Very high	88.4	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.211	C	C	.	.	S	Bend	trans	-84.1	7	171.8	-158.8	32	0	0	0	113.3	C133 S154 C237 F238 V243 K244	C133-N146 PolarHBondContact O-N 3.21Å; N146-S154 VanDerWaalsContact C-CB 3.44Å; N146-S154 WeakPolarHBondContact O-CB 3.4Å; N146-S154 VanDerWaalsContact OD1-CB 3.29Å; N146-S154 WeakPolarHBondContact OD1-CB 3.4Å; N146-S154 PolarHBondContact OD1-OG 3.19Å; N146-C237 WeakPolarHBondContact OD1-CB 3.42Å; N146-F238 PolarHBondContact ND2-O 3.36Å; N146-F238 PolarHBondContact OD1-N 2.93Å; N146-V243 HydrophobicContact CB-CB 4.24Å; N146-V243 HydrophobicContact CB-CG1 3.71Å; N146-V243 PolarHBondContact ND2-O 2.96Å; N146-K244 WeakPolarHBondContact CB-O 3.47Å
147	G	89.3	Confident	88.1	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.			trans	-72	151.7	169.9	0	0	0	0	0	112.4	C145 S154 H155	C145-G147 PolarHBondContact O-N 3.14Å; G147-S154 CarbonylContact O-C 3.47Å; G147-S154 VanDerWaalsContact O-CA 3.23Å; G147-S154 WeakPolarHBondContact O-CA 3.41Å; G147-H155 PolarHBondContact O-N 3.15Å
148	R	85.8	Confident	87.9	Confident	151 Å²	151	39.2 Å²	39.2	57%	0.57	21%	0.208	S	C	*	.			trans	-92.8	-30.8	-177.9	61.6	-176.6	173.4	-162	-3.9	113.7	N150 T151 G153	R148-N150 PolarHBondContact O-N 3Å; R148-T151 WeakPolarHBondContact O-CB 3.42Å; R148-T151 PolarHBondContact O-N 3.04Å; R148-T151 VanDerWaalsContact O-N 3.09Å; R148-T151 PolarHBondContact O-OG1 3.09Å; R148-G153 WeakPolarHBondContact CA-O 3.34Å
149	G	83.3	Confident	87.8	Confident	27 Å²	27	37.7 Å²	37.7	28%	0.278	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	-136.5	-173.5	0	0	0	0	0	111.7	T151	G149-T151 PolarHBondContact O-N 2.87Å; G149-T151 VanDerWaalsContact O-N 3.16Å
150	N	78.3	Confident	88	Confident	92 Å²	92	33 Å²	33	49%	0.492	17%	0.171	S	C	.	.	B	Isolated β-bridge	trans	-87.4	35.5	178.9	-60.5	-25.1	0	0	0	112.5	R148 Q256	R148-N150 PolarHBondContact O-N 3Å; N150-Q256 PolarHBondContact ND2-OE1 2.85Å
151	T	80.7	Confident	87.8	Confident	20 Å²	20	33.4 Å²	33.4	12%	0.123	17%	0.172	C	C	.	.	S	Bend	trans	-134.7	163.2	-175.3	85.5	0	0	0	0	113.7	R148 G149 G153 A259 I262	R148-T151 WeakPolarHBondContact O-CB 3.42Å; R148-T151 PolarHBondContact O-N 3.04Å; R148-T151 VanDerWaalsContact O-N 3.09Å; R148-T151 PolarHBondContact O-OG1 3.09Å; G149-T151 PolarHBondContact O-N 2.87Å; G149-T151 VanDerWaalsContact O-N 3.16Å; T151-G153 VanDerWaalsContact C-N 3.3Å; T151-G153 PolarHBondContact O-N 3.34Å; T151-G153 PolarHBondContact OG1-O 3.49Å; T151-A259 HydrophobicContact CG2-CB 4.35Å; T151-I262 HydrophobicContact CG2-CD1 3.75Å
152	S	76.4	Confident	87.2	Confident	77 Å²	77	29.3 Å²	29.3	54%	0.538	15%	0.152	S	C	.	.	S	Bend	trans	-88.3	27.4	-171.6	70.8	0	0	0	0	115.6	R236 Q848	S152-R236 WeakPolarHBondContact O-CD 3.36Å; S152-R236 PolarHBondContact O-NH1 3.05Å; S152-R236 PolarHBondContact OG-NH1 3.13Å; S152-Q848 PolarHBondContact O-NE2 3.1Å; S152-Q848 VanDerWaalsContact O-NE2 3.1Å
153	G	84.1	Confident	86.6	Confident	11 Å²	11	29.1 Å²	29.1	11%	0.113	16%	0.158	C	C	.	.	S	Bend	trans	177.1	177.4	-178.2	0	0	0	0	0	109.2	R148 T151	R148-G153 WeakPolarHBondContact CA-O 3.34Å; T151-G153 VanDerWaalsContact C-N 3.3Å; T151-G153 PolarHBondContact O-N 3.34Å; T151-G153 PolarHBondContact OG1-O 3.49Å
154	S	92.5	Very high	85.6	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.007	17%	0.172	C	C	.	.			trans	-75.8	154.4	177.8	71.4	0	0	0	0	113.1	N146 G147 I156 V157 N158 R236	N146-S154 VanDerWaalsContact C-CB 3.44Å; N146-S154 WeakPolarHBondContact O-CB 3.4Å; N146-S154 VanDerWaalsContact OD1-CB 3.29Å; N146-S154 WeakPolarHBondContact OD1-CB 3.4Å; N146-S154 PolarHBondContact OD1-OG 3.19Å; G147-S154 CarbonylContact O-C 3.47Å; G147-S154 VanDerWaalsContact O-CA 3.23Å; G147-S154 WeakPolarHBondContact O-CA 3.41Å; S154-I156 VanDerWaalsContact C-N 3.31Å; S154-I156 PolarHBondContact O-N 3.03Å; S154-I156 WeakPolarHBondContact OG-CG2 3.38Å; S154-V157 PolarHBondContact O-N 3.44Å; S154-V157 VanDerWaalsContact O-N 3.15Å; S154-N158 VanDerWaalsContact O-CB 3.28Å; S154-N158 WeakPolarHBondContact O-CB 3.49Å; S154-N158 PolarHBondContact O-N 3.17Å; S154-R236 PolarHBondContact N-O 2.74Å
155	H	92.1	Very high	85	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.019	17%	0.174	C	C	.	.	H	α-helix	trans	-57.2	-41.7	-178.6	-71	145.7	0	0	0	112.7	Y125 C126 C145 G147 N158 H159	Y125-H155 HydrophobicContact CD2-CB 3.77Å; Y125-H155 AromaticContact CD2-CD2 3.75Å; Y125-H155 AromaticContact CD2-CG 3.87Å; Y125-H155 HydrophobicContact CE2-CB 4.37Å; C126-H155 PolarHBondContact SG-CE1 3.43Å; C126-H155 PolarHBondContact SG-ND1 3.33Å; C145-H155 WeakPolarHBondContact O-CB 3.38Å; C145-H155 PolarHBondContact O-N 3.36Å; C145-H155 PolarHBondContact SG-ND1 2.78Å; G147-H155 PolarHBondContact O-N 3.15Å; H155-N158 PolarHBondContact O-N 3.3Å; H155-H159 WeakPolarHBondContact O-CB 3.21Å; H155-H159 PolarHBondContact O-N 3.46Å
156	I	93.6	Very high	84.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-48.3	173.6	-179.7	64.8	0	0	0	112.3	V135 F144 C145 S154 N158 H159 L160 V168 F238	V135-I156 HydrophobicContact CB-CB 4.35Å; V135-I156 HydrophobicContact CB-CD1 4Å; V135-I156 HydrophobicContact CB-CG1 3.84Å; V135-I156 HydrophobicContact CG1-CD1 3.96Å; V135-I156 HydrophobicContact CG1-CG1 3.94Å; V135-I156 HydrophobicContact CG2-CG1 4.35Å; V135-I156 HydrophobicContact CG2-CG2 4.38Å; F144-I156 HydrophobicContact CB-CB 3.79Å; F144-I156 HydrophobicContact CB-CD1 3.99Å; F144-I156 HydrophobicContact CB-CG1 4.49Å; F144-I156 HydrophobicContact CD2-CD1 4.15Å; F144-I156 HydrophobicContact CG-CD1 4.45Å; C145-I156 PolarHBondContact O-N 3.36Å; C145-I156 VanDerWaalsContact O-N 3.07Å; S154-I156 VanDerWaalsContact C-N 3.31Å; S154-I156 PolarHBondContact O-N 3.03Å; S154-I156 WeakPolarHBondContact OG-CG2 3.38Å; I156-N158 PolarHBondContact O-N 2.98Å; I156-H159 PolarHBondContact O-N 2.92Å; I156-L160 HydrophobicContact CD1-CD1 4.18Å; I156-L160 HydrophobicContact CD1-CD2 4.27Å; I156-L160 HydrophobicContact CD1-CG 3.97Å; I156-L160 HydrophobicContact CG1-CD1 3.98Å; I156-L160 HydrophobicContact CG1-CG 4.21Å; I156-L160 VanDerWaalsContact O-CG 3.29Å; I156-L160 WeakPolarHBondContact O-CG 3.22Å; I156-L160 PolarHBondContact O-N 3.39Å; I156-V168 HydrophobicContact CD1-CG1 4.23Å; I156-F238 HydrophobicContact CB-CE2 4.45Å; I156-F238 HydrophobicContact CG1-CE2 3.8Å; I156-F238 HydrophobicContact CG2-CD2 3.66Å; I156-F238 HydrophobicContact CG2-CE2 3.76Å
157	V	89.5	Confident	84.1	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.03	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-42	-179.7	175.4	0	0	0	0	110.7	S154 H159 L160 V161 I233 R236 F238	S154-V157 PolarHBondContact O-N 3.44Å; S154-V157 VanDerWaalsContact O-N 3.15Å; V157-H159 VanDerWaalsContact C-N 3.31Å; V157-H159 PolarHBondContact O-N 3.31Å; V157-L160 PolarHBondContact O-N 2.96Å; V157-V161 HydrophobicContact CG1-CG2 4.21Å; V157-V161 WeakPolarHBondContact O-CB 3.48Å; V157-V161 WeakPolarHBondContact O-CG2 3.43Å; V157-V161 PolarHBondContact O-N 3.47Å; V157-I233 HydrophobicContact CG1-CG2 4.45Å; V157-I233 HydrophobicContact CG2-CD1 4.25Å; V157-I233 HydrophobicContact CG2-CG1 4.43Å; V157-I233 HydrophobicContact CG2-CG2 4.07Å; V157-R236 WeakPolarHBondContact CB-O 3.14Å; V157-R236 HydrophobicContact CG1-CB 4.29Å; V157-R236 WeakPolarHBondContact CG2-O 3.46Å; V157-F238 HydrophobicContact CG2-CD2 4.06Å; V157-F238 HydrophobicContact CG2-CE2 4.08Å
158	N	87.3	Confident	84.3	Confident	28 Å²	28	38.3 Å²	38.3	15%	0.15	20%	0.201	C	C	.	.	H	α-helix	trans	-59.1	-41.4	175.9	-170.1	36.4	0	0	0	111.3	S154 H155 I156 R162	S154-N158 VanDerWaalsContact O-CB 3.28Å; S154-N158 WeakPolarHBondContact O-CB 3.49Å; S154-N158 PolarHBondContact O-N 3.17Å; H155-N158 PolarHBondContact O-N 3.3Å; I156-N158 PolarHBondContact O-N 2.98Å; N158-R162 WeakPolarHBondContact O-CD 3.32Å; N158-R162 WeakPolarHBondContact O-CG 3.47Å; N158-R162 PolarHBondContact O-N 3.41Å; N158-R162 PolarHBondContact OD1-NE 3.24Å; N158-R162 PolarHBondContact OD1-NH2 2.84Å
159	H	87.7	Confident	84.7	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.019	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-55.1	174.3	174.6	67.3	0	0	0	112.6	Y125 S140 F144 H155 I156 V157 V161 R162 A163 E266 W269	Y125-H159 HydrophobicContact CE2-CB 4.12Å; Y125-H159 AromaticContact CZ-CE1 3.84Å; Y125-H159 WeakPolarHBondContact OH-CA 3.42Å; Y125-H159 WeakPolarHBondContact OH-CB 3.34Å; Y125-H159 PolarHBondContact OH-CE1 3.13Å; S140-H159 WeakPolarHBondContact CB-NE2 3.46Å; S140-H159 PolarHBondContact OG-NE2 3.24Å; F144-H159 HydrophobicContact CD1-CB 3.89Å; F144-H159 HydrophobicContact CD2-CB 4.19Å; F144-H159 AromaticContact CD2-CD2 3.64Å; F144-H159 AromaticContact CD2-CG 3.91Å; F144-H159 HydrophobicContact CE1-CB 3.84Å; F144-H159 AromaticContact CE1-CE1 3.99Å; F144-H159 AromaticContact CE1-CG 3.7Å; F144-H159 AromaticContact CE1-ND1 3.86Å; F144-H159 HydrophobicContact CE2-CB 4.15Å; F144-H159 AromaticContact CE2-CD2 3.17Å; F144-H159 WeakPolarHBondContact CE2-CD2 3.48Å; F144-H159 AromaticContact CE2-CG 3.43Å; F144-H159 VanDerWaalsContact CE2-CG 3.43Å; F144-H159 AromaticContact CE2-ND1 3.83Å; F144-H159 HydrophobicContact CG-CB 4.08Å; F144-H159 HydrophobicContact CZ-CB 3.98Å; F144-H159 AromaticContact CZ-CD2 3.57Å; F144-H159 AromaticContact CZ-CE1 3.72Å; F144-H159 AromaticContact CZ-CG 3.32Å; F144-H159 AromaticContact CZ-ND1 3.35Å; F144-H159 VanDerWaalsContact CZ-ND1 3.35Å; F144-H159 WeakPolarHBondContact CZ-ND1 3.39Å; H155-H159 WeakPolarHBondContact O-CB 3.21Å; H155-H159 PolarHBondContact O-N 3.46Å; I156-H159 PolarHBondContact O-N 2.92Å; V157-H159 VanDerWaalsContact C-N 3.31Å; V157-H159 PolarHBondContact O-N 3.31Å; H159-V161 PolarHBondContact O-N 2.86Å; H159-V161 VanDerWaalsContact O-N 3.17Å; H159-R162 PolarHBondContact O-N 3.39Å; H159-A163 VanDerWaalsContact NE2-CB 3.27Å; H159-A163 WeakPolarHBondContact NE2-CB 3.39Å; H159-A163 PolarHBondContact O-N 2.69Å; H159-E266 IonicContact CE1-OE1 3.87Å; H159-E266 PolarHBondContact CE1-OE1 2.84Å; H159-E266 IonicContact CE1-OE2 3.22Å; H159-E266 PolarHBondContact CE1-OE2 3.08Å; H159-E266 IonicContact ND1-OE1 3.05Å; H159-E266 PolarHBondContact ND1-OE1 3.17Å; H159-E266 IonicContact ND1-OE2 2.78Å; H159-E266 PolarHBondContact ND1-OE2 3.22Å; H159-E266 VanDerWaalsContact ND1-OE2 3.11Å; H159-E266 IonicContact NE2-OE1 2.72Å; H159-E266 PolarHBondContact NE2-OE1 3.15Å; H159-E266 IonicContact NE2-OE2 2.65Å; H159-W269 AromaticContact CE1-CZ3 3.84Å
160	L	84.8	Confident	85.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-51.8	-42.9	-179.2	-69.1	174.9	0	0	0	111.8	I156 V157 R162 K164 C165 V168 V191 F192 F238	I156-L160 HydrophobicContact CD1-CD1 4.18Å; I156-L160 HydrophobicContact CD1-CD2 4.27Å; I156-L160 HydrophobicContact CD1-CG 3.97Å; I156-L160 HydrophobicContact CG1-CD1 3.98Å; I156-L160 HydrophobicContact CG1-CG 4.21Å; I156-L160 VanDerWaalsContact O-CG 3.29Å; I156-L160 WeakPolarHBondContact O-CG 3.22Å; I156-L160 PolarHBondContact O-N 3.39Å; V157-L160 PolarHBondContact O-N 2.96Å; L160-R162 PolarHBondContact O-N 2.91Å; L160-K164 CarbonylContact O-C 3.53Å; L160-K164 VanDerWaalsContact O-CA 3.29Å; L160-K164 WeakPolarHBondContact O-CA 3.29Å; L160-K164 PolarHBondContact O-N 2.91Å; L160-C165 HydrophobicContact CD2-CB 3.77Å; L160-C165 PolarHBondContact O-N 3.13Å; L160-V168 HydrophobicContact CD1-CG1 4Å; L160-V168 HydrophobicContact CD2-CG1 3.89Å; L160-V191 HydrophobicContact CD1-CG2 3.97Å; L160-F192 HydrophobicContact CB-CE2 4.26Å; L160-F192 HydrophobicContact CB-CZ 3.79Å; L160-F238 HydrophobicContact CD1-CE2 4.25Å; L160-F238 HydrophobicContact CD1-CZ 4.3Å
161	V	78.2	Confident	86	Confident	39 Å²	39	27 Å²	27	24%	0.236	15%	0.145	C	C	.	.	H	α-helix	trans	-65.5	-33.9	178.5	171.5	0	0	0	0	112.8	V157 H159 F192 G761 T762	V157-V161 HydrophobicContact CG1-CG2 4.21Å; V157-V161 WeakPolarHBondContact O-CB 3.48Å; V157-V161 WeakPolarHBondContact O-CG2 3.43Å; V157-V161 PolarHBondContact O-N 3.47Å; H159-V161 PolarHBondContact O-N 2.86Å; H159-V161 VanDerWaalsContact O-N 3.17Å; V161-F192 HydrophobicContact CG2-CE1 3.92Å; V161-F192 HydrophobicContact CG2-CZ 3.82Å; V161-G761 WeakPolarHBondContact CG2-O 3.45Å; V161-T762 HydrophobicContact CG1-CG2 3.59Å; V161-T762 WeakPolarHBondContact O-CG2 3.33Å
162	R	78.1	Confident	86.5	Confident	76 Å²	76	32 Å²	32	29%	0.287	17%	0.165	S	C	.	.	H	α-helix	trans	-87.8	-46.3	-176.9	-68	163.3	179.2	-93.6	-0.7	113.4	N158 H159 L160 K164 N263 E266	N158-R162 WeakPolarHBondContact O-CD 3.32Å; N158-R162 WeakPolarHBondContact O-CG 3.47Å; N158-R162 PolarHBondContact O-N 3.41Å; N158-R162 PolarHBondContact OD1-NE 3.24Å; N158-R162 PolarHBondContact OD1-NH2 2.84Å; H159-R162 PolarHBondContact O-N 3.39Å; L160-R162 PolarHBondContact O-N 2.91Å; R162-K164 PolarHBondContact O-N 3.25Å; R162-N263 VanDerWaalsContact CZ-OD1 3.28Å; R162-N263 PolarHBondContact NH1-OD1 3.29Å; R162-N263 PolarHBondContact NH2-OD1 3.42Å; R162-E266 HydrophobicContact CB-CG 3.66Å; R162-E266 HydrophobicContact CG-CG 4.45Å
163	A	78.3	Confident	87.2	Confident	36 Å²	36	32.9 Å²	32.9	30%	0.298	16%	0.164	S	C	.	.	H	α-helix	trans	-76.6	-2.4	176.2	0	0	0	0	0	112.5	H159 C165	H159-A163 VanDerWaalsContact NE2-CB 3.27Å; H159-A163 WeakPolarHBondContact NE2-CB 3.39Å; H159-A163 PolarHBondContact O-N 2.69Å; A163-C165 WeakPolarHBondContact CB-SG 3.29Å; A163-C165 PolarHBondContact O-N 2.87Å; A163-C165 VanDerWaalsContact O-N 3.16Å; A163-C165 PolarHBondContact O-SG 3.2Å; A163-C165 VanDerWaalsContact O-SG 3.38Å
164	K	74.3	Confident	87.3	Confident	105 Å²	105	33 Å²	33	46%	0.457	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	21.7	-177.8	-56.5	-178.3	179.1	180	0	113.5	L160 R162	L160-K164 CarbonylContact O-C 3.53Å; L160-K164 VanDerWaalsContact O-CA 3.29Å; L160-K164 WeakPolarHBondContact O-CA 3.29Å; L160-K164 PolarHBondContact O-N 2.91Å; R162-K164 PolarHBondContact O-N 3.25Å
165	C	80.4	Confident	86.9	Confident	6 Å²	6	36.1 Å²	36.1	4%	0.041	19%	0.185	C	C	.	.			trans	-77.5	149.2	179.6	-52.8	0	0	0	0	110.7	C137 L160 A163	C137-C165 WeakPolarHBondContact SG-CB 3.4Å; C137-C165 VanDerWaalsContact SG-SG 3.67Å; L160-C165 HydrophobicContact CD2-CB 3.77Å; L160-C165 PolarHBondContact O-N 3.13Å; A163-C165 WeakPolarHBondContact CB-SG 3.29Å; A163-C165 PolarHBondContact O-N 2.87Å; A163-C165 VanDerWaalsContact O-N 3.16Å; A163-C165 PolarHBondContact O-SG 3.2Å; A163-C165 VanDerWaalsContact O-SG 3.38Å
166	K	83.2	Confident	86.5	Confident	48 Å²	48	40.2 Å²	40.2	21%	0.209	21%	0.207	C	C	.	.			trans	-132.6	-12	-171.2	-59.8	176.1	-170.4	170.7	0	114.5	N190 V191	K166-N190 WeakPolarHBondContact O-CA 3.4Å; K166-V191 WeakPolarHBondContact O-CG2 3.46Å; K166-V191 PolarHBondContact O-N 2.94Å; K166-V191 VanDerWaalsContact O-N 3.16Å
167	E	89.1	Confident	86.2	Confident	74 Å²	74	41.2 Å²	41.2	35%	0.346	22%	0.217	S	C	.	.			trans	-115.2	137.9	-175	-53.5	-164.6	168.9	0	0	110.8	N138 R189	N138-E167 HydrophobicContact CB-CB 4.1Å; N138-E167 PolarHBondContact N-O 2.86Å; E167-R189 HydrophobicContact CB-CB 4.22Å; E167-R189 HydrophobicContact CG-CB 3.67Å
168	V	93.4	Very high	86.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	155.1	-179.1	-65.1	0	0	0	0	112.4	V135 Y136 I156 L160 L181 V191 F238	V135-V168 HydrophobicContact CG1-CB 3.57Å; V135-V168 HydrophobicContact CG1-CG1 3.75Å; V135-V168 HydrophobicContact CG1-CG2 4.15Å; Y136-V168 WeakPolarHBondContact O-CA 2.96Å; Y136-V168 WeakPolarHBondContact O-CB 3.25Å; I156-V168 HydrophobicContact CD1-CG1 4.23Å; L160-V168 HydrophobicContact CD1-CG1 4Å; L160-V168 HydrophobicContact CD2-CG1 3.89Å; V168-L181 HydrophobicContact CG2-CB 4.2Å; V168-L181 HydrophobicContact CG2-CD1 3.76Å; V168-L181 HydrophobicContact CG2-CG 4.2Å; V168-L181 PolarHBondContact O-N 2.95Å; V168-V191 HydrophobicContact CG1-CG2 4.26Å; V168-V191 HydrophobicContact CG2-CG1 3.57Å; V168-V191 HydrophobicContact CG2-CG2 4.06Å; V168-F238 HydrophobicContact CG2-CE1 4.35Å; V168-F238 HydrophobicContact CG2-CZ 4.18Å
169	T	94.4	Very high	86.3	Confident	15 Å²	15	49.6 Å²	49.6	9%	0.092	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.8	173.4	-48.5	0	0	0	0	109	Y136 N138 E178 V180	Y136-T169 WeakPolarHBondContact CB-O 3.34Å; Y136-T169 PolarHBondContact N-O 3.43Å; Y136-T169 PolarHBondContact O-N 3.05Å; N138-T169 PolarHBondContact ND2-OG1 3.04Å; N138-T169 PolarHBondContact OD1-N 2.55Å; N138-T169 PolarHBondContact OD1-OG1 3.03Å; T169-E178 HydrophobicContact CG2-CG 4.03Å; T169-V180 HydrophobicContact CG2-CG2 4.08Å
170	L	93.9	Very high	86.5	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	158.8	175.6	-63.5	-176.6	0	0	0	111.4	L176 G177 T179 L181 L242 V243	L170-L176 HydrophobicContact CD1-CB 4.04Å; L170-L176 HydrophobicContact CD1-CD1 4.27Å; L170-G177 WeakPolarHBondContact CB-O 3.39Å; L170-T179 PolarHBondContact N-O 3.48Å; L170-L181 HydrophobicContact CD1-CD2 3.99Å; L170-L181 HydrophobicContact CD2-CD1 4.19Å; L170-L181 HydrophobicContact CG-CD1 4.32Å; L170-L181 HydrophobicContact CG-CD2 4.19Å; L170-L181 HydrophobicContact CG-CG 4.32Å; L170-L242 HydrophobicContact CD1-CG 4.4Å; L170-V243 HydrophobicContact CD2-CG2 3.63Å
171	H	94.6	Very high	86.8	Confident	13 Å²	13	52 Å²	52	6%	0.06	27%	0.274	C	S	.	.			trans	-71.1	145.9	176.8	-165.2	-101.1	0	0	0	111.7	H121 P131 V134 W143 D173 G174 G177	H121-H171 AromaticContact CE1-NE2 3.78Å; H121-H171 AromaticContact CG-CD2 3.95Å; H121-H171 AromaticContact CG-NE2 3.54Å; H121-H171 AromaticContact ND1-CD2 3.81Å; H121-H171 AromaticContact ND1-CE1 3.61Å; H121-H171 AromaticContact ND1-NE2 2.93Å; H121-H171 PolarHBondContact ND1-NE2 3.16Å; P131-H171 WeakPolarHBondContact CB-ND1 3.45Å; P131-H171 WeakPolarHBondContact O-CB 3.3Å; V134-H171 HydrophobicContact CG2-CB 4.27Å; W143-H171 HydrophobicContact CH2-CB 4.04Å; W143-H171 AromaticContact CH2-CD2 3.48Å; W143-H171 VanDerWaalsContact CH2-CD2 3.48Å; W143-H171 WeakPolarHBondContact CH2-CD2 3.46Å; W143-H171 HydrophobicContact CZ3-CB 3.83Å; W143-H171 AromaticContact CZ3-CD2 3.76Å; H171-D173 IonicContact CE1-OD2 3.39Å; H171-D173 PolarHBondContact CE1-OD2 3.02Å; H171-D173 PolarHBondContact ND1-N 3.2Å; H171-D173 IonicContact ND1-OD2 2.78Å; H171-D173 PolarHBondContact ND1-OD2 2.74Å; H171-D173 PolarHBondContact O-N 3.06Å; H171-D173 VanDerWaalsContact O-N 3.14Å; H171-G174 WeakPolarHBondContact O-CA 3.23Å; H171-G174 PolarHBondContact O-N 3.22Å; H171-G177 CarbonylContact O-C 3.26Å; H171-G177 VanDerWaalsContact O-C 3.26Å
172	K	91.5	Very high	87.4	Confident	127 Å²	127	53.8 Å²	53.8	55%	0.552	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-32.6	179	58.6	159.5	-158.1	168.8	0	115	G177 E178	K172-G177 WeakPolarHBondContact O-CA 3.45Å; K172-E178 HydrophobicContact CB-CB 4.09Å
173	D	90.4	Very high	87.8	Confident	95 Å²	95	50.2 Å²	50.2	51%	0.508	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	14	177.8	-36.9	-59.8	0	0	0	112.2	P131 H171	P131-D173 HydrophobicContact CB-CB 4.01Å; H171-D173 IonicContact CE1-OD2 3.39Å; H171-D173 PolarHBondContact CE1-OD2 3.02Å; H171-D173 PolarHBondContact ND1-N 3.2Å; H171-D173 IonicContact ND1-OD2 2.78Å; H171-D173 PolarHBondContact ND1-OD2 2.74Å; H171-D173 PolarHBondContact O-N 3.06Å; H171-D173 VanDerWaalsContact O-N 3.14Å
174	G	85.8	Confident	88.1	Confident	13 Å²	13	58.2 Å²	58.2	13%	0.134	29%	0.29	C	S	.	.	S	Bend	trans	-82.2	173.5	175	0	0	0	0	0	113	H171 L176 G177	H171-G174 WeakPolarHBondContact O-CA 3.23Å; H171-G174 PolarHBondContact O-N 3.22Å; G174-L176 PolarHBondContact O-N 2.9Å; G174-G177 PolarHBondContact O-N 3.35Å
175	P	84.6	Confident	88.5	Confident	66 Å²	66	57.4 Å²	57.4	43%	0.429	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.4	-170.3	-26.5	35.7	0	0	0	116.6
176	L	84.4	Confident	88.4	Confident	90 Å²	90	60.4 Å²	60.4	47%	0.471	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	18.3	178.9	-62	175.5	0	0	0	112.5	L170 G174 T179 L242	L170-L176 HydrophobicContact CD1-CB 4.04Å; L170-L176 HydrophobicContact CD1-CD1 4.27Å; G174-L176 PolarHBondContact O-N 2.9Å; L176-T179 PolarHBondContact O-OG1 3.23Å; L176-L242 HydrophobicContact CD1-CD1 3.58Å
177	G	86.6	Confident	88.4	Confident	21 Å²	21	59.9 Å²	59.9	22%	0.216	32%	0.32	C	S	.	.			trans	61.1	-163.2	-175.5	0	0	0	0	0	114.5	L170 H171 K172 G174 T179	L170-G177 WeakPolarHBondContact CB-O 3.39Å; H171-G177 CarbonylContact O-C 3.26Å; H171-G177 VanDerWaalsContact O-C 3.26Å; K172-G177 WeakPolarHBondContact O-CA 3.45Å; G174-G177 PolarHBondContact O-N 3.35Å; G177-T179 PolarHBondContact O-N 3.49Å
178	E	90.5	Very high	88	Confident	146 Å²	146	58.3 Å²	58.3	68%	0.682	32%	0.317	S	S	*	.	S	Bend	trans	-76.4	73.4	-179.3	-164.8	171.5	159	0	0	111.5	T169 K172	T169-E178 HydrophobicContact CG2-CG 4.03Å; K172-E178 HydrophobicContact CB-CB 4.09Å
179	T	88.2	Confident	87.8	Confident	63 Å²	63	63 Å²	63	39%	0.387	33%	0.334	S	S	.	.			trans	-109.3	128.4	-176.8	-64.1	0	0	0	0	111	L170 L176 G177	L170-T179 PolarHBondContact N-O 3.48Å; L176-T179 PolarHBondContact O-OG1 3.23Å; G177-T179 PolarHBondContact O-N 3.49Å
180	V	91.4	Very high	87.2	Confident	48 Å²	48	63.3 Å²	63.3	29%	0.291	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-75.8	128.7	166.9	-175.6	0	0	0	0	108.3	T169 E182 R189	T169-V180 HydrophobicContact CG2-CG2 4.08Å; V180-E182 PolarHBondContact O-N 3.17Å; V180-R189 HydrophobicContact CG1-CG 4.08Å
181	L	91.7	Very high	87	Confident	6 Å²	6	63.2 Å²	63.2	3%	0.031	34%	0.335	C	S	.	.			trans	-83.1	106.8	-175.4	-61.4	-178.9	0	0	0	111.2	V168 L170 R189 V191 L194 L207 L232 F238 L242	V168-L181 HydrophobicContact CG2-CB 4.2Å; V168-L181 HydrophobicContact CG2-CD1 3.76Å; V168-L181 HydrophobicContact CG2-CG 4.2Å; V168-L181 PolarHBondContact O-N 2.95Å; L170-L181 HydrophobicContact CD1-CD2 3.99Å; L170-L181 HydrophobicContact CD2-CD1 4.19Å; L170-L181 HydrophobicContact CG-CD1 4.32Å; L170-L181 HydrophobicContact CG-CD2 4.19Å; L170-L181 HydrophobicContact CG-CG 4.32Å; L181-R189 WeakPolarHBondContact O-CA 3.46Å; L181-V191 HydrophobicContact CB-CG1 4.33Å; L181-V191 HydrophobicContact CD1-CG1 4.21Å; L181-L194 HydrophobicContact CB-CD1 4.49Å; L181-L194 WeakPolarHBondContact O-CD1 3.26Å; L181-L207 HydrophobicContact CB-CD2 4.43Å; L181-L232 HydrophobicContact CD1-CD2 4.16Å; L181-F238 HydrophobicContact CD1-CE1 4.13Å; L181-L242 HydrophobicContact CD1-CD2 3.78Å
182	E	90.4	Very high	86.5	Confident	77 Å²	77	63.3 Å²	63.3	36%	0.36	34%	0.335	S	S	.	.			trans	-138.6	158.6	-178	63.7	-172.8	-152.1	0	0	114.3	V180 Y184 C188 R189	V180-E182 PolarHBondContact O-N 3.17Å; E182-Y184 PolarHBondContact O-N 3.43Å; E182-C188 WeakPolarHBondContact CA-O 3.49Å; E182-R189 HydrophobicContact CB-CG 3.72Å; E182-R189 IonicContact OE2-CZ 2.62Å; E182-R189 IonicContact OE2-NE 2.61Å; E182-R189 PolarHBondContact OE2-NE 3.37Å; E182-R189 IonicContact OE2-NH2 3.27Å; E182-R189 PolarHBondContact OE2-NH2 3.41Å
183	C	86.9	Confident	86.2	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.014	32%	0.316	C	S	.	.			trans	-72.1	121	179.5	178.4	0	0	0	0	111.4	N185 C186 G187 C188 L194 C209	C183-N185 PolarHBondContact O-N 2.95Å; C183-C186 PolarHBondContact O-N 3.19Å; C183-C186 VanDerWaalsContact O-N 3.17Å; C183-C186 PolarHBondContact SG-SG 2.93Å; C183-G187 WeakPolarHBondContact O-CA 3.41Å; C183-G187 PolarHBondContact O-N 2.86Å; C183-C188 HydrophobicContact CB-CB 4.25Å; C183-C188 PolarHBondContact N-O 3.21Å; C183-L194 HydrophobicContact CB-CD2 3.69Å; C183-C209 VanDerWaalsContact CB-SG 3.51Å; C183-C209 PolarHBondContact SG-N 2.94Å
184	Y	84.8	Confident	86.1	Confident	204 Å²	204	54.3 Å²	54.3	80%	0.8	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.6	179.4	-170.2	-94.4	0	0	0	113.9	E182 V206 L207	E182-Y184 PolarHBondContact O-N 3.43Å; Y184-V206 HydrophobicContact CD1-CG1 4.19Å; Y184-V206 HydrophobicContact CG-CG1 4.02Å; Y184-L207 PolarHBondContact N-O 3.15Å
185	N	81.7	Confident	86.1	Confident	88 Å²	88	53.7 Å²	53.7	47%	0.471	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-28.5	-178.3	179.1	-89.3	0	0	0	113.9	C183 L208 C213	C183-N185 PolarHBondContact O-N 2.95Å; N185-L208 HydrophobicContact CB-CD2 3.69Å; N185-C213 HydrophobicContact CB-CB 4.07Å; N185-C213 PolarHBondContact OD1-SG 2.9Å
186	C	78.4	Confident	86.2	Confident	68 Å²	68	51.6 Å²	51.6	46%	0.459	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.2	8.9	-170.1	73.1	0	0	0	0	116.2	C183 C188	C183-C186 PolarHBondContact O-N 3.19Å; C183-C186 VanDerWaalsContact O-N 3.17Å; C183-C186 PolarHBondContact SG-SG 2.93Å; C186-C188 PolarHBondContact O-N 2.74Å
187	G	83.1	Confident	86.2	Confident	38 Å²	38	47.3 Å²	47.3	39%	0.392	25%	0.248	S	C	.	.			trans	66	5.2	177.4	0	0	0	0	0	115.8	C183 R189	C183-G187 WeakPolarHBondContact O-CA 3.41Å; C183-G187 PolarHBondContact O-N 2.86Å; G187-R189 PolarHBondContact O-N 3.22Å
188	C	81.2	Confident	85.5	Confident	41 Å²	41	48.2 Å²	48.2	28%	0.277	25%	0.25	S	S	.	.			trans	-69.3	120.8	-177.2	-175.3	0	0	0	0	111.5	E182 C183 C186 C209	E182-C188 WeakPolarHBondContact CA-O 3.49Å; C183-C188 HydrophobicContact CB-CB 4.25Å; C183-C188 PolarHBondContact N-O 3.21Å; C186-C188 PolarHBondContact O-N 2.74Å; C188-C209 VanDerWaalsContact CB-SG 3.56Å
189	R	88.5	Confident	84.2	Confident	98 Å²	98	42.5 Å²	42.5	37%	0.37	23%	0.228	S	C	.	.			trans	-86.2	3.4	-175.9	-74	165.6	-176.2	-172.9	-2.5	115.8	E167 V180 L181 E182 G187 V191	E167-R189 HydrophobicContact CB-CB 4.22Å; E167-R189 HydrophobicContact CG-CB 3.67Å; V180-R189 HydrophobicContact CG1-CG 4.08Å; L181-R189 WeakPolarHBondContact O-CA 3.46Å; E182-R189 HydrophobicContact CB-CG 3.72Å; E182-R189 IonicContact OE2-CZ 2.62Å; E182-R189 IonicContact OE2-NE 2.61Å; E182-R189 PolarHBondContact OE2-NE 3.37Å; E182-R189 IonicContact OE2-NH2 3.27Å; E182-R189 PolarHBondContact OE2-NH2 3.41Å; G187-R189 PolarHBondContact O-N 3.22Å; R189-V191 PolarHBondContact O-N 3.4Å; R189-V191 VanDerWaalsContact O-N 3.14Å
190	N	83.3	Confident	82.7	Confident	22 Å²	22	46.4 Å²	46.4	12%	0.118	24%	0.24	C	C	.	.			trans	-78.3	100.2	-170.1	-176.5	-5.4	0	0	0	112.1	K166 F192 L193 L194 S759	K166-N190 WeakPolarHBondContact O-CA 3.4Å; N190-F192 PolarHBondContact O-N 2.89Å; N190-F192 VanDerWaalsContact O-N 3.07Å; N190-F192 PolarHBondContact OD1-N 3.48Å; N190-L193 HydrophobicContact CB-CB 4.17Å; N190-L193 WeakPolarHBondContact O-CA 3.42Å; N190-L193 PolarHBondContact O-N 3.39Å; N190-L194 WeakPolarHBondContact O-CG 3.46Å; N190-L194 PolarHBondContact O-N 3.46Å; N190-L194 VanDerWaalsContact O-N 3.1Å; N190-S759 PolarHBondContact ND2-O 3.28Å
191	V	88	Confident	80.8	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-22.5	-178.1	-98.9	0	0	0	0	115.3	L160 K166 V168 L181 R189 L193 L194 L232 I233 F238	L160-V191 HydrophobicContact CD1-CG2 3.97Å; K166-V191 WeakPolarHBondContact O-CG2 3.46Å; K166-V191 PolarHBondContact O-N 2.94Å; K166-V191 VanDerWaalsContact O-N 3.16Å; V168-V191 HydrophobicContact CG1-CG2 4.26Å; V168-V191 HydrophobicContact CG2-CG1 3.57Å; V168-V191 HydrophobicContact CG2-CG2 4.06Å; L181-V191 HydrophobicContact CB-CG1 4.33Å; L181-V191 HydrophobicContact CD1-CG1 4.21Å; R189-V191 PolarHBondContact O-N 3.4Å; R189-V191 VanDerWaalsContact O-N 3.14Å; V191-L193 VanDerWaalsContact C-N 3.34Å; V191-L194 HydrophobicContact CG1-CD1 4.47Å; V191-L232 HydrophobicContact CG1-CD2 4Å; V191-I233 HydrophobicContact CB-CD1 4.23Å; V191-F238 HydrophobicContact CB-CE1 4.32Å; V191-F238 HydrophobicContact CB-CZ 4.16Å; V191-F238 HydrophobicContact CG1-CE1 3.62Å; V191-F238 HydrophobicContact CG1-CZ 3.84Å; V191-F238 HydrophobicContact CG2-CZ 4.33Å
192	F	84.9	Confident	78.9	Confident	16 Å²	16	53.8 Å²	53.8	7%	0.07	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-14.7	173.5	-55.8	-73	0	0	0	113.8	L160 V161 N190 I233 I757 A758	L160-F192 HydrophobicContact CB-CE2 4.26Å; L160-F192 HydrophobicContact CB-CZ 3.79Å; V161-F192 HydrophobicContact CG2-CE1 3.92Å; V161-F192 HydrophobicContact CG2-CZ 3.82Å; N190-F192 PolarHBondContact O-N 2.89Å; N190-F192 VanDerWaalsContact O-N 3.07Å; N190-F192 PolarHBondContact OD1-N 3.48Å; F192-I233 HydrophobicContact CD1-CD1 3.78Å; F192-I233 HydrophobicContact CE1-CD1 3.89Å; F192-I757 HydrophobicContact CD1-CB 4.42Å; F192-I757 HydrophobicContact CD1-CG2 3.69Å; F192-I757 HydrophobicContact CE1-CG2 4.2Å; F192-I757 HydrophobicContact CG-CG2 4.43Å; F192-A758 WeakPolarHBondContact CB-O 3.48Å
193	L	84.3	Confident	77.4	Confident	30 Å²	30	56.2 Å²	56.2	16%	0.157	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-20	176.1	-172.8	67	0	0	0	112.2	N190 V191 C209 R210	N190-L193 HydrophobicContact CB-CB 4.17Å; N190-L193 WeakPolarHBondContact O-CA 3.42Å; N190-L193 PolarHBondContact O-N 3.39Å; V191-L193 VanDerWaalsContact C-N 3.34Å; L193-C209 HydrophobicContact CD2-CB 4.02Å; L193-C209 HydrophobicContact CG-CB 3.98Å; L193-C209 WeakPolarHBondContact O-CA 3.28Å; L193-R210 HydrophobicContact CD1-CB 3.81Å; L193-R210 WeakPolarHBondContact O-CB 3.36Å; L193-R210 PolarHBondContact O-N 2.92Å
194	L	88.6	Confident	76.4	Confident	2 Å²	2	60 Å²	60	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	149.5	-178.3	-68.5	168.3	0	0	0	112.6	L181 C183 N190 V191 L207 L232	L181-L194 HydrophobicContact CB-CD1 4.49Å; L181-L194 WeakPolarHBondContact O-CD1 3.26Å; C183-L194 HydrophobicContact CB-CD2 3.69Å; N190-L194 WeakPolarHBondContact O-CG 3.46Å; N190-L194 PolarHBondContact O-N 3.46Å; N190-L194 VanDerWaalsContact O-N 3.1Å; V191-L194 HydrophobicContact CG1-CD1 4.47Å; L194-L207 HydrophobicContact CB-CD2 4.27Å; L194-L207 HydrophobicContact CB-CG 4.29Å; L194-L207 HydrophobicContact CD1-CD2 3.96Å; L194-L207 HydrophobicContact CD2-CD2 4.14Å; L194-L207 HydrophobicContact CD2-CG 4.14Å; L194-L207 HydrophobicContact CG-CD2 4.34Å; L194-L232 HydrophobicContact CB-CB 4.42Å; L194-L232 HydrophobicContact CB-CD2 4.05Å; L194-L232 WeakPolarHBondContact O-CB 3.43Å; L194-L232 PolarHBondContact O-N 2.75Å
195	G	86.4	Confident	75.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	172.4	175.1	0	0	0	0	0	109.5	L207 L208 W229 Q230	G195-L207 WeakPolarHBondContact O-CA 3.34Å; G195-L207 WeakPolarHBondContact O-CD1 3.12Å; G195-L208 PolarHBondContact N-O 3.49Å; G195-L208 VanDerWaalsContact N-O 3.16Å; G195-L208 PolarHBondContact O-N 2.98Å; G195-L208 VanDerWaalsContact O-O 3.05Å; G195-W229 VanDerWaalsContact CA-CZ2 3.43Å; G195-Q230 CarbonylContact C-O 3.28Å; G195-Q230 WeakPolarHBondContact CA-O 3.41Å
196	F	87.1	Confident	76	Confident	23 Å²	23	50.1 Å²	50.1	10%	0.101	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	151.1	-168.7	77.3	-86.1	0	0	0	112.3	V205 V206 L207 W229 Q230 L239 W241	F196-V205 HydrophobicContact CB-CG1 3.54Å; F196-V205 HydrophobicContact CD2-CG1 3.67Å; F196-V205 HydrophobicContact CG-CG1 3.94Å; F196-V206 WeakPolarHBondContact CA-O 3.3Å; F196-L207 HydrophobicContact CB-CD1 4.33Å; F196-W229 WeakPolarHBondContact O-CA 3.17Å; F196-Q230 HydrophobicContact CD1-CB 4.04Å; F196-Q230 HydrophobicContact CE1-CB 3.5Å; F196-Q230 VanDerWaalsContact CE1-CB 3.5Å; F196-Q230 HydrophobicContact CE1-CG 4.47Å; F196-Q230 HydrophobicContact CZ-CB 3.92Å; F196-Q230 HydrophobicContact CZ-CG 4.45Å; F196-Q230 PolarHBondContact N-O 3.08Å; F196-Q230 PolarHBondContact O-N 3.15Å; F196-L239 HydrophobicContact CD1-CD1 3.63Å; F196-L239 HydrophobicContact CE1-CD1 3.4Å; F196-L239 VanDerWaalsContact CE1-CD1 3.4Å; F196-W241 AromaticContact CD1-CZ2 3.88Å; F196-W241 HydrophobicContact CD1-CZ2 3.88Å; F196-W241 HydrophobicContact CD2-CZ2 4.39Å; F196-W241 HydrophobicContact CE1-CZ2 4.12Å; F196-W241 HydrophobicContact CG-CZ2 4.02Å; F196-W241 HydrophobicContact CZ-CZ2 4.48Å
197	I	83.8	Confident	76.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.2	166.5	-50.4	-172.1	0	0	0	108.1	V206 L208 A214 W224 D225 W229	I197-V206 PolarHBondContact N-O 3.48Å; I197-V206 PolarHBondContact O-N 2.92Å; I197-V206 VanDerWaalsContact O-N 3.16Å; I197-L208 HydrophobicContact CD1-CD1 3.86Å; I197-L208 HydrophobicContact CG1-CD1 4.35Å; I197-A214 HydrophobicContact CD1-CB 4.42Å; I197-W224 HydrophobicContact CG2-CB 4.44Å; I197-W224 HydrophobicContact CG2-CE3 4.32Å; I197-D225 WeakPolarHBondContact CG2-O 3.27Å; I197-W229 HydrophobicContact CD1-CB 4.3Å; I197-W229 HydrophobicContact CG1-CB 4.03Å; I197-W229 HydrophobicContact CG1-CG 4.3Å
198	P	71.4	Confident	76.6	Confident	40 Å²	40	46.8 Å²	46.8	26%	0.26	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	146.6	173.5	31.7	-35	0	0	0	111.7	Q228	P198-Q228 HydrophobicContact CG-CB 4.29Å
199	A	64.5	Low	76.7	Confident	26 Å²	26	44.9 Å²	44.9	22%	0.215	26%	0.258	C	S	.	.			trans	-72.9	150.9	168.5	0	0	0	0	0	111.3	A201 V204 W224	A199-A201 VanDerWaalsContact C-N 3.32Å; A199-V204 WeakPolarHBondContact CB-O 3.28Å; A199-V204 PolarHBondContact N-O 2.88Å; A199-V204 VanDerWaalsContact N-O 3.1Å; A199-W224 HydrophobicContact CB-CH2 3.94Å; A199-W224 HydrophobicContact CB-CZ3 3.6Å
200	K	57.1	Low	76.1	Confident	145 Å²	145	41 Å²	41	63%	0.63	24%	0.243	S	C	*	.	S	Bend	trans	-82.6	-4.2	176.2	-78.6	179.9	172.6	166.9	0	114.5	D225	K200-D225 WeakPolarHBondContact CE-OD2 3.29Å; K200-D225 IonicContact NZ-OD2 3.77Å; K200-D225 PolarHBondContact NZ-OD2 2.93Å
201	A	51.1	Low	75.4	Confident	92 Å²	92	42.4 Å²	42.4	76%	0.76	25%	0.249	S	C	*	.	S	Bend	trans	-130.3	-29	-171.5	0	0	0	0	0	114.8	A199	A199-A201 VanDerWaalsContact C-N 3.32Å
202	D	51.9	Low	74.5	Confident	116 Å²	116	46.3 Å²	46.3	62%	0.62	28%	0.275	S	S	*	.	S	Bend	trans	-132.1	164.4	-175.3	-69.2	-71	0	0	0	111.3	V204	D202-V204 HydrophobicContact CB-CB 4.39Å; D202-V204 HydrophobicContact CB-CG2 3.99Å; D202-V204 PolarHBondContact O-N 2.99Å
203	S	58.9	Low	74.1	Confident	128 Å²	128	45.6 Å²	45.6	90%	0.895	27%	0.272	S	S	*	.	S	Bend	trans	-72.4	20.8	171.8	51.3	0	0	0	0	114.1
204	V	66.2	Low	73.6	Confident	81 Å²	81	44.6 Å²	44.6	49%	0.491	27%	0.267	S	S	.	.			trans	-85.3	133.5	179.6	178.6	0	0	0	0	110.3	A199 D202	A199-V204 WeakPolarHBondContact CB-O 3.28Å; A199-V204 PolarHBondContact N-O 2.88Å; A199-V204 VanDerWaalsContact N-O 3.1Å; D202-V204 HydrophobicContact CB-CB 4.39Å; D202-V204 HydrophobicContact CB-CG2 3.99Å; D202-V204 PolarHBondContact O-N 2.99Å
205	V	74.1	Confident	72.6	Confident	68 Å²	68	45.9 Å²	45.9	41%	0.412	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.3	-177.8	175.7	0	0	0	0	108.8	F196 W241	F196-V205 HydrophobicContact CB-CG1 3.54Å; F196-V205 HydrophobicContact CD2-CG1 3.67Å; F196-V205 HydrophobicContact CG-CG1 3.94Å; V205-W241 HydrophobicContact CG1-CH2 4.08Å
206	V	83.9	Confident	71.3	Confident	17 Å²	17	52.8 Å²	52.8	10%	0.103	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.1	-178.6	-175.1	0	0	0	0	110.5	Y184 F196 I197 L208 W224	Y184-V206 HydrophobicContact CD1-CG1 4.19Å; Y184-V206 HydrophobicContact CG-CG1 4.02Å; F196-V206 WeakPolarHBondContact CA-O 3.3Å; I197-V206 PolarHBondContact N-O 3.48Å; I197-V206 PolarHBondContact O-N 2.92Å; I197-V206 VanDerWaalsContact O-N 3.16Å; V206-L208 HydrophobicContact CG1-CD2 4.12Å; V206-L208 HydrophobicContact CG1-CG 4.04Å; V206-W224 HydrophobicContact CB-CH2 4.39Å; V206-W224 HydrophobicContact CB-CZ3 4.49Å; V206-W224 HydrophobicContact CG2-CE3 4.49Å; V206-W224 HydrophobicContact CG2-CH2 3.32Å; V206-W224 HydrophobicContact CG2-CZ2 3.54Å; V206-W224 HydrophobicContact CG2-CZ3 3.81Å
207	L	86.8	Confident	69.8	Low	31 Å²	31	55.8 Å²	55.8	16%	0.162	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119.9	178.7	-156.9	72.7	0	0	0	110.7	L181 Y184 L194 G195 F196 L232	L181-L207 HydrophobicContact CB-CD2 4.43Å; Y184-L207 PolarHBondContact N-O 3.15Å; L194-L207 HydrophobicContact CB-CD2 4.27Å; L194-L207 HydrophobicContact CB-CG 4.29Å; L194-L207 HydrophobicContact CD1-CD2 3.96Å; L194-L207 HydrophobicContact CD2-CD2 4.14Å; L194-L207 HydrophobicContact CD2-CG 4.14Å; L194-L207 HydrophobicContact CG-CD2 4.34Å; G195-L207 WeakPolarHBondContact O-CA 3.34Å; G195-L207 WeakPolarHBondContact O-CD1 3.12Å; F196-L207 HydrophobicContact CB-CD1 4.33Å; L207-L232 HydrophobicContact CD1-CD1 3.82Å; L207-L232 HydrophobicContact CD1-CD2 3.89Å; L207-L232 HydrophobicContact CD1-CG 4.35Å; L207-L232 HydrophobicContact CD2-CD2 4.04Å
208	L	87.1	Confident	68.4	Low	5 Å²	5	58.1 Å²	58.1	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	144.3	-174.8	-66.4	177.1	0	0	0	112	N185 G195 I197 V206 R210 C213 L219 W229	N185-L208 HydrophobicContact CB-CD2 3.69Å; G195-L208 PolarHBondContact N-O 3.49Å; G195-L208 VanDerWaalsContact N-O 3.16Å; G195-L208 PolarHBondContact O-N 2.98Å; G195-L208 VanDerWaalsContact O-O 3.05Å; I197-L208 HydrophobicContact CD1-CD1 3.86Å; I197-L208 HydrophobicContact CG1-CD1 4.35Å; V206-L208 HydrophobicContact CG1-CD2 4.12Å; V206-L208 HydrophobicContact CG1-CG 4.04Å; L208-R210 PolarHBondContact O-N 3.42Å; L208-C213 HydrophobicContact CB-CB 4.4Å; L208-C213 HydrophobicContact CD2-CB 4.35Å; L208-L219 HydrophobicContact CD1-CD2 4.22Å; L208-W229 PolarHBondContact O-NE1 2.82Å
209	C	81.9	Confident	67.8	Low	1 Å²	1	57 Å²	57	1%	0.007	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	131.8	167.9	-70.3	0	0	0	0	111.4	C183 C188 L193 Q211 C213 A214	C183-C209 VanDerWaalsContact CB-SG 3.51Å; C183-C209 PolarHBondContact SG-N 2.94Å; C188-C209 VanDerWaalsContact CB-SG 3.56Å; L193-C209 HydrophobicContact CD2-CB 4.02Å; L193-C209 HydrophobicContact CG-CB 3.98Å; L193-C209 WeakPolarHBondContact O-CA 3.28Å; C209-Q211 PolarHBondContact O-N 3.02Å; C209-C213 HydrophobicContact CB-CB 4.17Å; C209-A214 WeakPolarHBondContact O-CB 3.37Å; C209-A214 PolarHBondContact O-N 3.05Å
210	R	76.9	Confident	67.3	Low	18 Å²	18	64 Å²	64	7%	0.068	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-34.2	-48.1	168.1	179.2	-153.6	-172.3	71.6	18.5	113.8	L193 L208 W229 E756 R767	L193-R210 HydrophobicContact CD1-CB 3.81Å; L193-R210 WeakPolarHBondContact O-CB 3.36Å; L193-R210 PolarHBondContact O-N 2.92Å; L208-R210 PolarHBondContact O-N 3.42Å; R210-W229 HydrophobicContact CB-CH2 3.98Å; R210-W229 HydrophobicContact CB-CZ2 3.69Å; R210-W229 HydrophobicContact CG-CH2 4.36Å; R210-W229 HydrophobicContact CG-CZ2 4.46Å; R210-E756 IonicContact CZ-OE1 2.1Å; R210-E756 IonicContact CZ-OE2 2.76Å; R210-E756 IonicContact NH1-OE1 3.99Å; R210-E756 PolarHBondContact NH1-OE1 3.42Å; R210-E756 VanDerWaalsContact NH1-OE1 3.09Å; R210-E756 IonicContact NH1-OE2 3.17Å; R210-E756 PolarHBondContact NH1-OE2 3.08Å; R210-E756 IonicContact NH2-OE1 3.11Å; R210-E756 PolarHBondContact NH2-OE1 2.97Å; R210-E756 IonicContact NH2-OE2 2.71Å; R210-R767 VanDerWaalsContact NH2-CG 3.31Å; R210-R767 VanDerWaalsContact NH2-NE 3.13Å
211	Q	69.1	Low	67	Low	50 Å²	50	64.6 Å²	64.6	23%	0.234	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151	146.2	176.1	-75.5	-60.7	-70.9	0	0	108.5	C209	C209-Q211 PolarHBondContact O-N 3.02Å
212	P	69.5	Low	67.2	Low	84 Å²	84	65 Å²	65	55%	0.545	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	cis	-73.5	-23.9	-8	31.2	-34.8	0	0	0	112.9	A214 S215 S218	P212-A214 PolarHBondContact O-N 3.43Å; P212-A214 VanDerWaalsContact O-N 3.16Å; P212-S215 WeakPolarHBondContact O-CB 3.18Å; P212-S215 PolarHBondContact O-N 2.88Å; P212-S218 PolarHBondContact O-OG 2.94Å
213	C	75.7	Confident	67.6	Low	1 Å²	1	67 Å²	67	1%	0.007	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-40.9	-160.8	-52.1	0	0	0	0	115.6	N185 L208 C209 S215 S218 L219	N185-C213 HydrophobicContact CB-CB 4.07Å; N185-C213 PolarHBondContact OD1-SG 2.9Å; L208-C213 HydrophobicContact CB-CB 4.4Å; L208-C213 HydrophobicContact CD2-CB 4.35Å; C209-C213 HydrophobicContact CB-CB 4.17Å; C213-S215 PolarHBondContact O-N 3.14Å; C213-S218 PolarHBondContact O-OG 3.42Å; C213-L219 WeakPolarHBondContact O-CG 3.39Å
214	A	73.4	Confident	68	Low	8 Å²	8	63.7 Å²	63.7	7%	0.066	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	5	177	0	0	0	0	0	114.6	I197 C209 P212 S226 W229	I197-A214 HydrophobicContact CD1-CB 4.42Å; C209-A214 WeakPolarHBondContact O-CB 3.37Å; C209-A214 PolarHBondContact O-N 3.05Å; P212-A214 PolarHBondContact O-N 3.43Å; P212-A214 VanDerWaalsContact O-N 3.16Å; A214-S226 WeakPolarHBondContact O-CB 3.17Å; A214-W229 HydrophobicContact CB-CB 4.45Å; A214-W229 HydrophobicContact CB-CG 3.97Å
215	S	68.4	Low	68	Low	30 Å²	30	61.5 Å²	61.5	21%	0.21	33%	0.329	C	S	.	.	S	Bend	trans	-78.3	143	172.5	-173.2	0	0	0	0	111.6	P212 C213 S217 S218	P212-S215 WeakPolarHBondContact O-CB 3.18Å; P212-S215 PolarHBondContact O-N 2.88Å; C213-S215 PolarHBondContact O-N 3.14Å; S215-S217 WeakPolarHBondContact CB-OG 3.28Å; S215-S217 PolarHBondContact O-N 2.98Å; S215-S217 VanDerWaalsContact O-N 3.1Å; S215-S217 PolarHBondContact OG-N 2.88Å; S215-S217 PolarHBondContact OG-OG 3.13Å; S215-S218 PolarHBondContact O-N 3.09Å; S215-S218 VanDerWaalsContact O-N 3.12Å; S215-S218 PolarHBondContact O-OG 2.93Å; S215-S218 VanDerWaalsContact O-OG 3.08Å
216	Q	58.3	Low	67.7	Low	144 Å²	144	59.6 Å²	59.6	67%	0.673	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-58.6	-24.3	174.5	-63.4	-175.5	-16.8	0	0	113.1	S218 S226	Q216-S218 PolarHBondContact O-N 2.9Å; Q216-S226 WeakPolarHBondContact CG-OG 3.21Å; Q216-S226 PolarHBondContact NE2-OG 3.09Å
217	S	55.2	Low	66.9	Low	87 Å²	87	63.4 Å²	63.4	61%	0.608	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64.2	-24.8	177.7	53.1	0	0	0	0	114.1	S215	S215-S217 WeakPolarHBondContact CB-OG 3.28Å; S215-S217 PolarHBondContact O-N 2.98Å; S215-S217 VanDerWaalsContact O-N 3.1Å; S215-S217 PolarHBondContact OG-N 2.88Å; S215-S217 PolarHBondContact OG-OG 3.13Å
218	S	55.5	Low	66.5	Low	49 Å²	49	65.7 Å²	65.7	34%	0.343	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-112.6	3.9	-176.2	46.5	0	0	0	0	114.6	P212 C213 S215 Q216	P212-S218 PolarHBondContact O-OG 2.94Å; C213-S218 PolarHBondContact O-OG 3.42Å; S215-S218 PolarHBondContact O-N 3.09Å; S215-S218 VanDerWaalsContact O-N 3.12Å; S215-S218 PolarHBondContact O-OG 2.93Å; S215-S218 VanDerWaalsContact O-OG 3.08Å; Q216-S218 PolarHBondContact O-N 2.9Å
219	L	59.1	Low	66.3	Low	17 Å²	17	66.4 Å²	66.4	9%	0.089	36%	0.358	C	S	.	.			trans	-116.7	16.1	-175	-66.6	172.1	0	0	0	113.3	L208 C213 D221 I222 W224	L208-L219 HydrophobicContact CD1-CD2 4.22Å; C213-L219 WeakPolarHBondContact O-CG 3.39Å; L219-D221 PolarHBondContact O-N 3.39Å; L219-D221 VanDerWaalsContact O-N 3.08Å; L219-I222 PolarHBondContact O-N 3.16Å; L219-I222 VanDerWaalsContact O-O 3.09Å; L219-W224 HydrophobicContact CD1-CB 4.48Å
220	K	53.6	Low	66.4	Low	173 Å²	173	70.9 Å²	70.9	75%	0.752	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.4	-168.1	-72.6	-172.4	175.2	-177.3	0	115.3
221	D	49.8	Very low	66.8	Low	157 Å²	157	71.6 Å²	71.6	84%	0.84	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	2.1	-172.3	-49.7	-63.2	0	0	0	113.7	L219	L219-D221 PolarHBondContact O-N 3.39Å; L219-D221 VanDerWaalsContact O-N 3.08Å
222	I	56.6	Low	67.8	Low	101 Å²	101	69.2 Å²	69.2	52%	0.518	38%	0.375	S	S	.	.	S	Bend	trans	-142.5	137.7	-175	-31.7	172.7	0	0	0	111.8	L219 W224	L219-I222 PolarHBondContact O-N 3.16Å; L219-I222 VanDerWaalsContact O-O 3.09Å; I222-W224 HydrophobicContact CG2-CZ2 4.48Å; I222-W224 PolarHBondContact O-N 2.8Å
223	N	59.2	Low	68.6	Low	157 Å²	157	66 Å²	66	84%	0.84	35%	0.353	S	S	*	.			trans	-70.1	32.9	-170.4	-74.1	-36.7	0	0	0	116.8
224	W	67.2	Low	68.9	Low	59 Å²	59	69.3 Å²	69.3	22%	0.223	37%	0.369	C	S	.	.			trans	-78.9	137.8	178.6	-57.4	110.5	0	0	0	112.4	I197 A199 V206 L219 I222 S226	I197-W224 HydrophobicContact CG2-CB 4.44Å; I197-W224 HydrophobicContact CG2-CE3 4.32Å; A199-W224 HydrophobicContact CB-CH2 3.94Å; A199-W224 HydrophobicContact CB-CZ3 3.6Å; V206-W224 HydrophobicContact CB-CH2 4.39Å; V206-W224 HydrophobicContact CB-CZ3 4.49Å; V206-W224 HydrophobicContact CG2-CE3 4.49Å; V206-W224 HydrophobicContact CG2-CH2 3.32Å; V206-W224 HydrophobicContact CG2-CZ2 3.54Å; V206-W224 HydrophobicContact CG2-CZ3 3.81Å; L219-W224 HydrophobicContact CD1-CB 4.48Å; I222-W224 HydrophobicContact CG2-CZ2 4.48Å; I222-W224 PolarHBondContact O-N 2.8Å; W224-S226 PolarHBondContact O-N 3.34Å
225	D	66.6	Low	69.3	Low	35 Å²	35	75.1 Å²	75.1	19%	0.187	40%	0.398	C	S	.	.			trans	-93.5	98.5	177.8	-160.5	-36.3	0	0	0	111.4	I197 K200 S227 Q228	I197-D225 WeakPolarHBondContact CG2-O 3.27Å; K200-D225 WeakPolarHBondContact CE-OD2 3.29Å; K200-D225 IonicContact NZ-OD2 3.77Å; K200-D225 PolarHBondContact NZ-OD2 2.93Å; D225-S227 PolarHBondContact O-N 3.27Å; D225-S227 WeakPolarHBondContact OD1-CB 3.49Å; D225-S227 PolarHBondContact OD1-N 2.85Å; D225-S227 VanDerWaalsContact OD1-N 3.09Å; D225-S227 PolarHBondContact OD1-OG 3.47Å; D225-Q228 HydrophobicContact CB-CB 4.49Å; D225-Q228 HydrophobicContact CB-CG 3.98Å; D225-Q228 PolarHBondContact O-N 2.82Å; D225-Q228 PolarHBondContact OD2-NE2 3.09Å
226	S	67.1	Low	69.9	Low	27 Å²	27	76.3 Å²	76.3	19%	0.189	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-56.5	-21.3	179.2	66.3	0	0	0	0	114.2	A214 Q216 W224 Q228	A214-S226 WeakPolarHBondContact O-CB 3.17Å; Q216-S226 WeakPolarHBondContact CG-OG 3.21Å; Q216-S226 PolarHBondContact NE2-OG 3.09Å; W224-S226 PolarHBondContact O-N 3.34Å; S226-Q228 PolarHBondContact O-N 3.18Å
227	S	68.3	Low	71.4	Confident	98 Å²	98	70.8 Å²	70.8	69%	0.685	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-73.9	-17	178.3	73.5	0	0	0	0	113.2	D225	D225-S227 PolarHBondContact O-N 3.27Å; D225-S227 WeakPolarHBondContact OD1-CB 3.49Å; D225-S227 PolarHBondContact OD1-N 2.85Å; D225-S227 VanDerWaalsContact OD1-N 3.09Å; D225-S227 PolarHBondContact OD1-OG 3.47Å
228	Q	77.2	Confident	73.2	Confident	79 Å²	79	66.7 Å²	66.7	37%	0.369	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-99.4	7.3	-176.1	-54.2	-172.6	26.4	0	0	113.3	P198 D225 S226 Q230	P198-Q228 HydrophobicContact CG-CB 4.29Å; D225-Q228 HydrophobicContact CB-CB 4.49Å; D225-Q228 HydrophobicContact CB-CG 3.98Å; D225-Q228 PolarHBondContact O-N 2.82Å; D225-Q228 PolarHBondContact OD2-NE2 3.09Å; S226-Q228 PolarHBondContact O-N 3.18Å; Q228-Q230 PolarHBondContact O-N 3.38Å
229	W	84.7	Confident	74.8	Confident	19 Å²	19	65.3 Å²	65.3	7%	0.072	34%	0.335	C	S	.	.			trans	-62.7	127.8	175	-173.9	98.4	0	0	0	111	G195 F196 I197 L208 R210 A214 P231	G195-W229 VanDerWaalsContact CA-CZ2 3.43Å; F196-W229 WeakPolarHBondContact O-CA 3.17Å; I197-W229 HydrophobicContact CD1-CB 4.3Å; I197-W229 HydrophobicContact CG1-CB 4.03Å; I197-W229 HydrophobicContact CG1-CG 4.3Å; L208-W229 PolarHBondContact O-NE1 2.82Å; R210-W229 HydrophobicContact CB-CH2 3.98Å; R210-W229 HydrophobicContact CB-CZ2 3.69Å; R210-W229 HydrophobicContact CG-CH2 4.36Å; R210-W229 HydrophobicContact CG-CZ2 4.46Å; A214-W229 HydrophobicContact CB-CB 4.45Å; A214-W229 HydrophobicContact CB-CG 3.97Å; W229-P231 HydrophobicContact CH2-CB 3.83Å; W229-P231 VanDerWaalsContact CZ3-CA 3.49Å; W229-P231 HydrophobicContact CZ3-CB 3.71Å; W229-P231 HydrophobicContact CZ3-CG 4.32Å; W229-P231 VanDerWaalsContact CZ3-N 3.3Å
230	Q	82.1	Confident	76.2	Confident	95 Å²	95	68.1 Å²	68.1	44%	0.444	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.5	174.3	-70.7	-170.6	0.6	0	0	111.6	G195 F196 Q228	G195-Q230 CarbonylContact C-O 3.28Å; G195-Q230 WeakPolarHBondContact CA-O 3.41Å; F196-Q230 HydrophobicContact CD1-CB 4.04Å; F196-Q230 HydrophobicContact CE1-CB 3.5Å; F196-Q230 VanDerWaalsContact CE1-CB 3.5Å; F196-Q230 HydrophobicContact CE1-CG 4.47Å; F196-Q230 HydrophobicContact CZ-CB 3.92Å; F196-Q230 HydrophobicContact CZ-CG 4.45Å; F196-Q230 PolarHBondContact N-O 3.08Å; F196-Q230 PolarHBondContact O-N 3.15Å; Q228-Q230 PolarHBondContact O-N 3.38Å
231	P	86.1	Confident	77.8	Confident	33 Å²	33	65.3 Å²	65.3	21%	0.214	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	146.4	-176	30.6	-35.6	0	0	0	111.8	W229 I233	W229-P231 HydrophobicContact CH2-CB 3.83Å; W229-P231 VanDerWaalsContact CZ3-CA 3.49Å; W229-P231 HydrophobicContact CZ3-CB 3.71Å; W229-P231 HydrophobicContact CZ3-CG 4.32Å; W229-P231 VanDerWaalsContact CZ3-N 3.3Å; P231-I233 VanDerWaalsContact C-N 3.29Å; P231-I233 PolarHBondContact O-N 2.65Å
232	L	89.6	Confident	79.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-73.5	-23.9	-179.6	-165.3	61.7	0	0	0	113.2	L181 V191 L194 L207 F238 L239 L242	L181-L232 HydrophobicContact CD1-CD2 4.16Å; V191-L232 HydrophobicContact CG1-CD2 4Å; L194-L232 HydrophobicContact CB-CB 4.42Å; L194-L232 HydrophobicContact CB-CD2 4.05Å; L194-L232 WeakPolarHBondContact O-CB 3.43Å; L194-L232 PolarHBondContact O-N 2.75Å; L207-L232 HydrophobicContact CD1-CD1 3.82Å; L207-L232 HydrophobicContact CD1-CD2 3.89Å; L207-L232 HydrophobicContact CD1-CG 4.35Å; L207-L232 HydrophobicContact CD2-CD2 4.04Å; L232-F238 HydrophobicContact CG-CD1 4.45Å; L232-L239 HydrophobicContact CD1-CD1 4.3Å; L232-L239 PolarHBondContact O-N 3.08Å; L232-L242 HydrophobicContact CD1-CD1 4.23Å; L232-L242 HydrophobicContact CD1-CD2 3.63Å; L232-L242 HydrophobicContact CD1-CG 4.43Å; L232-L242 HydrophobicContact CD2-CD2 4.23Å; L232-L242 HydrophobicContact CG-CD2 4Å
233	I	87.2	Confident	81.3	Confident	17 Å²	17	53.4 Å²	53.4	9%	0.087	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.4	169.8	-64.4	171.1	0	0	0	107.9	V157 V191 F192 P231 C237 F238 I757	V157-I233 HydrophobicContact CG1-CG2 4.45Å; V157-I233 HydrophobicContact CG2-CD1 4.25Å; V157-I233 HydrophobicContact CG2-CG1 4.43Å; V157-I233 HydrophobicContact CG2-CG2 4.07Å; V191-I233 HydrophobicContact CB-CD1 4.23Å; F192-I233 HydrophobicContact CD1-CD1 3.78Å; F192-I233 HydrophobicContact CE1-CD1 3.89Å; P231-I233 VanDerWaalsContact C-N 3.29Å; P231-I233 PolarHBondContact O-N 2.65Å; I233-C237 CarbonylContact C-O 3.51Å; I233-C237 VanDerWaalsContact CA-O 3.29Å; I233-C237 WeakPolarHBondContact CA-O 3.37Å; I233-C237 WeakPolarHBondContact CG2-O 3.44Å; I233-F238 HydrophobicContact CD1-CE2 4.37Å; I233-F238 HydrophobicContact CD1-CZ 4.32Å; I233-F238 HydrophobicContact CG1-CD2 4.46Å; I233-F238 HydrophobicContact CG1-CE1 4.43Å; I233-F238 HydrophobicContact CG1-CE2 4.33Å; I233-F238 HydrophobicContact CG1-CZ 4.34Å; I233-I757 HydrophobicContact CG2-CD1 4.05Å
234	Q	82.2	Confident	82.9	Confident	71 Å²	71	51.2 Å²	51.2	33%	0.332	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	142.5	176.3	-169.8	-172.9	-45.3	0	0	109	R236 C237 L239	Q234-R236 PolarHBondContact O-N 3.37Å; Q234-C237 PolarHBondContact N-O 3.43Å; Q234-C237 PolarHBondContact O-N 3.16Å; Q234-C237 PolarHBondContact O-SG 2.97Å; Q234-C237 VanDerWaalsContact O-SG 3.39Å; Q234-L239 HydrophobicContact CB-CD2 4.11Å
235	D	80.8	Confident	84.1	Confident	129 Å²	129	52.4 Å²	52.4	69%	0.69	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	27.2	178.2	-63	-55.8	0	0	0	114.8
236	R	82.1	Confident	85.1	Confident	55 Å²	55	50.9 Å²	50.9	21%	0.208	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	26.9	-175.6	-53.8	172.3	170.1	-176	-3.4	115.5	S152 S154 V157 Q234 I757 Y764 Q848	S152-R236 WeakPolarHBondContact O-CD 3.36Å; S152-R236 PolarHBondContact O-NH1 3.05Å; S152-R236 PolarHBondContact OG-NH1 3.13Å; S154-R236 PolarHBondContact N-O 2.74Å; V157-R236 WeakPolarHBondContact CB-O 3.14Å; V157-R236 HydrophobicContact CG1-CB 4.29Å; V157-R236 WeakPolarHBondContact CG2-O 3.46Å; Q234-R236 PolarHBondContact O-N 3.37Å; R236-I757 HydrophobicContact CG-CD1 4.36Å; R236-Y764 PolarHBondContact NE-OH 3.31Å; R236-Y764 PolarHBondContact NH2-OH 2.87Å; R236-Q848 VanDerWaalsContact NH2-OE1 3.12Å
237	C	89.9	Confident	86.1	Confident	29 Å²	29	52.2 Å²	52.2	20%	0.196	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	168.3	162.1	59.6	0	0	0	0	110.6	N146 I233 Q234	N146-C237 WeakPolarHBondContact OD1-CB 3.42Å; I233-C237 CarbonylContact C-O 3.51Å; I233-C237 VanDerWaalsContact CA-O 3.29Å; I233-C237 WeakPolarHBondContact CA-O 3.37Å; I233-C237 WeakPolarHBondContact CG2-O 3.44Å; Q234-C237 PolarHBondContact N-O 3.43Å; Q234-C237 PolarHBondContact O-N 3.16Å; Q234-C237 PolarHBondContact O-SG 2.97Å; Q234-C237 VanDerWaalsContact O-SG 3.39Å
238	F	91.6	Very high	86.7	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	150.4	166.2	-78.6	-103	0	0	0	109.9	N146 I156 V157 L160 V168 L181 V191 L232 I233 S240 L242 V243	N146-F238 PolarHBondContact ND2-O 3.36Å; N146-F238 PolarHBondContact OD1-N 2.93Å; I156-F238 HydrophobicContact CB-CE2 4.45Å; I156-F238 HydrophobicContact CG1-CE2 3.8Å; I156-F238 HydrophobicContact CG2-CD2 3.66Å; I156-F238 HydrophobicContact CG2-CE2 3.76Å; V157-F238 HydrophobicContact CG2-CD2 4.06Å; V157-F238 HydrophobicContact CG2-CE2 4.08Å; L160-F238 HydrophobicContact CD1-CE2 4.25Å; L160-F238 HydrophobicContact CD1-CZ 4.3Å; V168-F238 HydrophobicContact CG2-CE1 4.35Å; V168-F238 HydrophobicContact CG2-CZ 4.18Å; L181-F238 HydrophobicContact CD1-CE1 4.13Å; V191-F238 HydrophobicContact CB-CE1 4.32Å; V191-F238 HydrophobicContact CB-CZ 4.16Å; V191-F238 HydrophobicContact CG1-CE1 3.62Å; V191-F238 HydrophobicContact CG1-CZ 3.84Å; V191-F238 HydrophobicContact CG2-CZ 4.33Å; L232-F238 HydrophobicContact CG-CD1 4.45Å; I233-F238 HydrophobicContact CD1-CE2 4.37Å; I233-F238 HydrophobicContact CD1-CZ 4.32Å; I233-F238 HydrophobicContact CG1-CD2 4.46Å; I233-F238 HydrophobicContact CG1-CE1 4.43Å; I233-F238 HydrophobicContact CG1-CE2 4.33Å; I233-F238 HydrophobicContact CG1-CZ 4.34Å; F238-S240 PolarHBondContact O-N 2.8Å; F238-L242 HydrophobicContact CD1-CD2 3.83Å; F238-L242 HydrophobicContact CE1-CD2 4.48Å; F238-V243 HydrophobicContact CB-CB 4.14Å; F238-V243 HydrophobicContact CB-CG2 4.1Å; F238-V243 HydrophobicContact CD1-CG2 4.41Å; F238-V243 HydrophobicContact CG-CG2 4.34Å
239	L	89.9	Confident	86.6	Confident	19 Å²	19	56.8 Å²	56.8	10%	0.099	28%	0.284	C	S	.	.			trans	-54.8	132.3	174.3	-66.2	169.1	0	0	0	111.3	F196 L232 Q234 W241 L242 V243	F196-L239 HydrophobicContact CD1-CD1 3.63Å; F196-L239 HydrophobicContact CE1-CD1 3.4Å; F196-L239 VanDerWaalsContact CE1-CD1 3.4Å; L232-L239 HydrophobicContact CD1-CD1 4.3Å; L232-L239 PolarHBondContact O-N 3.08Å; Q234-L239 HydrophobicContact CB-CD2 4.11Å; L239-W241 HydrophobicContact CD1-CZ2 3.88Å; L239-W241 PolarHBondContact O-N 2.66Å; L239-W241 VanDerWaalsContact O-N 3.14Å; L239-L242 WeakPolarHBondContact O-CB 3.3Å; L239-L242 PolarHBondContact O-N 3.25Å; L239-V243 PolarHBondContact O-N 3.49Å
240	S	88.3	Confident	86.1	Confident	77 Å²	77	59.7 Å²	59.7	54%	0.538	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.5	-170.5	53.2	0	0	0	0	115.2	F238 V243	F238-S240 PolarHBondContact O-N 2.8Å; S240-V243 WeakPolarHBondContact CA-O 3.31Å
241	W	86.6	Confident	85.8	Confident	114 Å²	114	56.3 Å²	56.3	43%	0.432	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-23.1	173.6	62.8	-102.3	0	0	0	113.1	F196 V205 L239	F196-W241 AromaticContact CD1-CZ2 3.88Å; F196-W241 HydrophobicContact CD1-CZ2 3.88Å; F196-W241 HydrophobicContact CD2-CZ2 4.39Å; F196-W241 HydrophobicContact CE1-CZ2 4.12Å; F196-W241 HydrophobicContact CG-CZ2 4.02Å; F196-W241 HydrophobicContact CZ-CZ2 4.48Å; V205-W241 HydrophobicContact CG1-CH2 4.08Å; L239-W241 HydrophobicContact CD1-CZ2 3.88Å; L239-W241 PolarHBondContact O-N 2.66Å; L239-W241 VanDerWaalsContact O-N 3.14Å
242	L	88.4	Confident	85.1	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.026	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-47.3	177.6	-168	91.6	0	0	0	110.7	L170 L176 L181 L232 F238 L239	L170-L242 HydrophobicContact CD1-CG 4.4Å; L176-L242 HydrophobicContact CD1-CD1 3.58Å; L181-L242 HydrophobicContact CD1-CD2 3.78Å; L232-L242 HydrophobicContact CD1-CD1 4.23Å; L232-L242 HydrophobicContact CD1-CD2 3.63Å; L232-L242 HydrophobicContact CD1-CG 4.43Å; L232-L242 HydrophobicContact CD2-CD2 4.23Å; L232-L242 HydrophobicContact CG-CD2 4Å; F238-L242 HydrophobicContact CD1-CD2 3.83Å; F238-L242 HydrophobicContact CE1-CD2 4.48Å; L239-L242 WeakPolarHBondContact O-CB 3.3Å; L239-L242 PolarHBondContact O-N 3.25Å
243	V	92.4	Very high	84.3	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.012	34%	0.344	C	S	.	.	S	Bend	trans	-136.8	116.1	176	-169.6	0	0	0	0	107.6	V135 N146 L170 F238 L239 S240	V135-V243 HydrophobicContact CG2-CB 4.32Å; V135-V243 HydrophobicContact CG2-CG1 3.74Å; V135-V243 HydrophobicContact CG2-CG2 3.76Å; N146-V243 HydrophobicContact CB-CB 4.24Å; N146-V243 HydrophobicContact CB-CG1 3.71Å; N146-V243 PolarHBondContact ND2-O 2.96Å; L170-V243 HydrophobicContact CD2-CG2 3.63Å; F238-V243 HydrophobicContact CB-CB 4.14Å; F238-V243 HydrophobicContact CB-CG2 4.1Å; F238-V243 HydrophobicContact CD1-CG2 4.41Å; F238-V243 HydrophobicContact CG-CG2 4.34Å; L239-V243 PolarHBondContact O-N 3.49Å; S240-V243 WeakPolarHBondContact CA-O 3.31Å
244	K	92.4	Very high	83.7	Confident	112 Å²	112	71.4 Å²	71.4	49%	0.487	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-60.8	152.3	-178.2	-65.1	-175	-170	168.4	0	110.5	A132 C133 N146	A132-K244 HydrophobicContact CB-CB 4.45Å; A132-K244 HydrophobicContact CB-CD 3.71Å; A132-K244 HydrophobicContact CB-CG 4.13Å; A132-K244 WeakPolarHBondContact O-CB 3.41Å; A132-K244 PolarHBondContact O-N 3.09Å; C133-K244 WeakPolarHBondContact CA-O 3.33Å; C133-K244 VanDerWaalsContact SG-C 3.58Å; C133-K244 VanDerWaalsContact SG-CB 3.58Å; C133-K244 PolarHBondContact SG-O 3.15Å; N146-K244 WeakPolarHBondContact CB-O 3.47Å
245	I	91.8	Very high	83.4	Confident	83 Å²	83	74 Å²	74	43%	0.426	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-93.2	126.3	169.7	-58	176	0	0	0	106.2
246	P	89.7	Confident	83.3	Confident	4 Å²	4	71.9 Å²	71.9	3%	0.026	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-57.9	148.5	178.7	-18.6	26.1	0	0	0	111.5	I128 C133 C145 E250 Q251	I128-P246 HydrophobicContact CD1-CB 4.13Å; I128-P246 HydrophobicContact CD1-CG 4.03Å; I128-P246 HydrophobicContact CG2-CB 4.24Å; I128-P246 HydrophobicContact CG2-CG 3.86Å; C133-P246 HydrophobicContact CB-CG 3.76Å; C133-P246 VanDerWaalsContact SG-N 3.39Å; C145-P246 HydrophobicContact CB-CG 4.48Å; P246-E250 HydrophobicContact CB-CB 4.23Å; P246-Q251 HydrophobicContact CB-CG 4.07Å; P246-Q251 PolarHBondContact O-NE2 3.4Å
247	S	87.9	Confident	83.1	Confident	55 Å²	55	69.5 Å²	69.5	39%	0.385	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60.8	160	176.9	70.6	0	0	0	0	111.8	Q249 E250 Q251	S247-Q249 PolarHBondContact O-N 2.96Å; S247-E250 WeakPolarHBondContact CB-OE2 3.47Å; S247-E250 PolarHBondContact N-OE2 3.21Å; S247-E250 PolarHBondContact O-N 3.4Å; S247-E250 WeakPolarHBondContact OG-CG 3.39Å; S247-E250 PolarHBondContact OG-N 3.14Å; S247-E250 PolarHBondContact OG-OE2 3.3Å; S247-Q251 PolarHBondContact O-N 3.28Å
248	E	79.4	Confident	82.7	Confident	139 Å²	139	70.9 Å²	70.9	65%	0.65	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-31.2	177.9	-59.5	-167.6	142.3	0	0	111.6	Q251 L252	E248-Q251 PolarHBondContact O-N 3.11Å; E248-L252 WeakPolarHBondContact O-CB 3.5Å; E248-L252 WeakPolarHBondContact O-CD1 3.39Å; E248-L252 WeakPolarHBondContact O-CG 3.43Å; E248-L252 PolarHBondContact O-N 2.94Å
249	Q	75.1	Confident	82	Confident	134 Å²	134	72.7 Å²	72.7	63%	0.626	35%	0.353	S	S	*	.	H	α-helix	trans	-64.8	-40.8	174.5	-61.2	-173.8	9.5	0	0	112.1	S247 L252 R253	S247-Q249 PolarHBondContact O-N 2.96Å; Q249-L252 PolarHBondContact O-N 2.61Å; Q249-R253 WeakPolarHBondContact O-CB 3.26Å; Q249-R253 VanDerWaalsContact O-CG 3.31Å; Q249-R253 WeakPolarHBondContact O-CG 3.47Å; Q249-R253 PolarHBondContact O-N 3.11Å
250	E	74.8	Confident	81.2	Confident	79 Å²	79	79.1 Å²	79.1	37%	0.369	38%	0.383	S	S	.	.	H	α-helix	trans	-69.8	-40.2	175.3	-68.1	160.9	117.5	0	0	111.7	P246 S247 L252 R253 A254	P246-E250 HydrophobicContact CB-CB 4.23Å; S247-E250 WeakPolarHBondContact CB-OE2 3.47Å; S247-E250 PolarHBondContact N-OE2 3.21Å; S247-E250 PolarHBondContact O-N 3.4Å; S247-E250 WeakPolarHBondContact OG-CG 3.39Å; S247-E250 PolarHBondContact OG-N 3.14Å; S247-E250 PolarHBondContact OG-OE2 3.3Å; E250-L252 VanDerWaalsContact C-N 3.3Å; E250-L252 PolarHBondContact O-N 2.81Å; E250-R253 PolarHBondContact O-N 2.95Å; E250-A254 WeakPolarHBondContact O-CB 3.32Å; E250-A254 PolarHBondContact O-N 2.71Å
251	Q	75.7	Confident	80.7	Confident	25 Å²	25	78.9 Å²	78.9	12%	0.117	37%	0.373	C	S	.	.	H	α-helix	trans	-68	-27.3	176.3	-69.5	-175.1	79.2	0	0	113.1	I128 P246 S247 E248 Q256	I128-Q251 HydrophobicContact CD1-CG 3.95Å; P246-Q251 HydrophobicContact CB-CG 4.07Å; P246-Q251 PolarHBondContact O-NE2 3.4Å; S247-Q251 PolarHBondContact O-N 3.28Å; E248-Q251 PolarHBondContact O-N 3.11Å; Q251-Q256 PolarHBondContact O-NE2 3.48Å
252	L	71.3	Confident	80.5	Confident	133 Å²	133	73.5 Å²	73.5	70%	0.696	35%	0.353	S	S	*	.	H	α-helix	trans	-77.7	-36.7	172.5	-73.5	167.3	0	0	0	112.7	E248 Q249 E250 A254 Q256	E248-L252 WeakPolarHBondContact O-CB 3.5Å; E248-L252 WeakPolarHBondContact O-CD1 3.39Å; E248-L252 WeakPolarHBondContact O-CG 3.43Å; E248-L252 PolarHBondContact O-N 2.94Å; Q249-L252 PolarHBondContact O-N 2.61Å; E250-L252 VanDerWaalsContact C-N 3.3Å; E250-L252 PolarHBondContact O-N 2.81Å; L252-A254 VanDerWaalsContact C-N 3.33Å; L252-Q256 PolarHBondContact O-NE2 2.84Å; L252-Q256 VanDerWaalsContact O-NE2 3.17Å
253	R	72	Confident	79.9	Confident	217 Å²	217	76.9 Å²	76.9	82%	0.819	37%	0.371	S	S	*	.	H	α-helix	trans	-73.9	-21.7	175.4	-71.8	175.7	-176.4	-176.7	2.1	113.6	Q249 E250	Q249-R253 WeakPolarHBondContact O-CB 3.26Å; Q249-R253 VanDerWaalsContact O-CG 3.31Å; Q249-R253 WeakPolarHBondContact O-CG 3.47Å; Q249-R253 PolarHBondContact O-N 3.11Å; E250-R253 PolarHBondContact O-N 2.95Å
254	A	75.7	Confident	79.2	Confident	16 Å²	16	81.2 Å²	81.2	13%	0.132	39%	0.389	C	S	.	.	S	Bend	trans	-66.2	159.9	178.3	0	0	0	0	0	113	C126 I128 E250 L252 Q256	C126-A254 HydrophobicContact CB-CB 4.14Å; C126-A254 WeakPolarHBondContact O-CB 3.49Å; I128-A254 HydrophobicContact CD1-CB 3.91Å; I128-A254 HydrophobicContact CG1-CB 3.61Å; E250-A254 WeakPolarHBondContact O-CB 3.32Å; E250-A254 PolarHBondContact O-N 2.71Å; L252-A254 VanDerWaalsContact C-N 3.33Å; A254-Q256 PolarHBondContact O-N 3.06Å; A254-Q256 VanDerWaalsContact O-N 3.14Å; A254-Q256 PolarHBondContact O-NE2 2.91Å
255	R	75.4	Confident	78.7	Confident	127 Å²	127	75.9 Å²	75.9	48%	0.479	37%	0.366	S	S	.	.			trans	-60.2	117.7	173.5	178	-175.9	-82.3	-150.8	-8.3	109	C126 I257 E278	C126-R255 PolarHBondContact O-N 3.08Å; R255-I257 PolarHBondContact O-N 3.12Å; R255-E278 IonicContact CZ-OE1 2.86Å; R255-E278 VanDerWaalsContact CZ-OE1 3.22Å; R255-E278 IonicContact NH1-OE1 2.7Å; R255-E278 PolarHBondContact NH1-OE1 2.91Å; R255-E278 IonicContact NH1-OE2 2.82Å; R255-E278 IonicContact NH2-OE1 3.18Å; R255-E278 PolarHBondContact NH2-OE1 3.37Å
256	Q	78.5	Confident	78.3	Confident	84 Å²	84	72.5 Å²	72.5	39%	0.393	35%	0.349	S	S	.	.			trans	-75.3	59	-172.7	-65.6	-56.5	-45.8	0	0	113.5	N150 Q251 L252 A254 T258	N150-Q256 PolarHBondContact ND2-OE1 2.85Å; Q251-Q256 PolarHBondContact O-NE2 3.48Å; L252-Q256 PolarHBondContact O-NE2 2.84Å; L252-Q256 VanDerWaalsContact O-NE2 3.17Å; A254-Q256 PolarHBondContact O-N 3.06Å; A254-Q256 VanDerWaalsContact O-N 3.14Å; A254-Q256 PolarHBondContact O-NE2 2.91Å; Q256-T258 PolarHBondContact O-N 3.42Å
257	I	78.4	Confident	77.6	Confident	5 Å²	5	76.8 Å²	76.8	3%	0.026	37%	0.368	C	S	.	.			trans	-67.7	127.6	-178.3	-168.6	175.9	0	0	0	111.8	Y125 C126 R255 Q261 I262 L265 L277	Y125-I257 HydrophobicContact CG-CD1 4.5Å; Y125-I257 WeakPolarHBondContact O-CD1 3.38Å; C126-I257 HydrophobicContact CB-CG2 4.27Å; R255-I257 PolarHBondContact O-N 3.12Å; I257-Q261 HydrophobicContact CD1-CB 4.5Å; I257-Q261 HydrophobicContact CG1-CB 3.86Å; I257-I262 HydrophobicContact CD1-CD1 4.27Å; I257-I262 HydrophobicContact CD1-CG1 3.45Å; I257-I262 VanDerWaalsContact CD1-CG1 3.45Å; I257-I262 HydrophobicContact CG1-CD1 4.44Å; I257-I262 HydrophobicContact CG1-CG1 3.83Å; I257-I262 HydrophobicContact CG2-CD1 4.18Å; I257-I262 HydrophobicContact CG2-CG1 4.45Å; I257-L265 HydrophobicContact CD1-CD2 4.34Å; I257-L277 HydrophobicContact CD1-CD1 4.04Å; I257-L277 HydrophobicContact CD1-CD2 3.72Å; I257-L277 HydrophobicContact CD1-CG 4.38Å; I257-L277 HydrophobicContact CG1-CD2 3.89Å
258	T	80.6	Confident	77.2	Confident	57 Å²	57	76.1 Å²	76.1	35%	0.35	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-80	155.5	176.8	65.2	0	0	0	0	111.9	Q256 Q260 Q261 I262	Q256-T258 PolarHBondContact O-N 3.42Å; T258-Q260 PolarHBondContact O-N 3.11Å; T258-Q260 VanDerWaalsContact O-N 3.11Å; T258-Q261 PolarHBondContact O-N 2.98Å; T258-Q261 VanDerWaalsContact O-N 3.12Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.47Å; T258-Q261 PolarHBondContact OG1-N 3.32Å; T258-Q261 VanDerWaalsContact OG1-N 3.09Å; T258-Q261 PolarHBondContact OG1-OE1 3.2Å; T258-I262 PolarHBondContact O-N 3.2Å
259	A	76.8	Confident	77.4	Confident	40 Å²	40	70.8 Å²	70.8	33%	0.331	33%	0.334	S	S	.	.	H	α-helix	trans	-57.6	-23.8	170.7	0	0	0	0	0	113.4	T151 N263	T151-A259 HydrophobicContact CG2-CB 4.35Å; A259-N263 PolarHBondContact O-N 3.49Å; A259-N263 VanDerWaalsContact O-N 3.14Å; A259-N263 PolarHBondContact O-ND2 3.28Å; A259-N263 PolarHBondContact O-OD1 2.83Å; A259-N263 VanDerWaalsContact O-OD1 3.06Å
260	Q	74	Confident	77.3	Confident	154 Å²	154	69.8 Å²	69.8	72%	0.72	33%	0.328	S	S	*	.	H	α-helix	trans	-77.5	-40.9	174.5	-64.9	-166.7	15.1	0	0	112.7	T258 I262 N263 K264	T258-Q260 PolarHBondContact O-N 3.11Å; T258-Q260 VanDerWaalsContact O-N 3.11Å; Q260-I262 VanDerWaalsContact C-N 3.33Å; Q260-N263 VanDerWaalsContact O-CB 3.29Å; Q260-N263 WeakPolarHBondContact O-CB 3.26Å; Q260-N263 PolarHBondContact O-N 2.93Å; Q260-N263 VanDerWaalsContact O-N 3.09Å; Q260-K264 PolarHBondContact O-N 2.97Å; Q260-K264 VanDerWaalsContact O-N 3.14Å
261	Q	78.6	Confident	77.1	Confident	72 Å²	72	73.1 Å²	73.1	34%	0.336	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-40.8	172.4	-76.3	154.9	-45.1	0	0	111.1	I257 T258 N263 K264 L265 L277 L280	I257-Q261 HydrophobicContact CD1-CB 4.5Å; I257-Q261 HydrophobicContact CG1-CB 3.86Å; T258-Q261 PolarHBondContact O-N 2.98Å; T258-Q261 VanDerWaalsContact O-N 3.12Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.47Å; T258-Q261 PolarHBondContact OG1-N 3.32Å; T258-Q261 VanDerWaalsContact OG1-N 3.09Å; T258-Q261 PolarHBondContact OG1-OE1 3.2Å; Q261-N263 VanDerWaalsContact C-N 3.29Å; Q261-N263 PolarHBondContact O-N 3.49Å; Q261-K264 PolarHBondContact O-N 2.73Å; Q261-L265 VanDerWaalsContact O-CB 3.28Å; Q261-L265 WeakPolarHBondContact O-CB 3.32Å; Q261-L265 PolarHBondContact O-N 3.06Å; Q261-L277 HydrophobicContact CB-CD2 3.89Å; Q261-L277 HydrophobicContact CG-CD2 4.32Å; Q261-L280 HydrophobicContact CB-CD1 4.48Å
262	I	81.2	Confident	77.2	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.1	-36.9	171.2	-64.9	169.1	0	0	0	111.6	Y125 T151 I257 T258 Q260 K264 E266	Y125-I262 HydrophobicContact CD1-CG1 4.26Å; Y125-I262 HydrophobicContact CD2-CD1 3.79Å; Y125-I262 HydrophobicContact CD2-CG1 4.2Å; Y125-I262 HydrophobicContact CE1-CG1 4.38Å; Y125-I262 HydrophobicContact CE1-CG2 3.92Å; Y125-I262 HydrophobicContact CE2-CD1 4.04Å; Y125-I262 HydrophobicContact CE2-CG1 4.35Å; Y125-I262 HydrophobicContact CE2-CG2 3.93Å; Y125-I262 HydrophobicContact CG-CD1 4.15Å; Y125-I262 HydrophobicContact CG-CG1 4.16Å; T151-I262 HydrophobicContact CG2-CD1 3.75Å; I257-I262 HydrophobicContact CD1-CD1 4.27Å; I257-I262 HydrophobicContact CD1-CG1 3.45Å; I257-I262 VanDerWaalsContact CD1-CG1 3.45Å; I257-I262 HydrophobicContact CG1-CD1 4.44Å; I257-I262 HydrophobicContact CG1-CG1 3.83Å; I257-I262 HydrophobicContact CG2-CD1 4.18Å; I257-I262 HydrophobicContact CG2-CG1 4.45Å; T258-I262 PolarHBondContact O-N 3.2Å; Q260-I262 VanDerWaalsContact C-N 3.33Å; I262-K264 PolarHBondContact O-N 2.9Å; I262-E266 WeakPolarHBondContact O-CB 3.37Å; I262-E266 PolarHBondContact O-N 2.98Å
263	N	77.3	Confident	77.7	Confident	76 Å²	76	72.6 Å²	72.6	41%	0.406	35%	0.347	S	S	.	.	H	α-helix	trans	-57.6	-49.7	174.2	-62.3	-26.7	0	0	0	111.6	R162 A259 Q260 Q261 E267	R162-N263 VanDerWaalsContact CZ-OD1 3.28Å; R162-N263 PolarHBondContact NH1-OD1 3.29Å; R162-N263 PolarHBondContact NH2-OD1 3.42Å; A259-N263 PolarHBondContact O-N 3.49Å; A259-N263 VanDerWaalsContact O-N 3.14Å; A259-N263 PolarHBondContact O-ND2 3.28Å; A259-N263 PolarHBondContact O-OD1 2.83Å; A259-N263 VanDerWaalsContact O-OD1 3.06Å; Q260-N263 VanDerWaalsContact O-CB 3.29Å; Q260-N263 WeakPolarHBondContact O-CB 3.26Å; Q260-N263 PolarHBondContact O-N 2.93Å; Q260-N263 VanDerWaalsContact O-N 3.09Å; Q261-N263 VanDerWaalsContact C-N 3.29Å; Q261-N263 PolarHBondContact O-N 3.49Å; N263-E267 WeakPolarHBondContact O-CB 3.31Å; N263-E267 PolarHBondContact O-N 2.68Å
264	K	77.1	Confident	78	Confident	93 Å²	93	66.7 Å²	66.7	40%	0.404	34%	0.339	S	S	.	.	H	α-helix	trans	-73.1	-41.2	-177.7	-61.5	-163.4	-178.6	-168.7	0	112.7	Q260 Q261 I262 E266 E267 L268 L280 D286	Q260-K264 PolarHBondContact O-N 2.97Å; Q260-K264 VanDerWaalsContact O-N 3.14Å; Q261-K264 PolarHBondContact O-N 2.73Å; I262-K264 PolarHBondContact O-N 2.9Å; K264-E266 PolarHBondContact O-N 2.86Å; K264-E267 WeakPolarHBondContact O-CA 3.26Å; K264-E267 WeakPolarHBondContact O-CB 3.37Å; K264-E267 PolarHBondContact O-N 3.26Å; K264-E267 VanDerWaalsContact O-N 3.09Å; K264-L268 PolarHBondContact O-N 3.17Å; K264-L280 HydrophobicContact CB-CD1 4.28Å; K264-L280 HydrophobicContact CB-CD2 3.4Å; K264-L280 HydrophobicContact CB-CG 4.48Å; K264-L280 HydrophobicContact CD-CD2 4.19Å; K264-L280 HydrophobicContact CG-CD2 4.46Å; K264-D286 IonicContact NZ-OD2 2.73Å; K264-D286 PolarHBondContact NZ-OD2 2.91Å
265	L	81.2	Confident	78.1	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-45.3	179.2	-177.7	66.4	0	0	0	111.6	Y125 I257 Q261 E267 L268 W269 T276 L277	Y125-L265 HydrophobicContact CD1-CD2 4.1Å; Y125-L265 HydrophobicContact CE1-CD2 4.46Å; I257-L265 HydrophobicContact CD1-CD2 4.34Å; Q261-L265 VanDerWaalsContact O-CB 3.28Å; Q261-L265 WeakPolarHBondContact O-CB 3.32Å; Q261-L265 PolarHBondContact O-N 3.06Å; L265-E267 PolarHBondContact O-N 3.15Å; L265-L268 PolarHBondContact O-N 3.46Å; L265-W269 HydrophobicContact CD1-CZ2 4Å; L265-W269 HydrophobicContact CD2-CH2 3.89Å; L265-W269 HydrophobicContact CD2-CZ2 3.6Å; L265-W269 HydrophobicContact CG-CD2 4.21Å; L265-W269 HydrophobicContact CG-CH2 4.24Å; L265-W269 HydrophobicContact CG-CZ2 3.7Å; L265-W269 PolarHBondContact O-N 2.79Å; L265-T276 WeakPolarHBondContact CD1-O 3.28Å; L265-L277 HydrophobicContact CD1-CG 4.47Å; L265-L277 HydrophobicContact CD2-CD1 4Å; L265-L277 HydrophobicContact CD2-CG 4.08Å
266	E	82.8	Confident	78.2	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.056	33%	0.331	C	S	.	.	H	α-helix	trans	-72.9	-14.2	176.7	-158.1	69.9	-127.5	0	0	112.6	Y125 H159 R162 I262 K264 W269 K270	Y125-E266 WeakPolarHBondContact CE1-OE2 3.39Å; Y125-E266 PolarHBondContact OH-OE2 2.94Å; H159-E266 IonicContact CE1-OE1 3.87Å; H159-E266 PolarHBondContact CE1-OE1 2.84Å; H159-E266 IonicContact CE1-OE2 3.22Å; H159-E266 PolarHBondContact CE1-OE2 3.08Å; H159-E266 IonicContact ND1-OE1 3.05Å; H159-E266 PolarHBondContact ND1-OE1 3.17Å; H159-E266 IonicContact ND1-OE2 2.78Å; H159-E266 PolarHBondContact ND1-OE2 3.22Å; H159-E266 VanDerWaalsContact ND1-OE2 3.11Å; H159-E266 IonicContact NE2-OE1 2.72Å; H159-E266 PolarHBondContact NE2-OE1 3.15Å; H159-E266 IonicContact NE2-OE2 2.65Å; R162-E266 HydrophobicContact CB-CG 3.66Å; R162-E266 HydrophobicContact CG-CG 4.45Å; I262-E266 WeakPolarHBondContact O-CB 3.37Å; I262-E266 PolarHBondContact O-N 2.98Å; K264-E266 PolarHBondContact O-N 2.86Å; E266-W269 WeakPolarHBondContact OE2-CZ3 3.41Å; E266-K270 WeakPolarHBondContact O-CE 3.25Å; E266-K270 WeakPolarHBondContact O-CG 3.36Å
267	E	76.6	Confident	77.9	Confident	93 Å²	93	60.3 Å²	60.3	44%	0.435	32%	0.318	S	S	.	.	H	α-helix	trans	-81.5	-44.3	169.3	-165.7	114	-98.4	0	0	110.9	N263 K264 L265 K270	N263-E267 WeakPolarHBondContact O-CB 3.31Å; N263-E267 PolarHBondContact O-N 2.68Å; K264-E267 WeakPolarHBondContact O-CA 3.26Å; K264-E267 WeakPolarHBondContact O-CB 3.37Å; K264-E267 PolarHBondContact O-N 3.26Å; K264-E267 VanDerWaalsContact O-N 3.09Å; L265-E267 PolarHBondContact O-N 3.15Å; E267-K270 WeakPolarHBondContact O-CB 3.33Å; E267-K270 PolarHBondContact O-N 3.08Å; E267-K270 IonicContact OE1-NZ 3.96Å; E267-K270 PolarHBondContact OE1-NZ 3.37Å
268	L	78.9	Confident	77.4	Confident	41 Å²	41	64.4 Å²	64.4	22%	0.215	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-41.8	172.5	-73.8	-173.2	0	0	0	112.1	K264 L265 K270 E271 N272 A275 D279 L280	K264-L268 PolarHBondContact O-N 3.17Å; L265-L268 PolarHBondContact O-N 3.46Å; L268-K270 PolarHBondContact O-N 3.04Å; L268-E271 PolarHBondContact O-N 2.99Å; L268-N272 PolarHBondContact O-N 2.9Å; L268-A275 HydrophobicContact CB-CB 3.94Å; L268-A275 HydrophobicContact CD1-CB 4.11Å; L268-D279 HydrophobicContact CD1-CB 3.93Å; L268-L280 HydrophobicContact CD1-CD2 3.58Å; L268-L280 HydrophobicContact CD1-CG 4.39Å; L268-L280 HydrophobicContact CG-CD2 4.19Å
269	W	82.8	Confident	76.9	Confident	27 Å²	27	63.3 Å²	63.3	10%	0.102	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14	179	-72.9	-11	0	0	0	114.8	S124 Y125 K142 F144 H159 L265 E266 E271 N272 A275	S124-W269 WeakPolarHBondContact O-CH2 3.3Å; Y125-W269 AromaticContact CD1-CH2 3.87Å; Y125-W269 HydrophobicContact CD1-CH2 3.87Å; Y125-W269 HydrophobicContact CD1-CZ3 4.15Å; Y125-W269 AromaticContact CE1-CH2 3.79Å; Y125-W269 HydrophobicContact CE1-CH2 3.79Å; Y125-W269 AromaticContact CE1-CZ3 3.58Å; Y125-W269 HydrophobicContact CE1-CZ3 3.58Å; K142-W269 HydrophobicContact CD-CE3 4.44Å; K142-W269 HydrophobicContact CD-CH2 4.17Å; K142-W269 HydrophobicContact CD-CZ2 4.4Å; K142-W269 HydrophobicContact CD-CZ3 4.18Å; F144-W269 HydrophobicContact CE1-CH2 4.25Å; F144-W269 HydrophobicContact CE1-CZ3 4.02Å; F144-W269 HydrophobicContact CZ-CH2 4.38Å; F144-W269 AromaticContact CZ-CZ3 3.93Å; F144-W269 HydrophobicContact CZ-CZ3 3.93Å; H159-W269 AromaticContact CE1-CZ3 3.84Å; L265-W269 HydrophobicContact CD1-CZ2 4Å; L265-W269 HydrophobicContact CD2-CH2 3.89Å; L265-W269 HydrophobicContact CD2-CZ2 3.6Å; L265-W269 HydrophobicContact CG-CD2 4.21Å; L265-W269 HydrophobicContact CG-CH2 4.24Å; L265-W269 HydrophobicContact CG-CZ2 3.7Å; L265-W269 PolarHBondContact O-N 2.79Å; E266-W269 WeakPolarHBondContact OE2-CZ3 3.41Å; W269-E271 VanDerWaalsContact C-N 3.31Å; W269-N272 WeakPolarHBondContact CA-O 3.26Å; W269-A275 PolarHBondContact NE1-O 2.9Å
270	K	72.8	Confident	76.3	Confident	113 Å²	113	62.9 Å²	62.9	49%	0.491	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-17.5	172.2	-58	168.6	-168.5	168.7	0	113.4	E266 E267 L268	E266-K270 WeakPolarHBondContact O-CE 3.25Å; E266-K270 WeakPolarHBondContact O-CG 3.36Å; E267-K270 WeakPolarHBondContact O-CB 3.33Å; E267-K270 PolarHBondContact O-N 3.08Å; E267-K270 IonicContact OE1-NZ 3.96Å; E267-K270 PolarHBondContact OE1-NZ 3.37Å; L268-K270 PolarHBondContact O-N 3.04Å
271	E	71.7	Confident	75.8	Confident	149 Å²	149	63.3 Å²	63.3	70%	0.696	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-39.4	-177.2	-63.7	-174.6	178.8	0	0	111.9	L268 W269 K319	L268-E271 PolarHBondContact O-N 2.99Å; W269-E271 VanDerWaalsContact C-N 3.31Å; E271-K319 IonicContact OE1-NZ 3.76Å; E271-K319 PolarHBondContact OE1-NZ 2.84Å
272	N	78.7	Confident	75	Confident	63 Å²	63	65.5 Å²	65.5	34%	0.337	33%	0.331	S	S	.	.			trans	-125.6	92.7	173.3	177.4	5.8	0	0	0	109.1	L268 W269 S274 A275	L268-N272 PolarHBondContact O-N 2.9Å; W269-N272 WeakPolarHBondContact CA-O 3.26Å; N272-S274 PolarHBondContact O-N 2.66Å; N272-S274 VanDerWaalsContact O-N 3.15Å; N272-S274 PolarHBondContact OD1-N 3.16Å; N272-S274 PolarHBondContact OD1-OG 3.02Å; N272-A275 HydrophobicContact CB-CB 4.09Å; N272-A275 VanDerWaalsContact O-CB 3.28Å; N272-A275 WeakPolarHBondContact O-CB 3.5Å; N272-A275 PolarHBondContact O-N 3.23Å; N272-A275 PolarHBondContact OD1-N 2.87Å
273	P	81.7	Confident	73.2	Confident	85 Å²	85	71.9 Å²	71.9	55%	0.552	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-17	-178.5	27.8	-35.4	0	0	0	113.3	K142	K142-P273 PolarHBondContact NZ-O 3.01Å
274	S	78	Confident	72	Confident	93 Å²	93	71.8 Å²	71.8	65%	0.65	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.4	173.5	29.8	0	0	0	0	114.4	N272	N272-S274 PolarHBondContact O-N 2.66Å; N272-S274 VanDerWaalsContact O-N 3.15Å; N272-S274 PolarHBondContact OD1-N 3.16Å; N272-S274 PolarHBondContact OD1-OG 3.02Å
275	A	78.3	Confident	70.9	Confident	4 Å²	4	71.2 Å²	71.2	3%	0.033	39%	0.394	C	S	.	.			trans	-61	147.1	179.1	0	0	0	0	0	112.2	L268 W269 N272 D279	L268-A275 HydrophobicContact CB-CB 3.94Å; L268-A275 HydrophobicContact CD1-CB 4.11Å; W269-A275 PolarHBondContact NE1-O 2.9Å; N272-A275 HydrophobicContact CB-CB 4.09Å; N272-A275 VanDerWaalsContact O-CB 3.28Å; N272-A275 WeakPolarHBondContact O-CB 3.5Å; N272-A275 PolarHBondContact O-N 3.23Å; N272-A275 PolarHBondContact OD1-N 2.87Å; A275-D279 WeakPolarHBondContact CA-OD2 3.41Å; A275-D279 HydrophobicContact CB-CB 4.44Å
276	T	77.4	Confident	69.4	Low	66 Å²	66	74.9 Å²	74.9	41%	0.405	41%	0.413	S	S	.	.			trans	-115	-174.6	176.6	73.5	0	0	0	0	111.3	L265 E278 D279	L265-T276 WeakPolarHBondContact CD1-O 3.28Å; T276-E278 VanDerWaalsContact C-N 3.25Å; T276-E278 WeakPolarHBondContact CB-OE2 3.35Å; T276-E278 PolarHBondContact OG1-OE2 3.45Å; T276-D279 PolarHBondContact N-OD2 2.96Å; T276-D279 PolarHBondContact O-N 3.36Å
277	L	70.4	Confident	68.3	Low	23 Å²	23	82.9 Å²	82.9	12%	0.12	45%	0.451	C	S	.	.	S	Bend	trans	-71.1	-27.9	177.1	-81	117	0	0	0	112	I257 Q261 L265 D279 L280	I257-L277 HydrophobicContact CD1-CD1 4.04Å; I257-L277 HydrophobicContact CD1-CD2 3.72Å; I257-L277 HydrophobicContact CD1-CG 4.38Å; I257-L277 HydrophobicContact CG1-CD2 3.89Å; Q261-L277 HydrophobicContact CB-CD2 3.89Å; Q261-L277 HydrophobicContact CG-CD2 4.32Å; L265-L277 HydrophobicContact CD1-CG 4.47Å; L265-L277 HydrophobicContact CD2-CD1 4Å; L265-L277 HydrophobicContact CD2-CG 4.08Å; L277-D279 PolarHBondContact O-N 3.08Å; L277-L280 HydrophobicContact CD2-CD1 4.24Å; L277-L280 HydrophobicContact CG-CD1 4.48Å; L277-L280 WeakPolarHBondContact O-CB 3.39Å; L277-L280 VanDerWaalsContact O-CG 3.31Å; L277-L280 WeakPolarHBondContact O-CG 3.34Å; L277-L280 PolarHBondContact O-N 3.34Å
278	E	69.6	Low	68	Low	90 Å²	90	84 Å²	84	42%	0.421	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-70.6	-18.1	179.9	-58	73.1	-164.4	0	0	111.5	R255 T276 L280	R255-E278 IonicContact CZ-OE1 2.86Å; R255-E278 VanDerWaalsContact CZ-OE1 3.22Å; R255-E278 IonicContact NH1-OE1 2.7Å; R255-E278 PolarHBondContact NH1-OE1 2.91Å; R255-E278 IonicContact NH1-OE2 2.82Å; R255-E278 IonicContact NH2-OE1 3.18Å; R255-E278 PolarHBondContact NH2-OE1 3.37Å; T276-E278 VanDerWaalsContact C-N 3.25Å; T276-E278 WeakPolarHBondContact CB-OE2 3.35Å; T276-E278 PolarHBondContact OG1-OE2 3.45Å; E278-L280 VanDerWaalsContact C-N 3.29Å
279	D	69.3	Low	68.2	Low	35 Å²	35	83.4 Å²	83.4	19%	0.187	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-72.1	-18.7	168.2	-75.3	-55.2	0	0	0	113.5	L268 A275 T276 L277 E281 K282	L268-D279 HydrophobicContact CD1-CB 3.93Å; A275-D279 WeakPolarHBondContact CA-OD2 3.41Å; A275-D279 HydrophobicContact CB-CB 4.44Å; T276-D279 PolarHBondContact N-OD2 2.96Å; T276-D279 PolarHBondContact O-N 3.36Å; L277-D279 PolarHBondContact O-N 3.08Å; D279-E281 PolarHBondContact O-N 3.5Å; D279-K282 IonicContact OD1-NZ 3.27Å; D279-K282 PolarHBondContact OD1-NZ 3.34Å
280	L	65	Low	68.2	Low	31 Å²	31	87.8 Å²	87.8	16%	0.162	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-74.1	-11.5	-178.1	-60.5	175.3	0	0	0	113.8	Q261 K264 L268 L277 E278	Q261-L280 HydrophobicContact CB-CD1 4.48Å; K264-L280 HydrophobicContact CB-CD1 4.28Å; K264-L280 HydrophobicContact CB-CD2 3.4Å; K264-L280 HydrophobicContact CB-CG 4.48Å; K264-L280 HydrophobicContact CD-CD2 4.19Å; K264-L280 HydrophobicContact CG-CD2 4.46Å; L268-L280 HydrophobicContact CD1-CD2 3.58Å; L268-L280 HydrophobicContact CD1-CG 4.39Å; L268-L280 HydrophobicContact CG-CD2 4.19Å; L277-L280 HydrophobicContact CD2-CD1 4.24Å; L277-L280 HydrophobicContact CG-CD1 4.48Å; L277-L280 WeakPolarHBondContact O-CB 3.39Å; L277-L280 VanDerWaalsContact O-CG 3.31Å; L277-L280 WeakPolarHBondContact O-CG 3.34Å; L277-L280 PolarHBondContact O-N 3.34Å; E278-L280 VanDerWaalsContact C-N 3.29Å
281	E	61.9	Low	69	Low	162 Å²	162	87.3 Å²	87.3	76%	0.757	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-102.6	1.3	-171.3	-58.4	-176.7	168.1	0	0	112.4	D279	D279-E281 PolarHBondContact O-N 3.5Å
282	K	62.6	Low	70.1	Confident	119 Å²	119	80.6 Å²	80.6	52%	0.517	45%	0.445	S	S	.	.			trans	-77.2	129.1	-179.2	-70.2	171.6	179.5	171.3	0	111.5	D279 V285	D279-K282 IonicContact OD1-NZ 3.27Å; D279-K282 PolarHBondContact OD1-NZ 3.34Å; K282-V285 WeakPolarHBondContact O-CG2 3.38Å
283	P	42.5	Very low	70.6	Confident	133 Å²	133	80.5 Å²	80.5	86%	0.864	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	144.5	179.7	27.5	-34.3	0	0	0	111.8
284	G	53.5	Low	71	Confident	75 Å²	75	80.1 Å²	80.1	77%	0.773	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	-2	-178.4	0	0	0	0	0	115.7
285	V	52.5	Low	71.4	Confident	81 Å²	81	81.8 Å²	81.8	49%	0.491	43%	0.429	S	S	.	.	S	Bend	trans	-86	-19.8	-179.6	-179.6	0	0	0	0	113.3	K282	K282-V285 WeakPolarHBondContact O-CG2 3.38Å
286	D	51.4	Low	71.7	Confident	77 Å²	77	81.9 Å²	81.9	41%	0.412	43%	0.428	S	S	.	.			trans	-132.4	82.1	179.4	-85.2	-50.9	0	0	0	112	K264 K674	K264-D286 IonicContact NZ-OD2 2.73Å; K264-D286 PolarHBondContact NZ-OD2 2.91Å; D286-K674 IonicContact OD1-NZ 3.08Å; D286-K674 PolarHBondContact OD1-NZ 2.89Å
287	E	58.3	Low	71.5	Confident	181 Å²	181	86.2 Å²	86.2	85%	0.846	44%	0.444	S	S	*	.			trans	-82.1	113.6	149.5	-74.1	-168.7	158.8	0	0	108.2
288	E	71.7	Confident	71.5	Confident	116 Å²	116	88 Å²	88	54%	0.542	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-77.6	134.6	171.1	-77.4	-72.6	122.4	0	0	109.7	K674	E288-K674 VanDerWaalsContact OE1-CE 3.22Å; E288-K674 WeakPolarHBondContact OE1-CE 3.31Å; E288-K674 IonicContact OE1-NZ 3.52Å; E288-K674 PolarHBondContact OE1-NZ 3.17Å
289	P	82.7	Confident	71.9	Confident	29 Å²	29	83.8 Å²	83.8	19%	0.188	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-71.4	145.6	-176.2	29.9	-35.8	0	0	0	112.2	H291 L309 L312 A678	P289-H291 PolarHBondContact O-N 2.84Å; P289-L309 HydrophobicContact CB-CD2 3.89Å; P289-L309 HydrophobicContact CG-CD2 4.03Å; P289-L312 HydrophobicContact CB-CD1 3.85Å; P289-L312 HydrophobicContact CG-CD1 3.75Å; P289-A678 HydrophobicContact CG-CB 3.95Å
290	Q	81.4	Confident	71.9	Confident	119 Å²	119	87.5 Å²	87.5	56%	0.556	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-55.1	131.8	175.6	178.7	55.1	47.9	0	0	111.5	I305	Q290-I305 HydrophobicContact CB-CG1 4.46Å; Q290-I305 HydrophobicContact CG-CD1 3.96Å; Q290-I305 HydrophobicContact CG-CG1 3.8Å
291	H	91.3	Very high	72.4	Confident	102 Å²	102	88.4 Å²	88.4	47%	0.472	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-73.4	144.5	-178.3	-161.5	-72.5	0	0	0	112	P289 K677 A678	P289-H291 PolarHBondContact O-N 2.84Å; H291-K677 PolarHBondContact NE2-O 3.44Å; H291-A678 WeakPolarHBondContact CA-O 3.41Å
292	V	93.7	Very high	73.4	Confident	9 Å²	9	80.7 Å²	80.7	6%	0.055	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-53.1	137.2	169.5	168.1	0	0	0	0	110.8	I305 F306 L309 A678	V292-I305 HydrophobicContact CG2-CG2 4.44Å; V292-F306 HydrophobicContact CG1-CZ 3.95Å; V292-F306 HydrophobicContact CG2-CD1 4.32Å; V292-F306 HydrophobicContact CG2-CE1 3.62Å; V292-F306 HydrophobicContact CG2-CZ 3.78Å; V292-L309 HydrophobicContact CG2-CD1 3.74Å; V292-A678 WeakPolarHBondContact CG2-O 3.49Å; V292-A678 PolarHBondContact N-O 3.02Å
293	L	88.7	Confident	74.4	Confident	60 Å²	60	77 Å²	77	31%	0.314	40%	0.398	S	S	.	.			trans	-106.5	157.6	-178.2	-57	177.4	0	0	0	110.5	R295 Y296 I305 R687	L293-R295 VanDerWaalsContact CB-O 3.23Å; L293-R295 WeakPolarHBondContact CB-O 2.95Å; L293-Y296 HydrophobicContact CB-CE1 4.19Å; L293-Y296 HydrophobicContact CB-CE2 4.26Å; L293-Y296 PolarHBondContact N-OH 3.48Å; L293-Y296 WeakPolarHBondContact O-CE2 3.48Å; L293-Y296 PolarHBondContact O-OH 2.64Å; L293-I305 HydrophobicContact CD1-CD1 3.67Å; L293-I305 HydrophobicContact CG-CD1 3.91Å; L293-R687 WeakPolarHBondContact O-CD 3.43Å
294	L	90.9	Very high	76.2	Confident	77 Å²	77	76 Å²	76	40%	0.403	39%	0.385	S	S	.	.	S	Bend	trans	-75.8	-41.8	171.1	-65.7	179.7	0	0	0	111.5	R687 V690 L691	L294-R687 HydrophobicContact CD2-CG 4.22Å; L294-R687 PolarHBondContact O-NH1 3.02Å; L294-V690 HydrophobicContact CD1-CG1 3.92Å; L294-V690 HydrophobicContact CD2-CB 4.17Å; L294-V690 HydrophobicContact CD2-CG1 3.64Å; L294-V690 HydrophobicContact CG-CG1 4.46Å; L294-L691 HydrophobicContact CB-CD1 4.11Å; L294-L691 WeakPolarHBondContact O-CD1 3.4Å
295	R	87.3	Confident	77.7	Confident	128 Å²	128	73 Å²	73	48%	0.483	35%	0.352	S	S	.	.	S	Bend	trans	-117.5	148.3	177.1	-62.4	-171.2	176	105.8	-13.5	110.1	L293 L446 G447 E449 L691	L293-R295 VanDerWaalsContact CB-O 3.23Å; L293-R295 WeakPolarHBondContact CB-O 2.95Å; R295-L446 CarbonylContact C-O 3.59Å; R295-L446 VanDerWaalsContact CA-O 3.3Å; R295-L446 WeakPolarHBondContact CA-O 3.2Å; R295-G447 WeakPolarHBondContact CD-O 3.42Å; R295-G447 WeakPolarHBondContact CG-O 3.38Å; R295-G447 PolarHBondContact NE-O 2.87Å; R295-E449 IonicContact NH2-OE1 2.89Å; R295-L691 HydrophobicContact CG-CD1 3.96Å
296	Y	83.1	Confident	79.7	Confident	6 Å²	6	69.2 Å²	69.2	2%	0.024	33%	0.328	C	S	.	.			trans	-128.5	149.3	177.7	-64.1	-96.2	0	0	0	108.7	L293 Q301 Y302 I305 F306 L446 H448	L293-Y296 HydrophobicContact CB-CE1 4.19Å; L293-Y296 HydrophobicContact CB-CE2 4.26Å; L293-Y296 PolarHBondContact N-OH 3.48Å; L293-Y296 WeakPolarHBondContact O-CE2 3.48Å; L293-Y296 PolarHBondContact O-OH 2.64Å; Y296-Q301 VanDerWaalsContact CA-OE1 3.25Å; Y296-Y302 HydrophobicContact CD1-CD2 4.11Å; Y296-Y302 HydrophobicContact CD1-CG 4.43Å; Y296-Y302 AromaticContact CD2-CD2 3.87Å; Y296-Y302 HydrophobicContact CD2-CD2 3.87Å; Y296-Y302 AromaticContact CE1-CD2 3.99Å; Y296-Y302 HydrophobicContact CE1-CD2 3.99Å; Y296-Y302 HydrophobicContact CE1-CG 4.46Å; Y296-Y302 AromaticContact CE2-CD2 3.78Å; Y296-Y302 HydrophobicContact CE2-CD2 3.78Å; Y296-Y302 HydrophobicContact CE2-CE2 4.29Å; Y296-Y302 HydrophobicContact CG-CD2 4.04Å; Y296-Y302 AromaticContact CZ-CD2 3.84Å; Y296-I305 HydrophobicContact CD1-CD1 4.35Å; Y296-I305 HydrophobicContact CE1-CB 4.31Å; Y296-I305 HydrophobicContact CE1-CD1 3.86Å; Y296-F306 VanDerWaalsContact OH-CE2 3.24Å; Y296-F306 WeakPolarHBondContact OH-CE2 3.44Å; Y296-L446 PolarHBondContact N-O 2.72Å; Y296-H448 PolarHBondContact O-CD2 3.12Å; Y296-H448 PolarHBondContact O-NE2 2.85Å
297	E	73.6	Confident	81.6	Confident	157 Å²	157	66 Å²	66	73%	0.734	31%	0.313	S	S	*	.	S	Bend	trans	-74	-44.3	176.8	-70.6	168.6	-139.9	0	0	111.9	Q301 H448	E297-Q301 PolarHBondContact OE1-NE2 2.81Å; E297-Q301 VanDerWaalsContact OE1-NE2 3.11Å; E297-H448 PolarHBondContact O-CE1 3.23Å; E297-H448 PolarHBondContact O-NE2 2.9Å
298	D	71.1	Confident	83.1	Confident	62 Å²	62	60.4 Å²	60.4	33%	0.332	29%	0.293	S	S	.	.	S	Bend	trans	-149.4	177.5	177.4	71.8	15.2	0	0	0	111.9	Y300 Q301 Y302	D298-Y300 VanDerWaalsContact C-N 3.29Å; D298-Y300 PolarHBondContact O-N 2.88Å; D298-Y300 WeakPolarHBondContact OD1-CA 3.49Å; D298-Y300 WeakPolarHBondContact OD1-CB 3.44Å; D298-Y300 PolarHBondContact OD1-N 2.82Å; D298-Q301 PolarHBondContact OD1-N 2.84Å; D298-Y302 PolarHBondContact O-N 2.78Å
299	A	76.4	Confident	84.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-73.3	-14.9	177.3	0	0	0	0	0	114.3	Q303 F430 A431 Y442 L446	A299-Q303 WeakPolarHBondContact O-CB 3.33Å; A299-Q303 PolarHBondContact O-N 2.73Å; A299-F430 HydrophobicContact CB-CD1 3.6Å; A299-F430 HydrophobicContact CB-CE1 3.63Å; A299-F430 HydrophobicContact CB-CG 4.21Å; A299-F430 HydrophobicContact CB-CZ 4.24Å; A299-F430 WeakPolarHBondContact CB-O 3.34Å; A299-A431 HydrophobicContact CB-CB 4.24Å; A299-Y442 HydrophobicContact CB-CE2 3.61Å; A299-Y442 PolarHBondContact N-OH 2.73Å; A299-L446 HydrophobicContact CB-CD2 4.43Å
300	Y	69.5	Low	84.7	Confident	114 Å²	114	53.6 Å²	53.6	45%	0.447	26%	0.259	S	S	.	.	H	α-helix	trans	-75.4	-43.9	172.4	-69.1	-84.2	0	0	0	111.1	D298 Y302 Q303 N304 A431 V432	D298-Y300 VanDerWaalsContact C-N 3.29Å; D298-Y300 PolarHBondContact O-N 2.88Å; D298-Y300 WeakPolarHBondContact OD1-CA 3.49Å; D298-Y300 WeakPolarHBondContact OD1-CB 3.44Å; D298-Y300 PolarHBondContact OD1-N 2.82Å; Y300-Y302 VanDerWaalsContact C-N 3.28Å; Y300-Y302 PolarHBondContact O-N 2.97Å; Y300-Q303 PolarHBondContact O-N 2.78Å; Y300-N304 VanDerWaalsContact O-CB 3.31Å; Y300-N304 WeakPolarHBondContact O-CB 3.47Å; Y300-N304 PolarHBondContact O-N 3.22Å; Y300-N304 PolarHBondContact O-ND2 3.45Å; Y300-A431 HydrophobicContact CD1-CB 3.97Å; Y300-A431 HydrophobicContact CE1-CB 4.06Å; Y300-A431 VanDerWaalsContact CE2-O 3.29Å; Y300-A431 WeakPolarHBondContact CE2-O 3.15Å; Y300-A431 HydrophobicContact CG-CB 4.24Å; Y300-A431 VanDerWaalsContact CZ-O 3.24Å; Y300-A431 PolarHBondContact OH-O 2.63Å; Y300-V432 HydrophobicContact CE1-CG2 4.24Å
301	Q	76.6	Confident	85.2	Confident	49 Å²	49	53.8 Å²	53.8	23%	0.229	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-41.9	171.8	-168.7	-172.8	68.3	0	0	110.6	Y296 E297 D298 N304 I305	Y296-Q301 VanDerWaalsContact CA-OE1 3.25Å; E297-Q301 PolarHBondContact OE1-NE2 2.81Å; E297-Q301 VanDerWaalsContact OE1-NE2 3.11Å; D298-Q301 PolarHBondContact OD1-N 2.84Å; Q301-N304 PolarHBondContact O-N 2.84Å; Q301-I305 HydrophobicContact CG-CD1 4.35Å; Q301-I305 WeakPolarHBondContact O-CG1 3.15Å; Q301-I305 PolarHBondContact O-N 3.34Å; Q301-I305 VanDerWaalsContact O-N 3.08Å
302	Y	82.5	Confident	85.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.9	-47	172.9	-179	-88.5	0	0	0	112.6	Y296 D298 Y300 I305 F306 L427 F430 L446 E643 M647	Y296-Y302 HydrophobicContact CD1-CD2 4.11Å; Y296-Y302 HydrophobicContact CD1-CG 4.43Å; Y296-Y302 AromaticContact CD2-CD2 3.87Å; Y296-Y302 HydrophobicContact CD2-CD2 3.87Å; Y296-Y302 AromaticContact CE1-CD2 3.99Å; Y296-Y302 HydrophobicContact CE1-CD2 3.99Å; Y296-Y302 HydrophobicContact CE1-CG 4.46Å; Y296-Y302 AromaticContact CE2-CD2 3.78Å; Y296-Y302 HydrophobicContact CE2-CD2 3.78Å; Y296-Y302 HydrophobicContact CE2-CE2 4.29Å; Y296-Y302 HydrophobicContact CG-CD2 4.04Å; Y296-Y302 AromaticContact CZ-CD2 3.84Å; D298-Y302 PolarHBondContact O-N 2.78Å; Y300-Y302 VanDerWaalsContact C-N 3.28Å; Y300-Y302 PolarHBondContact O-N 2.97Å; Y302-I305 PolarHBondContact O-N 3.41Å; Y302-F306 HydrophobicContact CD1-CD2 4.23Å; Y302-F306 AromaticContact CD2-CD2 3.95Å; Y302-F306 HydrophobicContact CD2-CD2 3.95Å; Y302-F306 AromaticContact CD2-CE2 3.92Å; Y302-F306 HydrophobicContact CD2-CE2 3.92Å; Y302-F306 HydrophobicContact CE1-CD2 4.03Å; Y302-F306 AromaticContact CE2-CD2 3.73Å; Y302-F306 HydrophobicContact CE2-CD2 3.73Å; Y302-F306 AromaticContact CE2-CE2 3.46Å; Y302-F306 HydrophobicContact CE2-CE2 3.46Å; Y302-F306 VanDerWaalsContact CE2-CE2 3.46Å; Y302-F306 HydrophobicContact CG-CD2 4.2Å; Y302-F306 AromaticContact CZ-CD2 3.77Å; Y302-F306 AromaticContact CZ-CE2 3.81Å; Y302-F306 PolarHBondContact O-N 2.82Å; Y302-L427 HydrophobicContact CD1-CD2 4.08Å; Y302-L427 HydrophobicContact CE1-CD2 3.54Å; Y302-F430 AromaticContact CD1-CD1 3.6Å; Y302-F430 HydrophobicContact CD1-CD1 3.6Å; Y302-F430 AromaticContact CD1-CE1 3.68Å; Y302-F430 HydrophobicContact CD1-CE1 3.68Å; Y302-F430 HydrophobicContact CD2-CE1 4.49Å; Y302-F430 AromaticContact CE1-CD1 3.77Å; Y302-F430 HydrophobicContact CE1-CD1 3.77Å; Y302-F430 AromaticContact CE1-CE1 3.89Å; Y302-F430 HydrophobicContact CE1-CE1 3.89Å; Y302-F430 HydrophobicContact CG-CD1 4.35Å; Y302-F430 AromaticContact CG-CE1 4Å; Y302-F430 HydrophobicContact CG-CE1 4Å; Y302-L446 HydrophobicContact CD2-CD2 4.4Å; Y302-L446 HydrophobicContact CG-CD2 4.38Å; Y302-E643 WeakPolarHBondContact CE2-OE1 3.46Å; Y302-E643 VanDerWaalsContact OH-CG 3.25Å; Y302-E643 WeakPolarHBondContact OH-CG 3.39Å; Y302-E643 PolarHBondContact OH-OE1 3.25Å; Y302-E643 VanDerWaalsContact OH-OE1 3.08Å; Y302-M647 WeakPolarHBondContact OH-CG 3.28Å
303	Q	84.6	Confident	85.1	Confident	42 Å²	42	52.2 Å²	52.2	20%	0.196	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-42.3	173.8	179.3	-179.9	4.9	0	0	112	A299 Y300 I305 G307 L427 A431	A299-Q303 WeakPolarHBondContact O-CB 3.33Å; A299-Q303 PolarHBondContact O-N 2.73Å; Y300-Q303 PolarHBondContact O-N 2.78Å; Q303-I305 PolarHBondContact O-N 3.26Å; Q303-G307 WeakPolarHBondContact O-CA 3.4Å; Q303-G307 PolarHBondContact O-N 2.9Å; Q303-L427 HydrophobicContact CB-CB 4.49Å; Q303-L427 HydrophobicContact CG-CB 4.13Å; Q303-A431 HydrophobicContact CB-CB 4.32Å; Q303-A431 VanDerWaalsContact OE1-CB 3.31Å
304	N	78.8	Confident	85.2	Confident	111 Å²	111	49.8 Å²	49.8	59%	0.594	24%	0.24	S	C	*	.	H	α-helix	trans	-68	-23.5	-177.3	-71.2	-20.8	0	0	0	112.9	Y300 Q301 P308	Y300-N304 VanDerWaalsContact O-CB 3.31Å; Y300-N304 WeakPolarHBondContact O-CB 3.47Å; Y300-N304 PolarHBondContact O-N 3.22Å; Y300-N304 PolarHBondContact O-ND2 3.45Å; Q301-N304 PolarHBondContact O-N 2.84Å; N304-P308 WeakPolarHBondContact O-CD 3.29Å; N304-P308 VanDerWaalsContact O-CG 3.25Å; N304-P308 WeakPolarHBondContact O-CG 3.35Å
305	I	86.2	Confident	84.9	Confident	13 Å²	13	50 Å²	50	7%	0.067	24%	0.242	C	C	.	.	H	α-helix	trans	-88.8	-51.1	174.2	-67.8	172.9	0	0	0	110.9	Q290 V292 L293 Y296 Q301 Y302 Q303 L309	Q290-I305 HydrophobicContact CB-CG1 4.46Å; Q290-I305 HydrophobicContact CG-CD1 3.96Å; Q290-I305 HydrophobicContact CG-CG1 3.8Å; V292-I305 HydrophobicContact CG2-CG2 4.44Å; L293-I305 HydrophobicContact CD1-CD1 3.67Å; L293-I305 HydrophobicContact CG-CD1 3.91Å; Y296-I305 HydrophobicContact CD1-CD1 4.35Å; Y296-I305 HydrophobicContact CE1-CB 4.31Å; Y296-I305 HydrophobicContact CE1-CD1 3.86Å; Q301-I305 HydrophobicContact CG-CD1 4.35Å; Q301-I305 WeakPolarHBondContact O-CG1 3.15Å; Q301-I305 PolarHBondContact O-N 3.34Å; Q301-I305 VanDerWaalsContact O-N 3.08Å; Y302-I305 PolarHBondContact O-N 3.41Å; Q303-I305 PolarHBondContact O-N 3.26Å; I305-L309 HydrophobicContact CG2-CD1 4.47Å; I305-L309 WeakPolarHBondContact O-CG 3.4Å
306	F	93.7	Very high	84.9	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-73.9	-29.1	-177.8	-81.6	-68.4	0	0	0	114.2	V292 Y296 Y302 L309 V310 L427 E643 P644 L680	V292-F306 HydrophobicContact CG1-CZ 3.95Å; V292-F306 HydrophobicContact CG2-CD1 4.32Å; V292-F306 HydrophobicContact CG2-CE1 3.62Å; V292-F306 HydrophobicContact CG2-CZ 3.78Å; Y296-F306 VanDerWaalsContact OH-CE2 3.24Å; Y296-F306 WeakPolarHBondContact OH-CE2 3.44Å; Y302-F306 HydrophobicContact CD1-CD2 4.23Å; Y302-F306 AromaticContact CD2-CD2 3.95Å; Y302-F306 HydrophobicContact CD2-CD2 3.95Å; Y302-F306 AromaticContact CD2-CE2 3.92Å; Y302-F306 HydrophobicContact CD2-CE2 3.92Å; Y302-F306 HydrophobicContact CE1-CD2 4.03Å; Y302-F306 AromaticContact CE2-CD2 3.73Å; Y302-F306 HydrophobicContact CE2-CD2 3.73Å; Y302-F306 AromaticContact CE2-CE2 3.46Å; Y302-F306 HydrophobicContact CE2-CE2 3.46Å; Y302-F306 VanDerWaalsContact CE2-CE2 3.46Å; Y302-F306 HydrophobicContact CG-CD2 4.2Å; Y302-F306 AromaticContact CZ-CD2 3.77Å; Y302-F306 AromaticContact CZ-CE2 3.81Å; Y302-F306 PolarHBondContact O-N 2.82Å; F306-L309 HydrophobicContact CD1-CD1 4.45Å; F306-L309 PolarHBondContact O-N 2.72Å; F306-V310 WeakPolarHBondContact O-CG2 3.39Å; F306-V310 PolarHBondContact O-N 3.3Å; F306-L427 HydrophobicContact CB-CD1 3.73Å; F306-L427 HydrophobicContact CB-CD2 3.95Å; F306-E643 HydrophobicContact CE1-CB 4.07Å; F306-E643 HydrophobicContact CE1-CG 4.3Å; F306-E643 HydrophobicContact CE2-CG 4.08Å; F306-E643 HydrophobicContact CZ-CB 3.94Å; F306-E643 HydrophobicContact CZ-CG 3.76Å; F306-P644 HydrophobicContact CB-CG 3.98Å; F306-P644 HydrophobicContact CD1-CG 3.53Å; F306-P644 HydrophobicContact CE1-CG 4.23Å; F306-P644 HydrophobicContact CG-CG 3.92Å; F306-L680 HydrophobicContact CD1-CD1 4.26Å
307	G	90.8	Very high	84.9	Confident	9 Å²	9	49 Å²	49	9%	0.093	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-52.6	-179	0	0	0	0	0	113.4	Q303 L309 V310 K311 Q424	Q303-G307 WeakPolarHBondContact O-CA 3.4Å; Q303-G307 PolarHBondContact O-N 2.9Å; G307-L309 VanDerWaalsContact C-N 3.32Å; G307-L309 PolarHBondContact O-N 2.73Å; G307-V310 PolarHBondContact O-N 3.28Å; G307-K311 PolarHBondContact O-N 2.76Å; G307-Q424 PolarHBondContact O-NE2 3.12Å
308	P	90.5	Very high	85.3	Confident	64 Å²	64	45.2 Å²	45.2	42%	0.416	22%	0.222	S	C	.	.	H	α-helix	trans	-58.6	-39.2	172.7	-27.7	36.9	0	0	0	113.5	N304 K311 L312	N304-P308 WeakPolarHBondContact O-CD 3.29Å; N304-P308 VanDerWaalsContact O-CG 3.25Å; N304-P308 WeakPolarHBondContact O-CG 3.35Å; P308-K311 WeakPolarHBondContact O-CB 3.21Å; P308-K311 PolarHBondContact O-N 2.64Å; P308-L312 WeakPolarHBondContact O-CG 3.42Å; P308-L312 PolarHBondContact O-N 3.2Å
309	L	93.4	Very high	85.6	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-44	178.3	-61.5	176.6	0	0	0	112.1	P289 V292 I305 F306 G307 K311 L312 E313 A675 A678 L680	P289-L309 HydrophobicContact CB-CD2 3.89Å; P289-L309 HydrophobicContact CG-CD2 4.03Å; V292-L309 HydrophobicContact CG2-CD1 3.74Å; I305-L309 HydrophobicContact CG2-CD1 4.47Å; I305-L309 WeakPolarHBondContact O-CG 3.4Å; F306-L309 HydrophobicContact CD1-CD1 4.45Å; F306-L309 PolarHBondContact O-N 2.72Å; G307-L309 VanDerWaalsContact C-N 3.32Å; G307-L309 PolarHBondContact O-N 2.73Å; L309-K311 VanDerWaalsContact C-N 3.28Å; L309-K311 PolarHBondContact O-N 2.66Å; L309-L312 PolarHBondContact O-N 3.03Å; L309-E313 PolarHBondContact O-N 2.98Å; L309-E313 VanDerWaalsContact O-N 3.09Å; L309-A675 HydrophobicContact CD2-CB 4.4Å; L309-A678 HydrophobicContact CD2-CB 3.58Å; L309-L680 HydrophobicContact CB-CB 4.35Å; L309-L680 HydrophobicContact CB-CD1 4.32Å; L309-L680 HydrophobicContact CB-CD2 4.27Å
310	V	95.5	Very high	85.6	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-35.3	173.8	171.4	0	0	0	0	111.2	F306 G307 A314 F420 M423 Q424 L427 P644 L680	F306-V310 WeakPolarHBondContact O-CG2 3.39Å; F306-V310 PolarHBondContact O-N 3.3Å; G307-V310 PolarHBondContact O-N 3.28Å; V310-A314 WeakPolarHBondContact O-CB 3.49Å; V310-A314 PolarHBondContact O-N 2.89Å; V310-F420 HydrophobicContact CG1-CB 4.31Å; V310-F420 HydrophobicContact CG1-CD1 4.21Å; V310-M423 HydrophobicContact CG1-CB 4.08Å; V310-M423 HydrophobicContact CG1-CE 4.2Å; V310-Q424 HydrophobicContact CG1-CG 3.94Å; V310-L427 HydrophobicContact CG2-CD1 4.35Å; V310-P644 HydrophobicContact CG2-CB 3.65Å; V310-P644 HydrophobicContact CG2-CG 3.61Å; V310-L680 HydrophobicContact CG2-CD1 4.43Å
311	K	91.3	Very high	85.8	Confident	123 Å²	123	42.6 Å²	42.6	54%	0.535	21%	0.21	S	C	.	.	H	α-helix	trans	-67.4	-46.2	174.3	-174.3	-173.4	171.2	-166.2	0	111.8	G307 P308 L309 E313 A314 D315	G307-K311 PolarHBondContact O-N 2.76Å; P308-K311 WeakPolarHBondContact O-CB 3.21Å; P308-K311 PolarHBondContact O-N 2.64Å; L309-K311 VanDerWaalsContact C-N 3.28Å; L309-K311 PolarHBondContact O-N 2.66Å; K311-E313 VanDerWaalsContact C-N 3.26Å; K311-E313 PolarHBondContact O-N 2.82Å; K311-A314 WeakPolarHBondContact O-CB 3.14Å; K311-A314 PolarHBondContact O-N 2.84Å; K311-A314 VanDerWaalsContact O-N 3.09Å; K311-D315 WeakPolarHBondContact CE-OD2 3.25Å; K311-D315 WeakPolarHBondContact CG-OD2 3.49Å; K311-D315 PolarHBondContact O-N 3.24Å
312	L	89.9	Confident	85.7	Confident	60 Å²	60	45.2 Å²	45.2	31%	0.314	22%	0.223	S	C	.	.	H	α-helix	trans	-59.9	-34.9	177.7	-75.9	172.8	0	0	0	112.7	P289 P308 L309 Y316 A675	P289-L312 HydrophobicContact CB-CD1 3.85Å; P289-L312 HydrophobicContact CG-CD1 3.75Å; P308-L312 WeakPolarHBondContact O-CG 3.42Å; P308-L312 PolarHBondContact O-N 3.2Å; L309-L312 PolarHBondContact O-N 3.03Å; L312-Y316 VanDerWaalsContact O-CB 3.25Å; L312-Y316 WeakPolarHBondContact O-CB 3.47Å; L312-Y316 PolarHBondContact O-N 2.93Å; L312-A675 HydrophobicContact CB-CB 4.19Å
313	E	92.4	Very high	85.1	Confident	19 Å²	19	49.1 Å²	49.1	9%	0.089	25%	0.25	C	S	.	.	H	α-helix	trans	-72.5	-42.1	172.1	-173.5	66.4	-174.3	0	0	111.8	L309 K311 Y316 D317 F420 V670 M671 C672 L680	L309-E313 PolarHBondContact O-N 2.98Å; L309-E313 VanDerWaalsContact O-N 3.09Å; K311-E313 VanDerWaalsContact C-N 3.26Å; K311-E313 PolarHBondContact O-N 2.82Å; E313-Y316 PolarHBondContact O-N 2.8Å; E313-D317 WeakPolarHBondContact O-CB 3.35Å; E313-D317 PolarHBondContact O-N 2.96Å; E313-F420 HydrophobicContact CB-CE1 4.19Å; E313-F420 HydrophobicContact CG-CE1 3.81Å; E313-F420 HydrophobicContact CG-CZ 4.37Å; E313-V670 VanDerWaalsContact OE2-CG1 3.25Å; E313-V670 WeakPolarHBondContact OE2-CG1 3.46Å; E313-M671 WeakPolarHBondContact OE1-CB 3.48Å; E313-M671 PolarHBondContact OE1-N 3.28Å; E313-M671 PolarHBondContact OE2-N 3.08Å; E313-C672 WeakPolarHBondContact OE2-CA 3.49Å; E313-C672 WeakPolarHBondContact OE2-CB 3.14Å; E313-C672 PolarHBondContact OE2-N 2.68Å; E313-L680 HydrophobicContact CB-CD2 3.98Å
314	A	90.5	Very high	84.4	Confident	9 Å²	9	47.9 Å²	47.9	7%	0.074	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-47.3	179.5	0	0	0	0	0	112.9	V310 K311 Y316 K318 W415 F420	V310-A314 WeakPolarHBondContact O-CB 3.49Å; V310-A314 PolarHBondContact O-N 2.89Å; K311-A314 WeakPolarHBondContact O-CB 3.14Å; K311-A314 PolarHBondContact O-N 2.84Å; K311-A314 VanDerWaalsContact O-N 3.09Å; A314-Y316 VanDerWaalsContact C-N 3.3Å; A314-Y316 PolarHBondContact O-N 3.15Å; A314-K318 VanDerWaalsContact O-CB 3.26Å; A314-K318 WeakPolarHBondContact O-CB 3.38Å; A314-K318 PolarHBondContact O-N 3.33Å; A314-W415 HydrophobicContact CB-CZ2 4.36Å; A314-F420 HydrophobicContact CB-CB 3.76Å; A314-F420 HydrophobicContact CB-CD1 3.61Å; A314-F420 HydrophobicContact CB-CD2 3.79Å; A314-F420 HydrophobicContact CB-CE1 4.13Å; A314-F420 HydrophobicContact CB-CE2 4.28Å; A314-F420 HydrophobicContact CB-CG 3.43Å; A314-F420 VanDerWaalsContact CB-CG 3.43Å; A314-F420 HydrophobicContact CB-CZ 4.43Å
315	D	86.1	Confident	84.3	Confident	82 Å²	82	44.7 Å²	44.7	44%	0.439	23%	0.229	S	C	.	.	H	α-helix	trans	-67.2	-33.6	179.1	-70.2	-26.4	0	0	0	111	K311 K319	K311-D315 WeakPolarHBondContact CE-OD2 3.25Å; K311-D315 WeakPolarHBondContact CG-OD2 3.49Å; K311-D315 PolarHBondContact O-N 3.24Å; D315-K319 WeakPolarHBondContact O-CB 3.44Å; D315-K319 PolarHBondContact O-N 2.65Å
316	Y	86	Confident	84.1	Confident	83 Å²	83	46 Å²	46	33%	0.325	24%	0.235	S	C	.	.	H	α-helix	trans	-70.6	-48.6	174.9	-167.2	-87.5	0	0	0	112.5	L312 E313 A314 K318 K319 L320 M671 C672	L312-Y316 VanDerWaalsContact O-CB 3.25Å; L312-Y316 WeakPolarHBondContact O-CB 3.47Å; L312-Y316 PolarHBondContact O-N 2.93Å; E313-Y316 PolarHBondContact O-N 2.8Å; A314-Y316 VanDerWaalsContact C-N 3.3Å; A314-Y316 PolarHBondContact O-N 3.15Å; Y316-K318 VanDerWaalsContact C-N 3.31Å; Y316-K318 PolarHBondContact O-N 3.18Å; Y316-K319 PolarHBondContact O-N 3.12Å; Y316-L320 VanDerWaalsContact O-CB 3.22Å; Y316-L320 WeakPolarHBondContact O-CB 3.33Å; Y316-L320 PolarHBondContact O-N 3.15Å; Y316-M671 HydrophobicContact CD1-CB 3.77Å; Y316-M671 HydrophobicContact CE1-CB 3.85Å; Y316-C672 HydrophobicContact CD1-CB 4.39Å; Y316-C672 HydrophobicContact CD2-CB 4.32Å; Y316-C672 HydrophobicContact CG-CB 3.94Å
317	D	82.8	Confident	83.5	Confident	30 Å²	30	49.9 Å²	49.9	16%	0.16	26%	0.256	C	S	.	.	H	α-helix	trans	-61.3	-40.2	175.2	175.9	61.4	0	0	0	111.1	E313 L320 K321 W415 F420	E313-D317 WeakPolarHBondContact O-CB 3.35Å; E313-D317 PolarHBondContact O-N 2.96Å; D317-L320 PolarHBondContact O-N 2.89Å; D317-K321 WeakPolarHBondContact O-CB 3.44Å; D317-K321 VanDerWaalsContact O-CG 3.24Å; D317-K321 WeakPolarHBondContact O-CG 3.47Å; D317-K321 PolarHBondContact O-N 2.89Å; D317-W415 PolarHBondContact OD2-NE1 2.79Å; D317-F420 HydrophobicContact CB-CE2 4.32Å; D317-F420 HydrophobicContact CB-CZ 4.03Å
318	K	82.4	Confident	83.2	Confident	77 Å²	77	54.7 Å²	54.7	34%	0.335	28%	0.279	S	S	.	.	H	α-helix	trans	-57.5	-56.6	173.2	-175.7	-175.7	172.2	-166	0	111.6	A314 Y316 L320 K321 E322 W415	A314-K318 VanDerWaalsContact O-CB 3.26Å; A314-K318 WeakPolarHBondContact O-CB 3.38Å; A314-K318 PolarHBondContact O-N 3.33Å; Y316-K318 VanDerWaalsContact C-N 3.31Å; Y316-K318 PolarHBondContact O-N 3.18Å; K318-L320 PolarHBondContact O-N 3.29Å; K318-K321 PolarHBondContact O-N 2.74Å; K318-K321 VanDerWaalsContact O-N 3.13Å; K318-E322 WeakPolarHBondContact CE-OE1 3.02Å; K318-E322 WeakPolarHBondContact CE-OE2 3.14Å; K318-E322 HydrophobicContact CG-CG 4.34Å; K318-E322 IonicContact NZ-OE1 3.66Å; K318-E322 WeakPolarHBondContact O-CB 3.44Å; K318-E322 WeakPolarHBondContact O-CG 3.48Å; K318-E322 PolarHBondContact O-N 3.37Å; K318-W415 HydrophobicContact CB-CD2 3.7Å; K318-W415 HydrophobicContact CB-CE3 4.11Å; K318-W415 HydrophobicContact CB-CG 4.09Å; K318-W415 HydrophobicContact CB-CH2 4.25Å; K318-W415 HydrophobicContact CB-CZ2 3.9Å; K318-W415 HydrophobicContact CB-CZ3 4.36Å; K318-W415 HydrophobicContact CD-CD2 4.34Å; K318-W415 HydrophobicContact CD-CE3 3.88Å; K318-W415 HydrophobicContact CD-CH2 4.33Å; K318-W415 HydrophobicContact CD-CZ3 3.87Å; K318-W415 HydrophobicContact CG-CD2 3.7Å; K318-W415 HydrophobicContact CG-CE3 3.73Å; K318-W415 HydrophobicContact CG-CG 4.07Å; K318-W415 HydrophobicContact CG-CZ3 4.16Å
319	K	78.6	Confident	83.1	Confident	79 Å²	79	51.9 Å²	51.9	34%	0.343	26%	0.26	S	S	.	.	H	α-helix	trans	-60.6	-36	179.8	-170.7	174.4	-179.9	-179.1	0	111.4	E271 D315 Y316 S323	E271-K319 IonicContact OE1-NZ 3.76Å; E271-K319 PolarHBondContact OE1-NZ 2.84Å; D315-K319 WeakPolarHBondContact O-CB 3.44Å; D315-K319 PolarHBondContact O-N 2.65Å; Y316-K319 PolarHBondContact O-N 3.12Å; K319-S323 VanDerWaalsContact O-CB 3.25Å; K319-S323 WeakPolarHBondContact O-CB 3.45Å; K319-S323 PolarHBondContact O-N 3.15Å; K319-S323 VanDerWaalsContact O-N 3.12Å; K319-S323 PolarHBondContact O-OG 2.62Å
320	L	75.7	Confident	83	Confident	14 Å²	14	55.3 Å²	55.3	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-47.3	173.4	179.3	59.4	0	0	0	111.7	Y316 D317 K318 S323 Q324 D353	Y316-L320 VanDerWaalsContact O-CB 3.22Å; Y316-L320 WeakPolarHBondContact O-CB 3.33Å; Y316-L320 PolarHBondContact O-N 3.15Å; D317-L320 PolarHBondContact O-N 2.89Å; K318-L320 PolarHBondContact O-N 3.29Å; L320-S323 PolarHBondContact O-OG 3.34Å; L320-Q324 WeakPolarHBondContact O-CG 3.46Å; L320-Q324 PolarHBondContact O-NE2 3.45Å; L320-D353 HydrophobicContact CD2-CB 4.43Å
321	K	73.4	Confident	83	Confident	28 Å²	28	55.3 Å²	55.3	12%	0.122	28%	0.282	C	S	.	.	H	α-helix	trans	-66.9	-45.2	179.1	-70	-127.4	176	-149.6	0	112.7	D317 K318 S323 Q324 M354 D360 W415	D317-K321 WeakPolarHBondContact O-CB 3.44Å; D317-K321 VanDerWaalsContact O-CG 3.24Å; D317-K321 WeakPolarHBondContact O-CG 3.47Å; D317-K321 PolarHBondContact O-N 2.89Å; K318-K321 PolarHBondContact O-N 2.74Å; K318-K321 VanDerWaalsContact O-N 3.13Å; K321-S323 VanDerWaalsContact C-N 3.33Å; K321-S323 PolarHBondContact O-N 2.72Å; K321-Q324 PolarHBondContact O-N 2.91Å; K321-M354 HydrophobicContact CB-SD 4.28Å; K321-M354 HydrophobicContact CD-CG 4.27Å; K321-M354 HydrophobicContact CD-SD 3.35Å; K321-M354 WeakPolarHBondContact CD-SD 3.41Å; K321-M354 WeakPolarHBondContact CE-SD 3.39Å; K321-M354 HydrophobicContact CG-CG 4.47Å; K321-M354 HydrophobicContact CG-SD 3.55Å; K321-M354 VanDerWaalsContact CG-SD 3.55Å; K321-M354 PolarHBondContact NZ-SD 3.13Å; K321-M354 VanDerWaalsContact NZ-SD 3.38Å; K321-D360 IonicContact NZ-OD2 3.8Å; K321-W415 HydrophobicContact CB-CB 4.12Å; K321-W415 HydrophobicContact CB-CG 4.48Å
322	E	74.2	Confident	83.1	Confident	104 Å²	104	54.2 Å²	54.2	49%	0.486	27%	0.274	S	S	.	.	H	α-helix	trans	-69.1	-29.8	-178.3	-68.9	177.5	167.1	0	0	112.1	K318 Q324	K318-E322 WeakPolarHBondContact CE-OE1 3.02Å; K318-E322 WeakPolarHBondContact CE-OE2 3.14Å; K318-E322 HydrophobicContact CG-CG 4.34Å; K318-E322 IonicContact NZ-OE1 3.66Å; K318-E322 WeakPolarHBondContact O-CB 3.44Å; K318-E322 WeakPolarHBondContact O-CG 3.48Å; K318-E322 PolarHBondContact O-N 3.37Å; E322-Q324 PolarHBondContact O-N 2.82Å
323	S	70	Confident	83.4	Confident	82 Å²	82	53 Å²	53	57%	0.573	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	4.6	174	61.5	0	0	0	0	115.4	K319 L320 K321	K319-S323 VanDerWaalsContact O-CB 3.25Å; K319-S323 WeakPolarHBondContact O-CB 3.45Å; K319-S323 PolarHBondContact O-N 3.15Å; K319-S323 VanDerWaalsContact O-N 3.12Å; K319-S323 PolarHBondContact O-OG 2.62Å; L320-S323 PolarHBondContact O-OG 3.34Å; K321-S323 VanDerWaalsContact C-N 3.33Å; K321-S323 PolarHBondContact O-N 2.72Å
324	Q	69.7	Low	83.4	Confident	15 Å²	15	55.1 Å²	55.1	7%	0.07	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	4	-175.3	-74	175	70	0	0	115.3	L320 K321 E322 Q326 S352 F413	L320-Q324 WeakPolarHBondContact O-CG 3.46Å; L320-Q324 PolarHBondContact O-NE2 3.45Å; K321-Q324 PolarHBondContact O-N 2.91Å; E322-Q324 PolarHBondContact O-N 2.82Å; Q324-Q326 WeakPolarHBondContact O-CG 3.38Å; Q324-Q326 PolarHBondContact O-N 2.86Å; Q324-Q326 PolarHBondContact O-NE2 3.33Å; Q324-S352 PolarHBondContact NE2-OG 2.79Å; Q324-S352 VanDerWaalsContact NE2-OG 3.1Å; Q324-S352 PolarHBondContact OE1-OG 3.42Å; Q324-F413 HydrophobicContact CB-CD2 3.61Å; Q324-F413 HydrophobicContact CB-CE2 3.74Å; Q324-F413 WeakPolarHBondContact O-CE2 3.38Å
325	T	77.6	Confident	83.3	Confident	45 Å²	45	59 Å²	59	28%	0.276	30%	0.297	S	S	.	.			trans	-46.2	126	171.7	-76.4	0	0	0	0	111.3	Q410 V411 D412	T325-Q410 HydrophobicContact CG2-CG 3.69Å; T325-V411 WeakPolarHBondContact CA-O 3.38Å; T325-D412 WeakPolarHBondContact CB-OD1 3.38Å; T325-D412 WeakPolarHBondContact CG2-OD1 3.48Å; T325-D412 PolarHBondContact OG1-OD1 2.98Å
326	Q	80.9	Confident	83	Confident	40 Å²	40	55.8 Å²	55.8	19%	0.187	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.3	177.8	-58.5	-59.1	-80.1	0	0	109.7	Q324 I329 L347 Q410 V411	Q324-Q326 WeakPolarHBondContact O-CG 3.38Å; Q324-Q326 PolarHBondContact O-N 2.86Å; Q324-Q326 PolarHBondContact O-NE2 3.33Å; Q326-I329 HydrophobicContact CB-CD1 3.91Å; Q326-I329 HydrophobicContact CB-CG1 4.1Å; Q326-L347 HydrophobicContact CB-CD2 4.13Å; Q326-L347 HydrophobicContact CG-CD2 4.09Å; Q326-Q410 CarbonylContact O-C 3.5Å; Q326-Q410 WeakPolarHBondContact O-CA 3.29Å; Q326-V411 PolarHBondContact N-O 3.08Å; Q326-V411 PolarHBondContact O-N 2.77Å
327	D	82.1	Confident	82.7	Confident	83 Å²	83	60.8 Å²	60.8	44%	0.444	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	164.1	175.2	-82.4	-78.3	0	0	0	111.7	I329 K367 Q410	D327-I329 PolarHBondContact O-N 2.92Å; D327-K367 WeakPolarHBondContact OD1-CD 3.15Å; D327-K367 WeakPolarHBondContact OD1-CE 3.34Å; D327-K367 IonicContact OD1-NZ 3.21Å; D327-K367 PolarHBondContact OD1-NZ 3.35Å; D327-K367 IonicContact OD2-NZ 3.59Å; D327-Q410 WeakPolarHBondContact OD1-CB 3.42Å; D327-Q410 VanDerWaalsContact OD1-CG 3.32Å; D327-Q410 WeakPolarHBondContact OD1-CG 3.46Å; D327-Q410 PolarHBondContact OD1-NE2 3.28Å; D327-Q410 VanDerWaalsContact OD1-NE2 3.17Å; D327-Q410 PolarHBondContact OD2-NE2 2.86Å
328	N	84.8	Confident	82.3	Confident	109 Å²	109	63.5 Å²	63.5	58%	0.583	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.8	48.8	-176.7	-163.7	18	0	0	0	114.4	N408 F409	N328-N408 PolarHBondContact OD1-OD1 3.26Å; N328-F409 PolarHBondContact N-O 2.89Å; N328-F409 VanDerWaalsContact N-O 3.1Å
329	I	88.9	Confident	82.2	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.026	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.4	173.2	-61.7	-55.4	0	0	0	110.2	Q326 D327 V331 F345 L347 F409 V411	Q326-I329 HydrophobicContact CB-CD1 3.91Å; Q326-I329 HydrophobicContact CB-CG1 4.1Å; D327-I329 PolarHBondContact O-N 2.92Å; I329-V331 HydrophobicContact CG2-CG2 4.37Å; I329-F345 HydrophobicContact CG2-CB 3.56Å; I329-F345 HydrophobicContact CG2-CD2 4.2Å; I329-F345 HydrophobicContact CG2-CG 4.02Å; I329-L347 HydrophobicContact CD1-CD2 3.64Å; I329-L347 HydrophobicContact CG1-CD2 4.02Å; I329-F409 HydrophobicContact CB-CB 4.36Å; I329-F409 PolarHBondContact N-O 3.08Å; I329-F409 WeakPolarHBondContact O-CB 3.42Å; I329-F409 PolarHBondContact O-N 3.46Å; I329-F409 VanDerWaalsContact O-N 3.14Å; I329-V411 HydrophobicContact CB-CG2 4.23Å; I329-V411 HydrophobicContact CG1-CB 4.37Å; I329-V411 HydrophobicContact CG1-CG2 3.93Å; I329-V411 HydrophobicContact CG2-CG2 4.08Å
330	T	90.8	Very high	82.4	Confident	73 Å²	73	67.1 Å²	67.1	45%	0.448	34%	0.344	S	S	.	.			trans	-87.9	131.2	167.6	-55.4	0	0	0	0	109.8	F345 T406 H407	T330-F345 WeakPolarHBondContact O-CB 3.46Å; T330-T406 CarbonylContact C-O 3.54Å; T330-T406 WeakPolarHBondContact CA-O 3.32Å; T330-T406 VanDerWaalsContact CG2-O 3.31Å; T330-T406 WeakPolarHBondContact CG2-O 3.43Å; T330-H407 PolarHBondContact OG1-CD2 3.02Å
331	V	94.5	Very high	83.1	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.012	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.7	-178.3	176	0	0	0	0	110.3	I329 W333 A343 Y344 F345 L364 T406 F409	I329-V331 HydrophobicContact CG2-CG2 4.37Å; V331-W333 HydrophobicContact CG1-CD2 4.03Å; V331-W333 HydrophobicContact CG1-CG 4.37Å; V331-W333 HydrophobicContact CG1-CZ2 4.24Å; V331-A343 HydrophobicContact CG1-CB 3.78Å; V331-Y344 CarbonylContact C-O 3.55Å; V331-Y344 WeakPolarHBondContact CA-O 3.33Å; V331-F345 HydrophobicContact CG2-CB 4.38Å; V331-L364 HydrophobicContact CG2-CD1 4.03Å; V331-L364 HydrophobicContact CG2-CD2 4.28Å; V331-T406 PolarHBondContact N-O 2.77Å; V331-T406 WeakPolarHBondContact O-CB 3.22Å; V331-F409 HydrophobicContact CB-CD2 3.85Å; V331-F409 HydrophobicContact CB-CE2 3.93Å; V331-F409 HydrophobicContact CB-CG 4.34Å; V331-F409 HydrophobicContact CB-CZ 4.48Å; V331-F409 HydrophobicContact CG2-CB 3.84Å; V331-F409 HydrophobicContact CG2-CD1 4.11Å; V331-F409 HydrophobicContact CG2-CD2 3.51Å; V331-F409 HydrophobicContact CG2-CE2 4.04Å; V331-F409 HydrophobicContact CG2-CG 3.55Å
332	R	94.4	Very high	84	Confident	99 Å²	99	68.9 Å²	68.9	37%	0.374	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.7	166.4	178	-179.5	69.2	76.9	-8.6	108.6	D334 Y344 E390	R332-D334 IonicContact NH1-OD2 2.68Å; R332-D334 PolarHBondContact NH1-OD2 2.92Å; R332-Y344 PolarHBondContact N-O 2.83Å; R332-Y344 PolarHBondContact O-N 3.5Å; R332-E390 IonicContact CZ-OE1 2.85Å; R332-E390 IonicContact CZ-OE2 3.97Å; R332-E390 IonicContact NE-OE1 3.85Å; R332-E390 PolarHBondContact NE-OE1 2.93Å; R332-E390 VanDerWaalsContact NE-OE1 3.08Å; R332-E390 IonicContact NE-OE2 3.13Å; R332-E390 IonicContact NH2-OE1 3.92Å; R332-E390 IonicContact NH2-OE2 2.9Å; R332-E390 PolarHBondContact NH2-OE2 2.84Å
333	W	94.8	Very high	85	Confident	34 Å²	34	64 Å²	64	13%	0.129	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	148.6	178.1	-67.1	106.7	0	0	0	112.3	V331 R341 A343 L364 W374 L395 A401 P402 V403 V405 F409	V331-W333 HydrophobicContact CG1-CD2 4.03Å; V331-W333 HydrophobicContact CG1-CG 4.37Å; V331-W333 HydrophobicContact CG1-CZ2 4.24Å; W333-R341 HydrophobicContact CE3-CG 3.7Å; W333-R341 HydrophobicContact CZ3-CG 3.73Å; W333-A343 HydrophobicContact CE3-CB 3.97Å; W333-A343 HydrophobicContact CH2-CB 4.3Å; W333-A343 HydrophobicContact CZ3-CB 3.73Å; W333-L364 HydrophobicContact CH2-CD2 4.09Å; W333-W374 AromaticContact CH2-CH2 3.97Å; W333-W374 HydrophobicContact CH2-CH2 3.97Å; W333-W374 HydrophobicContact CH2-CZ3 4.25Å; W333-L395 HydrophobicContact CH2-CD1 4.04Å; W333-L395 HydrophobicContact CZ3-CD1 3.73Å; W333-L395 HydrophobicContact CZ3-CG 4.47Å; W333-A401 HydrophobicContact CH2-CB 4.07Å; W333-A401 HydrophobicContact CZ3-CB 4.21Å; W333-P402 HydrophobicContact CZ2-CG 4.48Å; W333-P402 WeakPolarHBondContact CZ2-O 3.48Å; W333-P402 PolarHBondContact NE1-O 3.26Å; W333-V403 HydrophobicContact CB-CB 4.44Å; W333-V403 HydrophobicContact CB-CG1 4.34Å; W333-V403 VanDerWaalsContact CD1-O 3.27Å; W333-V403 HydrophobicContact CD2-CG1 4.06Å; W333-V403 HydrophobicContact CE3-CG1 4.3Å; W333-V403 HydrophobicContact CG-CB 4.2Å; W333-V403 HydrophobicContact CG-CG1 4.1Å; W333-V405 PolarHBondContact NE1-O 2.96Å; W333-F409 AromaticContact CZ2-CE1 3.89Å; W333-F409 HydrophobicContact CZ2-CE1 3.89Å; W333-F409 AromaticContact CZ2-CZ 3.74Å; W333-F409 HydrophobicContact CZ2-CZ 3.74Å; W333-F409 AromaticContact NE1-CZ 3.98Å
334	D	93.3	Very high	86.1	Confident	65 Å²	65	62.2 Å²	62.2	35%	0.348	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	171.3	-179.4	-142.1	-37	0	0	0	111.2	R332 R341 I342 Y344	R332-D334 IonicContact NH1-OD2 2.68Å; R332-D334 PolarHBondContact NH1-OD2 2.92Å; D334-R341 WeakPolarHBondContact O-CD 3.26Å; D334-I342 HydrophobicContact CB-CB 4.21Å; D334-I342 PolarHBondContact N-O 2.93Å; D334-I342 PolarHBondContact O-N 2.99Å; D334-Y344 HydrophobicContact CB-CD2 3.9Å; D334-Y344 HydrophobicContact CB-CE2 3.57Å; D334-Y344 WeakPolarHBondContact OD2-CE2 3.46Å
335	L	87.9	Confident	87.1	Confident	91 Å²	91	61.6 Å²	61.6	48%	0.476	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	114.9	177.1	-170.9	73.4	0	0	0	110.3	K339	L335-K339 WeakPolarHBondContact CD1-O 3.45Å
336	G	80.8	Confident	87.4	Confident	13 Å²	13	63 Å²	63	13%	0.134	31%	0.313	C	S	.	.			trans	-65.1	156.2	177.2	0	0	0	0	0	112.5	N338 K339 K340	G336-N338 PolarHBondContact O-N 3.4Å; G336-N338 VanDerWaalsContact O-N 3.08Å; G336-K339 WeakPolarHBondContact O-CA 3.41Å; G336-K339 PolarHBondContact O-N 2.87Å; G336-K340 PolarHBondContact N-O 3.06Å
337	L	78.5	Confident	87.2	Confident	189 Å²	189	62.2 Å²	62.2	99%	0.99	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.9	174.7	-61.6	176.9	0	0	0	112.7	K339	L337-K339 PolarHBondContact O-N 2.93Å
338	N	75.1	Confident	86.4	Confident	87 Å²	87	61 Å²	61	47%	0.465	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	13.4	171.6	66.4	1.4	0	0	0	114.1	G336 K340 E394	G336-N338 PolarHBondContact O-N 3.4Å; G336-N338 VanDerWaalsContact O-N 3.08Å; N338-K340 PolarHBondContact O-N 2.98Å; N338-K340 VanDerWaalsContact O-N 3.15Å; N338-K340 WeakPolarHBondContact OD1-CB 3.34Å; N338-K340 PolarHBondContact OD1-N 2.86Å; N338-K340 VanDerWaalsContact OD1-N 3.12Å; N338-E394 PolarHBondContact ND2-OE2 3.31Å
339	K	80.6	Confident	85.2	Confident	153 Å²	153	59.1 Å²	59.1	67%	0.665	29%	0.294	S	S	*	.	S	Bend	trans	60.4	12.4	-176.9	-54.8	176.8	-176.9	171.7	0	115.6	L335 G336 L337	L335-K339 WeakPolarHBondContact CD1-O 3.45Å; G336-K339 WeakPolarHBondContact O-CA 3.41Å; G336-K339 PolarHBondContact O-N 2.87Å; L337-K339 PolarHBondContact O-N 2.93Å
340	K	82.3	Confident	83.3	Confident	78 Å²	78	61.8 Å²	61.8	34%	0.339	31%	0.31	S	S	.	.			trans	-87.2	147.3	175.3	-68.7	-178	177.7	-174.5	0	112.2	G336 N338 E394	G336-K340 PolarHBondContact N-O 3.06Å; N338-K340 PolarHBondContact O-N 2.98Å; N338-K340 VanDerWaalsContact O-N 3.15Å; N338-K340 WeakPolarHBondContact OD1-CB 3.34Å; N338-K340 PolarHBondContact OD1-N 2.86Å; N338-K340 VanDerWaalsContact OD1-N 3.12Å; K340-E394 HydrophobicContact CB-CG 3.93Å; K340-E394 HydrophobicContact CD-CG 3.65Å; K340-E394 WeakPolarHBondContact CD-OE1 3.29Å; K340-E394 WeakPolarHBondContact CD-OE2 3.02Å; K340-E394 WeakPolarHBondContact CE-OE1 3.38Å; K340-E394 IonicContact NZ-OE1 2.73Å; K340-E394 PolarHBondContact NZ-OE1 2.87Å
341	R	90.9	Very high	81.3	Confident	67 Å²	67	59.4 Å²	59.4	25%	0.253	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128	176.1	-165.8	68.2	62.9	-161.4	2.1	110.2	W333 D334 L395 S398 A401 V403	W333-R341 HydrophobicContact CE3-CG 3.7Å; W333-R341 HydrophobicContact CZ3-CG 3.73Å; D334-R341 WeakPolarHBondContact O-CD 3.26Å; R341-L395 HydrophobicContact CB-CD1 4.26Å; R341-L395 HydrophobicContact CG-CD1 4.18Å; R341-L395 PolarHBondContact O-N 2.93Å; R341-S398 PolarHBondContact N-OG 2.82Å; R341-A401 HydrophobicContact CG-CB 4.21Å; R341-V403 HydrophobicContact CG-CG1 4.42Å
342	I	93.1	Very high	79	Confident	13 Å²	13	60.6 Å²	60.6	7%	0.067	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.3	175	-55.5	172.8	0	0	0	108.3	D334 Y344 I381 A392 I393	D334-I342 HydrophobicContact CB-CB 4.21Å; D334-I342 PolarHBondContact N-O 2.93Å; D334-I342 PolarHBondContact O-N 2.99Å; I342-Y344 HydrophobicContact CB-CE2 4.12Å; I342-Y344 HydrophobicContact CG2-CD2 3.76Å; I342-Y344 HydrophobicContact CG2-CE2 3.4Å; I342-I381 HydrophobicContact CD1-CD1 3.89Å; I342-I381 HydrophobicContact CG1-CD1 4.19Å; I342-I381 HydrophobicContact CG2-CD1 4.01Å; I342-A392 HydrophobicContact CG2-CB 4.11Å; I342-I393 WeakPolarHBondContact CA-O 3.39Å; I342-I393 WeakPolarHBondContact CG2-O 3.48Å
343	A	94.5	Very high	76.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.9	170	0	0	0	0	0	109.2	V331 W333 L364 A392 I393	V331-A343 HydrophobicContact CG1-CB 3.78Å; W333-A343 HydrophobicContact CE3-CB 3.97Å; W333-A343 HydrophobicContact CH2-CB 4.3Å; W333-A343 HydrophobicContact CZ3-CB 3.73Å; A343-L364 HydrophobicContact CB-CD2 3.81Å; A343-A392 WeakPolarHBondContact O-CA 3.35Å; A343-I393 HydrophobicContact CB-CD1 4.49Å; A343-I393 HydrophobicContact CB-CG1 3.94Å; A343-I393 PolarHBondContact N-O 3.35Å; A343-I393 PolarHBondContact O-N 2.95Å
344	Y	93.1	Very high	74.5	Confident	45 Å²	45	60 Å²	60	18%	0.176	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136.7	171.7	-68.4	-100.1	0	0	0	109.7	V331 R332 D334 I342 E390 I391 A392	V331-Y344 CarbonylContact C-O 3.55Å; V331-Y344 WeakPolarHBondContact CA-O 3.33Å; R332-Y344 PolarHBondContact N-O 2.83Å; R332-Y344 PolarHBondContact O-N 3.5Å; D334-Y344 HydrophobicContact CB-CD2 3.9Å; D334-Y344 HydrophobicContact CB-CE2 3.57Å; D334-Y344 WeakPolarHBondContact OD2-CE2 3.46Å; I342-Y344 HydrophobicContact CB-CE2 4.12Å; I342-Y344 HydrophobicContact CG2-CD2 3.76Å; I342-Y344 HydrophobicContact CG2-CE2 3.4Å; Y344-E390 HydrophobicContact CD1-CB 4.48Å; Y344-E390 WeakPolarHBondContact CD1-OE2 3.47Å; Y344-I391 CarbonylContact C-O 3.54Å; Y344-I391 WeakPolarHBondContact CA-O 3.48Å; Y344-A392 HydrophobicContact CD1-CB 3.47Å; Y344-A392 VanDerWaalsContact CD1-CB 3.47Å; Y344-A392 HydrophobicContact CE1-CB 3.43Å; Y344-A392 VanDerWaalsContact CE1-CB 3.43Å; Y344-A392 HydrophobicContact CG-CB 4.06Å
345	F	90.1	Very high	73.1	Confident	3 Å²	3	63 Å²	63	1%	0.013	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	155.2	175.1	52.6	-91.4	0	0	0	110.8	I329 T330 V331 L347 I362 I391 I393 V411	I329-F345 HydrophobicContact CG2-CB 3.56Å; I329-F345 HydrophobicContact CG2-CD2 4.2Å; I329-F345 HydrophobicContact CG2-CG 4.02Å; T330-F345 WeakPolarHBondContact O-CB 3.46Å; V331-F345 HydrophobicContact CG2-CB 4.38Å; F345-L347 HydrophobicContact CD2-CD2 3.74Å; F345-L347 HydrophobicContact CD2-CG 3.95Å; F345-L347 HydrophobicContact CE2-CD1 4.23Å; F345-L347 HydrophobicContact CE2-CD2 3.84Å; F345-L347 HydrophobicContact CE2-CG 3.89Å; F345-I362 HydrophobicContact CZ-CD1 3.96Å; F345-I362 HydrophobicContact CZ-CG2 4.32Å; F345-I391 HydrophobicContact CD2-CB 4.28Å; F345-I391 HydrophobicContact CE2-CB 3.96Å; F345-I391 HydrophobicContact CE2-CD1 4.28Å; F345-I391 HydrophobicContact CE2-CG2 3.89Å; F345-I391 HydrophobicContact CZ-CB 4.32Å; F345-I391 HydrophobicContact CZ-CG2 3.82Å; F345-I391 PolarHBondContact N-O 3.01Å; F345-I391 PolarHBondContact O-N 3.01Å; F345-I393 HydrophobicContact CE1-CD1 4Å; F345-I393 HydrophobicContact CE1-CG1 4.04Å; F345-I393 HydrophobicContact CE1-CG2 3.92Å; F345-I393 HydrophobicContact CZ-CG2 3.97Å; F345-V411 HydrophobicContact CD2-CG2 4.13Å; F345-V411 HydrophobicContact CE2-CG1 4.07Å; F345-V411 HydrophobicContact CE2-CG2 3.91Å; F345-V411 HydrophobicContact CZ-CG1 4.27Å; F345-V411 HydrophobicContact CZ-CG2 4.12Å
346	T	83.6	Confident	72.3	Confident	73 Å²	73	60.2 Å²	60.2	45%	0.448	30%	0.301	S	S	.	.			trans	-106.7	127.4	171.4	-59.5	0	0	0	0	108.6	D389	T346-D389 HydrophobicContact CG2-CB 4.18Å
347	L	77	Confident	71.9	Confident	24 Å²	24	64.9 Å²	64.9	13%	0.126	32%	0.321	C	S	.	.			trans	-87.8	148.1	172.7	-64.6	-177.9	0	0	0	110.7	Q326 I329 F345 K349 I391 V411 F413	Q326-L347 HydrophobicContact CB-CD2 4.13Å; Q326-L347 HydrophobicContact CG-CD2 4.09Å; I329-L347 HydrophobicContact CD1-CD2 3.64Å; I329-L347 HydrophobicContact CG1-CD2 4.02Å; F345-L347 HydrophobicContact CD2-CD2 3.74Å; F345-L347 HydrophobicContact CD2-CG 3.95Å; F345-L347 HydrophobicContact CE2-CD1 4.23Å; F345-L347 HydrophobicContact CE2-CD2 3.84Å; F345-L347 HydrophobicContact CE2-CG 3.89Å; L347-K349 PolarHBondContact O-N 3.04Å; L347-I391 HydrophobicContact CB-CD1 4.34Å; L347-I391 HydrophobicContact CD1-CD1 3.67Å; L347-I391 HydrophobicContact CG-CD1 3.82Å; L347-V411 HydrophobicContact CD1-CG1 4.38Å; L347-V411 HydrophobicContact CD2-CB 4.11Å; L347-V411 HydrophobicContact CD2-CG1 4.09Å; L347-V411 HydrophobicContact CD2-CG2 4.15Å; L347-F413 HydrophobicContact CD1-CE1 4.28Å; L347-F413 HydrophobicContact CD1-CE2 4.35Å; L347-F413 HydrophobicContact CD1-CZ 3.54Å
348	P	65.9	Low	71.8	Confident	59 Å²	59	59.4 Å²	59.4	38%	0.383	29%	0.29	S	S	.	.			trans	-55.7	125.9	174.5	-24	33.7	0	0	0	110.6	T350	P348-T350 WeakPolarHBondContact O-CB 3.32Å; P348-T350 WeakPolarHBondContact O-CG2 3.26Å; P348-T350 PolarHBondContact O-N 3.13Å; P348-T350 PolarHBondContact O-OG1 3.19Å
349	K	59.3	Low	71.9	Confident	68 Å²	68	55.5 Å²	55.5	30%	0.296	27%	0.271	S	S	.	.			trans	-53.6	108.7	-178.7	-62.5	-171.5	-179.3	-168.3	0	109.3	L347 D389 S760 S801	L347-K349 PolarHBondContact O-N 3.04Å; K349-D389 WeakPolarHBondContact CE-OD2 3.33Å; K349-D389 IonicContact NZ-OD1 2.69Å; K349-D389 IonicContact NZ-OD2 3.63Å; K349-D389 PolarHBondContact NZ-OD2 2.92Å; K349-S760 WeakPolarHBondContact O-CB 3.01Å; K349-S801 WeakPolarHBondContact CE-OG 3.25Å; K349-S801 PolarHBondContact NZ-OG 3.17Å
350	T	49.9	Very low	72	Confident	61 Å²	61	50.1 Å²	50.1	37%	0.374	25%	0.249	S	C	.	.			trans	-133.6	126.9	-174.1	33.7	0	0	0	0	107.6	P348 S352	P348-T350 WeakPolarHBondContact O-CB 3.32Å; P348-T350 WeakPolarHBondContact O-CG2 3.26Å; P348-T350 PolarHBondContact O-N 3.13Å; P348-T350 PolarHBondContact O-OG1 3.19Å; T350-S352 PolarHBondContact O-N 3.21Å
351	D	47.4	Very low	72.3	Confident	23 Å²	23	47.4 Å²	47.4	12%	0.123	24%	0.238	C	C	.	.			trans	-77.8	70.7	173.9	-76.2	-52	0	0	0	107.8	S760 T762 S763	D351-S760 VanDerWaalsContact CG-CB 3.48Å; D351-S760 VanDerWaalsContact N-CB 3.32Å; D351-S760 WeakPolarHBondContact OD2-CB 3.38Å; D351-S760 PolarHBondContact OD2-OG 3.32Å; D351-T762 WeakPolarHBondContact CB-OG1 3.38Å; D351-T762 PolarHBondContact O-OG1 3.42Å; D351-S763 WeakPolarHBondContact OD1-CB 3.05Å; D351-S763 WeakPolarHBondContact OD2-CA 3.42Å; D351-S763 WeakPolarHBondContact OD2-CB 3.47Å; D351-S763 PolarHBondContact OD2-N 2.92Å
352	S	47.2	Very low	72.2	Confident	27 Å²	27	44.2 Å²	44.2	19%	0.189	23%	0.226	C	C	.	.			trans	-77.6	131.4	164	-167.7	0	0	0	0	108.9	Q324 T350 M354	Q324-S352 PolarHBondContact NE2-OG 2.79Å; Q324-S352 VanDerWaalsContact NE2-OG 3.1Å; Q324-S352 PolarHBondContact OE1-OG 3.42Å; T350-S352 PolarHBondContact O-N 3.21Å; S352-M354 PolarHBondContact O-N 3.23Å; S352-M354 VanDerWaalsContact O-N 3.11Å; S352-M354 VanDerWaalsContact OG-CB 3.27Å; S352-M354 WeakPolarHBondContact OG-CB 3.32Å; S352-M354 PolarHBondContact OG-N 3.14Å
353	D	43.9	Very low	72.1	Confident	101 Å²	101	43.9 Å²	43.9	54%	0.54	22%	0.224	S	C	.	.	S	Bend	trans	-59.6	-18.9	168.4	-51.7	-81.1	0	0	0	111.4	L320 R355 M671	L320-D353 HydrophobicContact CD2-CB 4.43Å; D353-R355 PolarHBondContact O-N 3.36Å; D353-M671 HydrophobicContact CB-CE 4.18Å; D353-M671 HydrophobicContact CB-SD 4Å; D353-M671 VanDerWaalsContact O-CE 3.32Å; D353-M671 WeakPolarHBondContact O-CE 3.43Å
354	M	51	Low	72.1	Confident	20 Å²	20	43.9 Å²	43.9	10%	0.099	22%	0.224	C	C	.	.			trans	-75.7	99.6	174.9	-172.6	-168.8	79.3	0	0	112.1	K321 S352 L356 F413	K321-M354 HydrophobicContact CB-SD 4.28Å; K321-M354 HydrophobicContact CD-CG 4.27Å; K321-M354 HydrophobicContact CD-SD 3.35Å; K321-M354 WeakPolarHBondContact CD-SD 3.41Å; K321-M354 WeakPolarHBondContact CE-SD 3.39Å; K321-M354 HydrophobicContact CG-CG 4.47Å; K321-M354 HydrophobicContact CG-SD 3.55Å; K321-M354 VanDerWaalsContact CG-SD 3.55Å; K321-M354 PolarHBondContact NZ-SD 3.13Å; K321-M354 VanDerWaalsContact NZ-SD 3.38Å; S352-M354 PolarHBondContact O-N 3.23Å; S352-M354 VanDerWaalsContact O-N 3.11Å; S352-M354 VanDerWaalsContact OG-CB 3.27Å; S352-M354 WeakPolarHBondContact OG-CB 3.32Å; S352-M354 PolarHBondContact OG-N 3.14Å; M354-L356 PolarHBondContact O-N 3.26Å; M354-F413 HydrophobicContact CE-CB 4.5Å; M354-F413 HydrophobicContact CE-CD1 3.52Å; M354-F413 HydrophobicContact CE-CD2 3.99Å; M354-F413 HydrophobicContact CE-CE1 3.54Å; M354-F413 HydrophobicContact CE-CE2 4Å; M354-F413 HydrophobicContact CE-CG 3.73Å; M354-F413 HydrophobicContact CE-CZ 3.76Å
355	R	63	Low	72.1	Confident	129 Å²	129	46 Å²	46	49%	0.487	23%	0.232	S	C	.	.			trans	-73	116.2	167.8	-62.7	176.8	-174.1	148.5	4.3	110	D353 D827	D353-R355 PolarHBondContact O-N 3.36Å; R355-D827 IonicContact CZ-OD2 3.32Å; R355-D827 VanDerWaalsContact NH1-CB 3.3Å; R355-D827 IonicContact NH1-OD2 2.72Å; R355-D827 PolarHBondContact NH1-OD2 3.43Å; R355-D827 IonicContact NH2-OD2 2.79Å; R355-D827 PolarHBondContact NH2-OD2 3.28Å
356	L	71.3	Confident	72.3	Confident	31 Å²	31	46 Å²	46	16%	0.162	23%	0.232	C	C	.	.			trans	-64.6	131.4	171.2	-167.5	67.5	0	0	0	109.8	M354 D360 I362 V380 V383 I391 F413	M354-L356 PolarHBondContact O-N 3.26Å; L356-D360 HydrophobicContact CD1-CB 3.9Å; L356-I362 HydrophobicContact CD1-CD1 4.31Å; L356-I362 HydrophobicContact CD2-CD1 4.28Å; L356-V380 HydrophobicContact CD1-CG2 3.99Å; L356-V380 HydrophobicContact CD2-CG1 4.02Å; L356-V380 HydrophobicContact CD2-CG2 3.94Å; L356-V380 HydrophobicContact CG-CG1 4.23Å; L356-V380 HydrophobicContact CG-CG2 4.05Å; L356-V383 HydrophobicContact CG-CG1 4.45Å; L356-V383 WeakPolarHBondContact O-CG1 3.2Å; L356-I391 HydrophobicContact CD2-CD1 3.81Å; L356-I391 HydrophobicContact CD2-CG1 4.21Å; L356-I391 HydrophobicContact CD2-CG2 3.91Å; L356-F413 HydrophobicContact CD1-CD1 4.09Å; L356-F413 HydrophobicContact CD1-CE1 3.85Å
357	M	71.7	Confident	72.7	Confident	111 Å²	111	47.5 Å²	47.5	55%	0.547	23%	0.232	S	C	.	.			trans	-111.9	150.8	177.7	-54.4	-162.1	-160.1	0	0	111.6	G359 D360	M357-G359 PolarHBondContact O-N 3.45Å; M357-D360 PolarHBondContact N-OD2 3.01Å; M357-D360 VanDerWaalsContact O-CB 3.3Å; M357-D360 WeakPolarHBondContact O-CB 3.39Å; M357-D360 PolarHBondContact O-N 3.31Å
358	Q	76	Confident	73.2	Confident	74 Å²	74	46.8 Å²	46.8	35%	0.346	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	128.7	166.9	-63.6	174.3	-50.2	0	0	109.6	V380 I381 V383 R549 I552	Q358-V380 CarbonylContact C-O 3.6Å; Q358-V380 VanDerWaalsContact CA-O 3.29Å; Q358-V380 WeakPolarHBondContact CA-O 3.15Å; Q358-I381 PolarHBondContact NE2-O 2.87Å; Q358-V383 HydrophobicContact CG-CG1 4.21Å; Q358-R549 PolarHBondContact O-NH1 2.9Å; Q358-I552 VanDerWaalsContact C-CD1 3.43Å; Q358-I552 HydrophobicContact CB-CD1 3.58Å; Q358-I552 HydrophobicContact CB-CG1 4.21Å; Q358-I552 WeakPolarHBondContact O-CD1 3.4Å
359	G	78.8	Confident	74.4	Confident	5 Å²	5	50.5 Å²	50.5	5%	0.052	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	4.9	-172.8	0	0	0	0	0	115.3	M357 V380 S548	M357-G359 PolarHBondContact O-N 3.45Å; G359-V380 PolarHBondContact N-O 3.1Å; G359-S548 WeakPolarHBondContact CA-O 3.39Å; G359-S548 WeakPolarHBondContact O-CB 3.3Å; G359-S548 PolarHBondContact O-OG 3.48Å
360	D	83.1	Confident	75.9	Confident	41 Å²	41	54 Å²	54	22%	0.219	27%	0.269	C	S	.	.			trans	-66.2	155.9	162.4	-76.5	-8.6	0	0	0	110.4	K321 L356 M357 H379 V380	K321-D360 IonicContact NZ-OD2 3.8Å; L356-D360 HydrophobicContact CD1-CB 3.9Å; M357-D360 PolarHBondContact N-OD2 3.01Å; M357-D360 VanDerWaalsContact O-CB 3.3Å; M357-D360 WeakPolarHBondContact O-CB 3.39Å; M357-D360 PolarHBondContact O-N 3.31Å; D360-H379 WeakPolarHBondContact O-CA 3.46Å; D360-V380 HydrophobicContact CB-CG2 4.09Å; D360-V380 PolarHBondContact O-N 2.97Å
361	E	86.8	Confident	77.8	Confident	21 Å²	21	51.9 Å²	51.9	10%	0.098	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133	176.9	-82.6	177.6	-160.1	0	0	111.9	I377 G378 H379 R396 V414 K416	E361-I377 HydrophobicContact CG-CG2 4.44Å; E361-G378 WeakPolarHBondContact CA-O 3.35Å; E361-H379 WeakPolarHBondContact CG-CD2 3.38Å; E361-H379 VanDerWaalsContact CG-NE2 3.34Å; E361-H379 WeakPolarHBondContact CG-NE2 3.18Å; E361-H379 IonicContact OE1-CD2 2.72Å; E361-H379 IonicContact OE1-CE1 2.82Å; E361-H379 IonicContact OE1-NE2 3.13Å; E361-H379 PolarHBondContact OE1-NE2 2.89Å; E361-R396 IonicContact OE1-CZ 4Å; E361-R396 IonicContact OE1-NE 2.7Å; E361-R396 IonicContact OE1-NH2 3.2Å; E361-R396 PolarHBondContact OE1-NH2 3.09Å; E361-R396 IonicContact OE2-CZ 2.7Å; E361-R396 IonicContact OE2-NH2 2.73Å; E361-R396 PolarHBondContact OE2-NH2 3.35Å; E361-V414 HydrophobicContact CB-CB 3.88Å; E361-V414 HydrophobicContact CB-CG1 4.4Å; E361-V414 HydrophobicContact CB-CG2 4.27Å; E361-V414 WeakPolarHBondContact O-CB 3.42Å; E361-V414 PolarHBondContact O-N 3.16Å; E361-K416 IonicContact OE1-NZ 2.66Å; E361-K416 PolarHBondContact OE1-NZ 3.02Å; E361-K416 WeakPolarHBondContact OE2-CE 3.44Å; E361-K416 IonicContact OE2-NZ 2.73Å; E361-K416 PolarHBondContact OE2-NZ 2.97Å
362	I	89.3	Confident	79.9	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.9	176.4	-71.8	-177.5	0	0	0	108.3	F345 L356 I377 G378 V380 I393 V411 F413	F345-I362 HydrophobicContact CZ-CD1 3.96Å; F345-I362 HydrophobicContact CZ-CG2 4.32Å; L356-I362 HydrophobicContact CD1-CD1 4.31Å; L356-I362 HydrophobicContact CD2-CD1 4.28Å; I362-I377 WeakPolarHBondContact O-CA 3.35Å; I362-G378 PolarHBondContact N-O 3.3Å; I362-G378 PolarHBondContact O-N 3.36Å; I362-V380 HydrophobicContact CD1-CG2 3.7Å; I362-V380 HydrophobicContact CG1-CG2 4.04Å; I362-I393 HydrophobicContact CB-CD1 4.38Å; I362-I393 HydrophobicContact CB-CG2 4.19Å; I362-I393 HydrophobicContact CD1-CG2 4Å; I362-I393 HydrophobicContact CG2-CD1 4.04Å; I362-V411 HydrophobicContact CD1-CG1 4.47Å; I362-V411 HydrophobicContact CG2-CG1 3.77Å; I362-F413 HydrophobicContact CD1-CD1 4.41Å; I362-F413 HydrophobicContact CD1-CE1 4.23Å; I362-F413 HydrophobicContact CG1-CD1 4.28Å
363	C	91.3	Very high	82	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.034	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	106	171.4	160.8	0	0	0	0	107.9	K375 G376 I377 D412 V414	C363-K375 WeakPolarHBondContact SG-CE 3.16Å; C363-G376 CarbonylContact C-O 3.53Å; C363-G376 WeakPolarHBondContact CA-O 3.45Å; C363-I377 HydrophobicContact CB-CG1 4.5Å; C363-D412 HydrophobicContact CB-CB 3.98Å; C363-D412 PolarHBondContact N-O 2.84Å; C363-D412 PolarHBondContact O-N 2.95Å; C363-V414 HydrophobicContact CB-CG2 3.7Å
364	L	94.1	Very high	84.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.8	176.2	-175.4	69	0	0	0	108.4	V331 W333 A343 W374 K375 G376 I393 F409 Q410 V411	V331-L364 HydrophobicContact CG2-CD1 4.03Å; V331-L364 HydrophobicContact CG2-CD2 4.28Å; W333-L364 HydrophobicContact CH2-CD2 4.09Å; A343-L364 HydrophobicContact CB-CD2 3.81Å; L364-W374 HydrophobicContact CB-CZ3 4.18Å; L364-W374 HydrophobicContact CD2-CH2 4.4Å; L364-W374 HydrophobicContact CD2-CZ3 4.01Å; L364-W374 HydrophobicContact CG-CZ3 4.02Å; L364-W374 WeakPolarHBondContact O-CZ3 3.36Å; L364-K375 WeakPolarHBondContact O-CA 3.28Å; L364-G376 PolarHBondContact N-O 3.19Å; L364-G376 PolarHBondContact O-N 2.63Å; L364-I393 HydrophobicContact CB-CD1 4.02Å; L364-I393 HydrophobicContact CD2-CD1 4.36Å; L364-F409 HydrophobicContact CD1-CB 3.98Å; L364-F409 HydrophobicContact CD1-CD1 3.95Å; L364-F409 HydrophobicContact CD1-CG 4.26Å; L364-F409 HydrophobicContact CD2-CD1 4.15Å; L364-F409 HydrophobicContact CD2-CE1 4.35Å; L364-F409 HydrophobicContact CG-CD1 3.84Å; L364-F409 HydrophobicContact CG-CE1 4.43Å; L364-Q410 WeakPolarHBondContact CA-O 2.99Å; L364-V411 HydrophobicContact CD1-CG2 3.73Å
365	R	93.5	Very high	86.4	Confident	89 Å²	89	63.6 Å²	63.6	34%	0.336	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144.4	177.1	-50.6	-174.7	-165.6	-137.6	10	110.7	W374 K375 F409 Q410 D412	R365-W374 CarbonylContact C-O 3.48Å; R365-W374 WeakPolarHBondContact CA-O 3.31Å; R365-K375 HydrophobicContact CG-CB 4.42Å; R365-K375 HydrophobicContact CG-CG 4.22Å; R365-F409 CarbonylContact O-C 3.35Å; R365-F409 WeakPolarHBondContact O-CA 3.37Å; R365-F409 WeakPolarHBondContact O-CB 3.01Å; R365-F409 VanDerWaalsContact O-CD1 3.28Å; R365-F409 WeakPolarHBondContact O-CD1 3.49Å; R365-Q410 HydrophobicContact CB-CB 4.34Å; R365-Q410 PolarHBondContact N-O 3.09Å; R365-Q410 PolarHBondContact O-N 3.34Å; R365-D412 IonicContact CZ-OD2 3.82Å; R365-D412 IonicContact NE-OD2 3.64Å; R365-D412 PolarHBondContact NE-OD2 3.04Å; R365-D412 IonicContact NH2-OD2 3.45Å; R365-D412 PolarHBondContact NH2-OD2 2.87Å
366	Y	95	Very high	87.8	Confident	4 Å²	4	58 Å²	58	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.9	164.7	-176.7	-105.2	0	0	0	109.2	G368 L370 A371 W374 V405 H407 N408 F409	Y366-G368 VanDerWaalsContact CE1-O 3.24Å; Y366-G368 WeakPolarHBondContact CE1-O 3.16Å; Y366-G368 VanDerWaalsContact CZ-CA 3.4Å; Y366-G368 WeakPolarHBondContact OH-CA 3.38Å; Y366-L370 WeakPolarHBondContact OH-CB 3.47Å; Y366-L370 PolarHBondContact OH-N 3Å; Y366-A371 HydrophobicContact CD1-CB 4.2Å; Y366-A371 HydrophobicContact CE1-CB 3.74Å; Y366-A371 WeakPolarHBondContact CE1-O 3.38Å; Y366-W374 PolarHBondContact N-O 3.16Å; Y366-V405 HydrophobicContact CD2-CB 4.44Å; Y366-V405 HydrophobicContact CD2-CG2 3.56Å; Y366-V405 HydrophobicContact CE2-CB 3.78Å; Y366-V405 HydrophobicContact CE2-CG1 4.3Å; Y366-V405 HydrophobicContact CE2-CG2 3.37Å; Y366-V405 HydrophobicContact CG-CG2 4.24Å; Y366-H407 VanDerWaalsContact CE2-O 3.27Å; Y366-H407 WeakPolarHBondContact CE2-O 3.34Å; Y366-N408 HydrophobicContact CE2-CB 4.49Å; Y366-F409 HydrophobicContact CD2-CD1 4.34Å; Y366-F409 HydrophobicContact CD2-CD2 4.26Å; Y366-F409 HydrophobicContact CD2-CE1 4.05Å; Y366-F409 AromaticContact CD2-CE2 3.96Å; Y366-F409 HydrophobicContact CD2-CE2 3.96Å; Y366-F409 HydrophobicContact CD2-CG 4.44Å; Y366-F409 AromaticContact CD2-CZ 3.85Å; Y366-F409 HydrophobicContact CD2-CZ 3.85Å; Y366-F409 HydrophobicContact CE2-CE2 4.5Å; Y366-F409 HydrophobicContact CG-CE1 4.46Å
367	K	91.1	Very high	88.7	Confident	104 Å²	104	59 Å²	59	45%	0.452	30%	0.302	S	S	.	.			trans	-119.6	-1.3	-179.7	-87.5	-169.5	178.7	174.9	0	113.8	D327 N408 Q410	D327-K367 WeakPolarHBondContact OD1-CD 3.15Å; D327-K367 WeakPolarHBondContact OD1-CE 3.34Å; D327-K367 IonicContact OD1-NZ 3.21Å; D327-K367 PolarHBondContact OD1-NZ 3.35Å; D327-K367 IonicContact OD2-NZ 3.59Å; K367-N408 PolarHBondContact N-O 3.13Å; K367-Q410 HydrophobicContact CD-CB 4.18Å; K367-Q410 VanDerWaalsContact CE-CD 3.43Å
368	G	88.6	Confident	89.6	Confident	10 Å²	10	53.7 Å²	53.7	10%	0.103	28%	0.276	C	S	.	.	S	Bend	trans	-74.3	-176.8	176.8	0	0	0	0	0	113.1	Y366 N408	Y366-G368 VanDerWaalsContact CE1-O 3.24Å; Y366-G368 WeakPolarHBondContact CE1-O 3.16Å; Y366-G368 VanDerWaalsContact CZ-CA 3.4Å; Y366-G368 WeakPolarHBondContact OH-CA 3.38Å; G368-N408 PolarHBondContact N-O 3.48Å
369	D	91.1	Very high	90.1	Very high	137 Å²	137	51.6 Å²	51.6	73%	0.733	27%	0.266	S	S	*	.	S	Bend	trans	-105	-23.3	-175.2	53.7	-16.2	0	0	0	113.5	A371	D369-A371 PolarHBondContact O-N 3.16Å
370	L	89.1	Confident	90.6	Very high	141 Å²	141	51.4 Å²	51.4	74%	0.738	26%	0.264	S	S	*	.	S	Bend	trans	-67.9	-11.9	-178.1	-53.3	177	0	0	0	114.5	Y366 V405	Y366-L370 WeakPolarHBondContact OH-CB 3.47Å; Y366-L370 PolarHBondContact OH-N 3Å; L370-V405 HydrophobicContact CB-CG1 4.03Å
371	A	91.4	Very high	90.7	Very high	16 Å²	16	51.5 Å²	51.5	13%	0.132	26%	0.264	C	S	.	.	S	Bend	trans	-150.1	164.5	179.8	0	0	0	0	0	111	Y366 D369 V405	Y366-A371 HydrophobicContact CD1-CB 4.2Å; Y366-A371 HydrophobicContact CE1-CB 3.74Å; Y366-A371 WeakPolarHBondContact CE1-O 3.38Å; D369-A371 PolarHBondContact O-N 3.16Å; A371-V405 HydrophobicContact CB-CG1 3.87Å; A371-V405 HydrophobicContact CB-CG2 4.38Å
372	P	91.3	Very high	90.5	Very high	110 Å²	110	52.5 Å²	52.5	71%	0.714	27%	0.268	S	S	*	.			trans	-59.6	145.2	174.5	-23.5	34.7	0	0	0	112.8	W374	P372-W374 PolarHBondContact O-N 2.92Å; P372-W374 VanDerWaalsContact O-N 3.16Å
373	L	91.2	Very high	90	Very high	144 Å²	144	54.3 Å²	54.3	75%	0.754	28%	0.279	S	S	*	.			trans	-55.9	120	174.9	-68	175.9	0	0	0	110.8
374	W	94	Very high	89.1	Confident	44 Å²	44	56.2 Å²	56.2	17%	0.167	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	154.3	-172.3	175.8	87.8	0	0	0	112.4	W333 L364 R365 Y366 P372 G376 L395 G400 A401 P402 F409	W333-W374 AromaticContact CH2-CH2 3.97Å; W333-W374 HydrophobicContact CH2-CH2 3.97Å; W333-W374 HydrophobicContact CH2-CZ3 4.25Å; L364-W374 HydrophobicContact CB-CZ3 4.18Å; L364-W374 HydrophobicContact CD2-CH2 4.4Å; L364-W374 HydrophobicContact CD2-CZ3 4.01Å; L364-W374 HydrophobicContact CG-CZ3 4.02Å; L364-W374 WeakPolarHBondContact O-CZ3 3.36Å; R365-W374 CarbonylContact C-O 3.48Å; R365-W374 WeakPolarHBondContact CA-O 3.31Å; Y366-W374 PolarHBondContact N-O 3.16Å; P372-W374 PolarHBondContact O-N 2.92Å; P372-W374 VanDerWaalsContact O-N 3.16Å; W374-G376 VanDerWaalsContact CH2-CA 3.46Å; W374-G376 VanDerWaalsContact CZ2-CA 3.48Å; W374-L395 HydrophobicContact CH2-CD1 3.75Å; W374-L395 HydrophobicContact CH2-CD2 4.22Å; W374-L395 HydrophobicContact CZ2-CD1 3.87Å; W374-G400 PolarHBondContact NE1-O 3.29Å; W374-A401 HydrophobicContact CZ2-CB 3.94Å; W374-P402 HydrophobicContact CB-CG 4.04Å; W374-P402 HydrophobicContact CD2-CG 3.96Å; W374-P402 HydrophobicContact CE3-CG 4.07Å; W374-P402 HydrophobicContact CG-CG 3.96Å; W374-F409 HydrophobicContact CE3-CE1 4.33Å; W374-F409 HydrophobicContact CZ3-CE1 4.31Å
375	K	93.6	Very high	88	Confident	120 Å²	120	58.4 Å²	58.4	52%	0.522	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	120	175.1	179.3	-175.4	-176.4	-171.7	0	110.8	C363 L364 R365	C363-K375 WeakPolarHBondContact SG-CE 3.16Å; L364-K375 WeakPolarHBondContact O-CA 3.28Å; R365-K375 HydrophobicContact CG-CB 4.42Å; R365-K375 HydrophobicContact CG-CG 4.22Å
376	G	91.5	Very high	86.7	Confident	11 Å²	11	55 Å²	55	11%	0.113	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.5	168.7	0	0	0	0	0	112	C363 L364 W374	C363-G376 CarbonylContact C-O 3.53Å; C363-G376 WeakPolarHBondContact CA-O 3.45Å; L364-G376 PolarHBondContact N-O 3.19Å; L364-G376 PolarHBondContact O-N 2.63Å; W374-G376 VanDerWaalsContact CH2-CA 3.46Å; W374-G376 VanDerWaalsContact CZ2-CA 3.48Å
377	I	91.1	Very high	85.2	Confident	52 Å²	52	61.1 Å²	61.1	27%	0.267	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.6	166.6	-61.4	175.1	0	0	0	107.6	E361 I362 C363 R396	E361-I377 HydrophobicContact CG-CG2 4.44Å; I362-I377 WeakPolarHBondContact O-CA 3.35Å; C363-I377 HydrophobicContact CB-CG1 4.5Å; I377-R396 WeakPolarHBondContact O-CB 3.42Å; I377-R396 WeakPolarHBondContact O-CG 3.34Å; I377-R396 PolarHBondContact O-N 3.28Å
378	G	89.3	Confident	83.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	165.3	175.6	0	0	0	0	0	113.2	E361 I362 E394	E361-G378 WeakPolarHBondContact CA-O 3.35Å; I362-G378 PolarHBondContact N-O 3.3Å; I362-G378 PolarHBondContact O-N 3.36Å; G378-E394 CarbonylContact C-O 3.6Å; G378-E394 WeakPolarHBondContact CA-O 3.45Å
379	H	87.7	Confident	83.1	Confident	30 Å²	30	58.9 Å²	58.9	14%	0.139	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.3	176.5	-69.3	113	0	0	0	110	D360 E361 I381 I393 E394 S548	D360-H379 WeakPolarHBondContact O-CA 3.46Å; E361-H379 WeakPolarHBondContact CG-CD2 3.38Å; E361-H379 VanDerWaalsContact CG-NE2 3.34Å; E361-H379 WeakPolarHBondContact CG-NE2 3.18Å; E361-H379 IonicContact OE1-CD2 2.72Å; E361-H379 IonicContact OE1-CE1 2.82Å; E361-H379 IonicContact OE1-NE2 3.13Å; E361-H379 PolarHBondContact OE1-NE2 2.89Å; H379-I381 PolarHBondContact O-N 3.31Å; H379-I393 CarbonylContact O-C 3.6Å; H379-I393 VanDerWaalsContact O-CA 3.25Å; H379-I393 WeakPolarHBondContact O-CA 3.39Å; H379-E394 PolarHBondContact N-O 3.43Å; H379-E394 PolarHBondContact O-N 3.09Å; H379-S548 WeakPolarHBondContact CD2-CB 3.43Å; H379-S548 WeakPolarHBondContact NE2-CB 3.3Å
380	V	87.6	Confident	82.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	116.4	178.3	179.3	0	0	0	0	110.1	L356 Q358 G359 D360 I362 K382 V383 I393	L356-V380 HydrophobicContact CD1-CG2 3.99Å; L356-V380 HydrophobicContact CD2-CG1 4.02Å; L356-V380 HydrophobicContact CD2-CG2 3.94Å; L356-V380 HydrophobicContact CG-CG1 4.23Å; L356-V380 HydrophobicContact CG-CG2 4.05Å; Q358-V380 CarbonylContact C-O 3.6Å; Q358-V380 VanDerWaalsContact CA-O 3.29Å; Q358-V380 WeakPolarHBondContact CA-O 3.15Å; G359-V380 PolarHBondContact N-O 3.1Å; D360-V380 HydrophobicContact CB-CG2 4.09Å; D360-V380 PolarHBondContact O-N 2.97Å; I362-V380 HydrophobicContact CD1-CG2 3.7Å; I362-V380 HydrophobicContact CG1-CG2 4.04Å; V380-K382 WeakPolarHBondContact CG1-O 3.01Å; V380-V383 HydrophobicContact CG1-CG1 3.75Å; V380-I393 HydrophobicContact CG2-CG2 4.12Å
381	I	85.4	Confident	82.7	Confident	43 Å²	43	48.9 Å²	48.9	22%	0.221	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-33	174.8	55.7	167.1	0	0	0	111.8	I342 Q358 H379 A392 E394	I342-I381 HydrophobicContact CD1-CD1 3.89Å; I342-I381 HydrophobicContact CG1-CD1 4.19Å; I342-I381 HydrophobicContact CG2-CD1 4.01Å; Q358-I381 PolarHBondContact NE2-O 2.87Å; H379-I381 PolarHBondContact O-N 3.31Å; I381-A392 HydrophobicContact CD1-CB 4.36Å; I381-A392 HydrophobicContact CG1-CB 3.96Å; I381-A392 WeakPolarHBondContact CG1-O 3.34Å; I381-A392 PolarHBondContact N-O 2.95Å; I381-E394 HydrophobicContact CD1-CB 4.33Å; I381-E394 HydrophobicContact CG2-CB 3.88Å
382	K	82.6	Confident	82.6	Confident	43 Å²	43	48.1 Å²	48.1	19%	0.187	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	133.8	172.2	-170.4	-170.1	175.9	-60.2	0	110.5	V380 D385 G388 E390 I391 A392	V380-K382 WeakPolarHBondContact CG1-O 3.01Å; K382-D385 WeakPolarHBondContact CE-OD1 3.46Å; K382-D385 WeakPolarHBondContact CE-OD2 3.36Å; K382-D385 IonicContact NZ-OD1 3.06Å; K382-D385 PolarHBondContact NZ-OD1 3.29Å; K382-D385 IonicContact NZ-OD2 2.76Å; K382-D385 PolarHBondContact NZ-OD2 2.94Å; K382-D385 VanDerWaalsContact NZ-OD2 3.11Å; K382-G388 PolarHBondContact NZ-O 3.26Å; K382-E390 PolarHBondContact NZ-O 3.13Å; K382-I391 WeakPolarHBondContact O-CA 3.34Å; K382-A392 HydrophobicContact CB-CB 3.63Å; K382-A392 PolarHBondContact N-O 2.93Å; K382-A392 PolarHBondContact O-N 3.02Å
383	V	79.4	Confident	82.6	Confident	37 Å²	37	42.9 Å²	42.9	22%	0.224	22%	0.216	C	C	.	.			trans	-104.1	164.5	169.6	-65.9	0	0	0	0	110.2	L356 Q358 V380 D385	L356-V383 HydrophobicContact CG-CG1 4.45Å; L356-V383 WeakPolarHBondContact O-CG1 3.2Å; Q358-V383 HydrophobicContact CG-CG1 4.21Å; V380-V383 HydrophobicContact CG1-CG1 3.75Å; V383-D385 PolarHBondContact O-N 3.2Å
384	P	72.4	Confident	82.6	Confident	46 Å²	46	36.5 Å²	36.5	30%	0.299	18%	0.182	S	C	.	.	S	Bend	trans	-59.7	127.4	175.4	-22.9	36.7	0	0	0	110.3	I391	P384-I391 HydrophobicContact CG-CD1 4.18Å; P384-I391 HydrophobicContact CG-CG1 3.76Å
385	D	70.6	Confident	82.4	Confident	45 Å²	45	34.5 Å²	34.5	24%	0.241	18%	0.175	C	C	.	.			trans	-143	-168	-170.6	62.8	18.2	0	0	0	111.3	K382 V383 Y387 G388	K382-D385 WeakPolarHBondContact CE-OD1 3.46Å; K382-D385 WeakPolarHBondContact CE-OD2 3.36Å; K382-D385 IonicContact NZ-OD1 3.06Å; K382-D385 PolarHBondContact NZ-OD1 3.29Å; K382-D385 IonicContact NZ-OD2 2.76Å; K382-D385 PolarHBondContact NZ-OD2 2.94Å; K382-D385 VanDerWaalsContact NZ-OD2 3.11Å; V383-D385 PolarHBondContact O-N 3.2Å; D385-Y387 VanDerWaalsContact C-N 3.26Å; D385-Y387 PolarHBondContact O-N 2.83Å; D385-Y387 WeakPolarHBondContact OD1-CA 3.43Å; D385-Y387 WeakPolarHBondContact OD1-CB 3.16Å; D385-Y387 PolarHBondContact OD1-N 2.88Å; D385-G388 PolarHBondContact N-O 3.41Å; D385-G388 VanDerWaalsContact N-O 3.15Å; D385-G388 PolarHBondContact OD1-N 2.86Å
386	N	66.8	Low	81.9	Confident	19 Å²	19	35.4 Å²	35.4	10%	0.102	18%	0.175	C	C	.	.	S	Bend	trans	-70.1	-19.2	178.1	-68.4	-5.9	0	0	0	114.2	Q808 Q819 V821 E822 I823	N386-Q808 PolarHBondContact O-NE2 2.98Å; N386-Q819 WeakPolarHBondContact CB-O 3Å; N386-Q819 PolarHBondContact ND2-O 3.22Å; N386-V821 VanDerWaalsContact ND2-C 3.32Å; N386-V821 PolarHBondContact ND2-O 3.16Å; N386-E822 WeakPolarHBondContact ND2-CA 3.49Å; N386-I823 PolarHBondContact OD1-N 2.87Å
387	Y	63.1	Low	81.5	Confident	132 Å²	132	37.4 Å²	37.4	52%	0.518	19%	0.187	S	C	.	.	S	Bend	trans	-87.7	-30.8	-178.2	-63	-80.6	0	0	0	111	D385 Q819	D385-Y387 VanDerWaalsContact C-N 3.26Å; D385-Y387 PolarHBondContact O-N 2.83Å; D385-Y387 WeakPolarHBondContact OD1-CA 3.43Å; D385-Y387 WeakPolarHBondContact OD1-CB 3.16Å; D385-Y387 PolarHBondContact OD1-N 2.88Å; Y387-Q819 HydrophobicContact CD1-CB 3.7Å; Y387-Q819 HydrophobicContact CD1-CG 4.3Å; Y387-Q819 HydrophobicContact CE1-CB 3.61Å; Y387-Q819 HydrophobicContact CG-CB 4.46Å
388	G	65	Low	80.9	Confident	21 Å²	21	36.8 Å²	36.8	22%	0.216	19%	0.188	C	C	.	.			trans	178.7	161.7	167.1	0	0	0	0	0	113.9	K382 D385 E390	K382-G388 PolarHBondContact NZ-O 3.26Å; D385-G388 PolarHBondContact N-O 3.41Å; D385-G388 VanDerWaalsContact N-O 3.15Å; D385-G388 PolarHBondContact OD1-N 2.86Å; G388-E390 PolarHBondContact O-N 3.21Å
389	D	71.9	Confident	80.5	Confident	46 Å²	46	42.6 Å²	42.6	25%	0.246	22%	0.223	C	C	.	.	S	Bend	trans	-72.4	-3.6	174.5	-66.8	-57.3	0	0	0	113.2	T346 K349 I391	T346-D389 HydrophobicContact CG2-CB 4.18Å; K349-D389 WeakPolarHBondContact CE-OD2 3.33Å; K349-D389 IonicContact NZ-OD1 2.69Å; K349-D389 IonicContact NZ-OD2 3.63Å; K349-D389 PolarHBondContact NZ-OD2 2.92Å; D389-I391 PolarHBondContact O-N 2.82Å
390	E	81.9	Confident	80.3	Confident	59 Å²	59	44 Å²	44	28%	0.276	25%	0.246	S	C	.	.			trans	-59.3	128.7	172.8	-78.3	-164.5	154.1	0	0	111.4	R332 Y344 K382 G388	R332-E390 IonicContact CZ-OE1 2.85Å; R332-E390 IonicContact CZ-OE2 3.97Å; R332-E390 IonicContact NE-OE1 3.85Å; R332-E390 PolarHBondContact NE-OE1 2.93Å; R332-E390 VanDerWaalsContact NE-OE1 3.08Å; R332-E390 IonicContact NE-OE2 3.13Å; R332-E390 IonicContact NH2-OE1 3.92Å; R332-E390 IonicContact NH2-OE2 2.9Å; R332-E390 PolarHBondContact NH2-OE2 2.84Å; Y344-E390 HydrophobicContact CD1-CB 4.48Å; Y344-E390 WeakPolarHBondContact CD1-OE2 3.47Å; K382-E390 PolarHBondContact NZ-O 3.13Å; G388-E390 PolarHBondContact O-N 3.21Å
391	I	88.1	Confident	80.5	Confident	8 Å²	8	44.6 Å²	44.6	4%	0.041	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	140.6	162.9	-64.2	168.2	0	0	0	107.4	Y344 F345 L347 L356 K382 P384 D389 I393	Y344-I391 CarbonylContact C-O 3.54Å; Y344-I391 WeakPolarHBondContact CA-O 3.48Å; F345-I391 HydrophobicContact CD2-CB 4.28Å; F345-I391 HydrophobicContact CE2-CB 3.96Å; F345-I391 HydrophobicContact CE2-CD1 4.28Å; F345-I391 HydrophobicContact CE2-CG2 3.89Å; F345-I391 HydrophobicContact CZ-CB 4.32Å; F345-I391 HydrophobicContact CZ-CG2 3.82Å; F345-I391 PolarHBondContact N-O 3.01Å; F345-I391 PolarHBondContact O-N 3.01Å; L347-I391 HydrophobicContact CB-CD1 4.34Å; L347-I391 HydrophobicContact CD1-CD1 3.67Å; L347-I391 HydrophobicContact CG-CD1 3.82Å; L356-I391 HydrophobicContact CD2-CD1 3.81Å; L356-I391 HydrophobicContact CD2-CG1 4.21Å; L356-I391 HydrophobicContact CD2-CG2 3.91Å; K382-I391 WeakPolarHBondContact O-CA 3.34Å; P384-I391 HydrophobicContact CG-CD1 4.18Å; P384-I391 HydrophobicContact CG-CG1 3.76Å; D389-I391 PolarHBondContact O-N 2.82Å; I391-I393 HydrophobicContact CG2-CG2 4.41Å
392	A	89.8	Confident	80.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.3	173.9	0	0	0	0	0	110.6	I342 A343 Y344 I381 K382	I342-A392 HydrophobicContact CG2-CB 4.11Å; A343-A392 WeakPolarHBondContact O-CA 3.35Å; Y344-A392 HydrophobicContact CD1-CB 3.47Å; Y344-A392 VanDerWaalsContact CD1-CB 3.47Å; Y344-A392 HydrophobicContact CE1-CB 3.43Å; Y344-A392 VanDerWaalsContact CE1-CB 3.43Å; Y344-A392 HydrophobicContact CG-CB 4.06Å; I381-A392 HydrophobicContact CD1-CB 4.36Å; I381-A392 HydrophobicContact CG1-CB 3.96Å; I381-A392 WeakPolarHBondContact CG1-O 3.34Å; I381-A392 PolarHBondContact N-O 2.95Å; K382-A392 HydrophobicContact CB-CB 3.63Å; K382-A392 PolarHBondContact N-O 2.93Å; K382-A392 PolarHBondContact O-N 3.02Å
393	I	92	Very high	81.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	134.1	173	72	177.6	0	0	0	110.9	I342 A343 F345 I362 L364 H379 V380 I391 L395	I342-I393 WeakPolarHBondContact CA-O 3.39Å; I342-I393 WeakPolarHBondContact CG2-O 3.48Å; A343-I393 HydrophobicContact CB-CD1 4.49Å; A343-I393 HydrophobicContact CB-CG1 3.94Å; A343-I393 PolarHBondContact N-O 3.35Å; A343-I393 PolarHBondContact O-N 2.95Å; F345-I393 HydrophobicContact CE1-CD1 4Å; F345-I393 HydrophobicContact CE1-CG1 4.04Å; F345-I393 HydrophobicContact CE1-CG2 3.92Å; F345-I393 HydrophobicContact CZ-CG2 3.97Å; I362-I393 HydrophobicContact CB-CD1 4.38Å; I362-I393 HydrophobicContact CB-CG2 4.19Å; I362-I393 HydrophobicContact CD1-CG2 4Å; I362-I393 HydrophobicContact CG2-CD1 4.04Å; L364-I393 HydrophobicContact CB-CD1 4.02Å; L364-I393 HydrophobicContact CD2-CD1 4.36Å; H379-I393 CarbonylContact O-C 3.6Å; H379-I393 VanDerWaalsContact O-CA 3.25Å; H379-I393 WeakPolarHBondContact O-CA 3.39Å; V380-I393 HydrophobicContact CG2-CG2 4.12Å; I391-I393 HydrophobicContact CG2-CG2 4.41Å; I393-L395 HydrophobicContact CD1-CD2 4.11Å; I393-L395 HydrophobicContact CG1-CD2 4.37Å
394	E	90.4	Very high	82	Confident	11 Å²	11	48.2 Å²	48.2	5%	0.051	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.8	166.8	-179.2	-178.4	99.4	0	0	108.6	N338 K340 G378 H379 I381	N338-E394 PolarHBondContact ND2-OE2 3.31Å; K340-E394 HydrophobicContact CB-CG 3.93Å; K340-E394 HydrophobicContact CD-CG 3.65Å; K340-E394 WeakPolarHBondContact CD-OE1 3.29Å; K340-E394 WeakPolarHBondContact CD-OE2 3.02Å; K340-E394 WeakPolarHBondContact CE-OE1 3.38Å; K340-E394 IonicContact NZ-OE1 2.73Å; K340-E394 PolarHBondContact NZ-OE1 2.87Å; G378-E394 CarbonylContact C-O 3.6Å; G378-E394 WeakPolarHBondContact CA-O 3.45Å; H379-E394 PolarHBondContact N-O 3.43Å; H379-E394 PolarHBondContact O-N 3.09Å; I381-E394 HydrophobicContact CD1-CB 4.33Å; I381-E394 HydrophobicContact CG2-CB 3.88Å
395	L	89.6	Confident	83	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	141.9	177.3	-65.2	-173.2	0	0	0	111.7	W333 R341 W374 I393 S397 A401	W333-L395 HydrophobicContact CH2-CD1 4.04Å; W333-L395 HydrophobicContact CZ3-CD1 3.73Å; W333-L395 HydrophobicContact CZ3-CG 4.47Å; R341-L395 HydrophobicContact CB-CD1 4.26Å; R341-L395 HydrophobicContact CG-CD1 4.18Å; R341-L395 PolarHBondContact O-N 2.93Å; W374-L395 HydrophobicContact CH2-CD1 3.75Å; W374-L395 HydrophobicContact CH2-CD2 4.22Å; W374-L395 HydrophobicContact CZ2-CD1 3.87Å; I393-L395 HydrophobicContact CD1-CD2 4.11Å; I393-L395 HydrophobicContact CG1-CD2 4.37Å; L395-S397 WeakPolarHBondContact CB-O 3.41Å; L395-S397 PolarHBondContact O-N 3.23Å; L395-A401 HydrophobicContact CD1-CB 3.8Å
396	R	84.3	Confident	84.1	Confident	139 Å²	139	47.3 Å²	47.3	53%	0.525	26%	0.264	S	S	.	.	S	Bend	trans	-62.4	-28.9	174.3	-73.1	-177.2	177.9	-175.3	1.1	113.3	E361 I377	E361-R396 IonicContact OE1-CZ 4Å; E361-R396 IonicContact OE1-NE 2.7Å; E361-R396 IonicContact OE1-NH2 3.2Å; E361-R396 PolarHBondContact OE1-NH2 3.09Å; E361-R396 IonicContact OE2-CZ 2.7Å; E361-R396 IonicContact OE2-NH2 2.73Å; E361-R396 PolarHBondContact OE2-NH2 3.35Å; I377-R396 WeakPolarHBondContact O-CB 3.42Å; I377-R396 WeakPolarHBondContact O-CG 3.34Å; I377-R396 PolarHBondContact O-N 3.28Å
397	S	82.9	Confident	85.3	Confident	52 Å²	52	51.2 Å²	51.2	36%	0.364	28%	0.281	S	S	.	.			trans	-136.8	136.7	172.2	179.9	0	0	0	0	109.5	L395 V399	L395-S397 WeakPolarHBondContact CB-O 3.41Å; L395-S397 PolarHBondContact O-N 3.23Å; S397-V399 VanDerWaalsContact C-N 3.33Å; S397-V399 PolarHBondContact OG-N 3.43Å
398	S	77.8	Confident	86.6	Confident	40 Å²	40	48 Å²	48	28%	0.28	27%	0.273	S	S	.	.			trans	-82.5	-9.8	174.9	-60.2	0	0	0	0	113.2	R341	R341-S398 PolarHBondContact N-OG 2.82Å
399	V	81.3	Confident	88	Confident	122 Å²	122	47.1 Å²	47.1	74%	0.739	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	131.1	-170.8	-176.1	0	0	0	0	110.6	S397 A401	S397-V399 VanDerWaalsContact C-N 3.33Å; S397-V399 PolarHBondContact OG-N 3.43Å; V399-A401 PolarHBondContact O-N 3.49Å
400	G	83.3	Confident	88.9	Confident	60 Å²	60	45.8 Å²	45.8	62%	0.619	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	13.7	176.9	0	0	0	0	0	115.1	W374	W374-G400 PolarHBondContact NE1-O 3.29Å
401	A	91.3	Very high	89.2	Confident	11 Å²	11	43 Å²	43	9%	0.091	24%	0.242	C	C	.	.			trans	-68.5	127.3	168.7	0	0	0	0	0	109.4	W333 R341 W374 L395 V399 V403	W333-A401 HydrophobicContact CH2-CB 4.07Å; W333-A401 HydrophobicContact CZ3-CB 4.21Å; R341-A401 HydrophobicContact CG-CB 4.21Å; W374-A401 HydrophobicContact CZ2-CB 3.94Å; L395-A401 HydrophobicContact CD1-CB 3.8Å; V399-A401 PolarHBondContact O-N 3.49Å; A401-V403 PolarHBondContact O-N 3.45Å
402	P	93.3	Very high	89.1	Confident	8 Å²	8	43.5 Å²	43.5	5%	0.052	25%	0.245	C	C	.	.			trans	-81.7	86.5	-173.5	34.4	-36.5	0	0	0	109.4	W333 W374 E404 V405 F409	W333-P402 HydrophobicContact CZ2-CG 4.48Å; W333-P402 WeakPolarHBondContact CZ2-O 3.48Å; W333-P402 PolarHBondContact NE1-O 3.26Å; W374-P402 HydrophobicContact CB-CG 4.04Å; W374-P402 HydrophobicContact CD2-CG 3.96Å; W374-P402 HydrophobicContact CE3-CG 4.07Å; W374-P402 HydrophobicContact CG-CG 3.96Å; P402-E404 VanDerWaalsContact C-N 3.34Å; P402-E404 WeakPolarHBondContact CA-OE1 3.33Å; P402-E404 VanDerWaalsContact CB-OE1 3.24Å; P402-E404 WeakPolarHBondContact CB-OE1 3.38Å; P402-V405 HydrophobicContact CB-CG2 3.85Å; P402-V405 HydrophobicContact CG-CG2 4.17Å; P402-F409 HydrophobicContact CG-CE1 4.28Å; P402-F409 HydrophobicContact CG-CZ 4.27Å
403	V	93.5	Very high	88.7	Confident	55 Å²	55	44.5 Å²	44.5	33%	0.333	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-20.5	-172.5	-68.7	0	0	0	0	113.2	W333 R341 A401 V405	W333-V403 HydrophobicContact CB-CB 4.44Å; W333-V403 HydrophobicContact CB-CG1 4.34Å; W333-V403 VanDerWaalsContact CD1-O 3.27Å; W333-V403 HydrophobicContact CD2-CG1 4.06Å; W333-V403 HydrophobicContact CE3-CG1 4.3Å; W333-V403 HydrophobicContact CG-CB 4.2Å; W333-V403 HydrophobicContact CG-CG1 4.1Å; R341-V403 HydrophobicContact CG-CG1 4.42Å; A401-V403 PolarHBondContact O-N 3.45Å; V403-V405 VanDerWaalsContact C-N 3.35Å
404	E	92.1	Very high	88.3	Confident	136 Å²	136	46.8 Å²	46.8	64%	0.636	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-18	178	62.6	-68.1	154.6	0	0	113.9	P402	P402-E404 VanDerWaalsContact C-N 3.34Å; P402-E404 WeakPolarHBondContact CA-OE1 3.33Å; P402-E404 VanDerWaalsContact CB-OE1 3.24Å; P402-E404 WeakPolarHBondContact CB-OE1 3.38Å
405	V	93.6	Very high	88	Confident	11 Å²	11	48.8 Å²	48.8	7%	0.067	27%	0.271	C	S	.	.			trans	-111	142	175.5	-59.8	0	0	0	0	111.7	W333 Y366 L370 A371 P402 V403 F409	W333-V405 PolarHBondContact NE1-O 2.96Å; Y366-V405 HydrophobicContact CD2-CB 4.44Å; Y366-V405 HydrophobicContact CD2-CG2 3.56Å; Y366-V405 HydrophobicContact CE2-CB 3.78Å; Y366-V405 HydrophobicContact CE2-CG1 4.3Å; Y366-V405 HydrophobicContact CE2-CG2 3.37Å; Y366-V405 HydrophobicContact CG-CG2 4.24Å; L370-V405 HydrophobicContact CB-CG1 4.03Å; A371-V405 HydrophobicContact CB-CG1 3.87Å; A371-V405 HydrophobicContact CB-CG2 4.38Å; P402-V405 HydrophobicContact CB-CG2 3.85Å; P402-V405 HydrophobicContact CG-CG2 4.17Å; V403-V405 VanDerWaalsContact C-N 3.35Å; V405-F409 HydrophobicContact CG2-CE2 4.12Å; V405-F409 HydrophobicContact CG2-CZ 3.86Å; V405-F409 WeakPolarHBondContact O-CE2 3.12Å
406	T	93.4	Very high	87.7	Confident	62 Å²	62	52.4 Å²	52.4	38%	0.38	29%	0.287	S	S	.	.			trans	-124.7	-10.1	-172.4	53.2	0	0	0	0	114.4	T330 V331	T330-T406 CarbonylContact C-O 3.54Å; T330-T406 WeakPolarHBondContact CA-O 3.32Å; T330-T406 VanDerWaalsContact CG2-O 3.31Å; T330-T406 WeakPolarHBondContact CG2-O 3.43Å; V331-T406 PolarHBondContact N-O 2.77Å; V331-T406 WeakPolarHBondContact O-CB 3.22Å
407	H	92.4	Very high	87.9	Confident	100 Å²	100	47.6 Å²	47.6	46%	0.463	27%	0.274	S	S	.	.	S	Bend	trans	-121.6	174.7	-175.7	-69.2	76.1	0	0	0	111.2	T330 Y366 F409	T330-H407 PolarHBondContact OG1-CD2 3.02Å; Y366-H407 VanDerWaalsContact CE2-O 3.27Å; Y366-H407 WeakPolarHBondContact CE2-O 3.34Å; H407-F409 VanDerWaalsContact C-N 3.28Å; H407-F409 WeakPolarHBondContact O-CD2 3.2Å; H407-F409 PolarHBondContact O-N 3.36Å
408	N	91.4	Very high	88.4	Confident	66 Å²	66	48.1 Å²	48.1	35%	0.353	28%	0.275	S	S	.	.	S	Bend	trans	57	34.5	178.1	-63	-24.5	0	0	0	114.6	N328 Y366 K367 G368	N328-N408 PolarHBondContact OD1-OD1 3.26Å; Y366-N408 HydrophobicContact CE2-CB 4.49Å; K367-N408 PolarHBondContact N-O 3.13Å; G368-N408 PolarHBondContact N-O 3.48Å
409	F	93.8	Very high	89.1	Confident	1 Å²	1	48 Å²	48	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	154.9	167.9	-71.5	-94.5	0	0	0	112	N328 I329 V331 W333 L364 R365 Y366 W374 P402 V405 H407	N328-F409 PolarHBondContact N-O 2.89Å; N328-F409 VanDerWaalsContact N-O 3.1Å; I329-F409 HydrophobicContact CB-CB 4.36Å; I329-F409 PolarHBondContact N-O 3.08Å; I329-F409 WeakPolarHBondContact O-CB 3.42Å; I329-F409 PolarHBondContact O-N 3.46Å; I329-F409 VanDerWaalsContact O-N 3.14Å; V331-F409 HydrophobicContact CB-CD2 3.85Å; V331-F409 HydrophobicContact CB-CE2 3.93Å; V331-F409 HydrophobicContact CB-CG 4.34Å; V331-F409 HydrophobicContact CB-CZ 4.48Å; V331-F409 HydrophobicContact CG2-CB 3.84Å; V331-F409 HydrophobicContact CG2-CD1 4.11Å; V331-F409 HydrophobicContact CG2-CD2 3.51Å; V331-F409 HydrophobicContact CG2-CE2 4.04Å; V331-F409 HydrophobicContact CG2-CG 3.55Å; W333-F409 AromaticContact CZ2-CE1 3.89Å; W333-F409 HydrophobicContact CZ2-CE1 3.89Å; W333-F409 AromaticContact CZ2-CZ 3.74Å; W333-F409 HydrophobicContact CZ2-CZ 3.74Å; W333-F409 AromaticContact NE1-CZ 3.98Å; L364-F409 HydrophobicContact CD1-CB 3.98Å; L364-F409 HydrophobicContact CD1-CD1 3.95Å; L364-F409 HydrophobicContact CD1-CG 4.26Å; L364-F409 HydrophobicContact CD2-CD1 4.15Å; L364-F409 HydrophobicContact CD2-CE1 4.35Å; L364-F409 HydrophobicContact CG-CD1 3.84Å; L364-F409 HydrophobicContact CG-CE1 4.43Å; R365-F409 CarbonylContact O-C 3.35Å; R365-F409 WeakPolarHBondContact O-CA 3.37Å; R365-F409 WeakPolarHBondContact O-CB 3.01Å; R365-F409 VanDerWaalsContact O-CD1 3.28Å; R365-F409 WeakPolarHBondContact O-CD1 3.49Å; Y366-F409 HydrophobicContact CD2-CD1 4.34Å; Y366-F409 HydrophobicContact CD2-CD2 4.26Å; Y366-F409 HydrophobicContact CD2-CE1 4.05Å; Y366-F409 AromaticContact CD2-CE2 3.96Å; Y366-F409 HydrophobicContact CD2-CE2 3.96Å; Y366-F409 HydrophobicContact CD2-CG 4.44Å; Y366-F409 AromaticContact CD2-CZ 3.85Å; Y366-F409 HydrophobicContact CD2-CZ 3.85Å; Y366-F409 HydrophobicContact CE2-CE2 4.5Å; Y366-F409 HydrophobicContact CG-CE1 4.46Å; W374-F409 HydrophobicContact CE3-CE1 4.33Å; W374-F409 HydrophobicContact CZ3-CE1 4.31Å; P402-F409 HydrophobicContact CG-CE1 4.28Å; P402-F409 HydrophobicContact CG-CZ 4.27Å; V405-F409 HydrophobicContact CG2-CE2 4.12Å; V405-F409 HydrophobicContact CG2-CZ 3.86Å; V405-F409 WeakPolarHBondContact O-CE2 3.12Å; H407-F409 VanDerWaalsContact C-N 3.28Å; H407-F409 WeakPolarHBondContact O-CD2 3.2Å; H407-F409 PolarHBondContact O-N 3.36Å
410	Q	90.3	Very high	89.7	Confident	18 Å²	18	43.2 Å²	43.2	8%	0.084	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138	168.1	-176.8	-175.1	47.9	0	0	109.3	T325 Q326 D327 L364 R365 K367	T325-Q410 HydrophobicContact CG2-CG 3.69Å; Q326-Q410 CarbonylContact O-C 3.5Å; Q326-Q410 WeakPolarHBondContact O-CA 3.29Å; D327-Q410 WeakPolarHBondContact OD1-CB 3.42Å; D327-Q410 VanDerWaalsContact OD1-CG 3.32Å; D327-Q410 WeakPolarHBondContact OD1-CG 3.46Å; D327-Q410 PolarHBondContact OD1-NE2 3.28Å; D327-Q410 VanDerWaalsContact OD1-NE2 3.17Å; D327-Q410 PolarHBondContact OD2-NE2 2.86Å; L364-Q410 WeakPolarHBondContact CA-O 2.99Å; R365-Q410 HydrophobicContact CB-CB 4.34Å; R365-Q410 PolarHBondContact N-O 3.09Å; R365-Q410 PolarHBondContact O-N 3.34Å; K367-Q410 HydrophobicContact CD-CB 4.18Å; K367-Q410 VanDerWaalsContact CE-CD 3.43Å
411	V	89.4	Confident	90.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	108.4	176.9	171.4	0	0	0	0	109	T325 Q326 I329 F345 L347 I362 L364	T325-V411 WeakPolarHBondContact CA-O 3.38Å; Q326-V411 PolarHBondContact N-O 3.08Å; Q326-V411 PolarHBondContact O-N 2.77Å; I329-V411 HydrophobicContact CB-CG2 4.23Å; I329-V411 HydrophobicContact CG1-CB 4.37Å; I329-V411 HydrophobicContact CG1-CG2 3.93Å; I329-V411 HydrophobicContact CG2-CG2 4.08Å; F345-V411 HydrophobicContact CD2-CG2 4.13Å; F345-V411 HydrophobicContact CE2-CG1 4.07Å; F345-V411 HydrophobicContact CE2-CG2 3.91Å; F345-V411 HydrophobicContact CZ-CG1 4.27Å; F345-V411 HydrophobicContact CZ-CG2 4.12Å; L347-V411 HydrophobicContact CD1-CG1 4.38Å; L347-V411 HydrophobicContact CD2-CB 4.11Å; L347-V411 HydrophobicContact CD2-CG1 4.09Å; L347-V411 HydrophobicContact CD2-CG2 4.15Å; I362-V411 HydrophobicContact CD1-CG1 4.47Å; I362-V411 HydrophobicContact CG2-CG1 3.77Å; L364-V411 HydrophobicContact CD1-CG2 3.73Å
412	D	84.8	Confident	90.6	Very high	19 Å²	19	46 Å²	46	10%	0.102	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.4	170.2	-64.7	-31.6	0	0	0	110.3	T325 C363 R365	T325-D412 WeakPolarHBondContact CB-OD1 3.38Å; T325-D412 WeakPolarHBondContact CG2-OD1 3.48Å; T325-D412 PolarHBondContact OG1-OD1 2.98Å; C363-D412 HydrophobicContact CB-CB 3.98Å; C363-D412 PolarHBondContact N-O 2.84Å; C363-D412 PolarHBondContact O-N 2.95Å; R365-D412 IonicContact CZ-OD2 3.82Å; R365-D412 IonicContact NE-OD2 3.64Å; R365-D412 PolarHBondContact NE-OD2 3.04Å; R365-D412 IonicContact NH2-OD2 3.45Å; R365-D412 PolarHBondContact NH2-OD2 2.87Å
413	F	82.6	Confident	90.8	Very high	21 Å²	21	46.3 Å²	46.3	9%	0.092	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119.7	169.8	-64.9	-80.8	0	0	0	110.2	Q324 L347 M354 L356 I362 W415	Q324-F413 HydrophobicContact CB-CD2 3.61Å; Q324-F413 HydrophobicContact CB-CE2 3.74Å; Q324-F413 WeakPolarHBondContact O-CE2 3.38Å; L347-F413 HydrophobicContact CD1-CE1 4.28Å; L347-F413 HydrophobicContact CD1-CE2 4.35Å; L347-F413 HydrophobicContact CD1-CZ 3.54Å; M354-F413 HydrophobicContact CE-CB 4.5Å; M354-F413 HydrophobicContact CE-CD1 3.52Å; M354-F413 HydrophobicContact CE-CD2 3.99Å; M354-F413 HydrophobicContact CE-CE1 3.54Å; M354-F413 HydrophobicContact CE-CE2 4Å; M354-F413 HydrophobicContact CE-CG 3.73Å; M354-F413 HydrophobicContact CE-CZ 3.76Å; L356-F413 HydrophobicContact CD1-CD1 4.09Å; L356-F413 HydrophobicContact CD1-CE1 3.85Å; I362-F413 HydrophobicContact CD1-CD1 4.41Å; I362-F413 HydrophobicContact CD1-CE1 4.23Å; I362-F413 HydrophobicContact CG1-CD1 4.28Å; F413-W415 PolarHBondContact O-N 3.04Å; F413-W415 VanDerWaalsContact O-N 3.12Å
414	V	82.4	Confident	90.8	Very high	48 Å²	48	46.4 Å²	46.4	29%	0.291	24%	0.237	S	C	.	.			trans	-81.2	99.1	-178.9	-175.7	0	0	0	0	109.2	E361 C363	E361-V414 HydrophobicContact CB-CB 3.88Å; E361-V414 HydrophobicContact CB-CG1 4.4Å; E361-V414 HydrophobicContact CB-CG2 4.27Å; E361-V414 WeakPolarHBondContact O-CB 3.42Å; E361-V414 PolarHBondContact O-N 3.16Å; C363-V414 HydrophobicContact CB-CG2 3.7Å
415	W	84.1	Confident	91	Very high	54 Å²	54	43.2 Å²	43.2	21%	0.205	23%	0.23	C	C	.	.			trans	-60.9	148.4	170.4	-175.1	73.6	0	0	0	111.5	A314 D317 K318 K321 F413 S417 F420	A314-W415 HydrophobicContact CB-CZ2 4.36Å; D317-W415 PolarHBondContact OD2-NE1 2.79Å; K318-W415 HydrophobicContact CB-CD2 3.7Å; K318-W415 HydrophobicContact CB-CE3 4.11Å; K318-W415 HydrophobicContact CB-CG 4.09Å; K318-W415 HydrophobicContact CB-CH2 4.25Å; K318-W415 HydrophobicContact CB-CZ2 3.9Å; K318-W415 HydrophobicContact CB-CZ3 4.36Å; K318-W415 HydrophobicContact CD-CD2 4.34Å; K318-W415 HydrophobicContact CD-CE3 3.88Å; K318-W415 HydrophobicContact CD-CH2 4.33Å; K318-W415 HydrophobicContact CD-CZ3 3.87Å; K318-W415 HydrophobicContact CG-CD2 3.7Å; K318-W415 HydrophobicContact CG-CE3 3.73Å; K318-W415 HydrophobicContact CG-CG 4.07Å; K318-W415 HydrophobicContact CG-CZ3 4.16Å; K321-W415 HydrophobicContact CB-CB 4.12Å; K321-W415 HydrophobicContact CB-CG 4.48Å; F413-W415 PolarHBondContact O-N 3.04Å; F413-W415 VanDerWaalsContact O-N 3.12Å; W415-S417 VanDerWaalsContact CH2-CA 3.48Å; W415-S417 VanDerWaalsContact CH2-CB 3.5Å; W415-F420 AromaticContact CZ2-CD2 3.92Å; W415-F420 HydrophobicContact CZ2-CD2 3.92Å; W415-F420 HydrophobicContact CZ2-CE2 4.15Å
416	K	83.4	Confident	91.1	Very high	78 Å²	78	42.9 Å²	42.9	34%	0.339	23%	0.229	S	C	.	.			trans	-139.3	119.9	177.2	-66.9	-175	178.2	-179.8	0	110.5	E361 T418	E361-K416 IonicContact OE1-NZ 2.66Å; E361-K416 PolarHBondContact OE1-NZ 3.02Å; E361-K416 WeakPolarHBondContact OE2-CE 3.44Å; E361-K416 IonicContact OE2-NZ 2.73Å; E361-K416 PolarHBondContact OE2-NZ 2.97Å; K416-T418 PolarHBondContact O-N 2.86Å; K416-T418 VanDerWaalsContact O-N 3.13Å
417	S	90.1	Very high	91	Very high	38 Å²	38	40 Å²	40	27%	0.266	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.3	171.8	57.5	0	0	0	0	114.2	W415 S419 F420 D421	W415-S417 VanDerWaalsContact CH2-CA 3.48Å; W415-S417 VanDerWaalsContact CH2-CB 3.5Å; S417-S419 VanDerWaalsContact C-N 3.26Å; S417-S419 PolarHBondContact O-N 2.88Å; S417-F420 CarbonylContact O-C 3.54Å; S417-F420 WeakPolarHBondContact O-CA 3.46Å; S417-F420 WeakPolarHBondContact O-CB 3.42Å; S417-F420 PolarHBondContact O-N 2.81Å; S417-D421 WeakPolarHBondContact CB-OD1 3.33Å; S417-D421 WeakPolarHBondContact CB-OD2 3.39Å; S417-D421 VanDerWaalsContact O-CG 3.26Å; S417-D421 PolarHBondContact O-N 2.93Å; S417-D421 PolarHBondContact OG-OD1 3.06Å; S417-D421 PolarHBondContact OG-OD2 3.12Å
418	T	91.4	Very high	90.8	Very high	63 Å²	63	41.1 Å²	41.1	39%	0.387	21%	0.214	S	C	.	.	H	α-helix	trans	-56	-27.9	-162.9	-50.6	0	0	0	0	116.1	K416 D421 R422	K416-T418 PolarHBondContact O-N 2.86Å; K416-T418 VanDerWaalsContact O-N 3.13Å; T418-D421 WeakPolarHBondContact CA-OD2 3.16Å; T418-D421 PolarHBondContact N-OD2 3.19Å; T418-R422 WeakPolarHBondContact O-CD 3.31Å; T418-R422 WeakPolarHBondContact O-CG 3.39Å; T418-R422 PolarHBondContact O-N 2.66Å
419	S	92.8	Very high	90.6	Very high	38 Å²	38	40 Å²	40	27%	0.266	21%	0.21	S	C	.	.	H	α-helix	trans	-69.4	-53.5	170.7	41.4	0	0	0	0	111.2	S417 R422 M423	S417-S419 VanDerWaalsContact C-N 3.26Å; S417-S419 PolarHBondContact O-N 2.88Å; S419-R422 PolarHBondContact O-N 2.96Å; S419-M423 WeakPolarHBondContact O-CG 3.34Å; S419-M423 PolarHBondContact O-N 3.22Å
420	F	95.1	Very high	90.5	Very high	21 Å²	21	40 Å²	40	9%	0.092	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-41.5	178.7	-52.2	-76.5	0	0	0	112.1	V310 E313 A314 D317 W415 S417 R422 M423 Q424	V310-F420 HydrophobicContact CG1-CB 4.31Å; V310-F420 HydrophobicContact CG1-CD1 4.21Å; E313-F420 HydrophobicContact CB-CE1 4.19Å; E313-F420 HydrophobicContact CG-CE1 3.81Å; E313-F420 HydrophobicContact CG-CZ 4.37Å; A314-F420 HydrophobicContact CB-CB 3.76Å; A314-F420 HydrophobicContact CB-CD1 3.61Å; A314-F420 HydrophobicContact CB-CD2 3.79Å; A314-F420 HydrophobicContact CB-CE1 4.13Å; A314-F420 HydrophobicContact CB-CE2 4.28Å; A314-F420 HydrophobicContact CB-CG 3.43Å; A314-F420 VanDerWaalsContact CB-CG 3.43Å; A314-F420 HydrophobicContact CB-CZ 4.43Å; D317-F420 HydrophobicContact CB-CE2 4.32Å; D317-F420 HydrophobicContact CB-CZ 4.03Å; W415-F420 AromaticContact CZ2-CD2 3.92Å; W415-F420 HydrophobicContact CZ2-CD2 3.92Å; W415-F420 HydrophobicContact CZ2-CE2 4.15Å; S417-F420 CarbonylContact O-C 3.54Å; S417-F420 WeakPolarHBondContact O-CA 3.46Å; S417-F420 WeakPolarHBondContact O-CB 3.42Å; S417-F420 PolarHBondContact O-N 2.81Å; F420-R422 VanDerWaalsContact C-N 3.3Å; F420-R422 PolarHBondContact O-N 2.98Å; F420-M423 HydrophobicContact CB-CE 4.48Å; F420-M423 HydrophobicContact CD1-CE 3.53Å; F420-M423 HydrophobicContact CE1-CE 4.04Å; F420-M423 HydrophobicContact CG-CE 4.23Å; F420-M423 PolarHBondContact O-N 3.18Å; F420-Q424 VanDerWaalsContact O-CG 3.31Å; F420-Q424 WeakPolarHBondContact O-CG 3.48Å; F420-Q424 PolarHBondContact O-N 2.97Å
421	D	94.9	Very high	89.7	Confident	84 Å²	84	39.7 Å²	39.7	45%	0.449	21%	0.21	S	C	.	.	H	α-helix	trans	-56	-43.7	174.2	-62.7	-31.6	0	0	0	111.8	S417 T418 S425	S417-D421 WeakPolarHBondContact CB-OD1 3.33Å; S417-D421 WeakPolarHBondContact CB-OD2 3.39Å; S417-D421 VanDerWaalsContact O-CG 3.26Å; S417-D421 PolarHBondContact O-N 2.93Å; S417-D421 PolarHBondContact OG-OD1 3.06Å; S417-D421 PolarHBondContact OG-OD2 3.12Å; T418-D421 WeakPolarHBondContact CA-OD2 3.16Å; T418-D421 PolarHBondContact N-OD2 3.19Å; D421-S425 VanDerWaalsContact O-CB 3.26Å; D421-S425 WeakPolarHBondContact O-CB 3.26Å; D421-S425 PolarHBondContact O-N 2.86Å
422	R	97.1	Very high	88.9	Confident	45 Å²	45	44 Å²	44	17%	0.17	24%	0.236	C	C	.	.	H	α-helix	trans	-70.5	-38.1	179.2	-72.1	174.9	-173.3	-152	-2.9	111.6	T418 S419 F420 A426 V618 G621 D622 V648	T418-R422 WeakPolarHBondContact O-CD 3.31Å; T418-R422 WeakPolarHBondContact O-CG 3.39Å; T418-R422 PolarHBondContact O-N 2.66Å; S419-R422 PolarHBondContact O-N 2.96Å; F420-R422 VanDerWaalsContact C-N 3.3Å; F420-R422 PolarHBondContact O-N 2.98Å; R422-A426 WeakPolarHBondContact O-CB 3.22Å; R422-A426 PolarHBondContact O-N 3.42Å; R422-V618 WeakPolarHBondContact CD-O 3.42Å; R422-V618 PolarHBondContact NH1-O 3.24Å; R422-G621 VanDerWaalsContact CZ-C 3.48Å; R422-G621 PolarHBondContact NE-O 2.98Å; R422-G621 VanDerWaalsContact NE-O 3.13Å; R422-G621 VanDerWaalsContact NH1-C 3.32Å; R422-G621 PolarHBondContact NH1-O 3.1Å; R422-D622 IonicContact NH2-OD2 3.05Å; R422-V648 HydrophobicContact CB-CG1 4.3Å; R422-V648 HydrophobicContact CB-CG2 4.48Å
423	M	97.8	Very high	88.7	Confident	15 Å²	15	46 Å²	46	7%	0.074	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-49.6	173.2	-69.3	-172.9	-70.5	0	0	111.4	V310 S419 F420 S425 A426 L427 P644 E645 V648	V310-M423 HydrophobicContact CG1-CB 4.08Å; V310-M423 HydrophobicContact CG1-CE 4.2Å; S419-M423 WeakPolarHBondContact O-CG 3.34Å; S419-M423 PolarHBondContact O-N 3.22Å; F420-M423 HydrophobicContact CB-CE 4.48Å; F420-M423 HydrophobicContact CD1-CE 3.53Å; F420-M423 HydrophobicContact CE1-CE 4.04Å; F420-M423 HydrophobicContact CG-CE 4.23Å; F420-M423 PolarHBondContact O-N 3.18Å; M423-S425 VanDerWaalsContact C-N 3.33Å; M423-S425 PolarHBondContact O-N 2.91Å; M423-A426 PolarHBondContact O-N 3.38Å; M423-A426 VanDerWaalsContact O-N 3.11Å; M423-L427 WeakPolarHBondContact O-CG 3.03Å; M423-L427 PolarHBondContact O-N 2.92Å; M423-P644 HydrophobicContact CB-CB 4.07Å; M423-P644 HydrophobicContact CG-CB 4.28Å; M423-P644 HydrophobicContact SD-CB 4.11Å; M423-E645 HydrophobicContact SD-CB 3.84Å; M423-V648 HydrophobicContact CG-CG2 3.96Å
424	Q	94.6	Very high	88.4	Confident	56 Å²	56	53.4 Å²	53.4	26%	0.262	28%	0.282	S	S	.	.	H	α-helix	trans	-59.3	-42.3	175.4	-66.3	-69.4	6.1	0	0	112.1	G307 V310 F420 A426 L427 K428	G307-Q424 PolarHBondContact O-NE2 3.12Å; V310-Q424 HydrophobicContact CG1-CG 3.94Å; F420-Q424 VanDerWaalsContact O-CG 3.31Å; F420-Q424 WeakPolarHBondContact O-CG 3.48Å; F420-Q424 PolarHBondContact O-N 2.97Å; Q424-A426 VanDerWaalsContact C-N 3.33Å; Q424-A426 PolarHBondContact O-N 2.97Å; Q424-L427 PolarHBondContact O-N 2.78Å; Q424-K428 WeakPolarHBondContact O-CB 3.48Å; Q424-K428 PolarHBondContact O-N 3.45Å
425	S	95.3	Very high	88.5	Confident	70 Å²	70	55 Å²	55	49%	0.49	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-37.1	175.2	-170.5	0	0	0	0	111.9	D421 M423 K428 T429	D421-S425 VanDerWaalsContact O-CB 3.26Å; D421-S425 WeakPolarHBondContact O-CB 3.26Å; D421-S425 PolarHBondContact O-N 2.86Å; M423-S425 VanDerWaalsContact C-N 3.33Å; M423-S425 PolarHBondContact O-N 2.91Å; S425-K428 PolarHBondContact O-N 3.09Å; S425-T429 WeakPolarHBondContact O-CB 3.42Å; S425-T429 PolarHBondContact O-N 2.95Å; S425-T429 PolarHBondContact O-OG1 3.11Å; S425-T429 VanDerWaalsContact O-OG1 3.07Å
426	A	96.9	Very high	88.8	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.033	28%	0.283	C	S	.	.	H	α-helix	trans	-69.3	-42.6	177.6	0	0	0	0	0	111.8	R422 M423 Q424 K428 T429 F430 V648 V651	R422-A426 WeakPolarHBondContact O-CB 3.22Å; R422-A426 PolarHBondContact O-N 3.42Å; M423-A426 PolarHBondContact O-N 3.38Å; M423-A426 VanDerWaalsContact O-N 3.11Å; Q424-A426 VanDerWaalsContact C-N 3.33Å; Q424-A426 PolarHBondContact O-N 2.97Å; A426-K428 VanDerWaalsContact C-N 3.31Å; A426-K428 PolarHBondContact O-N 2.95Å; A426-T429 PolarHBondContact O-N 3.46Å; A426-F430 WeakPolarHBondContact O-CB 3.42Å; A426-F430 PolarHBondContact O-N 3.23Å; A426-V648 HydrophobicContact CB-CB 4.4Å; A426-V648 HydrophobicContact CB-CG2 4.03Å; A426-V651 HydrophobicContact CB-CG2 3.94Å
427	L	90.9	Very high	89.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.8	-44.2	172.2	-64.6	175.9	0	0	0	111.2	Y302 Q303 F306 V310 M423 Q424 F430 A431 P644	Y302-L427 HydrophobicContact CD1-CD2 4.08Å; Y302-L427 HydrophobicContact CE1-CD2 3.54Å; Q303-L427 HydrophobicContact CB-CB 4.49Å; Q303-L427 HydrophobicContact CG-CB 4.13Å; F306-L427 HydrophobicContact CB-CD1 3.73Å; F306-L427 HydrophobicContact CB-CD2 3.95Å; V310-L427 HydrophobicContact CG2-CD1 4.35Å; M423-L427 WeakPolarHBondContact O-CG 3.03Å; M423-L427 PolarHBondContact O-N 2.92Å; Q424-L427 PolarHBondContact O-N 2.78Å; L427-F430 PolarHBondContact O-N 2.99Å; L427-A431 PolarHBondContact O-N 2.91Å; L427-A431 VanDerWaalsContact O-N 3.16Å; L427-P644 HydrophobicContact CD1-CB 4.36Å; L427-P644 HydrophobicContact CD2-CB 4.31Å; L427-P644 HydrophobicContact CD2-CG 4.46Å; L427-P644 HydrophobicContact CG-CB 4.44Å
428	K	86.7	Confident	89.5	Confident	124 Å²	124	48.5 Å²	48.5	54%	0.539	26%	0.264	S	S	.	.	H	α-helix	trans	-64.9	-42.3	175.6	-176.3	176.2	178.3	176.5	0	112.8	Q424 S425 A426 F430 A431 V432	Q424-K428 WeakPolarHBondContact O-CB 3.48Å; Q424-K428 PolarHBondContact O-N 3.45Å; S425-K428 PolarHBondContact O-N 3.09Å; A426-K428 VanDerWaalsContact C-N 3.31Å; A426-K428 PolarHBondContact O-N 2.95Å; K428-F430 VanDerWaalsContact C-N 3.34Å; K428-A431 PolarHBondContact O-N 3.25Å; K428-V432 HydrophobicContact CG-CG2 4.23Å; K428-V432 WeakPolarHBondContact O-CB 3.4Å; K428-V432 WeakPolarHBondContact O-CG2 3.49Å; K428-V432 PolarHBondContact O-N 2.92Å
429	T	89.1	Confident	89.3	Confident	42 Å²	42	47.6 Å²	47.6	26%	0.258	27%	0.267	S	S	.	.	H	α-helix	trans	-63.5	-41	176.2	-66.5	0	0	0	0	110.9	S425 A426 A431 V432 D433 V651	S425-T429 WeakPolarHBondContact O-CB 3.42Å; S425-T429 PolarHBondContact O-N 2.95Å; S425-T429 PolarHBondContact O-OG1 3.11Å; S425-T429 VanDerWaalsContact O-OG1 3.07Å; A426-T429 PolarHBondContact O-N 3.46Å; T429-A431 VanDerWaalsContact C-N 3.29Å; T429-A431 PolarHBondContact O-N 3.44Å; T429-V432 PolarHBondContact O-N 3.16Å; T429-D433 HydrophobicContact CG2-CB 3.99Å; T429-D433 WeakPolarHBondContact O-CA 3.43Å; T429-D433 WeakPolarHBondContact O-CB 3.35Å; T429-D433 PolarHBondContact O-N 2.91Å; T429-V651 HydrophobicContact CG2-CB 3.89Å; T429-V651 HydrophobicContact CG2-CG2 4.18Å
430	F	90.9	Very high	89.4	Confident	3 Å²	3	47.4 Å²	47.4	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-32.8	176.3	-177.8	-120.8	0	0	0	113.4	A299 Y302 A426 L427 K428 V437 Y442 L445 L446 M647 V651	A299-F430 HydrophobicContact CB-CD1 3.6Å; A299-F430 HydrophobicContact CB-CE1 3.63Å; A299-F430 HydrophobicContact CB-CG 4.21Å; A299-F430 HydrophobicContact CB-CZ 4.24Å; A299-F430 WeakPolarHBondContact CB-O 3.34Å; Y302-F430 AromaticContact CD1-CD1 3.6Å; Y302-F430 HydrophobicContact CD1-CD1 3.6Å; Y302-F430 AromaticContact CD1-CE1 3.68Å; Y302-F430 HydrophobicContact CD1-CE1 3.68Å; Y302-F430 HydrophobicContact CD2-CE1 4.49Å; Y302-F430 AromaticContact CE1-CD1 3.77Å; Y302-F430 HydrophobicContact CE1-CD1 3.77Å; Y302-F430 AromaticContact CE1-CE1 3.89Å; Y302-F430 HydrophobicContact CE1-CE1 3.89Å; Y302-F430 HydrophobicContact CG-CD1 4.35Å; Y302-F430 AromaticContact CG-CE1 4Å; Y302-F430 HydrophobicContact CG-CE1 4Å; A426-F430 WeakPolarHBondContact O-CB 3.42Å; A426-F430 PolarHBondContact O-N 3.23Å; L427-F430 PolarHBondContact O-N 2.99Å; K428-F430 VanDerWaalsContact C-N 3.34Å; F430-V437 HydrophobicContact CD2-CG2 4.19Å; F430-V437 HydrophobicContact CE2-CG2 4.02Å; F430-Y442 HydrophobicContact CD2-CD2 4.38Å; F430-Y442 AromaticContact CE2-CD2 3.69Å; F430-Y442 HydrophobicContact CE2-CD2 3.69Å; F430-Y442 HydrophobicContact CE2-CE2 4.25Å; F430-Y442 HydrophobicContact CZ-CD2 4.03Å; F430-Y442 HydrophobicContact CZ-CE2 4.32Å; F430-L445 HydrophobicContact CE2-CD1 4.06Å; F430-L445 HydrophobicContact CZ-CB 4.23Å; F430-L445 HydrophobicContact CZ-CD1 4.3Å; F430-L446 HydrophobicContact CE1-CD2 3.82Å; F430-L446 HydrophobicContact CZ-CD2 4Å; F430-L446 HydrophobicContact CZ-CG 4.28Å; F430-M647 HydrophobicContact CB-CE 4.06Å; F430-M647 HydrophobicContact CD1-CE 3.95Å; F430-M647 HydrophobicContact CD2-CE 3.49Å; F430-M647 VanDerWaalsContact CD2-CE 3.49Å; F430-M647 HydrophobicContact CE1-CE 4.24Å; F430-M647 HydrophobicContact CE2-CE 3.82Å; F430-M647 HydrophobicContact CG-CE 3.56Å; F430-M647 HydrophobicContact CZ-CE 4.19Å; F430-V651 HydrophobicContact CB-CG1 3.87Å
431	A	72.6	Confident	89.4	Confident	11 Å²	11	46.4 Å²	46.4	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-80.8	-33.9	176.7	0	0	0	0	0	114.5	A299 Y300 Q303 L427 K428 T429	A299-A431 HydrophobicContact CB-CB 4.24Å; Y300-A431 HydrophobicContact CD1-CB 3.97Å; Y300-A431 HydrophobicContact CE1-CB 4.06Å; Y300-A431 VanDerWaalsContact CE2-O 3.29Å; Y300-A431 WeakPolarHBondContact CE2-O 3.15Å; Y300-A431 HydrophobicContact CG-CB 4.24Å; Y300-A431 VanDerWaalsContact CZ-O 3.24Å; Y300-A431 PolarHBondContact OH-O 2.63Å; Q303-A431 HydrophobicContact CB-CB 4.32Å; Q303-A431 VanDerWaalsContact OE1-CB 3.31Å; L427-A431 PolarHBondContact O-N 2.91Å; L427-A431 VanDerWaalsContact O-N 3.16Å; K428-A431 PolarHBondContact O-N 3.25Å; T429-A431 VanDerWaalsContact C-N 3.29Å; T429-A431 PolarHBondContact O-N 3.44Å
432	V	74	Confident	89.4	Confident	89 Å²	89	45.1 Å²	45.1	54%	0.539	25%	0.246	S	C	.	.	H	α-helix	trans	-106.4	-24.9	-169	-179.2	0	0	0	0	113.6	Y300 K428 T429	Y300-V432 HydrophobicContact CE1-CG2 4.24Å; K428-V432 HydrophobicContact CG-CG2 4.23Å; K428-V432 WeakPolarHBondContact O-CB 3.4Å; K428-V432 WeakPolarHBondContact O-CG2 3.49Å; K428-V432 PolarHBondContact O-N 2.92Å; T429-V432 PolarHBondContact O-N 3.16Å
433	D	79.3	Confident	88.9	Confident	62 Å²	62	46.5 Å²	46.5	33%	0.332	25%	0.254	S	S	.	.			trans	-111.8	96.4	-178.4	-177.5	-3.3	0	0	0	111	T429 T435 S436	T429-D433 HydrophobicContact CG2-CB 3.99Å; T429-D433 WeakPolarHBondContact O-CA 3.43Å; T429-D433 WeakPolarHBondContact O-CB 3.35Å; T429-D433 PolarHBondContact O-N 2.91Å; D433-T435 PolarHBondContact O-N 3.43Å; D433-T435 VanDerWaalsContact O-N 3.11Å; D433-T435 WeakPolarHBondContact OD1-CA 3.22Å; D433-T435 WeakPolarHBondContact OD1-CB 3.26Å; D433-T435 PolarHBondContact OD1-N 2.82Å; D433-T435 PolarHBondContact OD1-OG1 2.98Å; D433-S436 WeakPolarHBondContact O-CB 3.18Å; D433-S436 PolarHBondContact O-N 2.78Å; D433-S436 VanDerWaalsContact O-N 3.09Å; D433-S436 PolarHBondContact O-OG 2.76Å; D433-S436 PolarHBondContact OD1-N 2.67Å
434	E	77.2	Confident	88.7	Confident	177 Å²	177	47 Å²	47	83%	0.827	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.4	174.7	61.4	178.2	-159.7	0	0	114.3
435	T	84.8	Confident	88.7	Confident	82 Å²	82	44.4 Å²	44.4	50%	0.503	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-13.3	178	76.8	0	0	0	0	113.3	D433 V437	D433-T435 PolarHBondContact O-N 3.43Å; D433-T435 VanDerWaalsContact O-N 3.11Å; D433-T435 WeakPolarHBondContact OD1-CA 3.22Å; D433-T435 WeakPolarHBondContact OD1-CB 3.26Å; D433-T435 PolarHBondContact OD1-N 2.82Å; D433-T435 PolarHBondContact OD1-OG1 2.98Å; T435-V437 PolarHBondContact O-N 2.79Å
436	S	89.2	Confident	88.5	Confident	1 Å²	1	41 Å²	41	1%	0.007	22%	0.22	C	C	.	.	S	Bend	trans	-60.3	-25.5	-178.8	68	0	0	0	0	114	D433 V651 G653 A654	D433-S436 WeakPolarHBondContact O-CB 3.18Å; D433-S436 PolarHBondContact O-N 2.78Å; D433-S436 VanDerWaalsContact O-N 3.09Å; D433-S436 PolarHBondContact O-OG 2.76Å; D433-S436 PolarHBondContact OD1-N 2.67Å; S436-V651 VanDerWaalsContact CB-O 3.32Å; S436-V651 WeakPolarHBondContact CB-O 3.24Å; S436-V651 CarbonylContact O-C 3.55Å; S436-V651 VanDerWaalsContact O-C 3.28Å; S436-V651 WeakPolarHBondContact O-CA 3.25Å; S436-G653 CarbonylContact O-C 3.46Å; S436-G653 WeakPolarHBondContact O-CA 3.19Å; S436-G653 PolarHBondContact O-N 2.86Å; S436-A654 PolarHBondContact O-N 3.14Å
437	V	93.9	Very high	88.1	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.036	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-142	157.5	173.4	-67.6	0	0	0	0	110.4	F430 T435 I441 Y442 V650 A654	F430-V437 HydrophobicContact CD2-CG2 4.19Å; F430-V437 HydrophobicContact CE2-CG2 4.02Å; T435-V437 PolarHBondContact O-N 2.79Å; V437-I441 HydrophobicContact CB-CG2 4.25Å; V437-I441 HydrophobicContact CG1-CG2 4.3Å; V437-Y442 HydrophobicContact CG2-CD2 4.15Å; V437-V650 HydrophobicContact CG1-CG1 3.75Å; V437-A654 HydrophobicContact CG1-CB 4.43Å
438	S	94.8	Very high	88	Confident	25 Å²	25	43.8 Å²	43.8	18%	0.175	23%	0.233	C	C	.	.			trans	-68.2	143.9	166.5	64.5	0	0	0	0	111.6	Y440 I441 Y442 A654	S438-Y440 PolarHBondContact O-N 3.03Å; S438-Y440 VanDerWaalsContact O-N 3.12Å; S438-I441 WeakPolarHBondContact O-CA 3.48Å; S438-I441 WeakPolarHBondContact O-CB 3.13Å; S438-I441 PolarHBondContact O-N 3.46Å; S438-I441 WeakPolarHBondContact OG-CG1 3.35Å; S438-Y442 PolarHBondContact O-N 3.21Å; S438-A654 PolarHBondContact N-O 2.86Å; S438-A654 PolarHBondContact OG-O 2.65Å
439	G	87.9	Confident	88	Confident	44 Å²	44	46.1 Å²	46.1	45%	0.454	25%	0.245	S	C	.	.	H	α-helix	trans	-54.5	-32.4	-179.8	0	0	0	0	0	115	Y442 H443	G439-Y442 WeakPolarHBondContact O-CB 3.48Å; G439-Y442 PolarHBondContact O-N 3Å; G439-H443 PolarHBondContact O-CD2 3.43Å; G439-H443 PolarHBondContact O-N 3.16Å
440	Y	94.4	Very high	88	Confident	34 Å²	34	46.1 Å²	46.1	13%	0.133	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-43.7	171.8	176.1	-87.2	0	0	0	112.2	S438 K444 V450 E451 V453 P486 L487	S438-Y440 PolarHBondContact O-N 3.03Å; S438-Y440 VanDerWaalsContact O-N 3.12Å; Y440-K444 HydrophobicContact CD1-CG 4.29Å; Y440-K444 HydrophobicContact CE1-CG 3.93Å; Y440-K444 HydrophobicContact CE2-CG 4.24Å; Y440-K444 VanDerWaalsContact CZ-CE 3.44Å; Y440-K444 WeakPolarHBondContact O-CB 3.48Å; Y440-K444 VanDerWaalsContact O-CG 3.29Å; Y440-K444 WeakPolarHBondContact O-CG 3.32Å; Y440-K444 PolarHBondContact O-N 3.06Å; Y440-K444 WeakPolarHBondContact OH-CE 3.49Å; Y440-V450 HydrophobicContact CD2-CG1 3.74Å; Y440-V450 HydrophobicContact CE2-CG1 4.05Å; Y440-E451 WeakPolarHBondContact CE2-O 3.34Å; Y440-V453 HydrophobicContact CD2-CB 3.95Å; Y440-V453 HydrophobicContact CD2-CG2 3.56Å; Y440-V453 HydrophobicContact CE2-CB 3.93Å; Y440-V453 HydrophobicContact CE2-CG2 3.84Å; Y440-V453 HydrophobicContact CG-CG2 4.44Å; Y440-P486 HydrophobicContact CD1-CB 3.59Å; Y440-P486 HydrophobicContact CD1-CG 3.8Å; Y440-P486 HydrophobicContact CE1-CB 3.75Å; Y440-P486 HydrophobicContact CE1-CG 3.78Å; Y440-P486 HydrophobicContact CG-CB 4.42Å; Y440-P486 HydrophobicContact CG-CG 4.31Å; Y440-L487 HydrophobicContact CE1-CB 4.07Å
441	I	95.8	Very high	88	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-43.9	176.9	-69.7	176.3	0	0	0	109.7	V437 S438 H443 K444 L445 A654 L657	V437-I441 HydrophobicContact CB-CG2 4.25Å; V437-I441 HydrophobicContact CG1-CG2 4.3Å; S438-I441 WeakPolarHBondContact O-CA 3.48Å; S438-I441 WeakPolarHBondContact O-CB 3.13Å; S438-I441 PolarHBondContact O-N 3.46Å; S438-I441 WeakPolarHBondContact OG-CG1 3.35Å; I441-H443 PolarHBondContact O-N 2.65Å; I441-K444 PolarHBondContact O-N 2.86Å; I441-L445 HydrophobicContact CG2-CD1 3.58Å; I441-L445 HydrophobicContact CG2-CG 3.99Å; I441-L445 VanDerWaalsContact O-CB 3.3Å; I441-L445 WeakPolarHBondContact O-CB 3.3Å; I441-L445 WeakPolarHBondContact O-CG 3.4Å; I441-L445 PolarHBondContact O-N 3.09Å; I441-A654 HydrophobicContact CD1-CB 4.23Å; I441-L657 HydrophobicContact CD1-CB 3.98Å
442	Y	93.3	Very high	88.8	Confident	57 Å²	57	59 Å²	59	22%	0.224	31%	0.307	C	S	.	.	H	α-helix	trans	-49.6	-57.4	174	-177.9	-95	0	0	0	111.9	A299 F430 V437 S438 G439 L445 L446	A299-Y442 HydrophobicContact CB-CE2 3.61Å; A299-Y442 PolarHBondContact N-OH 2.73Å; F430-Y442 HydrophobicContact CD2-CD2 4.38Å; F430-Y442 AromaticContact CE2-CD2 3.69Å; F430-Y442 HydrophobicContact CE2-CD2 3.69Å; F430-Y442 HydrophobicContact CE2-CE2 4.25Å; F430-Y442 HydrophobicContact CZ-CD2 4.03Å; F430-Y442 HydrophobicContact CZ-CE2 4.32Å; V437-Y442 HydrophobicContact CG2-CD2 4.15Å; S438-Y442 PolarHBondContact O-N 3.21Å; G439-Y442 WeakPolarHBondContact O-CB 3.48Å; G439-Y442 PolarHBondContact O-N 3Å; Y442-L445 PolarHBondContact O-N 3.04Å; Y442-L446 HydrophobicContact CD1-CD1 3.92Å; Y442-L446 HydrophobicContact CE1-CD1 3.38Å; Y442-L446 HydrophobicContact CE1-CG 4.49Å; Y442-L446 HydrophobicContact CE2-CD1 4.23Å; Y442-L446 WeakPolarHBondContact O-CG 3.49Å; Y442-L446 PolarHBondContact O-N 3.16Å
443	H	88.4	Confident	89.7	Confident	74 Å²	74	58.1 Å²	58.1	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-66.7	-40.9	-178.4	-69.7	-53.4	0	0	0	113.5	G439 I441 L445 L446 G447 H448 V450	G439-H443 PolarHBondContact O-CD2 3.43Å; G439-H443 PolarHBondContact O-N 3.16Å; I441-H443 PolarHBondContact O-N 2.65Å; H443-L445 VanDerWaalsContact C-N 3.3Å; H443-L445 PolarHBondContact O-N 3.31Å; H443-L446 PolarHBondContact O-N 3.35Å; H443-G447 PolarHBondContact O-N 3.09Å; H443-H448 HydrophobicContact CB-CB 4.1Å; H443-H448 AromaticContact CE1-ND1 3.97Å; H443-H448 AromaticContact ND1-CE1 3.76Å; H443-H448 AromaticContact ND1-CG 3.98Å; H443-H448 AromaticContact ND1-ND1 3.15Å; H443-H448 PolarHBondContact ND1-ND1 3.11Å; H443-H448 VanDerWaalsContact ND1-ND1 3.15Å; H443-H448 PolarHBondContact O-N 3.44Å; H443-V450 HydrophobicContact CB-CG2 3.42Å; H443-V450 VanDerWaalsContact CB-CG2 3.42Å
444	K	93.3	Very high	90.4	Very high	27 Å²	27	61.1 Å²	61.1	12%	0.117	32%	0.316	C	S	.	.	H	α-helix	trans	-67.7	-27.6	175.2	-68.1	-72.1	-156.1	-174.2	0	112.6	Y440 I441 V450 D452 L487 L688	Y440-K444 HydrophobicContact CD1-CG 4.29Å; Y440-K444 HydrophobicContact CE1-CG 3.93Å; Y440-K444 HydrophobicContact CE2-CG 4.24Å; Y440-K444 VanDerWaalsContact CZ-CE 3.44Å; Y440-K444 WeakPolarHBondContact O-CB 3.48Å; Y440-K444 VanDerWaalsContact O-CG 3.29Å; Y440-K444 WeakPolarHBondContact O-CG 3.32Å; Y440-K444 PolarHBondContact O-N 3.06Å; Y440-K444 WeakPolarHBondContact OH-CE 3.49Å; I441-K444 PolarHBondContact O-N 2.86Å; K444-V450 HydrophobicContact CD-CB 4.04Å; K444-V450 HydrophobicContact CD-CG2 4.19Å; K444-V450 HydrophobicContact CG-CB 4.4Å; K444-V450 HydrophobicContact CG-CG2 4.3Å; K444-V450 PolarHBondContact NZ-O 3.43Å; K444-D452 IonicContact NZ-OD1 3.38Å; K444-D452 PolarHBondContact NZ-OD1 3.15Å; K444-L487 HydrophobicContact CB-CD2 3.96Å; K444-L688 WeakPolarHBondContact O-CD2 3.22Å
445	L	94.7	Very high	91.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-73.5	-47.4	173.6	-73.5	174	0	0	0	111.5	F430 I441 Y442 H443 G447 M647 V650 L684 R687 L688	F430-L445 HydrophobicContact CE2-CD1 4.06Å; F430-L445 HydrophobicContact CZ-CB 4.23Å; F430-L445 HydrophobicContact CZ-CD1 4.3Å; I441-L445 HydrophobicContact CG2-CD1 3.58Å; I441-L445 HydrophobicContact CG2-CG 3.99Å; I441-L445 VanDerWaalsContact O-CB 3.3Å; I441-L445 WeakPolarHBondContact O-CB 3.3Å; I441-L445 WeakPolarHBondContact O-CG 3.4Å; I441-L445 PolarHBondContact O-N 3.09Å; Y442-L445 PolarHBondContact O-N 3.04Å; H443-L445 VanDerWaalsContact C-N 3.3Å; H443-L445 PolarHBondContact O-N 3.31Å; L445-G447 PolarHBondContact O-N 3.33Å; L445-M647 HydrophobicContact CD1-CE 3.99Å; L445-M647 HydrophobicContact CD1-SD 4.05Å; L445-V650 HydrophobicContact CD1-CG1 4.15Å; L445-L684 HydrophobicContact CD2-CD1 3.67Å; L445-L684 HydrophobicContact CD2-CD2 4.04Å; L445-L684 HydrophobicContact CD2-CG 4.41Å; L445-R687 PolarHBondContact O-NH1 3.43Å; L445-R687 PolarHBondContact O-NH2 3.14Å; L445-L688 HydrophobicContact CD2-CD1 4.41Å
446	L	90.3	Very high	91.4	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-16.2	173.8	-62.8	179.7	0	0	0	112.9	R295 Y296 A299 Y302 F430 Y442 H443 H448	R295-L446 CarbonylContact C-O 3.59Å; R295-L446 VanDerWaalsContact CA-O 3.3Å; R295-L446 WeakPolarHBondContact CA-O 3.2Å; Y296-L446 PolarHBondContact N-O 2.72Å; A299-L446 HydrophobicContact CB-CD2 4.43Å; Y302-L446 HydrophobicContact CD2-CD2 4.4Å; Y302-L446 HydrophobicContact CG-CD2 4.38Å; F430-L446 HydrophobicContact CE1-CD2 3.82Å; F430-L446 HydrophobicContact CZ-CD2 4Å; F430-L446 HydrophobicContact CZ-CG 4.28Å; Y442-L446 HydrophobicContact CD1-CD1 3.92Å; Y442-L446 HydrophobicContact CE1-CD1 3.38Å; Y442-L446 HydrophobicContact CE1-CG 4.49Å; Y442-L446 HydrophobicContact CE2-CD1 4.23Å; Y442-L446 WeakPolarHBondContact O-CG 3.49Å; Y442-L446 PolarHBondContact O-N 3.16Å; H443-L446 PolarHBondContact O-N 3.35Å; L446-H448 WeakPolarHBondContact CB-NE2 3.39Å
447	G	89.6	Confident	91.4	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.01	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	23	175	0	0	0	0	0	114.4	R295 H443 L445	R295-G447 WeakPolarHBondContact CD-O 3.42Å; R295-G447 WeakPolarHBondContact CG-O 3.38Å; R295-G447 PolarHBondContact NE-O 2.87Å; H443-G447 PolarHBondContact O-N 3.09Å; L445-G447 PolarHBondContact O-N 3.33Å
448	H	87.1	Confident	91.3	Very high	61 Å²	61	70 Å²	70	28%	0.282	35%	0.352	S	S	.	.			trans	-70.7	158	172.7	-59.2	-166.7	0	0	0	110.1	Y296 E297 H443 L446	Y296-H448 PolarHBondContact O-CD2 3.12Å; Y296-H448 PolarHBondContact O-NE2 2.85Å; E297-H448 PolarHBondContact O-CE1 3.23Å; E297-H448 PolarHBondContact O-NE2 2.9Å; H443-H448 HydrophobicContact CB-CB 4.1Å; H443-H448 AromaticContact CE1-ND1 3.97Å; H443-H448 AromaticContact ND1-CE1 3.76Å; H443-H448 AromaticContact ND1-CG 3.98Å; H443-H448 AromaticContact ND1-ND1 3.15Å; H443-H448 PolarHBondContact ND1-ND1 3.11Å; H443-H448 VanDerWaalsContact ND1-ND1 3.15Å; H443-H448 PolarHBondContact O-N 3.44Å; L446-H448 WeakPolarHBondContact CB-NE2 3.39Å
449	E	87.3	Confident	91.2	Very high	173 Å²	173	71.7 Å²	71.7	81%	0.808	36%	0.359	S	S	*	.			trans	-78.4	128.8	171.7	-60.3	-168.2	173.9	0	0	110	R295	R295-E449 IonicContact NH2-OE1 2.89Å
450	V	90.6	Very high	91.5	Very high	42 Å²	42	71.3 Å²	71.3	26%	0.255	35%	0.348	S	S	.	.			trans	-145.5	132.3	-175.4	-167.9	0	0	0	0	108.1	Y440 H443 K444	Y440-V450 HydrophobicContact CD2-CG1 3.74Å; Y440-V450 HydrophobicContact CE2-CG1 4.05Å; H443-V450 HydrophobicContact CB-CG2 3.42Å; H443-V450 VanDerWaalsContact CB-CG2 3.42Å; K444-V450 HydrophobicContact CD-CB 4.04Å; K444-V450 HydrophobicContact CD-CG2 4.19Å; K444-V450 HydrophobicContact CG-CB 4.4Å; K444-V450 HydrophobicContact CG-CG2 4.3Å; K444-V450 PolarHBondContact NZ-O 3.43Å
451	E	89.8	Confident	91.4	Very high	177 Å²	177	80.2 Å²	80.2	83%	0.827	39%	0.388	S	S	*	.			trans	-59	141	172.5	-63.6	-171.3	165.9	0	0	111.7	Y440 V453	Y440-E451 WeakPolarHBondContact CE2-O 3.34Å; E451-V453 PolarHBondContact O-N 3.3Å; E451-V453 VanDerWaalsContact O-N 3.15Å
452	D	89.8	Confident	91.3	Very high	106 Å²	106	87.6 Å²	87.6	57%	0.567	42%	0.416	S	S	*	.			trans	-73.1	106.8	-176.1	-89.1	10.1	0	0	0	112.1	K444	K444-D452 IonicContact NZ-OD1 3.38Å; K444-D452 PolarHBondContact NZ-OD1 3.15Å
453	V	93	Very high	91.5	Very high	72 Å²	72	86.7 Å²	86.7	44%	0.436	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-77.7	133.4	-179.8	174.7	0	0	0	0	111.4	Y440 E451 P486	Y440-V453 HydrophobicContact CD2-CB 3.95Å; Y440-V453 HydrophobicContact CD2-CG2 3.56Å; Y440-V453 HydrophobicContact CE2-CB 3.93Å; Y440-V453 HydrophobicContact CE2-CG2 3.84Å; Y440-V453 HydrophobicContact CG-CG2 4.44Å; E451-V453 PolarHBondContact O-N 3.3Å; E451-V453 VanDerWaalsContact O-N 3.15Å; V453-P486 HydrophobicContact CB-CG 4.08Å; V453-P486 HydrophobicContact CG1-CG 4.1Å; V453-P486 WeakPolarHBondContact O-CD 3.32Å
454	I	93.8	Very high	91.8	Very high	125 Å²	125	84.4 Å²	84.4	64%	0.641	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-99.9	121.2	173.5	-58.9	176	0	0	0	110	K456 Q484	I454-K456 PolarHBondContact O-N 2.85Å; I454-Q484 WeakPolarHBondContact CA-O 3.46Å; I454-Q484 HydrophobicContact CG2-CB 4.5Å
455	I	92.6	Very high	91.9	Very high	22 Å²	22	83.3 Å²	83.3	11%	0.113	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-74	120.6	171.3	-63.7	-177.6	0	0	0	109.2	C457 Q484 P486 Q656	I455-C457 HydrophobicContact CG2-CB 4.35Å; I455-C457 PolarHBondContact O-N 2.77Å; I455-Q484 PolarHBondContact N-O 2.87Å; I455-P486 HydrophobicContact CD1-CB 4.1Å; I455-P486 HydrophobicContact CD1-CG 4.05Å; I455-P486 HydrophobicContact CG1-CG 3.94Å; I455-Q656 HydrophobicContact CD1-CB 4.18Å; I455-Q656 HydrophobicContact CD1-CG 4.09Å
456	K	90.2	Very high	91.8	Very high	211 Å²	211	90.3 Å²	90.3	92%	0.917	43%	0.432	S	S	*	.			trans	-74.7	101.3	169.4	-67.6	-179.6	-179.2	176.2	0	109.4	I454	I454-K456 PolarHBondContact O-N 2.85Å
457	C	89.8	Confident	92	Very high	32 Å²	32	93 Å²	93	22%	0.216	46%	0.461	C	S	.	.			trans	-127.2	155.7	174.9	63.6	0	0	0	0	110.8	I455 L459 L483	I455-C457 HydrophobicContact CG2-CB 4.35Å; I455-C457 PolarHBondContact O-N 2.77Å; C457-L459 PolarHBondContact O-N 3.43Å; C457-L483 PolarHBondContact SG-O 3.33Å
458	Q	90.4	Very high	92.2	Very high	188 Å²	188	93.9 Å²	93.9	88%	0.879	47%	0.465	S	S	*	.			trans	-81.4	108.8	172.3	-173.9	175.1	11.2	0	0	109.2
459	L	93.9	Very high	92.6	Very high	60 Å²	60	95 Å²	95	31%	0.314	48%	0.478	S	S	.	.			trans	-65.8	142	176.1	-67.7	177.4	0	0	0	111.2	C457 F463 K480 L483 Q484	C457-L459 PolarHBondContact O-N 3.43Å; L459-F463 HydrophobicContact CB-CZ 4.42Å; L459-F463 HydrophobicContact CD2-CE1 4.3Å; L459-F463 HydrophobicContact CD2-CZ 4.4Å; L459-K480 HydrophobicContact CD1-CG 4.22Å; L459-L483 HydrophobicContact CD2-CB 4.25Å; L459-L483 HydrophobicContact CD2-CD1 4.33Å; L459-Q484 HydrophobicContact CD2-CG 4.02Å
460	P	93.9	Very high	93	Very high	35 Å²	35	92.1 Å²	92.1	23%	0.227	47%	0.468	C	S	.	.			trans	-73.3	152.1	-178.5	33	-38.4	0	0	0	112	R462 F463	P460-R462 VanDerWaalsContact C-N 3.3Å; P460-R462 WeakPolarHBondContact CB-O 3.44Å; P460-R462 PolarHBondContact O-N 3.13Å; P460-F463 HydrophobicContact CG-CD1 3.77Å; P460-F463 HydrophobicContact CG-CE1 3.8Å; P460-F463 HydrophobicContact CG-CG 4.43Å; P460-F463 HydrophobicContact CG-CZ 4.46Å
461	K	91.9	Very high	93.3	Very high	221 Å²	221	91 Å²	91	96%	0.961	46%	0.461	S	S	*	.	S	Bend	trans	-66.8	-27.3	178.4	-67.6	-176.3	178.8	-180	0	113.8
462	R	94.3	Very high	93.7	Very high	156 Å²	156	83.5 Å²	83.5	59%	0.589	43%	0.426	S	S	*	.			trans	-132.1	138.1	168.1	-78.1	-174.9	69.2	173	0.5	107.8	P460 D470 H508	P460-R462 VanDerWaalsContact C-N 3.3Å; P460-R462 WeakPolarHBondContact CB-O 3.44Å; P460-R462 PolarHBondContact O-N 3.13Å; R462-D470 IonicContact CZ-OD1 3.92Å; R462-D470 IonicContact NH2-OD1 2.75Å; R462-D470 PolarHBondContact NH2-OD1 2.96Å; R462-D470 IonicContact NH2-OD2 3.17Å; R462-D470 PolarHBondContact NH2-OD2 2.9Å; R462-D470 VanDerWaalsContact NH2-OD2 3.17Å; R462-H508 PolarHBondContact O-CE1 2.97Å
463	F	96.1	Very high	94	Very high	38 Å²	38	84 Å²	84	17%	0.167	42%	0.424	C	S	.	.	S	Bend	trans	-82.7	-26.8	177.1	-71.9	-79.2	0	0	0	113.1	L459 P460 A465 V476 V479 K480 L483 T504 H508	L459-F463 HydrophobicContact CB-CZ 4.42Å; L459-F463 HydrophobicContact CD2-CE1 4.3Å; L459-F463 HydrophobicContact CD2-CZ 4.4Å; P460-F463 HydrophobicContact CG-CD1 3.77Å; P460-F463 HydrophobicContact CG-CE1 3.8Å; P460-F463 HydrophobicContact CG-CG 4.43Å; P460-F463 HydrophobicContact CG-CZ 4.46Å; F463-A465 PolarHBondContact O-N 3.27Å; F463-V476 HydrophobicContact CB-CG1 4.15Å; F463-V476 HydrophobicContact CB-CG2 4.28Å; F463-V476 HydrophobicContact CD2-CG1 3.7Å; F463-V476 HydrophobicContact CE2-CG1 4.4Å; F463-V476 HydrophobicContact CG-CG1 4.03Å; F463-V479 HydrophobicContact CD1-CB 4.15Å; F463-V479 HydrophobicContact CD1-CG1 3.8Å; F463-K480 HydrophobicContact CE1-CB 3.82Å; F463-K480 HydrophobicContact CE1-CG 4.31Å; F463-K480 HydrophobicContact CZ-CB 3.82Å; F463-K480 HydrophobicContact CZ-CD 4.41Å; F463-K480 HydrophobicContact CZ-CG 3.94Å; F463-L483 HydrophobicContact CE1-CD1 4.42Å; F463-T504 WeakPolarHBondContact O-CG2 3.46Å; F463-H508 PolarHBondContact O-NE2 3.49Å
464	T	95.8	Very high	94.2	Very high	26 Å²	26	80.8 Å²	80.8	16%	0.16	41%	0.406	C	S	.	.	S	Bend	trans	-59.9	128.5	169.4	-50.2	0	0	0	0	111.1	D470 L471	T464-D470 VanDerWaalsContact CB-OD1 3.26Å; T464-D470 WeakPolarHBondContact CB-OD1 3.46Å; T464-D470 HydrophobicContact CG2-CB 4.39Å; T464-D470 WeakPolarHBondContact CG2-OD1 3.29Å; T464-D470 PolarHBondContact OG1-OD1 2.88Å; T464-L471 PolarHBondContact OG1-N 3.05Å
465	A	95	Very high	94.4	Very high	3 Å²	3	75.3 Å²	75.3	3%	0.025	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-79	152.9	170.5	0	0	0	0	0	111.4	F463 L468 T504 Y507 T537	F463-A465 PolarHBondContact O-N 3.27Å; A465-L468 HydrophobicContact CB-CD1 4.26Å; A465-L468 PolarHBondContact O-N 3.11Å; A465-T504 HydrophobicContact CB-CG2 4.03Å; A465-Y507 HydrophobicContact CB-CD1 3.48Å; A465-Y507 VanDerWaalsContact CB-CD1 3.48Å; A465-Y507 HydrophobicContact CB-CD2 4.3Å; A465-Y507 HydrophobicContact CB-CE1 3.96Å; A465-Y507 HydrophobicContact CB-CG 3.66Å; A465-T537 HydrophobicContact CB-CG2 3.96Å
466	Q	93	Very high	94.6	Very high	147 Å²	147	76.3 Å²	76.3	69%	0.687	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	144.5	173.3	-175.9	169.1	-15.3	0	0	110.2	L468 T537	Q466-L468 PolarHBondContact O-N 2.86Å; Q466-L468 VanDerWaalsContact O-N 3.15Å; Q466-T537 WeakPolarHBondContact O-CA 3.35Å
467	G	93.8	Very high	95	Very high	58 Å²	58	72.6 Å²	72.6	60%	0.598	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	-6.8	178.5	0	0	0	0	0	116.3	Q536	G467-Q536 WeakPolarHBondContact CA-O 3.36Å
468	L	95.3	Very high	95.4	Very high	19 Å²	19	71 Å²	71	10%	0.099	36%	0.355	C	S	.	.	S	Bend	trans	-107.4	159.2	175.3	-68.8	-178.6	0	0	0	112.2	A465 Q466 V500 A503 K533 Q536 T537	A465-L468 HydrophobicContact CB-CD1 4.26Å; A465-L468 PolarHBondContact O-N 3.11Å; Q466-L468 PolarHBondContact O-N 2.86Å; Q466-L468 VanDerWaalsContact O-N 3.15Å; L468-V500 HydrophobicContact CB-CG1 4.45Å; L468-A503 HydrophobicContact CD1-CB 3.77Å; L468-K533 HydrophobicContact CD2-CB 4.28Å; L468-K533 HydrophobicContact CD2-CD 4.34Å; L468-Q536 HydrophobicContact CD2-CB 4.32Å; L468-T537 HydrophobicContact CD1-CG2 3.68Å; L468-T537 HydrophobicContact CG-CG2 3.92Å
469	P	94.8	Very high	95.8	Very high	84 Å²	84	62.1 Å²	62.1	55%	0.545	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-58.9	147.7	175.3	-23.7	34.2	0	0	0	113.1	L471	P469-L471 PolarHBondContact O-N 3.19Å
470	D	96.3	Very high	95.9	Very high	113 Å²	113	63.8 Å²	63.8	60%	0.604	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-61.2	131.4	172.8	-97.3	-55.4	0	0	0	111.3	R462 T464	R462-D470 IonicContact CZ-OD1 3.92Å; R462-D470 IonicContact NH2-OD1 2.75Å; R462-D470 PolarHBondContact NH2-OD1 2.96Å; R462-D470 IonicContact NH2-OD2 3.17Å; R462-D470 PolarHBondContact NH2-OD2 2.9Å; R462-D470 VanDerWaalsContact NH2-OD2 3.17Å; T464-D470 VanDerWaalsContact CB-OD1 3.26Å; T464-D470 WeakPolarHBondContact CB-OD1 3.46Å; T464-D470 HydrophobicContact CG2-CB 4.39Å; T464-D470 WeakPolarHBondContact CG2-OD1 3.29Å; T464-D470 PolarHBondContact OG1-OD1 2.88Å
471	L	96.7	Very high	96.1	Very high	19 Å²	19	63 Å²	63	10%	0.099	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-79.9	141.1	-172.9	-65	-171.7	0	0	0	112.6	T464 P469 Q475 V476 V479 V500 T504	T464-L471 PolarHBondContact OG1-N 3.05Å; P469-L471 PolarHBondContact O-N 3.19Å; L471-Q475 HydrophobicContact CB-CB 3.98Å; L471-Q475 HydrophobicContact CD1-CB 4.3Å; L471-Q475 HydrophobicContact CD2-CB 4.13Å; L471-Q475 HydrophobicContact CG-CB 4.37Å; L471-V476 HydrophobicContact CB-CG2 3.63Å; L471-V479 HydrophobicContact CD1-CG2 3.63Å; L471-V500 HydrophobicContact CD2-CG1 4.04Å; L471-T504 HydrophobicContact CD1-CG2 3.81Å
472	N	96.8	Very high	96.4	Very high	19 Å²	19	52.5 Å²	52.5	10%	0.102	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-76.3	169.8	171.8	75.9	48.4	0	0	0	112.7	S474 Q475 V476 Y702	N472-S474 VanDerWaalsContact C-N 3.3Å; N472-S474 PolarHBondContact O-N 2.93Å; N472-S474 WeakPolarHBondContact OD1-CA 3.15Å; N472-S474 PolarHBondContact OD1-N 3.29Å; N472-S474 PolarHBondContact OD1-OG 2.76Å; N472-Q475 VanDerWaalsContact ND2-CD 3.28Å; N472-Q475 PolarHBondContact ND2-NE2 2.81Å; N472-Q475 PolarHBondContact ND2-OE1 3.02Å; N472-Q475 PolarHBondContact O-N 3.21Å; N472-Q475 VanDerWaalsContact O-N 3.11Å; N472-Q475 PolarHBondContact OD1-N 2.82Å; N472-V476 WeakPolarHBondContact O-CG2 3.39Å; N472-V476 PolarHBondContact O-N 2.78Å; N472-Y702 WeakPolarHBondContact CB-OH 3.44Å; N472-Y702 WeakPolarHBondContact ND2-CE2 3.4Å; N472-Y702 PolarHBondContact ND2-OH 3.38Å
473	H	96.6	Very high	96.5	Very high	115 Å²	115	45.2 Å²	45.2	53%	0.532	24%	0.24	S	C	.	.	H	α-helix	trans	-52.6	-41.3	-177.3	69.1	-90.6	0	0	0	114	Y477	H473-Y477 VanDerWaalsContact O-CB 3.31Å; H473-Y477 WeakPolarHBondContact O-CB 3.41Å; H473-Y477 PolarHBondContact O-N 2.92Å
474	S	97.1	Very high	96.6	Very high	6 Å²	6	46.2 Å²	46.2	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-72.9	-35.8	-178.9	71.4	0	0	0	0	112.1	N472 A478 Q699	N472-S474 VanDerWaalsContact C-N 3.3Å; N472-S474 PolarHBondContact O-N 2.93Å; N472-S474 WeakPolarHBondContact OD1-CA 3.15Å; N472-S474 PolarHBondContact OD1-N 3.29Å; N472-S474 PolarHBondContact OD1-OG 2.76Å; S474-A478 WeakPolarHBondContact O-CB 3.21Å; S474-A478 PolarHBondContact O-N 2.87Å; S474-Q699 PolarHBondContact OG-N 3.09Å
475	Q	97.9	Very high	96.6	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-70.5	-45.2	174.7	-65.1	166.1	-21	0	0	110.9	L471 N472 Y477 A478 V479 T496 T501 L698	L471-Q475 HydrophobicContact CB-CB 3.98Å; L471-Q475 HydrophobicContact CD1-CB 4.3Å; L471-Q475 HydrophobicContact CD2-CB 4.13Å; L471-Q475 HydrophobicContact CG-CB 4.37Å; N472-Q475 VanDerWaalsContact ND2-CD 3.28Å; N472-Q475 PolarHBondContact ND2-NE2 2.81Å; N472-Q475 PolarHBondContact ND2-OE1 3.02Å; N472-Q475 PolarHBondContact O-N 3.21Å; N472-Q475 VanDerWaalsContact O-N 3.11Å; N472-Q475 PolarHBondContact OD1-N 2.82Å; Q475-Y477 VanDerWaalsContact C-N 3.32Å; Q475-Y477 PolarHBondContact O-N 2.95Å; Q475-A478 WeakPolarHBondContact O-CB 3.46Å; Q475-A478 PolarHBondContact O-N 2.88Å; Q475-A478 VanDerWaalsContact O-N 3.12Å; Q475-V479 WeakPolarHBondContact O-CG2 3.13Å; Q475-V479 PolarHBondContact O-N 2.84Å; Q475-T496 PolarHBondContact NE2-O 3.21Å; Q475-T501 HydrophobicContact CB-CG2 4.48Å; Q475-L698 HydrophobicContact CG-CD2 4.03Å
476	V	97.9	Very high	96.7	Very high	43 Å²	43	49.6 Å²	49.6	26%	0.261	26%	0.255	S	S	.	.	H	α-helix	trans	-59.2	-43	174.1	171.6	0	0	0	0	111.2	F463 L471 N472 V479 K480	F463-V476 HydrophobicContact CB-CG1 4.15Å; F463-V476 HydrophobicContact CB-CG2 4.28Å; F463-V476 HydrophobicContact CD2-CG1 3.7Å; F463-V476 HydrophobicContact CE2-CG1 4.4Å; F463-V476 HydrophobicContact CG-CG1 4.03Å; L471-V476 HydrophobicContact CB-CG2 3.63Å; N472-V476 WeakPolarHBondContact O-CG2 3.39Å; N472-V476 PolarHBondContact O-N 2.78Å; V476-V479 PolarHBondContact O-N 2.74Å; V476-K480 WeakPolarHBondContact O-CB 3.3Å; V476-K480 PolarHBondContact O-N 2.94Å
477	Y	97.8	Very high	97	Very high	132 Å²	132	43.1 Å²	43.1	52%	0.518	23%	0.225	S	C	.	.	H	α-helix	trans	-60.8	-43.1	173.7	176.4	-98	0	0	0	112	H473 Q475 K480 T481 I696	H473-Y477 VanDerWaalsContact O-CB 3.31Å; H473-Y477 WeakPolarHBondContact O-CB 3.41Å; H473-Y477 PolarHBondContact O-N 2.92Å; Q475-Y477 VanDerWaalsContact C-N 3.32Å; Q475-Y477 PolarHBondContact O-N 2.95Å; Y477-K480 PolarHBondContact O-N 2.9Å; Y477-T481 WeakPolarHBondContact O-CB 3.49Å; Y477-T481 PolarHBondContact O-N 2.87Å; Y477-T481 PolarHBondContact O-OG1 2.8Å; Y477-I696 HydrophobicContact CD1-CG2 3.79Å; Y477-I696 HydrophobicContact CE1-CG2 3.92Å
478	A	97.9	Very high	97.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-54.3	175.2	0	0	0	0	0	112	S474 Q475 K480 T481 V482 I490 T501 I696 L698	S474-A478 WeakPolarHBondContact O-CB 3.21Å; S474-A478 PolarHBondContact O-N 2.87Å; Q475-A478 WeakPolarHBondContact O-CB 3.46Å; Q475-A478 PolarHBondContact O-N 2.88Å; Q475-A478 VanDerWaalsContact O-N 3.12Å; A478-K480 VanDerWaalsContact C-N 3.31Å; A478-K480 PolarHBondContact O-N 2.99Å; A478-T481 PolarHBondContact O-N 3Å; A478-V482 WeakPolarHBondContact O-CB 3.43Å; A478-V482 VanDerWaalsContact O-CG2 3.26Å; A478-V482 WeakPolarHBondContact O-CG2 3.29Å; A478-V482 PolarHBondContact O-N 3.08Å; A478-I490 HydrophobicContact CB-CD1 4.35Å; A478-T501 HydrophobicContact CB-CG2 4.15Å; A478-I696 HydrophobicContact CB-CG2 3.74Å; A478-L698 HydrophobicContact CB-CD2 3.96Å
479	V	98.1	Very high	97.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55.8	-46.7	178.7	-176.5	0	0	0	0	110.9	F463 L471 Q475 V476 L483 T501 T504 I505	F463-V479 HydrophobicContact CD1-CB 4.15Å; F463-V479 HydrophobicContact CD1-CG1 3.8Å; L471-V479 HydrophobicContact CD1-CG2 3.63Å; Q475-V479 WeakPolarHBondContact O-CG2 3.13Å; Q475-V479 PolarHBondContact O-N 2.84Å; V476-V479 PolarHBondContact O-N 2.74Å; V479-L483 HydrophobicContact CG1-CD1 3.96Å; V479-L483 HydrophobicContact CG1-CG 4.48Å; V479-L483 VanDerWaalsContact O-CG 3.25Å; V479-L483 WeakPolarHBondContact O-CG 3.2Å; V479-L483 PolarHBondContact O-N 2.85Å; V479-L483 VanDerWaalsContact O-N 3.17Å; V479-T501 HydrophobicContact CG2-CG2 4.07Å; V479-T504 HydrophobicContact CG1-CG2 4.46Å; V479-T504 HydrophobicContact CG2-CG2 4.11Å; V479-I505 HydrophobicContact CB-CG1 4.33Å; V479-I505 HydrophobicContact CG1-CG1 4.26Å; V479-I505 HydrophobicContact CG2-CG1 4.02Å
480	K	97.6	Very high	97.5	Very high	95 Å²	95	35.8 Å²	35.8	41%	0.413	17%	0.168	S	C	.	.	H	α-helix	trans	-59.3	-53.9	178.6	-178.3	-174.7	173.5	-172.2	0	112.1	L459 F463 V476 Y477 A478 Q484	L459-K480 HydrophobicContact CD1-CG 4.22Å; F463-K480 HydrophobicContact CE1-CB 3.82Å; F463-K480 HydrophobicContact CE1-CG 4.31Å; F463-K480 HydrophobicContact CZ-CB 3.82Å; F463-K480 HydrophobicContact CZ-CD 4.41Å; F463-K480 HydrophobicContact CZ-CG 3.94Å; V476-K480 WeakPolarHBondContact O-CB 3.3Å; V476-K480 PolarHBondContact O-N 2.94Å; Y477-K480 PolarHBondContact O-N 2.9Å; A478-K480 VanDerWaalsContact C-N 3.31Å; A478-K480 PolarHBondContact O-N 2.99Å; K480-Q484 WeakPolarHBondContact O-CG 3.08Å
481	T	97.5	Very high	97.5	Very high	18 Å²	18	30.6 Å²	30.6	11%	0.11	14%	0.14	C	C	.	.	H	α-helix	trans	-67.1	-38.5	-175.3	-65.9	0	0	0	0	111.8	Y477 A478 Q484 I696	Y477-T481 WeakPolarHBondContact O-CB 3.49Å; Y477-T481 PolarHBondContact O-N 2.87Å; Y477-T481 PolarHBondContact O-OG1 2.8Å; A478-T481 PolarHBondContact O-N 3Å; T481-Q484 PolarHBondContact O-N 3Å; T481-I696 HydrophobicContact CG2-CD1 3.76Å
482	V	97.8	Very high	97.3	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-64.2	-44.2	178.6	167.8	0	0	0	0	112.3	A478 Q484 R485 I490 I505 Q656 I658 I696	A478-V482 WeakPolarHBondContact O-CB 3.43Å; A478-V482 VanDerWaalsContact O-CG2 3.26Å; A478-V482 WeakPolarHBondContact O-CG2 3.29Å; A478-V482 PolarHBondContact O-N 3.08Å; V482-Q484 PolarHBondContact O-N 3.32Å; V482-R485 PolarHBondContact O-N 2.96Å; V482-I490 HydrophobicContact CG2-CD1 3.96Å; V482-I490 HydrophobicContact CG2-CG1 4.16Å; V482-I505 HydrophobicContact CB-CD1 4.32Å; V482-I505 HydrophobicContact CG1-CD1 4.18Å; V482-I505 HydrophobicContact CG1-CG1 4.45Å; V482-I505 HydrophobicContact CG1-CG2 3.92Å; V482-I505 HydrophobicContact CG2-CD1 4.32Å; V482-Q656 PolarHBondContact O-NE2 2.95Å; V482-I658 HydrophobicContact CG1-CB 4.36Å; V482-I658 HydrophobicContact CG1-CD1 4.4Å; V482-I658 HydrophobicContact CG1-CG1 3.39Å; V482-I658 HydrophobicContact CG1-CG2 3.99Å; V482-I696 HydrophobicContact CG2-CD1 3.86Å
483	L	97.4	Very high	97.1	Very high	3 Å²	3	29 Å²	29	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-58.7	-24	178.7	-73.3	170.6	0	0	0	113	C457 L459 F463 V479 H508 L509 Q656	C457-L483 PolarHBondContact SG-O 3.33Å; L459-L483 HydrophobicContact CD2-CB 4.25Å; L459-L483 HydrophobicContact CD2-CD1 4.33Å; F463-L483 HydrophobicContact CE1-CD1 4.42Å; V479-L483 HydrophobicContact CG1-CD1 3.96Å; V479-L483 HydrophobicContact CG1-CG 4.48Å; V479-L483 VanDerWaalsContact O-CG 3.25Å; V479-L483 WeakPolarHBondContact O-CG 3.2Å; V479-L483 PolarHBondContact O-N 2.85Å; V479-L483 VanDerWaalsContact O-N 3.17Å; L483-H508 HydrophobicContact CD1-CB 3.95Å; L483-H508 HydrophobicContact CD2-CB 3.99Å; L483-L509 HydrophobicContact CD2-CD2 3.78Å; L483-L509 HydrophobicContact CD2-CG 3.97Å; L483-Q656 PolarHBondContact O-NE2 3.42Å; L483-Q656 VanDerWaalsContact O-NE2 3.15Å
484	Q	97.1	Very high	96.9	Very high	59 Å²	59	23.7 Å²	23.7	28%	0.276	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	3.7	-176.4	-58.8	-171.8	-97.7	0	0	114.3	I454 I455 L459 K480 T481 V482	I454-Q484 WeakPolarHBondContact CA-O 3.46Å; I454-Q484 HydrophobicContact CG2-CB 4.5Å; I455-Q484 PolarHBondContact N-O 2.87Å; L459-Q484 HydrophobicContact CD2-CG 4.02Å; K480-Q484 WeakPolarHBondContact O-CG 3.08Å; T481-Q484 PolarHBondContact O-N 3Å; V482-Q484 PolarHBondContact O-N 3.32Å
485	R	96.8	Very high	96.6	Very high	94 Å²	94	24.3 Å²	24.3	36%	0.355	12%	0.115	S	C	.	.			trans	-128.6	143.2	-175.2	-72.3	-179.9	170.2	-176.6	-7.6	112.9	V482 Q656	V482-R485 PolarHBondContact O-N 2.96Å; R485-Q656 WeakPolarHBondContact O-CG 3.45Å; R485-Q656 PolarHBondContact O-NE2 2.9Å; R485-Q656 VanDerWaalsContact O-NE2 3.12Å
486	P	97.3	Very high	96.4	Very high	6 Å²	6	23.9 Å²	23.9	4%	0.039	11%	0.113	C	C	.	.	S	Bend	trans	-75.8	-22.7	175.4	-9.3	23	0	0	0	114.2	Y440 V453 I455 Q656 L657	Y440-P486 HydrophobicContact CD1-CB 3.59Å; Y440-P486 HydrophobicContact CD1-CG 3.8Å; Y440-P486 HydrophobicContact CE1-CB 3.75Å; Y440-P486 HydrophobicContact CE1-CG 3.78Å; Y440-P486 HydrophobicContact CG-CB 4.42Å; Y440-P486 HydrophobicContact CG-CG 4.31Å; V453-P486 HydrophobicContact CB-CG 4.08Å; V453-P486 HydrophobicContact CG1-CG 4.1Å; V453-P486 WeakPolarHBondContact O-CD 3.32Å; I455-P486 HydrophobicContact CD1-CB 4.1Å; I455-P486 HydrophobicContact CD1-CG 4.05Å; I455-P486 HydrophobicContact CG1-CG 3.94Å; P486-Q656 CarbonylContact O-C 3.58Å; P486-Q656 WeakPolarHBondContact O-CA 3.41Å; P486-L657 PolarHBondContact O-N 2.94Å
487	L	98.3	Very high	96.2	Very high	11 Å²	11	22.9 Å²	22.9	6%	0.058	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.1	172.2	-178.4	60.6	0	0	0	108.6	Y440 K444 L657 L688 I693	Y440-L487 HydrophobicContact CE1-CB 4.07Å; K444-L487 HydrophobicContact CB-CD2 3.96Å; L487-L657 WeakPolarHBondContact CA-O 3.37Å; L487-L657 HydrophobicContact CD1-CB 4.08Å; L487-L657 HydrophobicContact CD1-CD2 4.01Å; L487-L657 HydrophobicContact CD1-CG 4.09Å; L487-L688 HydrophobicContact CD2-CD1 4.45Å; L487-I693 HydrophobicContact CD2-CD1 3.87Å
488	S	98.4	Very high	95.9	Very high	3 Å²	3	17.5 Å²	17.5	2%	0.021	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	137.8	173	-76.2	0	0	0	0	112	L657 L659	S488-L657 PolarHBondContact N-O 3.08Å; S488-L659 PolarHBondContact O-N 3.02Å
489	L	98.4	Very high	95.7	Very high	3 Å²	3	19.3 Å²	19.3	2%	0.016	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.2	171.5	-50.2	-175.4	0	0	0	108.7	L659 F685 L688 V689 I693 P695 I696	L489-L659 CarbonylContact C-O 3.56Å; L489-L659 WeakPolarHBondContact CA-O 3.25Å; L489-L659 HydrophobicContact CD2-CB 3.77Å; L489-L659 HydrophobicContact CD2-CD1 3.84Å; L489-L659 HydrophobicContact CD2-CG 4.14Å; L489-F685 HydrophobicContact CB-CD2 4.42Å; L489-F685 HydrophobicContact CB-CE2 3.85Å; L489-F685 HydrophobicContact CB-CZ 4.04Å; L489-F685 HydrophobicContact CD2-CD2 4.22Å; L489-F685 HydrophobicContact CD2-CE2 4.48Å; L489-L688 HydrophobicContact CD1-CB 3.96Å; L489-L688 HydrophobicContact CD2-CD1 4.15Å; L489-V689 HydrophobicContact CD1-CG2 3.72Å; L489-I693 HydrophobicContact CD1-CB 4.07Å; L489-I693 HydrophobicContact CD1-CG2 3.87Å; L489-I693 HydrophobicContact CG-CG2 3.98Å; L489-P695 HydrophobicContact CB-CB 4.03Å; L489-P695 HydrophobicContact CB-CG 4.18Å; L489-P695 HydrophobicContact CD1-CG 4.37Å; L489-P695 WeakPolarHBondContact O-CA 3.35Å; L489-I696 PolarHBondContact O-N 3.31Å
490	I	98.2	Very high	95.6	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.8	169.5	-58.5	-179.7	0	0	0	108.5	A478 V482 I505 I658 L659 V660 G661 F685 I696 L698	A478-I490 HydrophobicContact CB-CD1 4.35Å; V482-I490 HydrophobicContact CG2-CD1 3.96Å; V482-I490 HydrophobicContact CG2-CG1 4.16Å; I490-I505 HydrophobicContact CD1-CD1 3.5Å; I490-I658 HydrophobicContact CD1-CG2 4.31Å; I490-L659 PolarHBondContact N-O 2.63Å; I490-V660 HydrophobicContact CB-CB 4.46Å; I490-V660 HydrophobicContact CB-CG1 4.19Å; I490-V660 HydrophobicContact CB-CG2 4.14Å; I490-V660 HydrophobicContact CD1-CG2 4.08Å; I490-V660 HydrophobicContact CG1-CG2 4.34Å; I490-V660 HydrophobicContact CG2-CG1 4.35Å; I490-G661 PolarHBondContact O-N 2.95Å; I490-F685 WeakPolarHBondContact O-CE2 3.38Å; I490-I696 WeakPolarHBondContact CA-O 3.41Å; I490-L698 HydrophobicContact CG2-CD1 4.22Å; I490-L698 HydrophobicContact CG2-CD2 4.36Å; I490-L698 HydrophobicContact CG2-CG 3.98Å
491	Q	96.2	Very high	95.6	Very high	5 Å²	5	16.2 Å²	16.2	2%	0.023	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.9	166.6	-174.7	-177.5	22.6	0	0	108.6	G661 D662 H663 F685 P695 I696 R697 L698	Q491-G661 WeakPolarHBondContact CA-O 3.29Å; Q491-D662 PolarHBondContact NE2-OD1 3.04Å; Q491-H663 PolarHBondContact NE2-CE1 2.74Å; Q491-F685 HydrophobicContact CB-CZ 4.4Å; Q491-P695 HydrophobicContact CB-CB 3.8Å; Q491-I696 PolarHBondContact N-O 3.23Å; Q491-R697 WeakPolarHBondContact O-CA 3.45Å; Q491-L698 PolarHBondContact O-N 2.78Å
492	G	92.4	Very high	95.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.085	C	C	.	.			trans	-126.2	99.4	175.5	0	0	0	0	0	112.9	T496 K498 G661	G492-T496 WeakPolarHBondContact CA-OG1 3.42Å; G492-K498 WeakPolarHBondContact O-CD 3.45Å; G492-K498 PolarHBondContact O-NZ 3.16Å; G492-G661 PolarHBondContact N-O 2.73Å
493	P	93.1	Very high	95.6	Very high	3 Å²	3	15.3 Å²	15.3	2%	0.019	9%	0.085	C	C	.	.			trans	-53.1	160.7	170.5	-25.4	33.7	0	0	0	112.8	G495 T496 L698 Y717 L721	P493-G495 PolarHBondContact O-N 2.86Å; P493-T496 HydrophobicContact CB-CG2 3.9Å; P493-T496 HydrophobicContact CG-CG2 4.27Å; P493-T496 WeakPolarHBondContact O-CB 3.34Å; P493-T496 VanDerWaalsContact O-CG2 3.29Å; P493-T496 WeakPolarHBondContact O-CG2 3.08Å; P493-T496 PolarHBondContact O-N 3.41Å; P493-T496 PolarHBondContact O-OG1 3.32Å; P493-L698 WeakPolarHBondContact CD-O 3.48Å; P493-Y717 HydrophobicContact CB-CD1 3.96Å; P493-Y717 HydrophobicContact CB-CD2 4.35Å; P493-Y717 HydrophobicContact CB-CE1 3.67Å; P493-Y717 HydrophobicContact CB-CE2 4.12Å; P493-Y717 HydrophobicContact CB-CG 4.29Å; P493-Y717 HydrophobicContact CG-CD1 3.63Å; P493-Y717 HydrophobicContact CG-CE1 3.65Å; P493-Y717 HydrophobicContact CG-CG 4.23Å; P493-L721 HydrophobicContact CB-CD1 3.69Å; P493-L721 HydrophobicContact CB-CD2 4.39Å; P493-L721 HydrophobicContact CG-CD1 4.08Å
494	P	91.1	Very high	95.6	Very high	5 Å²	5	15.1 Å²	15.1	3%	0.032	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	132	179.8	-29.9	35.1	0	0	0	113.8	T496 Q665 M704 Y717 T864	P494-T496 VanDerWaalsContact C-N 3.28Å; P494-T496 PolarHBondContact O-N 3.02Å; P494-Q665 HydrophobicContact CG-CG 4.37Å; P494-M704 HydrophobicContact CB-CE 4.19Å; P494-Y717 WeakPolarHBondContact CD-OH 3.49Å; P494-T864 VanDerWaalsContact CB-CB 3.49Å; P494-T864 HydrophobicContact CB-CG2 4.03Å; P494-T864 HydrophobicContact CG-CG2 3.88Å; P494-T864 VanDerWaalsContact CG-OG1 3.31Å; P494-T864 WeakPolarHBondContact CG-OG1 3.41Å
495	G	91.3	Very high	95.7	Very high	19 Å²	19	12.3 Å²	12.3	20%	0.196	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	2.1	177.8	0	0	0	0	0	116.2	P493 G497 Y702	P493-G495 PolarHBondContact O-N 2.86Å; G495-G497 VanDerWaalsContact C-N 3.26Å; G495-G497 PolarHBondContact O-N 3.2Å; G495-Y702 PolarHBondContact O-N 3.43Å
496	T	94.6	Very high	95.8	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.006	5%	0.054	C	C	.	.	S	Bend	trans	-79.3	3	-176.7	58.9	0	0	0	0	116	Q475 G492 P493 P494 L698 V700 Q701 L721	Q475-T496 PolarHBondContact NE2-O 3.21Å; G492-T496 WeakPolarHBondContact CA-OG1 3.42Å; P493-T496 HydrophobicContact CB-CG2 3.9Å; P493-T496 HydrophobicContact CG-CG2 4.27Å; P493-T496 WeakPolarHBondContact O-CB 3.34Å; P493-T496 VanDerWaalsContact O-CG2 3.29Å; P493-T496 WeakPolarHBondContact O-CG2 3.08Å; P493-T496 PolarHBondContact O-N 3.41Å; P493-T496 PolarHBondContact O-OG1 3.32Å; P494-T496 VanDerWaalsContact C-N 3.28Å; P494-T496 PolarHBondContact O-N 3.02Å; T496-L698 HydrophobicContact CG2-CB 4.42Å; T496-V700 WeakPolarHBondContact CA-O 3.32Å; T496-Q701 HydrophobicContact CG2-CB 4.28Å; T496-L721 HydrophobicContact CG2-CD1 3.52Å
497	G	92.6	Very high	95.8	Very high	22 Å²	22	8.6 Å²	8.6	23%	0.227	6%	0.056	C	C	.	.			trans	78.5	34.2	178	0	0	0	0	0	114.7	G495 T499 V500 T501	G495-G497 VanDerWaalsContact C-N 3.26Å; G495-G497 PolarHBondContact O-N 3.2Å; G497-T499 PolarHBondContact O-N 3.44Å; G497-V500 PolarHBondContact O-N 3.44Å; G497-T501 PolarHBondContact O-N 2.87Å; G497-T501 PolarHBondContact O-OG1 2.78Å
498	K	92.9	Very high	95.8	Very high	19 Å²	19	8.9 Å²	8.9	8%	0.083	6%	0.057	C	C	.	.	H	α-helix	trans	-43.1	-65	172.5	-73.3	-155.3	-56.9	-116.2	0	112	G492 V500 T501 S502 E637 V660 L698	G492-K498 WeakPolarHBondContact O-CD 3.45Å; G492-K498 PolarHBondContact O-NZ 3.16Å; K498-V500 PolarHBondContact O-N 2.95Å; K498-V500 VanDerWaalsContact O-N 3.15Å; K498-T501 CarbonylContact O-C 3.54Å; K498-T501 WeakPolarHBondContact O-CA 3.27Å; K498-T501 VanDerWaalsContact O-CB 3.31Å; K498-T501 WeakPolarHBondContact O-CB 3.39Å; K498-T501 PolarHBondContact O-N 2.99Å; K498-S502 PolarHBondContact O-N 3.31Å; K498-S502 PolarHBondContact O-OG 3.38Å; K498-S502 VanDerWaalsContact O-OG 3.08Å; K498-E637 WeakPolarHBondContact CE-OE1 3.48Å; K498-E637 IonicContact NZ-OE1 3.53Å; K498-E637 PolarHBondContact NZ-OE1 3.02Å; K498-V660 HydrophobicContact CB-CG1 4.29Å; K498-V660 HydrophobicContact CD-CG1 3.88Å; K498-V660 HydrophobicContact CG-CG1 4.33Å; K498-L698 HydrophobicContact CG-CD1 4.36Å
499	T	92	Very high	95.7	Very high	37 Å²	37	8.9 Å²	8.9	23%	0.227	6%	0.057	C	C	.	.	H	α-helix	trans	-57.2	-33.8	-175.2	-36.4	0	0	0	0	113.3	G497 A503 L530 K533	G497-T499 PolarHBondContact O-N 3.44Å; T499-A503 VanDerWaalsContact O-CB 3.25Å; T499-A503 WeakPolarHBondContact O-CB 3.18Å; T499-A503 PolarHBondContact O-N 2.85Å; T499-L530 HydrophobicContact CG2-CB 3.97Å; T499-L530 HydrophobicContact CG2-CD1 3.78Å; T499-L530 HydrophobicContact CG2-CG 4.43Å; T499-K533 HydrophobicContact CG2-CG 4.16Å
500	V	95.9	Very high	95.7	Very high	29 Å²	29	9.2 Å²	9.2	18%	0.176	6%	0.06	C	C	.	.	H	α-helix	trans	-71.4	-39.6	175.5	179.4	0	0	0	0	111	L468 L471 G497 K498 T504	L468-V500 HydrophobicContact CB-CG1 4.45Å; L471-V500 HydrophobicContact CD2-CG1 4.04Å; G497-V500 PolarHBondContact O-N 3.44Å; K498-V500 PolarHBondContact O-N 2.95Å; K498-V500 VanDerWaalsContact O-N 3.15Å; V500-T504 WeakPolarHBondContact O-CB 3.36Å; V500-T504 PolarHBondContact O-N 2.83Å; V500-T504 PolarHBondContact O-OG1 3.43Å
501	T	97.8	Very high	95.6	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-67.2	-46.1	174.5	-47.3	0	0	0	0	110.4	Q475 A478 V479 G497 K498 T504 I505 L698	Q475-T501 HydrophobicContact CB-CG2 4.48Å; A478-T501 HydrophobicContact CB-CG2 4.15Å; V479-T501 HydrophobicContact CG2-CG2 4.07Å; G497-T501 PolarHBondContact O-N 2.87Å; G497-T501 PolarHBondContact O-OG1 2.78Å; K498-T501 CarbonylContact O-C 3.54Å; K498-T501 WeakPolarHBondContact O-CA 3.27Å; K498-T501 VanDerWaalsContact O-CB 3.31Å; K498-T501 WeakPolarHBondContact O-CB 3.39Å; K498-T501 PolarHBondContact O-N 2.99Å; T501-T504 PolarHBondContact O-N 3.38Å; T501-I505 HydrophobicContact CG2-CD1 4.14Å; T501-I505 WeakPolarHBondContact O-CG1 3.4Å; T501-I505 PolarHBondContact O-N 3.04Å; T501-L698 HydrophobicContact CG2-CD2 4.47Å
502	S	97.7	Very high	95.3	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-56.4	-52	174.4	-56.1	0	0	0	0	111.7	K498 T504 I505 V506 D636	K498-S502 PolarHBondContact O-N 3.31Å; K498-S502 PolarHBondContact O-OG 3.38Å; K498-S502 VanDerWaalsContact O-OG 3.08Å; S502-T504 VanDerWaalsContact C-N 3.28Å; S502-T504 PolarHBondContact O-N 2.92Å; S502-I505 WeakPolarHBondContact O-CB 3.16Å; S502-I505 PolarHBondContact O-N 2.88Å; S502-V506 WeakPolarHBondContact O-CG2 3.3Å; S502-V506 PolarHBondContact O-N 2.95Å; S502-D636 VanDerWaalsContact CB-OD2 3.3Å; S502-D636 WeakPolarHBondContact CB-OD2 3.37Å; S502-D636 PolarHBondContact OG-OD2 3.23Å
503	A	97.9	Very high	95.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-36.3	177.4	0	0	0	0	0	112.4	L468 T499 V506 Y507 L530 K533 I534	L468-A503 HydrophobicContact CD1-CB 3.77Å; T499-A503 VanDerWaalsContact O-CB 3.25Å; T499-A503 WeakPolarHBondContact O-CB 3.18Å; T499-A503 PolarHBondContact O-N 2.85Å; A503-V506 PolarHBondContact O-N 2.8Å; A503-Y507 WeakPolarHBondContact O-CB 3.32Å; A503-Y507 PolarHBondContact O-N 2.56Å; A503-L530 HydrophobicContact CB-CD1 4.1Å; A503-K533 HydrophobicContact CB-CB 3.76Å; A503-I534 HydrophobicContact CB-CG1 3.76Å
504	T	98.3	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70.3	-37.4	175.9	-57.4	0	0	0	0	112.5	F463 A465 L471 V479 V500 T501 S502 Y507 H508	F463-T504 WeakPolarHBondContact O-CG2 3.46Å; A465-T504 HydrophobicContact CB-CG2 4.03Å; L471-T504 HydrophobicContact CD1-CG2 3.81Å; V479-T504 HydrophobicContact CG1-CG2 4.46Å; V479-T504 HydrophobicContact CG2-CG2 4.11Å; V500-T504 WeakPolarHBondContact O-CB 3.36Å; V500-T504 PolarHBondContact O-N 2.83Å; V500-T504 PolarHBondContact O-OG1 3.43Å; T501-T504 PolarHBondContact O-N 3.38Å; S502-T504 VanDerWaalsContact C-N 3.28Å; S502-T504 PolarHBondContact O-N 2.92Å; T504-Y507 PolarHBondContact O-N 2.87Å; T504-H508 PolarHBondContact O-CD2 3.43Å; T504-H508 PolarHBondContact O-N 3.23Å
505	I	98.4	Very high	95	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.5	-50.1	172.1	-71.8	162.2	0	0	0	110	V479 V482 I490 T501 S502 Y507 H508 L509 L634 I658	V479-I505 HydrophobicContact CB-CG1 4.33Å; V479-I505 HydrophobicContact CG1-CG1 4.26Å; V479-I505 HydrophobicContact CG2-CG1 4.02Å; V482-I505 HydrophobicContact CB-CD1 4.32Å; V482-I505 HydrophobicContact CG1-CD1 4.18Å; V482-I505 HydrophobicContact CG1-CG1 4.45Å; V482-I505 HydrophobicContact CG1-CG2 3.92Å; V482-I505 HydrophobicContact CG2-CD1 4.32Å; I490-I505 HydrophobicContact CD1-CD1 3.5Å; T501-I505 HydrophobicContact CG2-CD1 4.14Å; T501-I505 WeakPolarHBondContact O-CG1 3.4Å; T501-I505 PolarHBondContact O-N 3.04Å; S502-I505 WeakPolarHBondContact O-CB 3.16Å; S502-I505 PolarHBondContact O-N 2.88Å; I505-Y507 VanDerWaalsContact C-N 3.3Å; I505-Y507 PolarHBondContact O-N 3.14Å; I505-H508 PolarHBondContact O-N 3.14Å; I505-L509 HydrophobicContact CG2-CD1 3.61Å; I505-L509 HydrophobicContact CG2-CG 4.28Å; I505-L509 VanDerWaalsContact O-CG 3.3Å; I505-L509 WeakPolarHBondContact O-CG 3.32Å; I505-L509 PolarHBondContact O-N 2.93Å; I505-L634 HydrophobicContact CB-CD1 4.24Å; I505-L634 HydrophobicContact CG2-CD1 3.98Å; I505-I658 HydrophobicContact CG2-CG1 4.35Å
506	V	98.3	Very high	95.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.2	-43.4	176.9	171.6	0	0	0	0	111.3	S502 A503 H508 L509 A510 V517 V519 I534 V612 L634	S502-V506 WeakPolarHBondContact O-CG2 3.3Å; S502-V506 PolarHBondContact O-N 2.95Å; A503-V506 PolarHBondContact O-N 2.8Å; V506-H508 PolarHBondContact O-N 3.32Å; V506-L509 PolarHBondContact O-N 3.26Å; V506-A510 WeakPolarHBondContact O-CB 3.49Å; V506-A510 PolarHBondContact O-N 2.85Å; V506-V517 HydrophobicContact CG1-CB 4.32Å; V506-V517 HydrophobicContact CG1-CG1 4.15Å; V506-V517 HydrophobicContact CG2-CG1 4.31Å; V506-V519 HydrophobicContact CB-CG2 4.45Å; V506-V519 HydrophobicContact CG1-CG2 4Å; V506-V519 HydrophobicContact CG2-CG2 3.55Å; V506-I534 HydrophobicContact CB-CD1 4.29Å; V506-I534 HydrophobicContact CB-CG1 4.37Å; V506-I534 HydrophobicContact CG1-CD1 4Å; V506-I534 HydrophobicContact CG1-CG1 4.21Å; V506-I534 HydrophobicContact CG1-CG2 4.11Å; V506-I534 HydrophobicContact CG2-CD1 4.26Å; V506-V612 HydrophobicContact CG1-CB 4.37Å; V506-V612 HydrophobicContact CG1-CG1 3.83Å; V506-V612 HydrophobicContact CG1-CG2 3.52Å; V506-L634 HydrophobicContact CG2-CB 4.29Å; V506-L634 HydrophobicContact CG2-CD1 4.25Å
507	Y	98.3	Very high	95.5	Very high	22 Å²	22	29 Å²	29	9%	0.086	17%	0.174	C	C	.	.	H	α-helix	trans	-56.9	-47.5	176.9	173.9	-97.9	0	0	0	112.8	A465 A503 T504 I505 R511 T537 L539	A465-Y507 HydrophobicContact CB-CD1 3.48Å; A465-Y507 VanDerWaalsContact CB-CD1 3.48Å; A465-Y507 HydrophobicContact CB-CD2 4.3Å; A465-Y507 HydrophobicContact CB-CE1 3.96Å; A465-Y507 HydrophobicContact CB-CG 3.66Å; A503-Y507 WeakPolarHBondContact O-CB 3.32Å; A503-Y507 PolarHBondContact O-N 2.56Å; T504-Y507 PolarHBondContact O-N 2.87Å; I505-Y507 VanDerWaalsContact C-N 3.3Å; I505-Y507 PolarHBondContact O-N 3.14Å; Y507-R511 WeakPolarHBondContact O-CB 3.46Å; Y507-R511 VanDerWaalsContact O-CG 3.26Å; Y507-R511 WeakPolarHBondContact O-CG 3.36Å; Y507-R511 PolarHBondContact O-N 2.65Å; Y507-R511 PolarHBondContact OH-NH1 2.98Å; Y507-T537 HydrophobicContact CD2-CG2 4.11Å; Y507-T537 HydrophobicContact CG-CG2 4.41Å; Y507-L539 HydrophobicContact CD2-CD1 4.03Å; Y507-L539 HydrophobicContact CD2-CG 4.15Å
508	H	97.9	Very high	95.8	Very high	17 Å²	17	28 Å²	28	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-74.1	-26.4	178.5	-65.6	-61.6	0	0	0	113.4	R462 F463 L483 T504 I505 V506 Q512	R462-H508 PolarHBondContact O-CE1 2.97Å; F463-H508 PolarHBondContact O-NE2 3.49Å; L483-H508 HydrophobicContact CD1-CB 3.95Å; L483-H508 HydrophobicContact CD2-CB 3.99Å; T504-H508 PolarHBondContact O-CD2 3.43Å; T504-H508 PolarHBondContact O-N 3.23Å; I505-H508 PolarHBondContact O-N 3.14Å; V506-H508 PolarHBondContact O-N 3.32Å; H508-Q512 WeakPolarHBondContact O-CG 3.27Å
509	L	97.3	Very high	96.1	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-71.7	-48.1	174.3	-72.1	169.3	0	0	0	111.8	L483 I505 V506 R511 Q512 V517 I658	L483-L509 HydrophobicContact CD2-CD2 3.78Å; L483-L509 HydrophobicContact CD2-CG 3.97Å; I505-L509 HydrophobicContact CG2-CD1 3.61Å; I505-L509 HydrophobicContact CG2-CG 4.28Å; I505-L509 VanDerWaalsContact O-CG 3.3Å; I505-L509 WeakPolarHBondContact O-CG 3.32Å; I505-L509 PolarHBondContact O-N 2.93Å; V506-L509 PolarHBondContact O-N 3.26Å; L509-R511 VanDerWaalsContact C-N 3.28Å; L509-R511 PolarHBondContact O-N 2.79Å; L509-Q512 WeakPolarHBondContact O-CB 3.28Å; L509-Q512 PolarHBondContact O-N 3.47Å; L509-Q512 VanDerWaalsContact O-N 3.08Å; L509-V517 HydrophobicContact CB-CG2 3.87Å; L509-I658 HydrophobicContact CD1-CD1 3.91Å
510	A	97.2	Very high	96.4	Very high	9 Å²	9	25.4 Å²	25.4	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-59.7	-41	178.2	0	0	0	0	0	111.3	V506 Q512 G513 V517 L539 D611 V612	V506-A510 WeakPolarHBondContact O-CB 3.49Å; V506-A510 PolarHBondContact O-N 2.85Å; A510-Q512 PolarHBondContact O-N 3.4Å; A510-G513 PolarHBondContact O-N 2.99Å; A510-V517 HydrophobicContact CB-CG2 3.89Å; A510-L539 HydrophobicContact CB-CD1 3.91Å; A510-D611 HydrophobicContact CB-CB 4.29Å; A510-V612 HydrophobicContact CB-CG2 4.33Å
511	R	95.6	Very high	96.4	Very high	169 Å²	169	24 Å²	24	64%	0.638	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-2.3	176.9	-70.5	-172.6	70.9	106.3	20.2	115.5	Y507 L509 G513	Y507-R511 WeakPolarHBondContact O-CB 3.46Å; Y507-R511 VanDerWaalsContact O-CG 3.26Å; Y507-R511 WeakPolarHBondContact O-CG 3.36Å; Y507-R511 PolarHBondContact O-N 2.65Å; Y507-R511 PolarHBondContact OH-NH1 2.98Å; L509-R511 VanDerWaalsContact C-N 3.28Å; L509-R511 PolarHBondContact O-N 2.79Å; R511-G513 VanDerWaalsContact C-N 3.33Å
512	Q	91.8	Very high	96.2	Very high	63 Å²	63	25 Å²	25	29%	0.294	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-9.3	167.1	-61.8	174.7	21.9	0	0	113	H508 L509 A510 N514	H508-Q512 WeakPolarHBondContact O-CG 3.27Å; L509-Q512 WeakPolarHBondContact O-CB 3.28Å; L509-Q512 PolarHBondContact O-N 3.47Å; L509-Q512 VanDerWaalsContact O-N 3.08Å; A510-Q512 PolarHBondContact O-N 3.4Å; Q512-N514 VanDerWaalsContact C-N 3.34Å; Q512-N514 WeakPolarHBondContact CB-ND2 3.23Å; Q512-N514 PolarHBondContact O-N 3.21Å
513	G	86.3	Confident	95.7	Very high	67 Å²	67	27 Å²	27	69%	0.691	16%	0.161	S	C	*	.			trans	73.9	16.5	173.1	0	0	0	0	0	115.7	A510 R511 G515	A510-G513 PolarHBondContact O-N 2.99Å; R511-G513 VanDerWaalsContact C-N 3.33Å; G513-G515 PolarHBondContact O-N 2.96Å; G513-G515 VanDerWaalsContact O-N 3.1Å
514	N	90.4	Very high	95.3	Very high	84 Å²	84	28.7 Å²	28.7	45%	0.449	17%	0.17	S	C	.	.	S	Bend	trans	-82.2	29.6	-176.5	-69.8	-67.6	0	0	0	114.1	Q512	Q512-N514 VanDerWaalsContact C-N 3.34Å; Q512-N514 WeakPolarHBondContact CB-ND2 3.23Å; Q512-N514 PolarHBondContact O-N 3.21Å
515	G	93.6	Very high	94.7	Very high	45 Å²	45	32.5 Å²	32.5	46%	0.464	19%	0.189	S	C	.	.	S	Bend	trans	80.2	-174	-167.3	0	0	0	0	0	113.4	G513	G513-G515 PolarHBondContact O-N 2.96Å; G513-G515 VanDerWaalsContact O-N 3.1Å
516	P	97.6	Very high	94.3	Very high	19 Å²	19	32.9 Å²	32.9	12%	0.123	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-66	142.5	-174.9	-16.1	28.1	0	0	0	112.5	A610 D611 I613 M628 F630	P516-A610 WeakPolarHBondContact CB-O 3.43Å; P516-A610 WeakPolarHBondContact CG-O 3.24Å; P516-D611 WeakPolarHBondContact CA-O 3.49Å; P516-I613 HydrophobicContact CB-CD1 4.22Å; P516-I613 HydrophobicContact CB-CG1 4.42Å; P516-M628 HydrophobicContact CG-CE 4.26Å; P516-F630 HydrophobicContact CB-CE1 4.23Å
517	V	98.5	Very high	94.1	Very high	3 Å²	3	33 Å²	33	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	131.7	168.4	-177.2	0	0	0	0	109.3	V506 L509 A510 V519 D611 V612 I613	V506-V517 HydrophobicContact CG1-CB 4.32Å; V506-V517 HydrophobicContact CG1-CG1 4.15Å; V506-V517 HydrophobicContact CG2-CG1 4.31Å; L509-V517 HydrophobicContact CB-CG2 3.87Å; A510-V517 HydrophobicContact CB-CG2 3.89Å; V517-V519 HydrophobicContact CG1-CG2 4.19Å; V517-D611 PolarHBondContact N-O 3.39Å; V517-V612 WeakPolarHBondContact O-CA 3.48Å; V517-I613 PolarHBondContact O-N 2.78Å
518	L	98.7	Very high	93.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	131.1	172.2	-174	65.7	0	0	0	110.3	I613 A620 F630 S632 I633 L634 P649 L652	L518-I613 HydrophobicContact CD1-CB 4.33Å; L518-I613 HydrophobicContact CD1-CG2 4.16Å; L518-A620 HydrophobicContact CD2-CB 4.32Å; L518-F630 HydrophobicContact CB-CB 3.75Å; L518-F630 HydrophobicContact CB-CD1 3.91Å; L518-F630 HydrophobicContact CB-CD2 4.17Å; L518-F630 HydrophobicContact CB-CG 3.66Å; L518-F630 HydrophobicContact CD1-CD2 4.49Å; L518-F630 HydrophobicContact CD1-CE2 4.46Å; L518-F630 HydrophobicContact CD2-CB 4.35Å; L518-F630 HydrophobicContact CD2-CD2 3.83Å; L518-F630 HydrophobicContact CD2-CE2 4.42Å; L518-F630 HydrophobicContact CD2-CG 4.14Å; L518-F630 HydrophobicContact CG-CD2 4.39Å; L518-F630 HydrophobicContact CG-CG 4.37Å; L518-S632 PolarHBondContact N-O 2.84Å; L518-S632 VanDerWaalsContact N-O 3.16Å; L518-I633 HydrophobicContact CB-CG1 4.29Å; L518-I633 HydrophobicContact CB-CG2 4.35Å; L518-I633 HydrophobicContact CD2-CD1 4.26Å; L518-I633 HydrophobicContact CD2-CG2 4.27Å; L518-I633 HydrophobicContact CG-CG2 4.45Å; L518-I633 WeakPolarHBondContact O-CA 3.47Å; L518-L634 PolarHBondContact O-N 3.08Å; L518-P649 HydrophobicContact CD2-CB 3.78Å; L518-L652 HydrophobicContact CD2-CD1 3.98Å
519	V	98.7	Very high	93.5	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.1	-179	177.6	0	0	0	0	109.7	V506 V517 L530 I534 V612 I613 C614 C615 L634	V506-V519 HydrophobicContact CB-CG2 4.45Å; V506-V519 HydrophobicContact CG1-CG2 4Å; V506-V519 HydrophobicContact CG2-CG2 3.55Å; V517-V519 HydrophobicContact CG1-CG2 4.19Å; V519-L530 HydrophobicContact CG1-CD2 3.36Å; V519-L530 HydrophobicContact CG1-CG 3.79Å; V519-I534 HydrophobicContact CB-CD1 4.44Å; V519-I534 HydrophobicContact CG1-CD1 3.99Å; V519-I534 HydrophobicContact CG2-CD1 4.04Å; V519-V612 HydrophobicContact CB-CG1 4.24Å; V519-V612 HydrophobicContact CG2-CG1 3.54Å; V519-I613 PolarHBondContact N-O 2.99Å; V519-C614 WeakPolarHBondContact O-CA 3.42Å; V519-C615 PolarHBondContact O-N 3.4Å; V519-L634 WeakPolarHBondContact CA-O 3.43Å
520	C	98.3	Very high	93.4	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.007	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	157.9	-175.9	-63.2	0	0	0	0	113.1	C615 L634 I635 D636 P649	C520-C615 VanDerWaalsContact CA-O 3.31Å; C520-C615 WeakPolarHBondContact CA-O 3.13Å; C520-L634 PolarHBondContact N-O 3.06Å; C520-I635 HydrophobicContact CB-CG1 4.34Å; C520-I635 HydrophobicContact CB-CG2 4.36Å; C520-I635 CarbonylContact O-C 3.46Å; C520-I635 VanDerWaalsContact O-CA 3.32Å; C520-I635 WeakPolarHBondContact O-CA 3.24Å; C520-D636 PolarHBondContact O-N 3.39Å; C520-P649 HydrophobicContact CB-CG 4.34Å
521	A	96.1	Very high	93.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	157.2	161.1	0	0	0	0	0	108.3	A526 V527 T616 C617 D636	A521-A526 HydrophobicContact CB-CB 3.67Å; A521-V527 HydrophobicContact CB-CG2 3.83Å; A521-T616 CarbonylContact O-C 3.52Å; A521-T616 WeakPolarHBondContact O-CA 3.14Å; A521-T616 WeakPolarHBondContact O-CB 3.24Å; A521-C617 PolarHBondContact O-N 3.07Å; A521-D636 WeakPolarHBondContact CA-O 3.36Å; A521-D636 WeakPolarHBondContact CB-O 3.36Å
522	P	92.8	Very high	93.4	Very high	22 Å²	22	29.5 Å²	29.5	14%	0.143	18%	0.184	C	C	.	.	S	Bend	trans	-66.6	-46.2	179.3	20.1	-28.1	0	0	0	112.3	Q640 A641 E645	P522-Q640 HydrophobicContact CG-CB 3.62Å; P522-A641 HydrophobicContact CB-CB 4Å; P522-A641 HydrophobicContact CG-CB 4.02Å; P522-E645 WeakPolarHBondContact CB-OE1 3.38Å
523	S	88.6	Confident	93.6	Very high	42 Å²	42	29.2 Å²	29.2	29%	0.294	18%	0.182	S	C	.	.	S	Bend	trans	-90.2	138.2	-178.5	63.2	0	0	0	0	112.9	I525 A526 V527	S523-I525 VanDerWaalsContact C-N 3.27Å; S523-I525 PolarHBondContact O-N 3.15Å; S523-A526 PolarHBondContact O-N 3.09Å; S523-A526 VanDerWaalsContact O-N 3.13Å; S523-V527 PolarHBondContact O-N 3.25Å
524	N	87.7	Confident	94.2	Very high	35 Å²	35	26 Å²	26	19%	0.187	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-39.3	179.9	-78.6	-82.1	0	0	0	112.5	A526 V527 D528 R543 T616	N524-A526 VanDerWaalsContact C-N 3.31Å; N524-A526 PolarHBondContact O-N 3.44Å; N524-V527 WeakPolarHBondContact O-CB 3.5Å; N524-V527 PolarHBondContact O-N 2.84Å; N524-V527 VanDerWaalsContact O-N 3.14Å; N524-D528 WeakPolarHBondContact O-CB 3.32Å; N524-D528 PolarHBondContact O-N 3.37Å; N524-D528 VanDerWaalsContact O-OD2 3.1Å; N524-R543 PolarHBondContact OD1-NH2 3.5Å; N524-T616 HydrophobicContact CB-CG2 4.48Å
525	I	86.8	Confident	94.5	Very high	80 Å²	80	25.5 Å²	25.5	41%	0.41	14%	0.144	S	C	.	.	H	α-helix	trans	-59.6	-40.9	179.1	-60.8	176	0	0	0	111.4	S523 D528 Q529 R832	S523-I525 VanDerWaalsContact C-N 3.27Å; S523-I525 PolarHBondContact O-N 3.15Å; I525-D528 PolarHBondContact O-N 2.99Å; I525-Q529 WeakPolarHBondContact O-CB 3.29Å; I525-Q529 WeakPolarHBondContact O-CG 3.38Å; I525-Q529 PolarHBondContact O-N 2.99Å; I525-R832 HydrophobicContact CG2-CG 4.18Å
526	A	89.6	Confident	94.7	Very high	9 Å²	9	27.1 Å²	27.1	7%	0.074	14%	0.139	C	C	.	.	H	α-helix	trans	-67.6	-39.7	176.8	0	0	0	0	0	111.8	A521 S523 N524 D528 L530 E637	A521-A526 HydrophobicContact CB-CB 3.67Å; S523-A526 PolarHBondContact O-N 3.09Å; S523-A526 VanDerWaalsContact O-N 3.13Å; N524-A526 VanDerWaalsContact C-N 3.31Å; N524-A526 PolarHBondContact O-N 3.44Å; A526-D528 VanDerWaalsContact C-N 3.34Å; A526-D528 PolarHBondContact O-N 3.48Å; A526-L530 WeakPolarHBondContact O-CB 3.33Å; A526-L530 PolarHBondContact O-N 3.28Å; A526-L530 VanDerWaalsContact O-N 3.08Å; A526-E637 HydrophobicContact CB-CG 4.43Å
527	V	94.3	Very high	94.7	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-60.9	-43.9	172.2	-175	0	0	0	0	110.8	A521 S523 N524 L530 T531 C614 C615 T616	A521-V527 HydrophobicContact CB-CG2 3.83Å; S523-V527 PolarHBondContact O-N 3.25Å; N524-V527 WeakPolarHBondContact O-CB 3.5Å; N524-V527 PolarHBondContact O-N 2.84Å; N524-V527 VanDerWaalsContact O-N 3.14Å; V527-L530 PolarHBondContact O-N 3.39Å; V527-T531 VanDerWaalsContact O-CB 3.28Å; V527-T531 WeakPolarHBondContact O-CB 3.3Å; V527-T531 PolarHBondContact O-N 2.8Å; V527-T531 PolarHBondContact O-OG1 3.48Å; V527-C614 HydrophobicContact CG1-CB 3.96Å; V527-C615 WeakPolarHBondContact CG2-O 3.49Å; V527-T616 HydrophobicContact CG2-CG2 3.86Å
528	D	92.6	Very high	94.6	Very high	20 Å²	20	29.8 Å²	29.8	11%	0.107	17%	0.169	C	C	.	.	H	α-helix	trans	-69.1	-43.5	-175.6	-62.3	-24.5	0	0	0	111.5	N524 I525 A526 L530 T531 E532 R543 V556	N524-D528 WeakPolarHBondContact O-CB 3.32Å; N524-D528 PolarHBondContact O-N 3.37Å; N524-D528 VanDerWaalsContact O-OD2 3.1Å; I525-D528 PolarHBondContact O-N 2.99Å; A526-D528 VanDerWaalsContact C-N 3.34Å; A526-D528 PolarHBondContact O-N 3.48Å; D528-L530 VanDerWaalsContact C-N 3.34Å; D528-L530 PolarHBondContact O-N 3.3Å; D528-T531 WeakPolarHBondContact O-CB 3.3Å; D528-T531 PolarHBondContact O-N 3.43Å; D528-E532 PolarHBondContact O-N 3.36Å; D528-R543 IonicContact OD1-CZ 3.38Å; D528-R543 IonicContact OD1-NE 3.86Å; D528-R543 PolarHBondContact OD1-NE 2.99Å; D528-R543 IonicContact OD1-NH2 3.06Å; D528-R543 PolarHBondContact OD1-NH2 3.15Å; D528-R543 IonicContact OD2-NH2 3.18Å; D528-V556 HydrophobicContact CB-CG2 3.81Å
529	Q	91.1	Very high	94.6	Very high	59 Å²	59	30.7 Å²	30.7	28%	0.276	17%	0.174	S	C	.	.	H	α-helix	trans	-57.9	-44.2	171.5	-75.2	178.7	-14.1	0	0	112.4	I525 E532 K533 G831	I525-Q529 WeakPolarHBondContact O-CB 3.29Å; I525-Q529 WeakPolarHBondContact O-CG 3.38Å; I525-Q529 PolarHBondContact O-N 2.99Å; Q529-E532 PolarHBondContact O-N 3.26Å; Q529-K533 PolarHBondContact O-N 3.03Å; Q529-G831 PolarHBondContact NE2-O 3.1Å; Q529-G831 PolarHBondContact OE1-O 3.17Å
530	L	94.8	Very high	94.5	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-72.1	-36.7	-179.6	-174.9	50.9	0	0	0	111.6	T499 A503 V519 A526 V527 D528 E532 K533 I534 L634 D636	T499-L530 HydrophobicContact CG2-CB 3.97Å; T499-L530 HydrophobicContact CG2-CD1 3.78Å; T499-L530 HydrophobicContact CG2-CG 4.43Å; A503-L530 HydrophobicContact CB-CD1 4.1Å; V519-L530 HydrophobicContact CG1-CD2 3.36Å; V519-L530 HydrophobicContact CG1-CG 3.79Å; A526-L530 WeakPolarHBondContact O-CB 3.33Å; A526-L530 PolarHBondContact O-N 3.28Å; A526-L530 VanDerWaalsContact O-N 3.08Å; V527-L530 PolarHBondContact O-N 3.39Å; D528-L530 VanDerWaalsContact C-N 3.34Å; D528-L530 PolarHBondContact O-N 3.3Å; L530-E532 PolarHBondContact O-N 3Å; L530-K533 PolarHBondContact O-N 3.23Å; L530-I534 HydrophobicContact CD1-CD1 3.9Å; L530-I534 HydrophobicContact CD1-CG1 4.17Å; L530-I534 HydrophobicContact CG-CD1 3.8Å; L530-I534 WeakPolarHBondContact O-CD1 3.31Å; L530-I534 VanDerWaalsContact O-CG1 3.23Å; L530-I534 WeakPolarHBondContact O-CG1 3.47Å; L530-I534 PolarHBondContact O-N 3.3Å; L530-L634 HydrophobicContact CD2-CD2 4.04Å; L530-D636 HydrophobicContact CD2-CB 3.77Å
531	T	97.6	Very high	94.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.2	-46.6	171.5	-59.6	0	0	0	0	111.1	V527 D528 K533 I534 H535 V541 R543 V556 L559 C614	V527-T531 VanDerWaalsContact O-CB 3.28Å; V527-T531 WeakPolarHBondContact O-CB 3.3Å; V527-T531 PolarHBondContact O-N 2.8Å; V527-T531 PolarHBondContact O-OG1 3.48Å; D528-T531 WeakPolarHBondContact O-CB 3.3Å; D528-T531 PolarHBondContact O-N 3.43Å; T531-K533 PolarHBondContact O-N 3.31Å; T531-I534 PolarHBondContact O-N 3.09Å; T531-H535 WeakPolarHBondContact O-CB 3.47Å; T531-H535 PolarHBondContact O-N 3.18Å; T531-V541 HydrophobicContact CG2-CG1 3.87Å; T531-R543 HydrophobicContact CG2-CB 4.18Å; T531-V556 HydrophobicContact CG2-CB 3.93Å; T531-V556 HydrophobicContact CG2-CG1 3.96Å; T531-V556 HydrophobicContact CG2-CG2 4.17Å; T531-L559 HydrophobicContact CG2-CB 4.49Å; T531-L559 HydrophobicContact CG2-CD1 3.75Å; T531-C614 HydrophobicContact CG2-CB 4.49Å; T531-C614 WeakPolarHBondContact OG1-CB 3.36Å; T531-C614 PolarHBondContact OG1-SG 2.64Å
532	E	96.5	Very high	94.6	Very high	66 Å²	66	37.4 Å²	37.4	31%	0.308	20%	0.204	S	C	.	.	H	α-helix	trans	-59.2	-46	176.8	-168.5	-144.9	120.6	0	0	111.8	D528 Q529 L530 H535 Q536 V556	D528-E532 PolarHBondContact O-N 3.36Å; Q529-E532 PolarHBondContact O-N 3.26Å; L530-E532 PolarHBondContact O-N 3Å; E532-H535 PolarHBondContact O-N 3.1Å; E532-Q536 WeakPolarHBondContact O-CG 3.46Å; E532-Q536 PolarHBondContact O-N 2.95Å; E532-Q536 PolarHBondContact OE1-NE2 3.29Å; E532-V556 HydrophobicContact CB-CG1 4.04Å
533	K	95.8	Very high	94.9	Very high	58 Å²	58	36.6 Å²	36.6	25%	0.252	20%	0.198	S	C	.	.	H	α-helix	trans	-70.8	-31.7	-179.6	-63.9	-38.9	-177	-161.9	0	113.7	L468 T499 A503 Q529 L530 T531	L468-K533 HydrophobicContact CD2-CB 4.28Å; L468-K533 HydrophobicContact CD2-CD 4.34Å; T499-K533 HydrophobicContact CG2-CG 4.16Å; A503-K533 HydrophobicContact CB-CB 3.76Å; Q529-K533 PolarHBondContact O-N 3.03Å; L530-K533 PolarHBondContact O-N 3.23Å; T531-K533 PolarHBondContact O-N 3.31Å
534	I	97.9	Very high	95.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-72.5	-41.9	173.6	-64.3	160.8	0	0	0	109.8	A503 V506 V519 L530 T531 Q536 T537 L539 V541 V612	A503-I534 HydrophobicContact CB-CG1 3.76Å; V506-I534 HydrophobicContact CB-CD1 4.29Å; V506-I534 HydrophobicContact CB-CG1 4.37Å; V506-I534 HydrophobicContact CG1-CD1 4Å; V506-I534 HydrophobicContact CG1-CG1 4.21Å; V506-I534 HydrophobicContact CG1-CG2 4.11Å; V506-I534 HydrophobicContact CG2-CD1 4.26Å; V519-I534 HydrophobicContact CB-CD1 4.44Å; V519-I534 HydrophobicContact CG1-CD1 3.99Å; V519-I534 HydrophobicContact CG2-CD1 4.04Å; L530-I534 HydrophobicContact CD1-CD1 3.9Å; L530-I534 HydrophobicContact CD1-CG1 4.17Å; L530-I534 HydrophobicContact CG-CD1 3.8Å; L530-I534 WeakPolarHBondContact O-CD1 3.31Å; L530-I534 VanDerWaalsContact O-CG1 3.23Å; L530-I534 WeakPolarHBondContact O-CG1 3.47Å; L530-I534 PolarHBondContact O-N 3.3Å; T531-I534 PolarHBondContact O-N 3.09Å; I534-Q536 VanDerWaalsContact C-N 3.29Å; I534-Q536 PolarHBondContact O-N 3.24Å; I534-T537 WeakPolarHBondContact O-CB 3.24Å; I534-T537 PolarHBondContact O-N 3.09Å; I534-T537 PolarHBondContact O-OG1 3.35Å; I534-L539 HydrophobicContact CG2-CD1 4.42Å; I534-V541 HydrophobicContact CB-CG2 4.16Å; I534-V541 HydrophobicContact CG2-CG2 3.53Å; I534-V612 HydrophobicContact CD1-CG1 4.29Å; I534-V612 HydrophobicContact CG2-CB 4.2Å; I534-V612 HydrophobicContact CG2-CG1 4.23Å; I534-V612 HydrophobicContact CG2-CG2 3.82Å
535	H	97.8	Very high	95.6	Very high	72 Å²	72	34 Å²	34	33%	0.333	18%	0.181	S	C	.	.	H	α-helix	trans	-61.1	-36.7	176.6	177.7	56.4	0	0	0	112.7	T531 E532 T537 G538 V541 F558 L559	T531-H535 WeakPolarHBondContact O-CB 3.47Å; T531-H535 PolarHBondContact O-N 3.18Å; E532-H535 PolarHBondContact O-N 3.1Å; H535-T537 PolarHBondContact O-N 3.32Å; H535-G538 PolarHBondContact O-N 3.07Å; H535-V541 HydrophobicContact CB-CG2 4.26Å; H535-F558 AromaticContact CD2-CZ 3.74Å; H535-F558 AromaticContact NE2-CE2 3.62Å; H535-F558 AromaticContact NE2-CZ 3.68Å; H535-L559 HydrophobicContact CB-CD1 3.73Å
536	Q	97.1	Very high	95.6	Very high	79 Å²	79	32.6 Å²	32.6	37%	0.369	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-16.7	173.2	-79.3	162.6	10.5	0	0	114	G467 L468 E532 I534	G467-Q536 WeakPolarHBondContact CA-O 3.36Å; L468-Q536 HydrophobicContact CD2-CB 4.32Å; E532-Q536 WeakPolarHBondContact O-CG 3.46Å; E532-Q536 PolarHBondContact O-N 2.95Å; E532-Q536 PolarHBondContact OE1-NE2 3.29Å; I534-Q536 VanDerWaalsContact C-N 3.29Å; I534-Q536 PolarHBondContact O-N 3.24Å
537	T	97.3	Very high	95.4	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.055	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5	173.6	73.1	0	0	0	0	115.1	A465 Q466 L468 Y507 I534 H535	A465-T537 HydrophobicContact CB-CG2 3.96Å; Q466-T537 WeakPolarHBondContact O-CA 3.35Å; L468-T537 HydrophobicContact CD1-CG2 3.68Å; L468-T537 HydrophobicContact CG-CG2 3.92Å; Y507-T537 HydrophobicContact CD2-CG2 4.11Å; Y507-T537 HydrophobicContact CG-CG2 4.41Å; I534-T537 WeakPolarHBondContact O-CB 3.24Å; I534-T537 PolarHBondContact O-N 3.09Å; I534-T537 PolarHBondContact O-OG1 3.35Å; H535-T537 PolarHBondContact O-N 3.32Å
538	G	96.8	Very high	94.7	Very high	69 Å²	69	39.9 Å²	39.9	71%	0.711	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.2	10	-179	0	0	0	0	0	115.3	H535	H535-G538 PolarHBondContact O-N 3.07Å
539	L	97.6	Very high	94.2	Very high	19 Å²	19	41.3 Å²	41.3	10%	0.099	22%	0.219	C	C	.	.			trans	-77.1	154.5	174.6	-68.5	-179.8	0	0	0	112.7	Y507 A510 I534 V541 D611 V612	Y507-L539 HydrophobicContact CD2-CD1 4.03Å; Y507-L539 HydrophobicContact CD2-CG 4.15Å; A510-L539 HydrophobicContact CB-CD1 3.91Å; I534-L539 HydrophobicContact CG2-CD1 4.42Å; L539-V541 PolarHBondContact O-N 3.4Å; L539-V541 VanDerWaalsContact O-N 3.14Å; L539-D611 HydrophobicContact CB-CB 4.05Å; L539-D611 HydrophobicContact CD1-CB 4.48Å; L539-D611 HydrophobicContact CD2-CB 4.03Å; L539-D611 HydrophobicContact CG-CB 4.41Å; L539-V612 HydrophobicContact CD1-CG2 3.99Å
540	K	97.6	Very high	93.8	Very high	137 Å²	137	40.8 Å²	40.8	60%	0.596	22%	0.216	S	C	*	.			trans	-75.1	95	171.2	-62.3	175.1	-178.7	177.7	0	110.1	D611 V612	K540-D611 HydrophobicContact CB-CB 4.39Å; K540-D611 WeakPolarHBondContact CB-OD2 3.45Å; K540-D611 PolarHBondContact N-OD2 3.01Å; K540-D611 PolarHBondContact O-N 3.16Å; K540-V612 PolarHBondContact O-N 3.36Å
541	V	98.4	Very high	92.7	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.024	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.2	178.7	-169.1	0	0	0	0	110.6	T531 I534 H535 L539 Q564 V612 C614	T531-V541 HydrophobicContact CG2-CG1 3.87Å; I534-V541 HydrophobicContact CB-CG2 4.16Å; I534-V541 HydrophobicContact CG2-CG2 3.53Å; H535-V541 HydrophobicContact CB-CG2 4.26Å; L539-V541 PolarHBondContact O-N 3.4Å; L539-V541 VanDerWaalsContact O-N 3.14Å; V541-Q564 PolarHBondContact O-NE2 3.32Å; V541-V612 WeakPolarHBondContact CA-O 3.5Å; V541-V612 HydrophobicContact CG2-CB 4.49Å; V541-C614 HydrophobicContact CG1-CB 4.47Å
542	V	98.5	Very high	91.6	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117	170.3	174.6	0	0	0	0	109.4	L561 L607 A610 V612 I613 C614	V542-L561 HydrophobicContact CG1-CB 3.86Å; V542-L561 HydrophobicContact CG1-CD1 3.91Å; V542-L561 HydrophobicContact CG1-CG 4.35Å; V542-L607 HydrophobicContact CG1-CD2 3.86Å; V542-A610 HydrophobicContact CB-CB 4.31Å; V542-A610 HydrophobicContact CG2-CB 3.75Å; V542-V612 PolarHBondContact N-O 2.95Å; V542-I613 WeakPolarHBondContact O-CA 3.45Å; V542-C614 PolarHBondContact O-N 3.12Å
543	R	98.1	Very high	90.6	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.015	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	109	173.5	175.5	56.5	166.4	110.9	0.5	109.5	N524 D528 T531 V556 L559 A560 L561 C614	N524-R543 PolarHBondContact OD1-NH2 3.5Å; D528-R543 IonicContact OD1-CZ 3.38Å; D528-R543 IonicContact OD1-NE 3.86Å; D528-R543 PolarHBondContact OD1-NE 2.99Å; D528-R543 IonicContact OD1-NH2 3.06Å; D528-R543 PolarHBondContact OD1-NH2 3.15Å; D528-R543 IonicContact OD2-NH2 3.18Å; T531-R543 HydrophobicContact CG2-CB 4.18Å; R543-V556 HydrophobicContact CG-CG2 4.35Å; R543-L559 HydrophobicContact CB-CB 4.38Å; R543-L559 PolarHBondContact N-O 2.94Å; R543-A560 CarbonylContact O-C 3.17Å; R543-A560 VanDerWaalsContact O-CA 3.28Å; R543-A560 WeakPolarHBondContact O-CA 3.41Å; R543-L561 PolarHBondContact O-N 3.16Å; R543-C614 CarbonylContact C-O 3.46Å; R543-C614 WeakPolarHBondContact CA-O 3.47Å; R543-C614 WeakPolarHBondContact CD-O 3.18Å
544	L	97.5	Very high	90.1	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.026	26%	0.264	C	S	.	.			trans	-88.2	120.6	175.3	-172.3	71.3	0	0	0	109.9	L561 I613 C614 C615 D622 L625	L544-L561 HydrophobicContact CD1-CB 4.38Å; L544-L561 HydrophobicContact CD1-CD2 3.55Å; L544-I613 HydrophobicContact CB-CG2 4.48Å; L544-C614 PolarHBondContact N-O 3.33Å; L544-C615 HydrophobicContact CB-CB 4.06Å; L544-D622 HydrophobicContact CD2-CB 4.01Å; L544-L625 HydrophobicContact CD2-CD1 3.48Å; L544-L625 VanDerWaalsContact CD2-CD1 3.48Å; L544-L625 HydrophobicContact CD2-CD2 4.08Å; L544-L625 HydrophobicContact CD2-CG 3.6Å
545	C	93.1	Very high	89.5	Confident	17 Å²	17	52 Å²	52	12%	0.115	30%	0.297	C	S	.	.			trans	-110	153.2	175.8	-66.1	0	0	0	0	111.2	R549 R624	C545-R549 HydrophobicContact CB-CB 4.46Å; C545-R624 PolarHBondContact O-NH2 3.05Å
546	A	88.7	Confident	89.3	Confident	51 Å²	51	48.7 Å²	48.7	42%	0.421	28%	0.282	S	S	.	.			trans	-64.9	148	166.2	0	0	0	0	0	110.3	S548 R549	A546-S548 VanDerWaalsContact C-N 3.29Å; A546-S548 PolarHBondContact O-N 3.33Å; A546-R549 WeakPolarHBondContact O-CA 3.25Å; A546-R549 WeakPolarHBondContact O-CB 3.2Å; A546-R549 PolarHBondContact O-N 3.47Å
547	K	84.8	Confident	89.1	Confident	140 Å²	140	45.5 Å²	45.5	61%	0.609	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-60.2	-33.2	-172.6	-68.4	-168.4	171.9	-177	0	114.5	R549 E550	K547-R549 PolarHBondContact O-N 3.14Å; K547-E550 PolarHBondContact O-N 2.93Å
548	S	79.4	Confident	89	Confident	25 Å²	25	50.6 Å²	50.6	18%	0.175	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-73.5	-3.8	174.8	59.4	0	0	0	0	114	G359 H379 A546	G359-S548 WeakPolarHBondContact CA-O 3.39Å; G359-S548 WeakPolarHBondContact O-CB 3.3Å; G359-S548 PolarHBondContact O-OG 3.48Å; H379-S548 WeakPolarHBondContact CD2-CB 3.43Å; H379-S548 WeakPolarHBondContact NE2-CB 3.3Å; A546-S548 VanDerWaalsContact C-N 3.29Å; A546-S548 PolarHBondContact O-N 3.33Å
549	R	81.5	Confident	89	Confident	49 Å²	49	47.9 Å²	47.9	19%	0.185	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-108.3	10.3	172.2	-61.3	-163.1	59.7	113.3	-5.4	113.4	Q358 C545 A546 K547 A551 I552	Q358-R549 PolarHBondContact O-NH1 2.9Å; C545-R549 HydrophobicContact CB-CB 4.46Å; A546-R549 WeakPolarHBondContact O-CA 3.25Å; A546-R549 WeakPolarHBondContact O-CB 3.2Å; A546-R549 PolarHBondContact O-N 3.47Å; K547-R549 PolarHBondContact O-N 3.14Å; R549-A551 PolarHBondContact O-N 3.43Å; R549-I552 HydrophobicContact CB-CD1 3.74Å; R549-I552 HydrophobicContact CG-CD1 3.58Å; R549-I552 PolarHBondContact O-N 2.89Å
550	E	83.8	Confident	88.9	Confident	48 Å²	48	47 Å²	47	22%	0.224	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-5.6	174.7	-64.3	-175.3	-171.1	0	0	113.2	K547 H562 K599 R624	K547-E550 PolarHBondContact O-N 2.93Å; E550-H562 HydrophobicContact CG-CB 4.13Å; E550-H562 PolarHBondContact O-NE2 3.45Å; E550-K599 IonicContact OE2-NZ 2.85Å; E550-R624 IonicContact OE1-NH1 2.66Å
551	A	71.6	Confident	88.9	Confident	51 Å²	51	40.6 Å²	40.6	42%	0.421	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	16.6	175.2	0	0	0	0	0	113.5	R549	R549-A551 PolarHBondContact O-N 3.43Å
552	I	74.6	Confident	88.6	Confident	16 Å²	16	41.1 Å²	41.1	8%	0.082	23%	0.229	C	C	.	.			trans	-113.6	122.7	-176.7	-57.9	168.1	0	0	0	109.9	Q358 R549 S557	Q358-I552 VanDerWaalsContact C-CD1 3.43Å; Q358-I552 HydrophobicContact CB-CD1 3.58Å; Q358-I552 HydrophobicContact CB-CG1 4.21Å; Q358-I552 WeakPolarHBondContact O-CD1 3.4Å; R549-I552 HydrophobicContact CB-CD1 3.74Å; R549-I552 HydrophobicContact CG-CD1 3.58Å; R549-I552 PolarHBondContact O-N 2.89Å; I552-S557 PolarHBondContact O-OG 2.98Å
553	D	75.6	Confident	88.3	Confident	150 Å²	150	42.6 Å²	42.6	80%	0.802	24%	0.237	S	C	*	.			trans	-76.3	146.2	173.2	-74.6	-44.5	0	0	0	112.7
554	S	83.7	Confident	88.1	Confident	36 Å²	36	44.6 Å²	44.6	25%	0.252	25%	0.246	S	C	.	.			trans	-154.2	160.5	-179.1	71.8	0	0	0	0	108.9	V556 S557	S554-V556 PolarHBondContact O-N 3.48Å; S554-V556 PolarHBondContact OG-N 3.42Å; S554-S557 PolarHBondContact N-OG 3.26Å; S554-S557 PolarHBondContact O-N 3.11Å; S554-S557 PolarHBondContact OG-N 3.4Å; S554-S557 VanDerWaalsContact OG-N 3.09Å; S554-S557 PolarHBondContact OG-OG 2.84Å
555	P	86.5	Confident	87.9	Confident	109 Å²	109	44.8 Å²	44.8	71%	0.708	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.6	175.9	-25.7	35.5	0	0	0	114.6	F558	P555-F558 WeakPolarHBondContact O-CE1 3.28Å
556	V	93.5	Very high	87.6	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.012	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	13.5	-179.5	-61	0	0	0	0	113.3	D528 T531 E532 R543 S554 F558 L559 A560	D528-V556 HydrophobicContact CB-CG2 3.81Å; T531-V556 HydrophobicContact CG2-CB 3.93Å; T531-V556 HydrophobicContact CG2-CG1 3.96Å; T531-V556 HydrophobicContact CG2-CG2 4.17Å; E532-V556 HydrophobicContact CB-CG1 4.04Å; R543-V556 HydrophobicContact CG-CG2 4.35Å; S554-V556 PolarHBondContact O-N 3.48Å; S554-V556 PolarHBondContact OG-N 3.42Å; V556-F558 PolarHBondContact O-N 3.07Å; V556-F558 VanDerWaalsContact O-N 3.15Å; V556-L559 HydrophobicContact CB-CD1 4.34Å; V556-L559 HydrophobicContact CG1-CD1 4.46Å; V556-L559 WeakPolarHBondContact O-CA 3.49Å; V556-L559 WeakPolarHBondContact O-CB 3.38Å; V556-L559 PolarHBondContact O-N 2.85Å; V556-A560 PolarHBondContact O-N 3.4Å
557	S	92.1	Very high	87.5	Confident	12 Å²	12	52.5 Å²	52.5	8%	0.084	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-63.5	-22	-177.6	-75	0	0	0	0	113.6	I552 S554 L559 A560 N563	I552-S557 PolarHBondContact O-OG 2.98Å; S554-S557 PolarHBondContact N-OG 3.26Å; S554-S557 PolarHBondContact O-N 3.11Å; S554-S557 PolarHBondContact OG-N 3.4Å; S554-S557 VanDerWaalsContact OG-N 3.09Å; S554-S557 PolarHBondContact OG-OG 2.84Å; S557-L559 VanDerWaalsContact C-N 3.26Å; S557-L559 PolarHBondContact O-N 3.47Å; S557-A560 VanDerWaalsContact O-CB 3.26Å; S557-A560 WeakPolarHBondContact O-CB 3.42Å; S557-A560 PolarHBondContact O-N 2.85Å; S557-A560 VanDerWaalsContact O-N 3.14Å; S557-N563 PolarHBondContact O-ND2 3.39Å
558	F	94.9	Very high	87.5	Confident	116 Å²	116	46.7 Å²	46.7	51%	0.509	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-67.5	-24.4	170.5	72.7	-84	0	0	0	113.4	H535 P555 V556	H535-F558 AromaticContact CD2-CZ 3.74Å; H535-F558 AromaticContact NE2-CE2 3.62Å; H535-F558 AromaticContact NE2-CZ 3.68Å; P555-F558 WeakPolarHBondContact O-CE1 3.28Å; V556-F558 PolarHBondContact O-N 3.07Å; V556-F558 VanDerWaalsContact O-N 3.15Å
559	L	96.8	Very high	87.7	Confident	12 Å²	12	51.6 Å²	51.6	6%	0.063	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-88.2	-3.4	173.1	-59.8	171.6	0	0	0	112.5	T531 H535 R543 V556 S557 Q564	T531-L559 HydrophobicContact CG2-CB 4.49Å; T531-L559 HydrophobicContact CG2-CD1 3.75Å; H535-L559 HydrophobicContact CB-CD1 3.73Å; R543-L559 HydrophobicContact CB-CB 4.38Å; R543-L559 PolarHBondContact N-O 2.94Å; V556-L559 HydrophobicContact CB-CD1 4.34Å; V556-L559 HydrophobicContact CG1-CD1 4.46Å; V556-L559 WeakPolarHBondContact O-CA 3.49Å; V556-L559 WeakPolarHBondContact O-CB 3.38Å; V556-L559 PolarHBondContact O-N 2.85Å; S557-L559 VanDerWaalsContact C-N 3.26Å; S557-L559 PolarHBondContact O-N 3.47Å; L559-Q564 PolarHBondContact O-NE2 2.82Å
560	A	96.8	Very high	87.9	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.008	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-71.3	134.5	-177.9	0	0	0	0	0	111.5	R543 V556 S557 H562 N563 Q564	R543-A560 CarbonylContact O-C 3.17Å; R543-A560 VanDerWaalsContact O-CA 3.28Å; R543-A560 WeakPolarHBondContact O-CA 3.41Å; V556-A560 PolarHBondContact O-N 3.4Å; S557-A560 VanDerWaalsContact O-CB 3.26Å; S557-A560 WeakPolarHBondContact O-CB 3.42Å; S557-A560 PolarHBondContact O-N 2.85Å; S557-A560 VanDerWaalsContact O-N 3.14Å; A560-H562 WeakPolarHBondContact CB-CE1 3.32Å; A560-H562 PolarHBondContact O-N 3.14Å; A560-H562 VanDerWaalsContact O-N 3.09Å; A560-N563 PolarHBondContact O-N 3.47Å; A560-Q564 PolarHBondContact O-N 3.3Å
561	L	96.6	Very high	88	Confident	2 Å²	2	52 Å²	52	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-51.2	-41.2	-173	178.7	60.3	0	0	0	113.2	V542 R543 L544 N563 Q564 I565 E603 L606 L607	V542-L561 HydrophobicContact CG1-CB 3.86Å; V542-L561 HydrophobicContact CG1-CD1 3.91Å; V542-L561 HydrophobicContact CG1-CG 4.35Å; R543-L561 PolarHBondContact O-N 3.16Å; L544-L561 HydrophobicContact CD1-CB 4.38Å; L544-L561 HydrophobicContact CD1-CD2 3.55Å; L561-N563 VanDerWaalsContact C-N 3.3Å; L561-N563 PolarHBondContact O-N 2.83Å; L561-Q564 PolarHBondContact O-N 2.7Å; L561-I565 HydrophobicContact CD1-CD1 3.93Å; L561-I565 HydrophobicContact CD1-CG1 4.22Å; L561-I565 HydrophobicContact CG-CD1 3.85Å; L561-I565 WeakPolarHBondContact O-CD1 3.21Å; L561-I565 WeakPolarHBondContact O-CG1 3.22Å; L561-I565 PolarHBondContact O-N 3.35Å; L561-E603 HydrophobicContact CD2-CB 4.41Å; L561-E603 HydrophobicContact CD2-CG 4.09Å; L561-L606 HydrophobicContact CD1-CB 3.8Å; L561-L606 HydrophobicContact CD1-CD1 3.83Å; L561-L606 HydrophobicContact CD1-CG 4.5Å; L561-L607 HydrophobicContact CD1-CG 4.45Å; L561-L607 HydrophobicContact CD2-CD1 3.92Å; L561-L607 HydrophobicContact CD2-CD2 4.17Å; L561-L607 HydrophobicContact CD2-CG 4.02Å
562	H	92.4	Very high	88.9	Confident	14 Å²	14	53.2 Å²	53.2	7%	0.065	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-29.9	-179.8	60.2	-88.3	0	0	0	113.4	E550 A560 R566	E550-H562 HydrophobicContact CG-CB 4.13Å; E550-H562 PolarHBondContact O-NE2 3.45Å; A560-H562 WeakPolarHBondContact CB-CE1 3.32Å; A560-H562 PolarHBondContact O-N 3.14Å; A560-H562 VanDerWaalsContact O-N 3.09Å; H562-R566 PolarHBondContact O-N 3.06Å
563	N	92.6	Very high	89.6	Confident	35 Å²	35	56.3 Å²	56.3	19%	0.187	30%	0.303	C	S	.	.	H	α-helix	trans	-84.7	-36.9	176.5	-68.6	-28.7	0	0	0	111.8	S557 A560 L561 I565 R566 N567	S557-N563 PolarHBondContact O-ND2 3.39Å; A560-N563 PolarHBondContact O-N 3.47Å; L561-N563 VanDerWaalsContact C-N 3.3Å; L561-N563 PolarHBondContact O-N 2.83Å; N563-I565 VanDerWaalsContact C-N 3.26Å; N563-I565 PolarHBondContact O-N 3.12Å; N563-R566 PolarHBondContact O-N 3.27Å; N563-R566 VanDerWaalsContact O-N 3.15Å; N563-N567 PolarHBondContact O-N 3.19Å; N563-N567 VanDerWaalsContact O-N 3.09Å
564	Q	94.3	Very high	90.4	Very high	46 Å²	46	49.5 Å²	49.5	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-40.2	170.2	-64.6	-164.8	31.7	0	0	111.5	V541 L559 A560 L561 N567 M568 L606	V541-Q564 PolarHBondContact O-NE2 3.32Å; L559-Q564 PolarHBondContact O-NE2 2.82Å; A560-Q564 PolarHBondContact O-N 3.3Å; L561-Q564 PolarHBondContact O-N 2.7Å; Q564-N567 CarbonylContact O-C 3.13Å; Q564-N567 PolarHBondContact O-N 3.35Å; Q564-M568 PolarHBondContact O-N 3.39Å; Q564-L606 HydrophobicContact CB-CD1 3.84Å
565	I	92.6	Very high	90.6	Very high	8 Å²	8	50.7 Å²	50.7	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-66.3	-37.1	175.5	-67.8	164.6	0	0	0	112.6	L561 N563 N567 M568 L574 K599 A602 E603 L606	L561-I565 HydrophobicContact CD1-CD1 3.93Å; L561-I565 HydrophobicContact CD1-CG1 4.22Å; L561-I565 HydrophobicContact CG-CD1 3.85Å; L561-I565 WeakPolarHBondContact O-CD1 3.21Å; L561-I565 WeakPolarHBondContact O-CG1 3.22Å; L561-I565 PolarHBondContact O-N 3.35Å; N563-I565 VanDerWaalsContact C-N 3.26Å; N563-I565 PolarHBondContact O-N 3.12Å; I565-N567 VanDerWaalsContact C-N 3.29Å; I565-N567 PolarHBondContact O-N 2.87Å; I565-M568 VanDerWaalsContact O-CB 3.27Å; I565-M568 WeakPolarHBondContact O-CB 3.4Å; I565-M568 PolarHBondContact O-N 2.89Å; I565-L574 HydrophobicContact CG2-CD2 3.63Å; I565-K599 HydrophobicContact CD1-CG 4.46Å; I565-A602 HydrophobicContact CG1-CB 4.06Å; I565-A602 HydrophobicContact CG2-CB 4.02Å; I565-E603 HydrophobicContact CD1-CB 4.28Å; I565-E603 HydrophobicContact CD1-CG 3.4Å; I565-L606 HydrophobicContact CG1-CD1 3.56Å
566	R	87.8	Confident	90.8	Very high	104 Å²	104	52.7 Å²	52.7	39%	0.392	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-38	176.1	-83.3	174.6	150.1	170.7	-10.2	111.5	H562 N563 M568 Q578 D582	H562-R566 PolarHBondContact O-N 3.06Å; N563-R566 PolarHBondContact O-N 3.27Å; N563-R566 VanDerWaalsContact O-N 3.15Å; R566-M568 VanDerWaalsContact C-N 3.27Å; R566-M568 PolarHBondContact O-N 3.13Å; R566-Q578 HydrophobicContact CG-CG 4.14Å; R566-D582 IonicContact CZ-OD2 3.23Å; R566-D582 IonicContact NE-OD2 3.74Å; R566-D582 VanDerWaalsContact NH2-CG 3.34Å; R566-D582 IonicContact NH2-OD1 2.69Å; R566-D582 PolarHBondContact NH2-OD1 2.99Å; R566-D582 VanDerWaalsContact NH2-OD1 3.09Å; R566-D582 IonicContact NH2-OD2 3.38Å; R566-D582 PolarHBondContact NH2-OD2 3.41Å
567	N	86	Confident	90.6	Very high	127 Å²	127	53.3 Å²	53.3	68%	0.679	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	24.9	-178.8	-57.8	-7.1	0	0	0	112.9	N563 Q564 I565 D569	N563-N567 PolarHBondContact O-N 3.19Å; N563-N567 VanDerWaalsContact O-N 3.09Å; Q564-N567 CarbonylContact O-C 3.13Å; Q564-N567 PolarHBondContact O-N 3.35Å; I565-N567 VanDerWaalsContact C-N 3.29Å; I565-N567 PolarHBondContact O-N 2.87Å; N567-D569 PolarHBondContact O-N 2.68Å
568	M	84.4	Confident	90.3	Very high	17 Å²	17	53.9 Å²	53.9	8%	0.084	27%	0.27	C	S	.	.			trans	-100.7	84	-170.8	-163.9	168.6	-167.3	0	0	112.4	Q564 I565 R566 S570 M571 A602 E605 L606	Q564-M568 PolarHBondContact O-N 3.39Å; I565-M568 VanDerWaalsContact O-CB 3.27Å; I565-M568 WeakPolarHBondContact O-CB 3.4Å; I565-M568 PolarHBondContact O-N 2.89Å; R566-M568 VanDerWaalsContact C-N 3.27Å; R566-M568 PolarHBondContact O-N 3.13Å; M568-S570 WeakPolarHBondContact CG-OG 3.44Å; M568-S570 PolarHBondContact O-N 3Å; M568-M571 PolarHBondContact O-N 3.33Å; M568-A602 HydrophobicContact SD-CB 3.77Å; M568-E605 HydrophobicContact CE-CB 4.35Å; M568-E605 VanDerWaalsContact CE-CD 3.46Å; M568-E605 HydrophobicContact CE-CG 4.12Å; M568-E605 VanDerWaalsContact CE-OE1 3.23Å; M568-E605 WeakPolarHBondContact CE-OE1 3.36Å; M568-L606 HydrophobicContact CE-CD1 4.5Å; M568-L606 HydrophobicContact CE-CD2 4.02Å; M568-L606 HydrophobicContact CE-CG 3.97Å; M568-L606 HydrophobicContact SD-CD1 3.94Å; M568-L606 HydrophobicContact SD-CD2 4.38Å; M568-L606 HydrophobicContact SD-CG 4.06Å
569	D	83.8	Confident	89.9	Confident	129 Å²	129	53.8 Å²	53.8	69%	0.69	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.8	-175.9	-61.1	-31.6	0	0	0	114.7	N567 M571 Q575	N567-D569 PolarHBondContact O-N 2.68Å; D569-M571 PolarHBondContact O-N 2.59Å; D569-Q575 PolarHBondContact OD1-NE2 2.83Å
570	S	84.9	Confident	89.4	Confident	80 Å²	80	56.5 Å²	56.5	56%	0.559	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.5	171.9	58.6	0	0	0	0	113.8	M568	M568-S570 WeakPolarHBondContact CG-OG 3.44Å; M568-S570 PolarHBondContact O-N 3Å
571	M	87.1	Confident	88.7	Confident	26 Å²	26	58.6 Å²	58.6	13%	0.128	29%	0.294	C	S	.	.			trans	-128	68.1	179.3	-61.8	-158.1	-171.1	0	0	113.2	M568 D569 E573 L574 Q575 T601 A602 E605	M568-M571 PolarHBondContact O-N 3.33Å; D569-M571 PolarHBondContact O-N 2.59Å; M571-E573 PolarHBondContact O-N 3.01Å; M571-E573 VanDerWaalsContact O-N 3.15Å; M571-L574 HydrophobicContact CB-CB 3.94Å; M571-L574 WeakPolarHBondContact O-CB 3.49Å; M571-L574 PolarHBondContact O-N 2.82Å; M571-Q575 PolarHBondContact O-N 2.91Å; M571-Q575 VanDerWaalsContact O-N 3.13Å; M571-T601 HydrophobicContact CE-CG2 3.94Å; M571-A602 HydrophobicContact CE-CB 4.32Å; M571-A602 HydrophobicContact SD-CB 3.93Å; M571-E605 WeakPolarHBondContact CE-OE2 3.42Å
572	P	89.3	Confident	87.9	Confident	75 Å²	75	62.6 Å²	62.6	49%	0.487	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-22.7	-177.5	25.9	-35.6	0	0	0	114.2	K576	P572-K576 WeakPolarHBondContact O-CG 3.36Å; P572-K576 PolarHBondContact O-N 2.91Å; P572-K576 VanDerWaalsContact O-N 3.08Å
573	E	90.5	Very high	87.3	Confident	82 Å²	82	67.6 Å²	67.6	38%	0.383	34%	0.339	S	S	.	.	H	α-helix	trans	-68.5	-37.6	171.6	-165.6	-170.7	163.6	0	0	111.8	M571 L577 R594 L598	M571-E573 PolarHBondContact O-N 3.01Å; M571-E573 VanDerWaalsContact O-N 3.15Å; E573-L577 HydrophobicContact CG-CD1 4.45Å; E573-L577 WeakPolarHBondContact O-CG 3.49Å; E573-L577 PolarHBondContact O-N 2.88Å; E573-L577 VanDerWaalsContact O-N 3.1Å; E573-R594 WeakPolarHBondContact OE1-CG 3.32Å; E573-R594 IonicContact OE1-CZ 3.59Å; E573-R594 IonicContact OE1-NE 2.7Å; E573-R594 PolarHBondContact OE1-NE 3.06Å; E573-R594 IonicContact OE1-NH2 3.56Å; E573-R594 PolarHBondContact OE1-NH2 3.13Å; E573-R594 IonicContact OE2-CZ 3.78Å; E573-R594 IonicContact OE2-NE 3.97Å; E573-R594 IonicContact OE2-NH2 3.98Å; E573-R594 PolarHBondContact OE2-NH2 2.78Å; E573-L598 HydrophobicContact CB-CD1 4.05Å; E573-L598 HydrophobicContact CG-CD1 3.83Å
574	L	91.3	Very high	86.5	Confident	6 Å²	6	70 Å²	70	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-70.4	-39.4	175.9	-178.9	56.7	0	0	0	111	I565 M571 L577 Q578 Y595 L598 K599 A602	I565-L574 HydrophobicContact CG2-CD2 3.63Å; M571-L574 HydrophobicContact CB-CB 3.94Å; M571-L574 WeakPolarHBondContact O-CB 3.49Å; M571-L574 PolarHBondContact O-N 2.82Å; L574-L577 PolarHBondContact O-N 3.18Å; L574-Q578 WeakPolarHBondContact O-CB 3.44Å; L574-Q578 PolarHBondContact O-N 2.97Å; L574-Y595 HydrophobicContact CD1-CD2 3.66Å; L574-Y595 HydrophobicContact CD1-CE2 3.82Å; L574-L598 HydrophobicContact CB-CB 4.17Å; L574-L598 HydrophobicContact CB-CD1 4.44Å; L574-L598 HydrophobicContact CD1-CB 4Å; L574-L598 HydrophobicContact CD2-CB 4.45Å; L574-L598 HydrophobicContact CG-CB 4.44Å; L574-K599 HydrophobicContact CD1-CB 4.19Å; L574-A602 HydrophobicContact CD2-CB 3.83Å
575	Q	88.6	Confident	85.2	Confident	61 Å²	61	70.4 Å²	70.4	29%	0.285	37%	0.371	S	S	.	.	H	α-helix	trans	-58.6	-47.8	172.9	-70.5	176.9	-33.9	0	0	111.4	D569 M571 L577 Q578 Q579	D569-Q575 PolarHBondContact OD1-NE2 2.83Å; M571-Q575 PolarHBondContact O-N 2.91Å; M571-Q575 VanDerWaalsContact O-N 3.13Å; Q575-L577 PolarHBondContact O-N 2.85Å; Q575-Q578 PolarHBondContact O-N 3.16Å; Q575-Q579 WeakPolarHBondContact O-CB 3.38Å; Q575-Q579 PolarHBondContact O-N 2.93Å
576	K	89.8	Confident	84.4	Confident	152 Å²	152	77.1 Å²	77.1	66%	0.661	40%	0.402	S	S	*	.	H	α-helix	trans	-60.4	-44.8	176.9	-73.4	175.5	-177.5	-175.2	0	113.1	P572 Q578 Q579 L580	P572-K576 WeakPolarHBondContact O-CG 3.36Å; P572-K576 PolarHBondContact O-N 2.91Å; P572-K576 VanDerWaalsContact O-N 3.08Å; K576-Q578 VanDerWaalsContact C-N 3.34Å; K576-Q579 PolarHBondContact O-N 2.83Å; K576-L580 WeakPolarHBondContact O-CB 3.4Å; K576-L580 PolarHBondContact O-N 2.93Å
577	L	88.9	Confident	84	Confident	14 Å²	14	73.3 Å²	73.3	7%	0.073	39%	0.39	C	S	.	.	H	α-helix	trans	-69	-32.3	177.6	-72.2	168.5	0	0	0	112.5	E573 L574 Q575 K581 D591 R594 Y595 L598	E573-L577 HydrophobicContact CG-CD1 4.45Å; E573-L577 WeakPolarHBondContact O-CG 3.49Å; E573-L577 PolarHBondContact O-N 2.88Å; E573-L577 VanDerWaalsContact O-N 3.1Å; L574-L577 PolarHBondContact O-N 3.18Å; Q575-L577 PolarHBondContact O-N 2.85Å; L577-K581 VanDerWaalsContact O-CB 3.29Å; L577-K581 WeakPolarHBondContact O-CB 3.43Å; L577-K581 PolarHBondContact O-N 3.34Å; L577-K581 VanDerWaalsContact O-N 3.13Å; L577-D591 HydrophobicContact CD2-CB 3.85Å; L577-R594 HydrophobicContact CD1-CB 4.23Å; L577-R594 HydrophobicContact CD1-CG 3.89Å; L577-Y595 HydrophobicContact CB-CD2 4.04Å; L577-L598 HydrophobicContact CD1-CD1 3.89Å
578	Q	87.3	Confident	83.9	Confident	24 Å²	24	69.9 Å²	69.9	11%	0.112	38%	0.376	C	S	.	.	H	α-helix	trans	-70.1	-44.2	173.7	-178.6	61.4	61.7	0	0	111.6	R566 L574 Q575 K576 K581 D582 Y595	R566-Q578 HydrophobicContact CG-CG 4.14Å; L574-Q578 WeakPolarHBondContact O-CB 3.44Å; L574-Q578 PolarHBondContact O-N 2.97Å; Q575-Q578 PolarHBondContact O-N 3.16Å; K576-Q578 VanDerWaalsContact C-N 3.34Å; Q578-K581 PolarHBondContact O-N 3.4Å; Q578-D582 PolarHBondContact NE2-OD1 3.44Å; Q578-D582 VanDerWaalsContact NE2-OD1 3.08Å; Q578-D582 PolarHBondContact NE2-OD2 3.49Å; Q578-D582 PolarHBondContact O-N 3.34Å; Q578-Y595 HydrophobicContact CB-CE2 4.19Å; Q578-Y595 VanDerWaalsContact OE1-CE2 3.26Å; Q578-Y595 PolarHBondContact OE1-OH 3.32Å
579	Q	86.5	Confident	83.7	Confident	114 Å²	114	74.5 Å²	74.5	53%	0.533	41%	0.41	S	S	.	.	H	α-helix	trans	-60.4	-51.7	175.2	178.9	179.8	-5.4	0	0	110.9	Q575 K576 K581 D582 E583	Q575-Q579 WeakPolarHBondContact O-CB 3.38Å; Q575-Q579 PolarHBondContact O-N 2.93Å; K576-Q579 PolarHBondContact O-N 2.83Å; Q579-K581 PolarHBondContact O-N 3.1Å; Q579-D582 CarbonylContact O-C 3.56Å; Q579-D582 PolarHBondContact O-N 3.37Å; Q579-E583 HydrophobicContact CG-CG 4.43Å; Q579-E583 VanDerWaalsContact CG-OE1 3.28Å; Q579-E583 WeakPolarHBondContact CG-OE1 3.44Å; Q579-E583 PolarHBondContact NE2-OE1 3.03Å; Q579-E583 WeakPolarHBondContact O-CG 3.34Å; Q579-E583 PolarHBondContact O-N 2.92Å
580	L	85.4	Confident	83.9	Confident	69 Å²	69	71.4 Å²	71.4	36%	0.361	40%	0.402	S	S	.	.	H	α-helix	trans	-53.3	-44.9	176.8	-179.8	62.2	0	0	0	110.7	K576 E583 T584 L587	K576-L580 WeakPolarHBondContact O-CB 3.4Å; K576-L580 PolarHBondContact O-N 2.93Å; L580-E583 PolarHBondContact O-N 3.43Å; L580-T584 HydrophobicContact CD1-CG2 3.93Å; L580-T584 PolarHBondContact O-N 3.11Å; L580-T584 PolarHBondContact O-OG1 2.87Å; L580-L587 HydrophobicContact CB-CD2 4.08Å; L580-L587 HydrophobicContact CD2-CD2 3.73Å; L580-L587 HydrophobicContact CG-CD2 3.75Å
581	K	81.5	Confident	84.1	Confident	45 Å²	45	70.3 Å²	70.3	20%	0.196	39%	0.39	C	S	.	.	H	α-helix	trans	-65.3	-36.9	177.6	-169.1	167.9	-170.4	161.4	0	114.2	L577 Q578 Q579 E583 G585 L587 E592 Y595	L577-K581 VanDerWaalsContact O-CB 3.29Å; L577-K581 WeakPolarHBondContact O-CB 3.43Å; L577-K581 PolarHBondContact O-N 3.34Å; L577-K581 VanDerWaalsContact O-N 3.13Å; Q578-K581 PolarHBondContact O-N 3.4Å; Q579-K581 PolarHBondContact O-N 3.1Å; K581-E583 VanDerWaalsContact C-N 3.28Å; K581-G585 CarbonylContact O-C 3.6Å; K581-G585 WeakPolarHBondContact O-CA 3.44Å; K581-G585 PolarHBondContact O-N 3.39Å; K581-L587 HydrophobicContact CB-CD1 4.08Å; K581-L587 HydrophobicContact CB-CD2 3.98Å; K581-L587 HydrophobicContact CB-CG 3.79Å; K581-L587 HydrophobicContact CD-CD1 3.95Å; K581-L587 HydrophobicContact CD-CG 4.04Å; K581-L587 HydrophobicContact CG-CD1 4.38Å; K581-L587 HydrophobicContact CG-CG 4.01Å; K581-E592 VanDerWaalsContact NZ-CD 3.29Å; K581-E592 IonicContact NZ-OE1 3.2Å; K581-E592 PolarHBondContact NZ-OE1 3.26Å; K581-E592 IonicContact NZ-OE2 3.61Å; K581-E592 PolarHBondContact NZ-OE2 2.99Å; K581-Y595 HydrophobicContact CD-CE1 4.4Å
582	D	80.6	Confident	83.9	Confident	86 Å²	86	70.6 Å²	70.6	46%	0.46	39%	0.391	S	S	.	.	H	α-helix	trans	-76.3	-18.6	176.6	-69.1	-32.2	0	0	0	111.6	R566 Q578 Q579	R566-D582 IonicContact CZ-OD2 3.23Å; R566-D582 IonicContact NE-OD2 3.74Å; R566-D582 VanDerWaalsContact NH2-CG 3.34Å; R566-D582 IonicContact NH2-OD1 2.69Å; R566-D582 PolarHBondContact NH2-OD1 2.99Å; R566-D582 VanDerWaalsContact NH2-OD1 3.09Å; R566-D582 IonicContact NH2-OD2 3.38Å; R566-D582 PolarHBondContact NH2-OD2 3.41Å; Q578-D582 PolarHBondContact NE2-OD1 3.44Å; Q578-D582 VanDerWaalsContact NE2-OD1 3.08Å; Q578-D582 PolarHBondContact NE2-OD2 3.49Å; Q578-D582 PolarHBondContact O-N 3.34Å; Q579-D582 CarbonylContact O-C 3.56Å; Q579-D582 PolarHBondContact O-N 3.37Å
583	E	80.1	Confident	83.9	Confident	119 Å²	119	74.9 Å²	74.9	56%	0.556	40%	0.402	S	S	*	.	H	α-helix	trans	-86.8	-43.4	173.3	-72.9	174.2	-172.4	0	0	113.5	Q579 L580 K581	Q579-E583 HydrophobicContact CG-CG 4.43Å; Q579-E583 VanDerWaalsContact CG-OE1 3.28Å; Q579-E583 WeakPolarHBondContact CG-OE1 3.44Å; Q579-E583 PolarHBondContact NE2-OE1 3.03Å; Q579-E583 WeakPolarHBondContact O-CG 3.34Å; Q579-E583 PolarHBondContact O-N 2.92Å; L580-E583 PolarHBondContact O-N 3.43Å; K581-E583 VanDerWaalsContact C-N 3.28Å
584	T	75.1	Confident	84	Confident	87 Å²	87	76.7 Å²	76.7	53%	0.534	41%	0.405	S	S	.	.	H	α-helix	trans	-98.3	-10.9	-177.2	59.7	0	0	0	0	114.4	L580 E586	L580-T584 HydrophobicContact CD1-CG2 3.93Å; L580-T584 PolarHBondContact O-N 3.11Å; L580-T584 PolarHBondContact O-OG1 2.87Å; T584-E586 PolarHBondContact O-N 3.19Å; T584-E586 PolarHBondContact OG1-O 2.93Å
585	G	67.7	Low	83.9	Confident	53 Å²	53	77.2 Å²	77.2	55%	0.546	41%	0.407	S	S	.	.	S	Bend	trans	76.6	-41.6	-173.8	0	0	0	0	0	114	K581	K581-G585 CarbonylContact O-C 3.6Å; K581-G585 WeakPolarHBondContact O-CA 3.44Å; K581-G585 PolarHBondContact O-N 3.39Å
586	E	75.1	Confident	84	Confident	149 Å²	149	81 Å²	81	70%	0.696	42%	0.418	S	S	*	.	S	Bend	trans	-125.8	151.4	178.1	-62	-165	168	0	0	112.5	T584	T584-E586 PolarHBondContact O-N 3.19Å; T584-E586 PolarHBondContact OG1-O 2.93Å
587	L	79.3	Confident	84.2	Confident	24 Å²	24	76 Å²	76	13%	0.126	41%	0.406	C	S	.	.			trans	-106.2	157.6	176.7	-73.2	-179.4	0	0	0	110.7	L580 K581 D591 E592 Y595	L580-L587 HydrophobicContact CB-CD2 4.08Å; L580-L587 HydrophobicContact CD2-CD2 3.73Å; L580-L587 HydrophobicContact CG-CD2 3.75Å; K581-L587 HydrophobicContact CB-CD1 4.08Å; K581-L587 HydrophobicContact CB-CD2 3.98Å; K581-L587 HydrophobicContact CB-CG 3.79Å; K581-L587 HydrophobicContact CD-CD1 3.95Å; K581-L587 HydrophobicContact CD-CG 4.04Å; K581-L587 HydrophobicContact CG-CD1 4.38Å; K581-L587 HydrophobicContact CG-CG 4.01Å; L587-D591 HydrophobicContact CB-CB 4.01Å; L587-D591 HydrophobicContact CD1-CB 4.36Å; L587-D591 HydrophobicContact CD2-CB 4.3Å; L587-D591 HydrophobicContact CG-CB 4.46Å; L587-E592 HydrophobicContact CB-CB 4.04Å; L587-Y595 HydrophobicContact CD1-CD2 4.36Å; L587-Y595 HydrophobicContact CD1-CG 3.98Å
588	S	84.1	Confident	84.4	Confident	56 Å²	56	76.5 Å²	76.5	39%	0.392	41%	0.408	S	S	.	.			trans	-59.3	160.1	170.7	89.4	0	0	0	0	111.4	A590 D591 E592	S588-A590 PolarHBondContact O-N 2.97Å; S588-A590 PolarHBondContact OG-N 2.88Å; S588-D591 VanDerWaalsContact CB-OD2 3.29Å; S588-D591 WeakPolarHBondContact CB-OD2 3.41Å; S588-D591 PolarHBondContact O-N 2.86Å; S588-D591 VanDerWaalsContact O-N 3.15Å; S588-D591 WeakPolarHBondContact OG-CB 3.3Å; S588-D591 PolarHBondContact OG-N 2.88Å; S588-D591 VanDerWaalsContact OG-N 3.09Å; S588-D591 PolarHBondContact OG-OD2 2.86Å; S588-E592 WeakPolarHBondContact O-CB 3.47Å; S588-E592 PolarHBondContact O-N 2.98Å
589	S	81.3	Confident	84.7	Confident	114 Å²	114	76.7 Å²	76.7	80%	0.797	41%	0.409	S	S	*	.	H	α-helix	trans	-62.4	-26.9	179.5	59.9	0	0	0	0	113.5	K593	S589-K593 WeakPolarHBondContact O-CB 3.33Å; S589-K593 PolarHBondContact O-N 3.08Å
590	A	88	Confident	85	Confident	63 Å²	63	79.2 Å²	79.2	52%	0.521	41%	0.413	S	S	.	.	H	α-helix	trans	-76.6	-45.9	172.5	0	0	0	0	0	111.5	S588 K593 R594	S588-A590 PolarHBondContact O-N 2.97Å; S588-A590 PolarHBondContact OG-N 2.88Å; A590-K593 WeakPolarHBondContact O-CB 3.4Å; A590-K593 PolarHBondContact O-N 3.41Å; A590-R594 PolarHBondContact O-N 2.96Å
591	D	88.6	Confident	85.4	Confident	58 Å²	58	79.5 Å²	79.5	31%	0.31	42%	0.418	S	S	.	.	H	α-helix	trans	-68.4	-42.1	-178.1	-65.7	-50	0	0	0	111.9	L577 L587 S588 K593 R594 Y595	L577-D591 HydrophobicContact CD2-CB 3.85Å; L587-D591 HydrophobicContact CB-CB 4.01Å; L587-D591 HydrophobicContact CD1-CB 4.36Å; L587-D591 HydrophobicContact CD2-CB 4.3Å; L587-D591 HydrophobicContact CG-CB 4.46Å; S588-D591 VanDerWaalsContact CB-OD2 3.29Å; S588-D591 WeakPolarHBondContact CB-OD2 3.41Å; S588-D591 PolarHBondContact O-N 2.86Å; S588-D591 VanDerWaalsContact O-N 3.15Å; S588-D591 WeakPolarHBondContact OG-CB 3.3Å; S588-D591 PolarHBondContact OG-N 2.88Å; S588-D591 VanDerWaalsContact OG-N 3.09Å; S588-D591 PolarHBondContact OG-OD2 2.86Å; D591-K593 VanDerWaalsContact C-N 3.27Å; D591-K593 PolarHBondContact O-N 3.48Å; D591-R594 PolarHBondContact O-N 2.93Å; D591-R594 VanDerWaalsContact O-N 3.16Å; D591-Y595 WeakPolarHBondContact O-CB 3.33Å; D591-Y595 PolarHBondContact O-N 3.37Å
592	E	83.9	Confident	86	Confident	32 Å²	32	77.3 Å²	77.3	15%	0.15	41%	0.409	C	S	.	.	H	α-helix	trans	-63.2	-34.4	174.1	-178.8	63.5	-176.8	0	0	111.4	K581 L587 S588 R596	K581-E592 VanDerWaalsContact NZ-CD 3.29Å; K581-E592 IonicContact NZ-OE1 3.2Å; K581-E592 PolarHBondContact NZ-OE1 3.26Å; K581-E592 IonicContact NZ-OE2 3.61Å; K581-E592 PolarHBondContact NZ-OE2 2.99Å; L587-E592 HydrophobicContact CB-CB 4.04Å; S588-E592 WeakPolarHBondContact O-CB 3.47Å; S588-E592 PolarHBondContact O-N 2.98Å; E592-R596 VanDerWaalsContact O-CB 3.25Å; E592-R596 WeakPolarHBondContact O-CB 3.45Å; E592-R596 WeakPolarHBondContact O-CD 3.44Å; E592-R596 WeakPolarHBondContact O-CG 3.36Å; E592-R596 PolarHBondContact O-N 2.74Å; E592-R596 IonicContact OE1-CZ 2.87Å; E592-R596 IonicContact OE1-NE 3.97Å; E592-R596 PolarHBondContact OE1-NE 3.36Å; E592-R596 IonicContact OE1-NH2 2.96Å; E592-R596 PolarHBondContact OE1-NH2 3.24Å
593	K	88.8	Confident	86.7	Confident	164 Å²	164	74 Å²	74	71%	0.713	39%	0.39	S	S	*	.	H	α-helix	trans	-68.3	-41.6	173.6	-176.3	-178.1	179	-176.8	0	111.3	S589 A590 D591 A597	S589-K593 WeakPolarHBondContact O-CB 3.33Å; S589-K593 PolarHBondContact O-N 3.08Å; A590-K593 WeakPolarHBondContact O-CB 3.4Å; A590-K593 PolarHBondContact O-N 3.41Å; D591-K593 VanDerWaalsContact C-N 3.27Å; D591-K593 PolarHBondContact O-N 3.48Å; K593-A597 PolarHBondContact O-N 2.97Å; K593-A597 VanDerWaalsContact O-N 3.13Å
594	R	91.9	Very high	87.4	Confident	120 Å²	120	76 Å²	76	45%	0.453	39%	0.393	S	S	.	.	H	α-helix	trans	-69.1	-47.8	177.2	-175	60.9	177.5	176.7	3.4	111.8	E573 L577 A590 D591 R596 A597 L598	E573-R594 WeakPolarHBondContact OE1-CG 3.32Å; E573-R594 IonicContact OE1-CZ 3.59Å; E573-R594 IonicContact OE1-NE 2.7Å; E573-R594 PolarHBondContact OE1-NE 3.06Å; E573-R594 IonicContact OE1-NH2 3.56Å; E573-R594 PolarHBondContact OE1-NH2 3.13Å; E573-R594 IonicContact OE2-CZ 3.78Å; E573-R594 IonicContact OE2-NE 3.97Å; E573-R594 IonicContact OE2-NH2 3.98Å; E573-R594 PolarHBondContact OE2-NH2 2.78Å; L577-R594 HydrophobicContact CD1-CB 4.23Å; L577-R594 HydrophobicContact CD1-CG 3.89Å; A590-R594 PolarHBondContact O-N 2.96Å; D591-R594 PolarHBondContact O-N 2.93Å; D591-R594 VanDerWaalsContact O-N 3.16Å; R594-R596 PolarHBondContact O-N 3.47Å; R594-A597 WeakPolarHBondContact O-CB 3.49Å; R594-A597 PolarHBondContact O-N 3.31Å; R594-L598 HydrophobicContact CG-CD1 4.05Å; R594-L598 WeakPolarHBondContact O-CG 3.49Å; R594-L598 PolarHBondContact O-N 3.38Å
595	Y	90.6	Very high	88.3	Confident	18 Å²	18	75.5 Å²	75.5	7%	0.071	38%	0.384	C	S	.	.	H	α-helix	trans	-53.2	-48.9	172.4	172.1	-96.3	0	0	0	111.5	L574 L577 Q578 K581 L587 D591 A597 L598 K599	L574-Y595 HydrophobicContact CD1-CD2 3.66Å; L574-Y595 HydrophobicContact CD1-CE2 3.82Å; L577-Y595 HydrophobicContact CB-CD2 4.04Å; Q578-Y595 HydrophobicContact CB-CE2 4.19Å; Q578-Y595 VanDerWaalsContact OE1-CE2 3.26Å; Q578-Y595 PolarHBondContact OE1-OH 3.32Å; K581-Y595 HydrophobicContact CD-CE1 4.4Å; L587-Y595 HydrophobicContact CD1-CD2 4.36Å; L587-Y595 HydrophobicContact CD1-CG 3.98Å; D591-Y595 WeakPolarHBondContact O-CB 3.33Å; D591-Y595 PolarHBondContact O-N 3.37Å; Y595-A597 VanDerWaalsContact C-N 3.3Å; Y595-A597 PolarHBondContact O-N 3.38Å; Y595-L598 PolarHBondContact O-N 3.31Å; Y595-K599 HydrophobicContact CE1-CD 4.16Å; Y595-K599 VanDerWaalsContact O-CB 3.27Å; Y595-K599 WeakPolarHBondContact O-CB 3.26Å; Y595-K599 PolarHBondContact O-N 3.21Å
596	R	90.4	Very high	89.7	Confident	140 Å²	140	74.4 Å²	74.4	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-63.9	-31.5	176.1	-75.3	173.5	-172.7	-171.3	9.2	113.3	E592 R594 R600	E592-R596 VanDerWaalsContact O-CB 3.25Å; E592-R596 WeakPolarHBondContact O-CB 3.45Å; E592-R596 WeakPolarHBondContact O-CD 3.44Å; E592-R596 WeakPolarHBondContact O-CG 3.36Å; E592-R596 PolarHBondContact O-N 2.74Å; E592-R596 IonicContact OE1-CZ 2.87Å; E592-R596 IonicContact OE1-NE 3.97Å; E592-R596 PolarHBondContact OE1-NE 3.36Å; E592-R596 IonicContact OE1-NH2 2.96Å; E592-R596 PolarHBondContact OE1-NH2 3.24Å; R594-R596 PolarHBondContact O-N 3.47Å; R596-R600 WeakPolarHBondContact O-CB 3.38Å; R596-R600 VanDerWaalsContact O-CD 3.29Å; R596-R600 WeakPolarHBondContact O-CD 3.38Å; R596-R600 WeakPolarHBondContact O-CG 3.37Å; R596-R600 PolarHBondContact O-N 3.06Å
597	A	93.2	Very high	90.7	Very high	48 Å²	48	67.4 Å²	67.4	40%	0.397	33%	0.333	S	S	.	.	H	α-helix	trans	-70.9	-50.9	174.9	0	0	0	0	0	111.1	K593 R594 Y595 R600 T601	K593-A597 PolarHBondContact O-N 2.97Å; K593-A597 VanDerWaalsContact O-N 3.13Å; R594-A597 WeakPolarHBondContact O-CB 3.49Å; R594-A597 PolarHBondContact O-N 3.31Å; Y595-A597 VanDerWaalsContact C-N 3.3Å; Y595-A597 PolarHBondContact O-N 3.38Å; A597-R600 PolarHBondContact O-N 3.44Å; A597-T601 PolarHBondContact O-N 2.61Å; A597-T601 PolarHBondContact O-OG1 3.03Å
598	L	93.9	Very high	91.5	Very high	23 Å²	23	71.4 Å²	71.4	12%	0.12	35%	0.353	C	S	.	.	H	α-helix	trans	-62.6	-46	179	-67.8	169.3	0	0	0	112.2	E573 L574 L577 R594 Y595 R600 T601 A602	E573-L598 HydrophobicContact CB-CD1 4.05Å; E573-L598 HydrophobicContact CG-CD1 3.83Å; L574-L598 HydrophobicContact CB-CB 4.17Å; L574-L598 HydrophobicContact CB-CD1 4.44Å; L574-L598 HydrophobicContact CD1-CB 4Å; L574-L598 HydrophobicContact CD2-CB 4.45Å; L574-L598 HydrophobicContact CG-CB 4.44Å; L577-L598 HydrophobicContact CD1-CD1 3.89Å; R594-L598 HydrophobicContact CG-CD1 4.05Å; R594-L598 WeakPolarHBondContact O-CG 3.49Å; R594-L598 PolarHBondContact O-N 3.38Å; Y595-L598 PolarHBondContact O-N 3.31Å; L598-R600 VanDerWaalsContact C-N 3.28Å; L598-R600 PolarHBondContact O-N 3.19Å; L598-T601 WeakPolarHBondContact O-CA 3.04Å; L598-T601 WeakPolarHBondContact O-CB 3.3Å; L598-T601 PolarHBondContact O-N 2.88Å; L598-A602 PolarHBondContact O-N 3.49Å
599	K	92.8	Very high	92	Very high	28 Å²	28	73.5 Å²	73.5	12%	0.122	36%	0.359	C	S	.	.	H	α-helix	trans	-58.3	-38.4	176.1	-176.7	163	179.7	168.9	0	111.6	E550 I565 L574 Y595 T601 A602 E603	E550-K599 IonicContact OE2-NZ 2.85Å; I565-K599 HydrophobicContact CD1-CG 4.46Å; L574-K599 HydrophobicContact CD1-CB 4.19Å; Y595-K599 HydrophobicContact CE1-CD 4.16Å; Y595-K599 VanDerWaalsContact O-CB 3.27Å; Y595-K599 WeakPolarHBondContact O-CB 3.26Å; Y595-K599 PolarHBondContact O-N 3.21Å; K599-T601 VanDerWaalsContact C-N 3.33Å; K599-T601 PolarHBondContact O-N 3.38Å; K599-A602 PolarHBondContact O-N 3.3Å; K599-E603 HydrophobicContact CG-CG 4.21Å; K599-E603 VanDerWaalsContact O-CB 3.28Å; K599-E603 WeakPolarHBondContact O-CB 3.39Å; K599-E603 WeakPolarHBondContact O-CG 3.21Å; K599-E603 PolarHBondContact O-N 2.87Å
600	R	92.9	Very high	92.8	Very high	167 Å²	167	68.4 Å²	68.4	63%	0.63	32%	0.324	S	S	*	.	H	α-helix	trans	-67.2	-30.1	174.4	-75.4	169.4	-179.1	179	-0.5	113.5	R596 A597 L598 R604	R596-R600 WeakPolarHBondContact O-CB 3.38Å; R596-R600 VanDerWaalsContact O-CD 3.29Å; R596-R600 WeakPolarHBondContact O-CD 3.38Å; R596-R600 WeakPolarHBondContact O-CG 3.37Å; R596-R600 PolarHBondContact O-N 3.06Å; A597-R600 PolarHBondContact O-N 3.44Å; L598-R600 VanDerWaalsContact C-N 3.28Å; L598-R600 PolarHBondContact O-N 3.19Å; R600-R604 WeakPolarHBondContact O-CB 3.46Å; R600-R604 PolarHBondContact O-N 2.96Å; R600-R604 VanDerWaalsContact O-N 3.16Å
601	T	93.6	Very high	93.3	Very high	75 Å²	75	68 Å²	68	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-70.6	-49.6	173.8	-51.5	0	0	0	0	110.1	M571 A597 L598 K599 R604 E605	M571-T601 HydrophobicContact CE-CG2 3.94Å; A597-T601 PolarHBondContact O-N 2.61Å; A597-T601 PolarHBondContact O-OG1 3.03Å; L598-T601 WeakPolarHBondContact O-CA 3.04Å; L598-T601 WeakPolarHBondContact O-CB 3.3Å; L598-T601 PolarHBondContact O-N 2.88Å; K599-T601 VanDerWaalsContact C-N 3.33Å; K599-T601 PolarHBondContact O-N 3.38Å; T601-R604 PolarHBondContact O-N 2.89Å; T601-E605 WeakPolarHBondContact O-CB 3.39Å; T601-E605 PolarHBondContact O-N 2.97Å
602	A	94.4	Very high	93.8	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-43.7	175.8	0	0	0	0	0	112.8	I565 M568 M571 L574 L598 K599 R604 E605 L606	I565-A602 HydrophobicContact CG1-CB 4.06Å; I565-A602 HydrophobicContact CG2-CB 4.02Å; M568-A602 HydrophobicContact SD-CB 3.77Å; M571-A602 HydrophobicContact CE-CB 4.32Å; M571-A602 HydrophobicContact SD-CB 3.93Å; L574-A602 HydrophobicContact CD2-CB 3.83Å; L598-A602 PolarHBondContact O-N 3.49Å; K599-A602 PolarHBondContact O-N 3.3Å; A602-R604 VanDerWaalsContact C-N 3.3Å; A602-R604 PolarHBondContact O-N 2.97Å; A602-E605 PolarHBondContact O-N 3.03Å; A602-L606 WeakPolarHBondContact O-CG 3.31Å; A602-L606 PolarHBondContact O-N 3.19Å
603	E	94.9	Very high	94.5	Very high	16 Å²	16	63.7 Å²	63.7	8%	0.075	29%	0.291	C	S	.	.	H	α-helix	trans	-54.9	-46.2	172.5	-78.3	178	155.8	0	0	110.7	L561 I565 K599 L607 R624	L561-E603 HydrophobicContact CD2-CB 4.41Å; L561-E603 HydrophobicContact CD2-CG 4.09Å; I565-E603 HydrophobicContact CD1-CB 4.28Å; I565-E603 HydrophobicContact CD1-CG 3.4Å; K599-E603 HydrophobicContact CG-CG 4.21Å; K599-E603 VanDerWaalsContact O-CB 3.28Å; K599-E603 WeakPolarHBondContact O-CB 3.39Å; K599-E603 WeakPolarHBondContact O-CG 3.21Å; K599-E603 PolarHBondContact O-N 2.87Å; E603-L607 VanDerWaalsContact O-CB 3.28Å; E603-L607 WeakPolarHBondContact O-CB 3.22Å; E603-L607 VanDerWaalsContact O-CD1 3.3Å; E603-L607 WeakPolarHBondContact O-CD1 3.28Å; E603-L607 WeakPolarHBondContact O-CG 3.41Å; E603-L607 PolarHBondContact O-N 2.74Å; E603-L607 VanDerWaalsContact O-N 3.13Å; E603-R624 VanDerWaalsContact CD-CD 3.42Å; E603-R624 WeakPolarHBondContact OE1-CD 3.4Å; E603-R624 IonicContact OE1-NH1 3.58Å
604	R	94.5	Very high	95	Very high	162 Å²	162	55.9 Å²	55.9	61%	0.611	26%	0.257	S	S	*	.	H	α-helix	trans	-68	-44.7	179.1	-174.1	-174.3	-55.8	168.9	6.3	112.6	R600 T601 A602 L607 M608	R600-R604 WeakPolarHBondContact O-CB 3.46Å; R600-R604 PolarHBondContact O-N 2.96Å; R600-R604 VanDerWaalsContact O-N 3.16Å; T601-R604 PolarHBondContact O-N 2.89Å; A602-R604 VanDerWaalsContact C-N 3.3Å; A602-R604 PolarHBondContact O-N 2.97Å; R604-L607 PolarHBondContact O-N 2.96Å; R604-M608 HydrophobicContact CG-CE 3.9Å; R604-M608 HydrophobicContact CG-CG 4.15Å; R604-M608 HydrophobicContact CG-SD 3.58Å; R604-M608 VanDerWaalsContact CG-SD 3.58Å; R604-M608 WeakPolarHBondContact O-CB 3.4Å; R604-M608 WeakPolarHBondContact O-CG 3.48Å; R604-M608 PolarHBondContact O-N 3.33Å
605	E	94.9	Very high	95.3	Very high	75 Å²	75	50.1 Å²	50.1	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-60.2	-49.6	-178.1	-173.4	-178.7	143.4	0	0	111	M568 M571 T601 A602 N609	M568-E605 HydrophobicContact CE-CB 4.35Å; M568-E605 VanDerWaalsContact CE-CD 3.46Å; M568-E605 HydrophobicContact CE-CG 4.12Å; M568-E605 VanDerWaalsContact CE-OE1 3.23Å; M568-E605 WeakPolarHBondContact CE-OE1 3.36Å; M571-E605 WeakPolarHBondContact CE-OE2 3.42Å; T601-E605 WeakPolarHBondContact O-CB 3.39Å; T601-E605 PolarHBondContact O-N 2.97Å; A602-E605 PolarHBondContact O-N 3.03Å; E605-N609 WeakPolarHBondContact O-CB 3.49Å; E605-N609 VanDerWaalsContact O-CG 3.24Å; E605-N609 PolarHBondContact O-N 3.39Å; E605-N609 PolarHBondContact O-ND2 2.86Å; E605-N609 VanDerWaalsContact O-ND2 3.14Å
606	L	96	Very high	95.6	Very high	31 Å²	31	50.3 Å²	50.3	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-66.1	-41.2	178.4	-68.3	169.8	0	0	0	112.3	L561 Q564 I565 M568 A602 A610	L561-L606 HydrophobicContact CD1-CB 3.8Å; L561-L606 HydrophobicContact CD1-CD1 3.83Å; L561-L606 HydrophobicContact CD1-CG 4.5Å; Q564-L606 HydrophobicContact CB-CD1 3.84Å; I565-L606 HydrophobicContact CG1-CD1 3.56Å; M568-L606 HydrophobicContact CE-CD1 4.5Å; M568-L606 HydrophobicContact CE-CD2 4.02Å; M568-L606 HydrophobicContact CE-CG 3.97Å; M568-L606 HydrophobicContact SD-CD1 3.94Å; M568-L606 HydrophobicContact SD-CD2 4.38Å; M568-L606 HydrophobicContact SD-CG 4.06Å; A602-L606 WeakPolarHBondContact O-CG 3.31Å; A602-L606 PolarHBondContact O-N 3.19Å; L606-A610 WeakPolarHBondContact O-CB 3.31Å; L606-A610 PolarHBondContact O-N 3.41Å
607	L	96.9	Very high	95.9	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-37.9	178.9	-70.9	169.4	0	0	0	112.6	V542 L561 E603 R604 I613 R624 L625 M628	V542-L607 HydrophobicContact CG1-CD2 3.86Å; L561-L607 HydrophobicContact CD1-CG 4.45Å; L561-L607 HydrophobicContact CD2-CD1 3.92Å; L561-L607 HydrophobicContact CD2-CD2 4.17Å; L561-L607 HydrophobicContact CD2-CG 4.02Å; E603-L607 VanDerWaalsContact O-CB 3.28Å; E603-L607 WeakPolarHBondContact O-CB 3.22Å; E603-L607 VanDerWaalsContact O-CD1 3.3Å; E603-L607 WeakPolarHBondContact O-CD1 3.28Å; E603-L607 WeakPolarHBondContact O-CG 3.41Å; E603-L607 PolarHBondContact O-N 2.74Å; E603-L607 VanDerWaalsContact O-N 3.13Å; R604-L607 PolarHBondContact O-N 2.96Å; L607-I613 HydrophobicContact CB-CD1 4.26Å; L607-I613 HydrophobicContact CD2-CD1 3.7Å; L607-I613 HydrophobicContact CD2-CG1 4Å; L607-I613 HydrophobicContact CD2-CG2 4.33Å; L607-R624 HydrophobicContact CD1-CB 4.16Å; L607-L625 HydrophobicContact CD1-CD2 4.16Å; L607-L625 HydrophobicContact CD2-CD2 4.03Å; L607-M628 HydrophobicContact CB-CE 4.2Å; L607-M628 HydrophobicContact CB-SD 3.95Å; L607-M628 WeakPolarHBondContact O-CE 3.41Å
608	M	95.3	Very high	96.1	Very high	108 Å²	108	42.9 Å²	42.9	53%	0.532	20%	0.204	S	C	.	.	H	α-helix	trans	-75.7	-29.8	177.9	-72.5	-177.1	165.9	0	0	113.2	R604 M628	R604-M608 HydrophobicContact CG-CE 3.9Å; R604-M608 HydrophobicContact CG-CG 4.15Å; R604-M608 HydrophobicContact CG-SD 3.58Å; R604-M608 VanDerWaalsContact CG-SD 3.58Å; R604-M608 WeakPolarHBondContact O-CB 3.4Å; R604-M608 WeakPolarHBondContact O-CG 3.48Å; R604-M608 PolarHBondContact O-N 3.33Å; M608-M628 HydrophobicContact CG-CE 4.44Å
609	N	95.9	Very high	96.2	Very high	99 Å²	99	42.4 Å²	42.4	53%	0.529	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	5.9	-179.3	-64.7	-30.1	0	0	0	114.1	E605	E605-N609 WeakPolarHBondContact O-CB 3.49Å; E605-N609 VanDerWaalsContact O-CG 3.24Å; E605-N609 PolarHBondContact O-N 3.39Å; E605-N609 PolarHBondContact O-ND2 2.86Å; E605-N609 VanDerWaalsContact O-ND2 3.14Å
610	A	97.8	Very high	96.4	Very high	8 Å²	8	41.1 Å²	41.1	7%	0.066	20%	0.199	C	C	.	.			trans	-79.1	143.5	175.3	0	0	0	0	0	111.8	P516 V542 L606 I613	P516-A610 WeakPolarHBondContact CB-O 3.43Å; P516-A610 WeakPolarHBondContact CG-O 3.24Å; V542-A610 HydrophobicContact CB-CB 4.31Å; V542-A610 HydrophobicContact CG2-CB 3.75Å; L606-A610 WeakPolarHBondContact O-CB 3.31Å; L606-A610 PolarHBondContact O-N 3.41Å; A610-I613 HydrophobicContact CB-CG1 4.21Å
611	D	98.3	Very high	96.6	Very high	53 Å²	53	34.4 Å²	34.4	28%	0.283	18%	0.182	S	C	.	.	S	Bend	trans	-75.2	-33.4	167.6	-62.8	-50.8	0	0	0	110.3	A510 P516 V517 L539 K540	A510-D611 HydrophobicContact CB-CB 4.29Å; P516-D611 WeakPolarHBondContact CA-O 3.49Å; V517-D611 PolarHBondContact N-O 3.39Å; L539-D611 HydrophobicContact CB-CB 4.05Å; L539-D611 HydrophobicContact CD1-CB 4.48Å; L539-D611 HydrophobicContact CD2-CB 4.03Å; L539-D611 HydrophobicContact CG-CB 4.41Å; K540-D611 HydrophobicContact CB-CB 4.39Å; K540-D611 WeakPolarHBondContact CB-OD2 3.45Å; K540-D611 PolarHBondContact N-OD2 3.01Å; K540-D611 PolarHBondContact O-N 3.16Å
612	V	98.6	Very high	96.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	134.8	-174.7	-171.3	0	0	0	0	111.3	V506 A510 V517 V519 I534 L539 K540 V541 V542	V506-V612 HydrophobicContact CG1-CB 4.37Å; V506-V612 HydrophobicContact CG1-CG1 3.83Å; V506-V612 HydrophobicContact CG1-CG2 3.52Å; A510-V612 HydrophobicContact CB-CG2 4.33Å; V517-V612 WeakPolarHBondContact O-CA 3.48Å; V519-V612 HydrophobicContact CB-CG1 4.24Å; V519-V612 HydrophobicContact CG2-CG1 3.54Å; I534-V612 HydrophobicContact CD1-CG1 4.29Å; I534-V612 HydrophobicContact CG2-CB 4.2Å; I534-V612 HydrophobicContact CG2-CG1 4.23Å; I534-V612 HydrophobicContact CG2-CG2 3.82Å; L539-V612 HydrophobicContact CD1-CG2 3.99Å; K540-V612 PolarHBondContact O-N 3.36Å; V541-V612 WeakPolarHBondContact CA-O 3.5Å; V541-V612 HydrophobicContact CG2-CB 4.49Å; V542-V612 PolarHBondContact N-O 2.95Å
613	I	98.8	Very high	96.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.2	170	-64.8	167.1	0	0	0	108.9	P516 V517 L518 V519 V542 L544 L607 A610 L625 M628 F630	P516-I613 HydrophobicContact CB-CD1 4.22Å; P516-I613 HydrophobicContact CB-CG1 4.42Å; V517-I613 PolarHBondContact O-N 2.78Å; L518-I613 HydrophobicContact CD1-CB 4.33Å; L518-I613 HydrophobicContact CD1-CG2 4.16Å; V519-I613 PolarHBondContact N-O 2.99Å; V542-I613 WeakPolarHBondContact O-CA 3.45Å; L544-I613 HydrophobicContact CB-CG2 4.48Å; L607-I613 HydrophobicContact CB-CD1 4.26Å; L607-I613 HydrophobicContact CD2-CD1 3.7Å; L607-I613 HydrophobicContact CD2-CG1 4Å; L607-I613 HydrophobicContact CD2-CG2 4.33Å; A610-I613 HydrophobicContact CB-CG1 4.21Å; I613-L625 HydrophobicContact CD1-CD2 4.14Å; I613-L625 HydrophobicContact CG2-CD2 4.32Å; I613-M628 HydrophobicContact CD1-CE 3.83Å; I613-M628 HydrophobicContact CD1-SD 4.37Å; I613-F630 HydrophobicContact CD1-CE1 3.84Å; I613-F630 HydrophobicContact CD1-CZ 3.94Å
614	C	98.6	Very high	96.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	124	177.4	-64.7	0	0	0	0	110.7	V519 V527 T531 V541 V542 R543 L544	V519-C614 WeakPolarHBondContact O-CA 3.42Å; V527-C614 HydrophobicContact CG1-CB 3.96Å; T531-C614 HydrophobicContact CG2-CB 4.49Å; T531-C614 WeakPolarHBondContact OG1-CB 3.36Å; T531-C614 PolarHBondContact OG1-SG 2.64Å; V541-C614 HydrophobicContact CG1-CB 4.47Å; V542-C614 PolarHBondContact O-N 3.12Å; R543-C614 CarbonylContact C-O 3.46Å; R543-C614 WeakPolarHBondContact CA-O 3.47Å; R543-C614 WeakPolarHBondContact CD-O 3.18Å; L544-C614 PolarHBondContact N-O 3.33Å
615	C	98.1	Very high	96.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	173.7	177.5	66.9	0	0	0	0	111.2	V519 C520 V527 L544	V519-C615 PolarHBondContact O-N 3.4Å; C520-C615 VanDerWaalsContact CA-O 3.31Å; C520-C615 WeakPolarHBondContact CA-O 3.13Å; V527-C615 WeakPolarHBondContact CG2-O 3.49Å; L544-C615 HydrophobicContact CB-CB 4.06Å
616	T	97.2	Very high	96.6	Very high	22 Å²	22	29.7 Å²	29.7	14%	0.135	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	162.7	167.6	54.7	0	0	0	0	111	A521 N524 V527 G619 A620	A521-T616 CarbonylContact O-C 3.52Å; A521-T616 WeakPolarHBondContact O-CA 3.14Å; A521-T616 WeakPolarHBondContact O-CB 3.24Å; N524-T616 HydrophobicContact CB-CG2 4.48Å; V527-T616 HydrophobicContact CG2-CG2 3.86Å; T616-G619 CarbonylContact O-C 3.57Å; T616-G619 WeakPolarHBondContact O-CA 3.33Å; T616-G619 PolarHBondContact O-N 3.08Å; T616-G619 WeakPolarHBondContact OG1-CA 3.29Å; T616-G619 PolarHBondContact OG1-N 3.28Å; T616-G619 VanDerWaalsContact OG1-N 3.12Å; T616-A620 PolarHBondContact O-N 2.89Å
617	C	97.8	Very high	96.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-54.2	-55.9	176.4	-63.6	0	0	0	0	111.9	A521 G619 A620 E645 V648	A521-C617 PolarHBondContact O-N 3.07Å; C617-G619 PolarHBondContact O-N 3.16Å; C617-A620 WeakPolarHBondContact O-CB 3.32Å; C617-A620 PolarHBondContact O-N 3.4Å; C617-A620 VanDerWaalsContact O-N 3.1Å; C617-E645 HydrophobicContact CB-CG 3.68Å; C617-V648 WeakPolarHBondContact O-CG1 3.37Å
618	V	96.6	Very high	96.3	Very high	31 Å²	31	38.8 Å²	38.8	19%	0.188	22%	0.22	C	C	.	.	H	α-helix	trans	-55.9	-35.6	169.2	179.1	0	0	0	0	111.8	R422 A620 G621 E645	R422-V618 WeakPolarHBondContact CD-O 3.42Å; R422-V618 PolarHBondContact NH1-O 3.24Å; V618-A620 VanDerWaalsContact C-N 3.26Å; V618-A620 PolarHBondContact O-N 3.26Å; V618-G621 PolarHBondContact O-N 3.45Å; V618-E645 HydrophobicContact CG2-CG 3.88Å
619	G	96.3	Very high	96.3	Very high	14 Å²	14	39 Å²	39	14%	0.144	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-26.4	177.8	0	0	0	0	0	114.7	T616 C617 G621 D622	T616-G619 CarbonylContact O-C 3.57Å; T616-G619 WeakPolarHBondContact O-CA 3.33Å; T616-G619 PolarHBondContact O-N 3.08Å; T616-G619 WeakPolarHBondContact OG1-CA 3.29Å; T616-G619 PolarHBondContact OG1-N 3.28Å; T616-G619 VanDerWaalsContact OG1-N 3.12Å; C617-G619 PolarHBondContact O-N 3.16Å; G619-G621 VanDerWaalsContact C-N 3.3Å; G619-G621 PolarHBondContact O-N 3.38Å; G619-D622 WeakPolarHBondContact O-CB 3.5Å; G619-D622 PolarHBondContact O-N 3.01Å
620	A	97.9	Very high	96.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.7	-34.3	177.9	0	0	0	0	0	112.7	L518 T616 C617 V618 D622 V648 P649 L652	L518-A620 HydrophobicContact CD2-CB 4.32Å; T616-A620 PolarHBondContact O-N 2.89Å; C617-A620 WeakPolarHBondContact O-CB 3.32Å; C617-A620 PolarHBondContact O-N 3.4Å; C617-A620 VanDerWaalsContact O-N 3.1Å; V618-A620 VanDerWaalsContact C-N 3.26Å; V618-A620 PolarHBondContact O-N 3.26Å; A620-D622 PolarHBondContact O-N 2.8Å; A620-V648 HydrophobicContact CB-CG1 4.44Å; A620-P649 HydrophobicContact CB-CB 3.67Å; A620-P649 HydrophobicContact CB-CG 4.5Å; A620-L652 HydrophobicContact CB-CD1 3.99Å
621	G	96.8	Very high	96.4	Very high	26 Å²	26	38.3 Å²	38.3	27%	0.268	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	26.4	174	0	0	0	0	0	114.8	R422 V618 G619	R422-G621 VanDerWaalsContact CZ-C 3.48Å; R422-G621 PolarHBondContact NE-O 2.98Å; R422-G621 VanDerWaalsContact NE-O 3.13Å; R422-G621 VanDerWaalsContact NH1-C 3.32Å; R422-G621 PolarHBondContact NH1-O 3.1Å; V618-G621 PolarHBondContact O-N 3.45Å; G619-G621 VanDerWaalsContact C-N 3.3Å; G619-G621 PolarHBondContact O-N 3.38Å
622	D	96.7	Very high	96.4	Very high	13 Å²	13	36.1 Å²	36.1	7%	0.07	20%	0.196	C	C	.	.			trans	-77.5	136.7	176.1	-169	-71.7	0	0	0	110.8	R422 L544 G619 A620 R624 L625 A626	R422-D622 IonicContact NH2-OD2 3.05Å; L544-D622 HydrophobicContact CD2-CB 4.01Å; G619-D622 WeakPolarHBondContact O-CB 3.5Å; G619-D622 PolarHBondContact O-N 3.01Å; A620-D622 PolarHBondContact O-N 2.8Å; D622-R624 PolarHBondContact O-N 3.21Å; D622-R624 VanDerWaalsContact OD1-CB 3.29Å; D622-R624 WeakPolarHBondContact OD1-CB 3.17Å; D622-R624 WeakPolarHBondContact OD1-CG 3.49Å; D622-R624 IonicContact OD1-CZ 3.76Å; D622-R624 PolarHBondContact OD1-N 3.09Å; D622-R624 IonicContact OD1-NE 3.16Å; D622-R624 PolarHBondContact OD1-NE 3.18Å; D622-R624 IonicContact OD1-NH2 3.51Å; D622-R624 IonicContact OD2-CZ 2.68Å; D622-R624 IonicContact OD2-NE 2.73Å; D622-R624 IonicContact OD2-NH2 3.54Å; D622-R624 PolarHBondContact OD2-NH2 2.68Å; D622-L625 PolarHBondContact O-N 2.76Å; D622-A626 PolarHBondContact O-N 3.04Å
623	P	94.8	Very high	96.4	Very high	109 Å²	109	36.1 Å²	36.1	71%	0.708	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.1	178	-28.7	36.3	0	0	0	115.5
624	R	95.3	Very high	96.4	Very high	40 Å²	40	36.1 Å²	36.1	15%	0.151	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-27.2	172.3	-67.2	169.8	-72.6	-176.8	4.7	113	C545 E550 E603 L607 D622	C545-R624 PolarHBondContact O-NH2 3.05Å; E550-R624 IonicContact OE1-NH1 2.66Å; E603-R624 VanDerWaalsContact CD-CD 3.42Å; E603-R624 WeakPolarHBondContact OE1-CD 3.4Å; E603-R624 IonicContact OE1-NH1 3.58Å; L607-R624 HydrophobicContact CD1-CB 4.16Å; D622-R624 PolarHBondContact O-N 3.21Å; D622-R624 VanDerWaalsContact OD1-CB 3.29Å; D622-R624 WeakPolarHBondContact OD1-CB 3.17Å; D622-R624 WeakPolarHBondContact OD1-CG 3.49Å; D622-R624 IonicContact OD1-CZ 3.76Å; D622-R624 PolarHBondContact OD1-N 3.09Å; D622-R624 IonicContact OD1-NE 3.16Å; D622-R624 PolarHBondContact OD1-NE 3.18Å; D622-R624 IonicContact OD1-NH2 3.51Å; D622-R624 IonicContact OD2-CZ 2.68Å; D622-R624 IonicContact OD2-NE 2.73Å; D622-R624 IonicContact OD2-NH2 3.54Å; D622-R624 PolarHBondContact OD2-NH2 2.68Å
625	L	96.6	Very high	96.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-19.4	178.2	-60.1	-177.8	0	0	0	113.7	L544 L607 I613 D622 K627 M628 F630	L544-L625 HydrophobicContact CD2-CD1 3.48Å; L544-L625 VanDerWaalsContact CD2-CD1 3.48Å; L544-L625 HydrophobicContact CD2-CD2 4.08Å; L544-L625 HydrophobicContact CD2-CG 3.6Å; L607-L625 HydrophobicContact CD1-CD2 4.16Å; L607-L625 HydrophobicContact CD2-CD2 4.03Å; I613-L625 HydrophobicContact CD1-CD2 4.14Å; I613-L625 HydrophobicContact CG2-CD2 4.32Å; D622-L625 PolarHBondContact O-N 2.76Å; L625-K627 PolarHBondContact O-N 3.06Å; L625-M628 HydrophobicContact CD2-SD 3.92Å; L625-M628 WeakPolarHBondContact O-CB 3.49Å; L625-M628 PolarHBondContact O-N 2.87Å; L625-F630 HydrophobicContact CB-CE2 4.46Å; L625-F630 HydrophobicContact CD2-CZ 4.16Å
626	A	89.4	Confident	96.3	Very high	67 Å²	67	36.3 Å²	36.3	55%	0.554	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	1.8	-171.6	0	0	0	0	0	116.9	D622	D622-A626 PolarHBondContact O-N 3.04Å
627	K	90.6	Very high	96.1	Very high	202 Å²	202	36 Å²	36	88%	0.878	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.1	13.4	170.7	-63.5	-162.5	175.2	-162	0	113.3	L625	L625-K627 PolarHBondContact O-N 3.06Å
628	M	95.1	Very high	96.1	Very high	23 Å²	23	36 Å²	36	11%	0.113	20%	0.195	C	C	.	.			trans	-102.5	164.5	173.3	-60.7	-178.6	70.4	0	0	109.7	P516 L607 M608 I613 L625 F630	P516-M628 HydrophobicContact CG-CE 4.26Å; L607-M628 HydrophobicContact CB-CE 4.2Å; L607-M628 HydrophobicContact CB-SD 3.95Å; L607-M628 WeakPolarHBondContact O-CE 3.41Å; M608-M628 HydrophobicContact CG-CE 4.44Å; I613-M628 HydrophobicContact CD1-CE 3.83Å; I613-M628 HydrophobicContact CD1-SD 4.37Å; L625-M628 HydrophobicContact CD2-SD 3.92Å; L625-M628 WeakPolarHBondContact O-CB 3.49Å; L625-M628 PolarHBondContact O-N 2.87Å; M628-F630 HydrophobicContact CB-CE1 4.3Å; M628-F630 HydrophobicContact CB-CE2 3.74Å; M628-F630 HydrophobicContact CB-CZ 3.53Å; M628-F630 HydrophobicContact CE-CE1 3.95Å; M628-F630 HydrophobicContact CE-CZ 3.83Å; M628-F630 HydrophobicContact CG-CZ 4.34Å; M628-F630 HydrophobicContact SD-CZ 3.98Å
629	Q	95.4	Very high	95.9	Very high	112 Å²	112	34.6 Å²	34.6	52%	0.523	19%	0.186	S	C	.	.			trans	-135.6	129.7	179.2	-72.8	-72.7	-76.3	0	0	108.6	L652 G653	Q629-L652 CarbonylContact C-O 3.53Å; Q629-L652 WeakPolarHBondContact CA-O 3.35Å; Q629-L652 PolarHBondContact NE2-O 3.39Å; Q629-G653 VanDerWaalsContact OE1-CA 3.27Å
630	F	97.9	Very high	95.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.186	C	C	.	.			trans	-118.4	91.7	-171.6	-60.9	-67.8	0	0	0	109.4	P516 L518 I613 L625 M628 S632 I633 L652	P516-F630 HydrophobicContact CB-CE1 4.23Å; L518-F630 HydrophobicContact CB-CB 3.75Å; L518-F630 HydrophobicContact CB-CD1 3.91Å; L518-F630 HydrophobicContact CB-CD2 4.17Å; L518-F630 HydrophobicContact CB-CG 3.66Å; L518-F630 HydrophobicContact CD1-CD2 4.49Å; L518-F630 HydrophobicContact CD1-CE2 4.46Å; L518-F630 HydrophobicContact CD2-CB 4.35Å; L518-F630 HydrophobicContact CD2-CD2 3.83Å; L518-F630 HydrophobicContact CD2-CE2 4.42Å; L518-F630 HydrophobicContact CD2-CG 4.14Å; L518-F630 HydrophobicContact CG-CD2 4.39Å; L518-F630 HydrophobicContact CG-CG 4.37Å; I613-F630 HydrophobicContact CD1-CE1 3.84Å; I613-F630 HydrophobicContact CD1-CZ 3.94Å; L625-F630 HydrophobicContact CB-CE2 4.46Å; L625-F630 HydrophobicContact CD2-CZ 4.16Å; M628-F630 HydrophobicContact CB-CE1 4.3Å; M628-F630 HydrophobicContact CB-CE2 3.74Å; M628-F630 HydrophobicContact CB-CZ 3.53Å; M628-F630 HydrophobicContact CE-CE1 3.95Å; M628-F630 HydrophobicContact CE-CZ 3.83Å; M628-F630 HydrophobicContact CG-CZ 4.34Å; M628-F630 HydrophobicContact SD-CZ 3.98Å; F630-S632 PolarHBondContact O-N 3.33Å; F630-I633 HydrophobicContact CB-CD1 4.1Å; F630-I633 HydrophobicContact CB-CG1 3.99Å; F630-I633 WeakPolarHBondContact O-CG1 3.43Å; F630-L652 HydrophobicContact CD2-CB 3.86Å; F630-L652 HydrophobicContact CD2-CD1 4.05Å; F630-L652 HydrophobicContact CE2-CD1 4.21Å; F630-L652 PolarHBondContact N-O 2.92Å
631	R	97.3	Very high	95.6	Very high	93 Å²	93	35.5 Å²	35.5	35%	0.351	19%	0.186	S	C	.	.	S	Bend	trans	-52.5	-42.9	178.4	-177.3	-163.8	167.8	90.6	10.7	111.4	K655 Q656	R631-K655 HydrophobicContact CG-CB 3.99Å; R631-K655 HydrophobicContact CG-CG 4.37Å; R631-K655 CarbonylContact O-C 3.58Å; R631-K655 WeakPolarHBondContact O-CA 3.46Å; R631-K655 PolarHBondContact O-N 3.22Å; R631-Q656 PolarHBondContact O-N 3.49Å
632	S	98.3	Very high	95.6	Very high	6 Å²	6	35 Å²	35	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.7	-173.8	-57.4	0	0	0	0	109.8	L518 F630 Q656	L518-S632 PolarHBondContact N-O 2.84Å; L518-S632 VanDerWaalsContact N-O 3.16Å; F630-S632 PolarHBondContact O-N 3.33Å; S632-Q656 WeakPolarHBondContact CA-O 3.5Å
633	I	98.8	Very high	95.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.4	-174.9	-49.9	-170.6	0	0	0	109.4	L518 F630 I635 P649 A654 Q656 L657 I658	L518-I633 HydrophobicContact CB-CG1 4.29Å; L518-I633 HydrophobicContact CB-CG2 4.35Å; L518-I633 HydrophobicContact CD2-CD1 4.26Å; L518-I633 HydrophobicContact CD2-CG2 4.27Å; L518-I633 HydrophobicContact CG-CG2 4.45Å; L518-I633 WeakPolarHBondContact O-CA 3.47Å; F630-I633 HydrophobicContact CB-CD1 4.1Å; F630-I633 HydrophobicContact CB-CG1 3.99Å; F630-I633 WeakPolarHBondContact O-CG1 3.43Å; I633-I635 HydrophobicContact CG2-CG1 4.26Å; I633-P649 WeakPolarHBondContact CD1-O 3.39Å; I633-P649 HydrophobicContact CG2-CB 4.31Å; I633-A654 HydrophobicContact CD1-CB 3.85Å; I633-A654 HydrophobicContact CG1-CB 4.39Å; I633-Q656 PolarHBondContact N-O 3.45Å; I633-L657 HydrophobicContact CB-CD1 4.1Å; I633-L657 HydrophobicContact CG2-CD1 4.21Å; I633-L657 WeakPolarHBondContact O-CA 3.28Å; I633-I658 VanDerWaalsContact O-CD1 3.26Å; I633-I658 WeakPolarHBondContact O-CD1 3.29Å; I633-I658 PolarHBondContact O-N 3.21Å
634	L	98.8	Very high	95.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.8	171	-174.1	147	0	0	0	110.1	I505 V506 L518 V519 C520 L530 D636 I658 V660	I505-L634 HydrophobicContact CB-CD1 4.24Å; I505-L634 HydrophobicContact CG2-CD1 3.98Å; V506-L634 HydrophobicContact CG2-CB 4.29Å; V506-L634 HydrophobicContact CG2-CD1 4.25Å; L518-L634 PolarHBondContact O-N 3.08Å; V519-L634 WeakPolarHBondContact CA-O 3.43Å; C520-L634 PolarHBondContact N-O 3.06Å; L530-L634 HydrophobicContact CD2-CD2 4.04Å; L634-D636 HydrophobicContact CD2-CB 4.12Å; L634-I658 CarbonylContact C-O 3.55Å; L634-I658 WeakPolarHBondContact CA-O 3.4Å; L634-I658 HydrophobicContact CB-CB 4.22Å; L634-I658 HydrophobicContact CD1-CB 4.02Å; L634-I658 HydrophobicContact CD1-CG2 3.92Å; L634-I658 HydrophobicContact CG-CB 4.01Å; L634-I658 HydrophobicContact CG-CG2 4.23Å; L634-V660 HydrophobicContact CD1-CG2 4.21Å; L634-V660 HydrophobicContact CD2-CG2 4.34Å; L634-V660 HydrophobicContact CG-CG2 4.22Å
635	I	98.5	Very high	96	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113	175	-46.9	-176.2	0	0	0	108.3	C520 I633 P649 V650 L657 I658 L659 V660	C520-I635 HydrophobicContact CB-CG1 4.34Å; C520-I635 HydrophobicContact CB-CG2 4.36Å; C520-I635 CarbonylContact O-C 3.46Å; C520-I635 VanDerWaalsContact O-CA 3.32Å; C520-I635 WeakPolarHBondContact O-CA 3.24Å; I633-I635 HydrophobicContact CG2-CG1 4.26Å; I635-P649 HydrophobicContact CD1-CG 3.67Å; I635-P649 HydrophobicContact CG1-CG 4.36Å; I635-V650 HydrophobicContact CD1-CG2 4.09Å; I635-L657 HydrophobicContact CD1-CD1 4.34Å; I635-L657 HydrophobicContact CG1-CD1 4.41Å; I635-I658 PolarHBondContact N-O 3.15Å; I635-L659 HydrophobicContact CB-CD2 3.94Å; I635-L659 HydrophobicContact CD1-CD2 3.75Å; I635-L659 HydrophobicContact CG1-CD2 3.98Å; I635-V660 PolarHBondContact O-N 3.31Å
636	D	96	Very high	96.1	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.027	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	155	176	-148.8	-29	0	0	0	111.5	S502 C520 A521 L530 L634 S638 V660	S502-D636 VanDerWaalsContact CB-OD2 3.3Å; S502-D636 WeakPolarHBondContact CB-OD2 3.37Å; S502-D636 PolarHBondContact OG-OD2 3.23Å; C520-D636 PolarHBondContact O-N 3.39Å; A521-D636 WeakPolarHBondContact CA-O 3.36Å; A521-D636 WeakPolarHBondContact CB-O 3.36Å; L530-D636 HydrophobicContact CD2-CB 3.77Å; L634-D636 HydrophobicContact CD2-CB 4.12Å; D636-S638 PolarHBondContact O-N 2.9Å; D636-S638 VanDerWaalsContact O-N 3.16Å; D636-V660 CarbonylContact C-O 3.54Å; D636-V660 HydrophobicContact CB-CB 4.41Å; D636-V660 WeakPolarHBondContact OD1-CG1 3.25Å
637	E	94.4	Very high	96.5	Very high	15 Å²	15	25.6 Å²	25.6	7%	0.07	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.9	35.8	-163.8	-67.2	-76.2	141.3	0	0	113.3	K498 A526 T639 Q640 V660 Q830	K498-E637 WeakPolarHBondContact CE-OE1 3.48Å; K498-E637 IonicContact NZ-OE1 3.53Å; K498-E637 PolarHBondContact NZ-OE1 3.02Å; A526-E637 HydrophobicContact CB-CG 4.43Å; E637-T639 PolarHBondContact O-N 2.94Å; E637-Q640 HydrophobicContact CB-CG 4.35Å; E637-Q640 WeakPolarHBondContact O-CB 3.49Å; E637-Q640 PolarHBondContact O-N 3.35Å; E637-Q640 PolarHBondContact OE2-NE2 2.82Å; E637-V660 WeakPolarHBondContact CA-O 3.15Å; E637-V660 PolarHBondContact N-O 3.45Å; E637-Q830 PolarHBondContact OE2-NE2 3.13Å
638	S	96.1	Very high	96.9	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	7%	0.074	C	C	.	.	G	3₁₀ helix	trans	-61.3	-15.2	-175	67.3	0	0	0	0	114.3	D636 Q640 A641 V660 F685	D636-S638 PolarHBondContact O-N 2.9Å; D636-S638 VanDerWaalsContact O-N 3.16Å; S638-Q640 VanDerWaalsContact C-N 3.34Å; S638-A641 PolarHBondContact O-N 2.98Å; S638-V660 PolarHBondContact N-O 3.02Å; S638-V660 PolarHBondContact OG-O 2.89Å; S638-F685 WeakPolarHBondContact OG-CD2 3.34Å
639	T	93.9	Very high	97.1	Very high	1 Å²	1	15 Å²	15	1%	0.006	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-74.4	-19.4	172.9	45.9	0	0	0	0	113.4	E637 A641 D662 H663 G667 P668 F685	E637-T639 PolarHBondContact O-N 2.94Å; T639-A641 VanDerWaalsContact C-N 3.33Å; T639-D662 PolarHBondContact OG1-N 3.27Å; T639-D662 VanDerWaalsContact OG1-N 3.07Å; T639-D662 PolarHBondContact OG1-O 3.09Å; T639-H663 HydrophobicContact CG2-CB 4.44Å; T639-G667 VanDerWaalsContact O-CA 3.32Å; T639-G667 WeakPolarHBondContact O-CA 3.49Å; T639-P668 WeakPolarHBondContact O-CD 3.22Å; T639-F685 HydrophobicContact CG2-CB 3.72Å; T639-F685 HydrophobicContact CG2-CD1 3.68Å; T639-F685 HydrophobicContact CG2-CD2 4.35Å; T639-F685 HydrophobicContact CG2-CE1 4.4Å; T639-F685 HydrophobicContact CG2-CG 3.67Å
640	Q	92.3	Very high	97.2	Very high	33 Å²	33	9.7 Å²	9.7	15%	0.154	4%	0.044	C	C	.	.	G	3₁₀ helix	trans	-77.7	-16.5	172.1	-67.8	177.5	38.8	0	0	113.1	P522 E637 S638 P668 Q830	P522-Q640 HydrophobicContact CG-CB 3.62Å; E637-Q640 HydrophobicContact CB-CG 4.35Å; E637-Q640 WeakPolarHBondContact O-CB 3.49Å; E637-Q640 PolarHBondContact O-N 3.35Å; E637-Q640 PolarHBondContact OE2-NE2 2.82Å; S638-Q640 VanDerWaalsContact C-N 3.34Å; Q640-P668 VanDerWaalsContact O-CA 3.32Å; Q640-P668 WeakPolarHBondContact O-CA 3.31Å; Q640-Q830 VanDerWaalsContact CD-CD 3.4Å; Q640-Q830 VanDerWaalsContact CG-NE2 3.3Å; Q640-Q830 VanDerWaalsContact NE2-NE2 3.1Å
641	A	95.2	Very high	97.2	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.047	C	C	.	.	S	Bend	trans	-93.6	141.5	-175.3	0	0	0	0	0	111.2	P522 S638 T639 E645 P668 S683	P522-A641 HydrophobicContact CB-CB 4Å; P522-A641 HydrophobicContact CG-CB 4.02Å; S638-A641 PolarHBondContact O-N 2.98Å; T639-A641 VanDerWaalsContact C-N 3.33Å; A641-E645 WeakPolarHBondContact CA-OE2 3.42Å; A641-E645 HydrophobicContact CB-CB 4.33Å; A641-E645 HydrophobicContact CB-CG 4.29Å; A641-P668 WeakPolarHBondContact O-CG 3.36Å; A641-S683 WeakPolarHBondContact O-CB 3.35Å
642	T	97.2	Very high	97.3	Very high	16 Å²	16	6.8 Å²	6.8	10%	0.098	4%	0.035	C	C	.	.			trans	-63.8	155.5	167.4	66.1	0	0	0	0	109.7	E645 C646 P668 V670 L680	T642-E645 WeakPolarHBondContact O-CB 3.5Å; T642-E645 PolarHBondContact O-N 2.83Å; T642-E645 VanDerWaalsContact O-N 3.09Å; T642-E645 WeakPolarHBondContact OG1-CB 3.3Å; T642-E645 PolarHBondContact OG1-N 2.79Å; T642-C646 PolarHBondContact O-N 3.47Å; T642-P668 HydrophobicContact CG2-CB 3.76Å; T642-P668 HydrophobicContact CG2-CG 4.4Å; T642-V670 HydrophobicContact CG2-CG2 4.15Å; T642-L680 HydrophobicContact CG2-CG 4.38Å
643	E	98.1	Very high	97.2	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-57.6	-44.3	178.1	172.9	152.8	-169.6	0	0	113.6	Y302 F306 E645 C646 M647 L684 R687	Y302-E643 WeakPolarHBondContact CE2-OE1 3.46Å; Y302-E643 VanDerWaalsContact OH-CG 3.25Å; Y302-E643 WeakPolarHBondContact OH-CG 3.39Å; Y302-E643 PolarHBondContact OH-OE1 3.25Å; Y302-E643 VanDerWaalsContact OH-OE1 3.08Å; F306-E643 HydrophobicContact CE1-CB 4.07Å; F306-E643 HydrophobicContact CE1-CG 4.3Å; F306-E643 HydrophobicContact CE2-CG 4.08Å; F306-E643 HydrophobicContact CZ-CB 3.94Å; F306-E643 HydrophobicContact CZ-CG 3.76Å; E643-E645 VanDerWaalsContact C-N 3.31Å; E643-E645 PolarHBondContact O-N 3.31Å; E643-C646 WeakPolarHBondContact O-CB 3.33Å; E643-C646 PolarHBondContact O-N 3.1Å; E643-M647 WeakPolarHBondContact O-CG 3.42Å; E643-M647 PolarHBondContact O-N 3.38Å; E643-L684 HydrophobicContact CB-CB 4.14Å; E643-L684 HydrophobicContact CG-CB 3.99Å; E643-L684 HydrophobicContact CG-CD1 4.22Å; E643-L684 WeakPolarHBondContact OE1-CD1 3.24Å; E643-R687 VanDerWaalsContact CD-NE 3.32Å; E643-R687 IonicContact OE1-CZ 3.64Å; E643-R687 IonicContact OE1-NE 3.72Å; E643-R687 PolarHBondContact OE1-NE 3.13Å; E643-R687 IonicContact OE1-NH2 2.9Å; E643-R687 PolarHBondContact OE1-NH2 2.87Å; E643-R687 WeakPolarHBondContact OE2-CD 3.48Å; E643-R687 IonicContact OE2-CZ 2.82Å; E643-R687 IonicContact OE2-NE 3.82Å; E643-R687 PolarHBondContact OE2-NE 3.05Å; E643-R687 IonicContact OE2-NH2 3.27Å
644	P	98.4	Very high	97.1	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-61.7	-31.8	171.9	-26.7	37.8	0	0	0	114.6	F306 V310 M423 L427 M647 L680	F306-P644 HydrophobicContact CB-CG 3.98Å; F306-P644 HydrophobicContact CD1-CG 3.53Å; F306-P644 HydrophobicContact CE1-CG 4.23Å; F306-P644 HydrophobicContact CG-CG 3.92Å; V310-P644 HydrophobicContact CG2-CB 3.65Å; V310-P644 HydrophobicContact CG2-CG 3.61Å; M423-P644 HydrophobicContact CB-CB 4.07Å; M423-P644 HydrophobicContact CG-CB 4.28Å; M423-P644 HydrophobicContact SD-CB 4.11Å; L427-P644 HydrophobicContact CD1-CB 4.36Å; L427-P644 HydrophobicContact CD2-CB 4.31Å; L427-P644 HydrophobicContact CD2-CG 4.46Å; L427-P644 HydrophobicContact CG-CB 4.44Å; P644-M647 PolarHBondContact O-N 2.77Å; P644-L680 HydrophobicContact CG-CD1 4.03Å
645	E	98.4	Very high	97.1	Very high	31 Å²	31	11.3 Å²	11.3	15%	0.145	6%	0.055	C	C	.	.	H	α-helix	trans	-68.6	-44.4	173.8	-176.9	-175.9	-175.6	0	0	111.4	M423 P522 C617 V618 A641 T642 E643 M647 V648	M423-E645 HydrophobicContact SD-CB 3.84Å; P522-E645 WeakPolarHBondContact CB-OE1 3.38Å; C617-E645 HydrophobicContact CB-CG 3.68Å; V618-E645 HydrophobicContact CG2-CG 3.88Å; A641-E645 WeakPolarHBondContact CA-OE2 3.42Å; A641-E645 HydrophobicContact CB-CB 4.33Å; A641-E645 HydrophobicContact CB-CG 4.29Å; T642-E645 WeakPolarHBondContact O-CB 3.5Å; T642-E645 PolarHBondContact O-N 2.83Å; T642-E645 VanDerWaalsContact O-N 3.09Å; T642-E645 WeakPolarHBondContact OG1-CB 3.3Å; T642-E645 PolarHBondContact OG1-N 2.79Å; E643-E645 VanDerWaalsContact C-N 3.31Å; E643-E645 PolarHBondContact O-N 3.31Å; E645-M647 PolarHBondContact O-N 2.86Å; E645-V648 PolarHBondContact O-N 3.44Å
646	C	98.3	Very high	97.1	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-57.7	-32.6	173	-91.8	0	0	0	0	112.5	T642 E643 V648 P649 V650 L684	T642-C646 PolarHBondContact O-N 3.47Å; E643-C646 WeakPolarHBondContact O-CB 3.33Å; E643-C646 PolarHBondContact O-N 3.1Å; C646-V648 VanDerWaalsContact C-N 3.34Å; C646-V648 PolarHBondContact O-N 3.12Å; C646-P649 VanDerWaalsContact O-CD 3.3Å; C646-P649 WeakPolarHBondContact O-CD 3.33Å; C646-P649 WeakPolarHBondContact O-CG 3.42Å; C646-V650 VanDerWaalsContact O-CG2 3.26Å; C646-V650 WeakPolarHBondContact O-CG2 3.44Å; C646-L684 HydrophobicContact CB-CB 4.07Å; C646-L684 HydrophobicContact CB-CD2 3.95Å
647	M	98.4	Very high	97.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-71.5	-23.2	179.8	-71.5	-59.2	-72.8	0	0	114.2	Y302 F430 L445 E643 P644 E645 V650 V651 L684	Y302-M647 WeakPolarHBondContact OH-CG 3.28Å; F430-M647 HydrophobicContact CB-CE 4.06Å; F430-M647 HydrophobicContact CD1-CE 3.95Å; F430-M647 HydrophobicContact CD2-CE 3.49Å; F430-M647 VanDerWaalsContact CD2-CE 3.49Å; F430-M647 HydrophobicContact CE1-CE 4.24Å; F430-M647 HydrophobicContact CE2-CE 3.82Å; F430-M647 HydrophobicContact CG-CE 3.56Å; F430-M647 HydrophobicContact CZ-CE 4.19Å; L445-M647 HydrophobicContact CD1-CE 3.99Å; L445-M647 HydrophobicContact CD1-SD 4.05Å; E643-M647 WeakPolarHBondContact O-CG 3.42Å; E643-M647 PolarHBondContact O-N 3.38Å; P644-M647 PolarHBondContact O-N 2.77Å; E645-M647 PolarHBondContact O-N 2.86Å; M647-V650 HydrophobicContact CE-CG1 4.2Å; M647-V650 PolarHBondContact O-N 2.96Å; M647-V650 HydrophobicContact SD-CB 4.15Å; M647-V650 HydrophobicContact SD-CG1 4.06Å; M647-V651 HydrophobicContact CE-CG1 4.12Å; M647-V651 PolarHBondContact O-N 2.82Å; M647-V651 VanDerWaalsContact O-N 3.16Å; M647-L684 HydrophobicContact SD-CD2 4.5Å
648	V	98.6	Very high	97.4	Very high	4 Å²	4	10.4 Å²	10.4	2%	0.024	5%	0.05	C	C	.	.	H	α-helix	trans	-55.4	-47.2	-178.3	-177.9	0	0	0	0	113.6	R422 M423 A426 C617 A620 E645 C646	R422-V648 HydrophobicContact CB-CG1 4.3Å; R422-V648 HydrophobicContact CB-CG2 4.48Å; M423-V648 HydrophobicContact CG-CG2 3.96Å; A426-V648 HydrophobicContact CB-CB 4.4Å; A426-V648 HydrophobicContact CB-CG2 4.03Å; C617-V648 WeakPolarHBondContact O-CG1 3.37Å; A620-V648 HydrophobicContact CB-CG1 4.44Å; E645-V648 PolarHBondContact O-N 3.44Å; C646-V648 VanDerWaalsContact C-N 3.34Å; C646-V648 PolarHBondContact O-N 3.12Å
649	P	98.5	Very high	97.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-74.9	-33.5	170.1	27	-35	0	0	0	113.9	L518 C520 A620 I633 I635 C646 V651 L652	L518-P649 HydrophobicContact CD2-CB 3.78Å; C520-P649 HydrophobicContact CB-CG 4.34Å; A620-P649 HydrophobicContact CB-CB 3.67Å; A620-P649 HydrophobicContact CB-CG 4.5Å; I633-P649 WeakPolarHBondContact CD1-O 3.39Å; I633-P649 HydrophobicContact CG2-CB 4.31Å; I635-P649 HydrophobicContact CD1-CG 3.67Å; I635-P649 HydrophobicContact CG1-CG 4.36Å; C646-P649 VanDerWaalsContact O-CD 3.3Å; C646-P649 WeakPolarHBondContact O-CD 3.33Å; C646-P649 WeakPolarHBondContact O-CG 3.42Å; P649-V651 VanDerWaalsContact C-N 3.33Å; P649-V651 PolarHBondContact O-N 2.91Å; P649-L652 WeakPolarHBondContact O-CB 3.48Å; P649-L652 WeakPolarHBondContact O-CG 3.36Å; P649-L652 PolarHBondContact O-N 2.7Å; P649-L652 VanDerWaalsContact O-N 3.16Å
650	V	98.6	Very high	97.7	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62.1	-38.3	-172.1	171.8	0	0	0	0	112.4	V437 L445 I635 C646 M647 L652 A654 L657	V437-V650 HydrophobicContact CG1-CG1 3.75Å; L445-V650 HydrophobicContact CD1-CG1 4.15Å; I635-V650 HydrophobicContact CD1-CG2 4.09Å; C646-V650 VanDerWaalsContact O-CG2 3.26Å; C646-V650 WeakPolarHBondContact O-CG2 3.44Å; M647-V650 HydrophobicContact CE-CG1 4.2Å; M647-V650 PolarHBondContact O-N 2.96Å; M647-V650 HydrophobicContact SD-CB 4.15Å; M647-V650 HydrophobicContact SD-CG1 4.06Å; V650-L652 PolarHBondContact O-N 2.73Å; V650-L652 VanDerWaalsContact O-N 3.09Å; V650-A654 HydrophobicContact CG1-CB 4.28Å; V650-A654 WeakPolarHBondContact O-CB 3.19Å; V650-A654 PolarHBondContact O-N 3.29Å; V650-L657 HydrophobicContact CG1-CD2 4.16Å; V650-L657 HydrophobicContact CG2-CD1 3.89Å; V650-L657 HydrophobicContact CG2-CD2 3.75Å
651	V	98.1	Very high	97.8	Very high	11 Å²	11	8.9 Å²	8.9	7%	0.067	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	4.4	179.8	-60.5	0	0	0	0	114.6	A426 T429 F430 S436 M647 P649 G653	A426-V651 HydrophobicContact CB-CG2 3.94Å; T429-V651 HydrophobicContact CG2-CB 3.89Å; T429-V651 HydrophobicContact CG2-CG2 4.18Å; F430-V651 HydrophobicContact CB-CG1 3.87Å; S436-V651 VanDerWaalsContact CB-O 3.32Å; S436-V651 WeakPolarHBondContact CB-O 3.24Å; S436-V651 CarbonylContact O-C 3.55Å; S436-V651 VanDerWaalsContact O-C 3.28Å; S436-V651 WeakPolarHBondContact O-CA 3.25Å; M647-V651 HydrophobicContact CE-CG1 4.12Å; M647-V651 PolarHBondContact O-N 2.82Å; M647-V651 VanDerWaalsContact O-N 3.16Å; P649-V651 VanDerWaalsContact C-N 3.33Å; P649-V651 PolarHBondContact O-N 2.91Å; V651-G653 PolarHBondContact O-N 3.1Å
652	L	97.8	Very high	97.6	Very high	20 Å²	20	8.9 Å²	8.9	11%	0.105	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	33.5	177.4	-55.3	177.7	0	0	0	112.6	L518 A620 Q629 F630 P649 V650	L518-L652 HydrophobicContact CD2-CD1 3.98Å; A620-L652 HydrophobicContact CB-CD1 3.99Å; Q629-L652 CarbonylContact C-O 3.53Å; Q629-L652 WeakPolarHBondContact CA-O 3.35Å; Q629-L652 PolarHBondContact NE2-O 3.39Å; F630-L652 HydrophobicContact CD2-CB 3.86Å; F630-L652 HydrophobicContact CD2-CD1 4.05Å; F630-L652 HydrophobicContact CE2-CD1 4.21Å; F630-L652 PolarHBondContact N-O 2.92Å; P649-L652 WeakPolarHBondContact O-CB 3.48Å; P649-L652 WeakPolarHBondContact O-CG 3.36Å; P649-L652 PolarHBondContact O-N 2.7Å; P649-L652 VanDerWaalsContact O-N 3.16Å; V650-L652 PolarHBondContact O-N 2.73Å; V650-L652 VanDerWaalsContact O-N 3.09Å
653	G	96.2	Very high	97.1	Very high	2 Å²	2	10.3 Å²	10.3	2%	0.021	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	28.3	174.3	0	0	0	0	0	115.3	S436 Q629 V651 K655	S436-G653 CarbonylContact O-C 3.46Å; S436-G653 WeakPolarHBondContact O-CA 3.19Å; S436-G653 PolarHBondContact O-N 2.86Å; Q629-G653 VanDerWaalsContact OE1-CA 3.27Å; V651-G653 PolarHBondContact O-N 3.1Å; G653-K655 WeakPolarHBondContact O-CG 3.45Å; G653-K655 PolarHBondContact O-N 2.81Å
654	A	97.9	Very high	96.6	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.05	C	C	.	.	B	Isolated β-bridge	trans	-61.4	125.8	-172	0	0	0	0	0	113.6	S436 V437 S438 I441 I633 V650	S436-A654 PolarHBondContact O-N 3.14Å; V437-A654 HydrophobicContact CG1-CB 4.43Å; S438-A654 PolarHBondContact N-O 2.86Å; S438-A654 PolarHBondContact OG-O 2.65Å; I441-A654 HydrophobicContact CD1-CB 4.23Å; I633-A654 HydrophobicContact CD1-CB 3.85Å; I633-A654 HydrophobicContact CG1-CB 4.39Å; V650-A654 HydrophobicContact CG1-CB 4.28Å; V650-A654 WeakPolarHBondContact O-CB 3.19Å; V650-A654 PolarHBondContact O-N 3.29Å
655	K	97.6	Very high	96.1	Very high	100 Å²	100	10.7 Å²	10.7	44%	0.435	5%	0.051	S	C	.	.	S	Bend	trans	-126.1	-11.4	173.3	-44.4	-166.8	179	-177.8	0	112.9	R631 G653	R631-K655 HydrophobicContact CG-CB 3.99Å; R631-K655 HydrophobicContact CG-CG 4.37Å; R631-K655 CarbonylContact O-C 3.58Å; R631-K655 WeakPolarHBondContact O-CA 3.46Å; R631-K655 PolarHBondContact O-N 3.22Å; G653-K655 WeakPolarHBondContact O-CG 3.45Å; G653-K655 PolarHBondContact O-N 2.81Å
656	Q	98.2	Very high	95.4	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	107.5	167.8	-173.5	160.9	22.8	0	0	108.8	I455 V482 L483 R485 P486 R631 S632 I633 I658	I455-Q656 HydrophobicContact CD1-CB 4.18Å; I455-Q656 HydrophobicContact CD1-CG 4.09Å; V482-Q656 PolarHBondContact O-NE2 2.95Å; L483-Q656 PolarHBondContact O-NE2 3.42Å; L483-Q656 VanDerWaalsContact O-NE2 3.15Å; R485-Q656 WeakPolarHBondContact O-CG 3.45Å; R485-Q656 PolarHBondContact O-NE2 2.9Å; R485-Q656 VanDerWaalsContact O-NE2 3.12Å; P486-Q656 CarbonylContact O-C 3.58Å; P486-Q656 WeakPolarHBondContact O-CA 3.41Å; R631-Q656 PolarHBondContact O-N 3.49Å; S632-Q656 WeakPolarHBondContact CA-O 3.5Å; I633-Q656 PolarHBondContact N-O 3.45Å; Q656-I658 HydrophobicContact CG-CD1 4.19Å
657	L	98.6	Very high	94.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.3	-176.2	179.5	60.7	0	0	0	110.9	I441 P486 L487 S488 I633 I635 V650 L659	I441-L657 HydrophobicContact CD1-CB 3.98Å; P486-L657 PolarHBondContact O-N 2.94Å; L487-L657 WeakPolarHBondContact CA-O 3.37Å; L487-L657 HydrophobicContact CD1-CB 4.08Å; L487-L657 HydrophobicContact CD1-CD2 4.01Å; L487-L657 HydrophobicContact CD1-CG 4.09Å; S488-L657 PolarHBondContact N-O 3.08Å; I633-L657 HydrophobicContact CB-CD1 4.1Å; I633-L657 HydrophobicContact CG2-CD1 4.21Å; I633-L657 WeakPolarHBondContact O-CA 3.28Å; I635-L657 HydrophobicContact CD1-CD1 4.34Å; I635-L657 HydrophobicContact CG1-CD1 4.41Å; V650-L657 HydrophobicContact CG1-CD2 4.16Å; V650-L657 HydrophobicContact CG2-CD1 3.89Å; V650-L657 HydrophobicContact CG2-CD2 3.75Å; L657-L659 HydrophobicContact CD1-CD2 3.88Å; L657-L659 HydrophobicContact CD2-CD2 4.25Å; L657-L659 HydrophobicContact CD2-CG 4.47Å; L657-L659 HydrophobicContact CG-CD2 4.02Å; L657-L659 HydrophobicContact CG-CG 4.27Å
658	I	98.8	Very high	94.3	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.005	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.3	177.8	-49.3	81.9	0	0	0	108	V482 I490 I505 L509 I633 L634 I635 Q656 V660	V482-I658 HydrophobicContact CG1-CB 4.36Å; V482-I658 HydrophobicContact CG1-CD1 4.4Å; V482-I658 HydrophobicContact CG1-CG1 3.39Å; V482-I658 HydrophobicContact CG1-CG2 3.99Å; I490-I658 HydrophobicContact CD1-CG2 4.31Å; I505-I658 HydrophobicContact CG2-CG1 4.35Å; L509-I658 HydrophobicContact CD1-CD1 3.91Å; I633-I658 VanDerWaalsContact O-CD1 3.26Å; I633-I658 WeakPolarHBondContact O-CD1 3.29Å; I633-I658 PolarHBondContact O-N 3.21Å; L634-I658 CarbonylContact C-O 3.55Å; L634-I658 WeakPolarHBondContact CA-O 3.4Å; L634-I658 HydrophobicContact CB-CB 4.22Å; L634-I658 HydrophobicContact CD1-CB 4.02Å; L634-I658 HydrophobicContact CD1-CG2 3.92Å; L634-I658 HydrophobicContact CG-CB 4.01Å; L634-I658 HydrophobicContact CG-CG2 4.23Å; I635-I658 PolarHBondContact N-O 3.15Å; Q656-I658 HydrophobicContact CG-CD1 4.19Å; I658-V660 HydrophobicContact CG2-CG2 3.82Å
659	L	98.6	Very high	93.6	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	123.5	172.9	-54.7	-178.1	0	0	0	108.7	S488 L489 I490 I635 L657 L684 F685 L688	S488-L659 PolarHBondContact O-N 3.02Å; L489-L659 CarbonylContact C-O 3.56Å; L489-L659 WeakPolarHBondContact CA-O 3.25Å; L489-L659 HydrophobicContact CD2-CB 3.77Å; L489-L659 HydrophobicContact CD2-CD1 3.84Å; L489-L659 HydrophobicContact CD2-CG 4.14Å; I490-L659 PolarHBondContact N-O 2.63Å; I635-L659 HydrophobicContact CB-CD2 3.94Å; I635-L659 HydrophobicContact CD1-CD2 3.75Å; I635-L659 HydrophobicContact CG1-CD2 3.98Å; L657-L659 HydrophobicContact CD1-CD2 3.88Å; L657-L659 HydrophobicContact CD2-CD2 4.25Å; L657-L659 HydrophobicContact CD2-CG 4.47Å; L657-L659 HydrophobicContact CG-CD2 4.02Å; L657-L659 HydrophobicContact CG-CG 4.27Å; L659-L684 HydrophobicContact CD1-CD2 3.82Å; L659-L684 HydrophobicContact CD1-CG 3.91Å; L659-F685 HydrophobicContact CB-CD2 3.94Å; L659-L688 HydrophobicContact CD1-CD1 3.95Å
660	V	97.7	Very high	93	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.006	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127	-176.9	-176	0	0	0	0	107.9	I490 K498 L634 I635 D636 E637 S638 I658	I490-V660 HydrophobicContact CB-CB 4.46Å; I490-V660 HydrophobicContact CB-CG1 4.19Å; I490-V660 HydrophobicContact CB-CG2 4.14Å; I490-V660 HydrophobicContact CD1-CG2 4.08Å; I490-V660 HydrophobicContact CG1-CG2 4.34Å; I490-V660 HydrophobicContact CG2-CG1 4.35Å; K498-V660 HydrophobicContact CB-CG1 4.29Å; K498-V660 HydrophobicContact CD-CG1 3.88Å; K498-V660 HydrophobicContact CG-CG1 4.33Å; L634-V660 HydrophobicContact CD1-CG2 4.21Å; L634-V660 HydrophobicContact CD2-CG2 4.34Å; L634-V660 HydrophobicContact CG-CG2 4.22Å; I635-V660 PolarHBondContact O-N 3.31Å; D636-V660 CarbonylContact C-O 3.54Å; D636-V660 HydrophobicContact CB-CB 4.41Å; D636-V660 WeakPolarHBondContact OD1-CG1 3.25Å; E637-V660 WeakPolarHBondContact CA-O 3.15Å; E637-V660 PolarHBondContact N-O 3.45Å; S638-V660 PolarHBondContact N-O 3.02Å; S638-V660 PolarHBondContact OG-O 2.89Å; I658-V660 HydrophobicContact CG2-CG2 3.82Å
661	G	94.3	Very high	92.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.3	-166.7	-172.1	0	0	0	0	0	113.3	I490 Q491 G492	I490-G661 PolarHBondContact O-N 2.95Å; Q491-G661 WeakPolarHBondContact CA-O 3.29Å; G492-G661 PolarHBondContact N-O 2.73Å
662	D	91.5	Very high	91.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.095	C	C	.	.			trans	-161.1	107.2	172	-174.8	22.9	0	0	0	111	Q491 T639 C664 Q665 Y717	Q491-D662 PolarHBondContact NE2-OD1 3.04Å; T639-D662 PolarHBondContact OG1-N 3.27Å; T639-D662 VanDerWaalsContact OG1-N 3.07Å; T639-D662 PolarHBondContact OG1-O 3.09Å; D662-C664 PolarHBondContact O-N 3.29Å; D662-C664 WeakPolarHBondContact OD1-CB 3.5Å; D662-C664 PolarHBondContact OD1-N 3.32Å; D662-Q665 HydrophobicContact CB-CB 4.42Å; D662-Q665 PolarHBondContact O-N 3.03Å; D662-Q665 PolarHBondContact OD2-NE2 2.94Å; D662-Y717 PolarHBondContact OD2-OH 2.84Å
663	H	86.6	Confident	90.9	Very high	46 Å²	46	24.8 Å²	24.8	21%	0.213	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.3	-178.9	56.4	-98	0	0	0	113.3	Q491 T639 Q665 F685 E686	Q491-H663 PolarHBondContact NE2-CE1 2.74Å; T639-H663 HydrophobicContact CG2-CB 4.44Å; H663-Q665 VanDerWaalsContact C-N 3.27Å; H663-F685 AromaticContact ND1-CE1 3.9Å; H663-E686 HydrophobicContact CB-CG 3.61Å
664	C	87.3	Confident	90.5	Very high	4 Å²	4	27.9 Å²	27.9	3%	0.027	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.2	170.1	-55.6	0	0	0	0	112.3	D662 F716 Y717 N860	D662-C664 PolarHBondContact O-N 3.29Å; D662-C664 WeakPolarHBondContact OD1-CB 3.5Å; D662-C664 PolarHBondContact OD1-N 3.32Å; C664-F716 HydrophobicContact CB-CB 4.34Å; C664-F716 PolarHBondContact SG-O 3.08Å; C664-F716 VanDerWaalsContact SG-O 3.39Å; C664-Y717 HydrophobicContact CB-CD1 4.44Å; C664-Y717 HydrophobicContact CB-CE1 3.54Å; C664-Y717 WeakPolarHBondContact CB-OH 3.49Å; C664-N860 PolarHBondContact O-ND2 3.16Å
665	Q	87.8	Confident	90.1	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.019	14%	0.138	C	C	.	.	S	Bend	trans	-103.4	179.4	171.2	-74.2	175.7	92.8	0	0	110.4	P494 D662 H663 G667 R857 V861	P494-Q665 HydrophobicContact CG-CG 4.37Å; D662-Q665 HydrophobicContact CB-CB 4.42Å; D662-Q665 PolarHBondContact O-N 3.03Å; D662-Q665 PolarHBondContact OD2-NE2 2.94Å; H663-Q665 VanDerWaalsContact C-N 3.27Å; Q665-G667 PolarHBondContact O-N 2.82Å; Q665-R857 WeakPolarHBondContact O-CB 3.28Å; Q665-R857 WeakPolarHBondContact O-CD 3.48Å; Q665-V861 HydrophobicContact CB-CG2 3.77Å; Q665-V861 HydrophobicContact CG-CG2 3.74Å
666	L	83.3	Confident	89.6	Confident	6 Å²	6	24.2 Å²	24.2	3%	0.031	13%	0.126	C	C	.	.			trans	-52.5	132	-173	-89.1	164.1	0	0	0	113.5	D827 R858 V861	L666-D827 HydrophobicContact CD1-CB 4.22Å; L666-D827 VanDerWaalsContact CD1-OD1 3.28Å; L666-D827 WeakPolarHBondContact CD1-OD1 3.44Å; L666-R858 HydrophobicContact CD2-CG 3.62Å; L666-R858 HydrophobicContact CG-CG 4.35Å; L666-V861 HydrophobicContact CB-CG2 4.41Å; L666-V861 HydrophobicContact CD1-CG1 4.43Å; L666-V861 HydrophobicContact CD1-CG2 4.19Å; L666-V861 HydrophobicContact CG-CG2 4.14Å
667	G	86.1	Confident	89.1	Confident	8 Å²	8	31.8 Å²	31.8	8%	0.082	16%	0.159	C	C	.	.			trans	-88.4	-168	171.1	0	0	0	0	0	113.3	T639 Q665	T639-G667 VanDerWaalsContact O-CA 3.32Å; T639-G667 WeakPolarHBondContact O-CA 3.49Å; Q665-G667 PolarHBondContact O-N 2.82Å
668	P	88.1	Confident	88.7	Confident	16 Å²	16	32 Å²	32	10%	0.104	16%	0.161	C	C	.	.			trans	-65.5	150.2	-179	-18.5	32.6	0	0	0	113.5	T639 Q640 A641 T642 V670 S681	T639-P668 WeakPolarHBondContact O-CD 3.22Å; Q640-P668 VanDerWaalsContact O-CA 3.32Å; Q640-P668 WeakPolarHBondContact O-CA 3.31Å; A641-P668 WeakPolarHBondContact O-CG 3.36Å; T642-P668 HydrophobicContact CG2-CB 3.76Å; T642-P668 HydrophobicContact CG2-CG 4.4Å; P668-V670 HydrophobicContact CB-CG2 4.43Å; P668-S681 WeakPolarHBondContact CD-O 3.35Å
669	V	84	Confident	88.4	Confident	82 Å²	82	32.4 Å²	32.4	50%	0.497	17%	0.165	S	C	.	.			trans	-92.8	117.2	169.2	-178.4	0	0	0	0	108.3	M671	V669-M671 HydrophobicContact CG1-CE 3.74Å; V669-M671 HydrophobicContact CG1-SD 4.01Å
670	V	86.3	Confident	88.2	Confident	24 Å²	24	32.6 Å²	32.6	15%	0.145	17%	0.166	C	C	.	.			trans	-127.2	119.9	177.2	-177.1	0	0	0	0	107.4	E313 T642 P668 A675 A676 L680	E313-V670 VanDerWaalsContact OE2-CG1 3.25Å; E313-V670 WeakPolarHBondContact OE2-CG1 3.46Å; T642-V670 HydrophobicContact CG2-CG2 4.15Å; P668-V670 HydrophobicContact CB-CG2 4.43Å; V670-A675 HydrophobicContact CG1-CB 4.33Å; V670-A676 HydrophobicContact CB-CB 4.03Å; V670-A676 HydrophobicContact CG1-CB 3.82Å; V670-L680 HydrophobicContact CG1-CB 4.47Å; V670-L680 HydrophobicContact CG1-CD2 4.08Å; V670-L680 HydrophobicContact CG1-CG 4.45Å; V670-L680 HydrophobicContact CG2-CG 4.31Å
671	M	81.5	Confident	88	Confident	49 Å²	49	34.9 Å²	34.9	24%	0.241	18%	0.183	C	C	.	.			trans	-84.5	-39.4	-173.5	-57.2	-59.4	-169.7	0	0	111.7	E313 Y316 D353 V669 K673	E313-M671 WeakPolarHBondContact OE1-CB 3.48Å; E313-M671 PolarHBondContact OE1-N 3.28Å; E313-M671 PolarHBondContact OE2-N 3.08Å; Y316-M671 HydrophobicContact CD1-CB 3.77Å; Y316-M671 HydrophobicContact CE1-CB 3.85Å; D353-M671 HydrophobicContact CB-CE 4.18Å; D353-M671 HydrophobicContact CB-SD 4Å; D353-M671 VanDerWaalsContact O-CE 3.32Å; D353-M671 WeakPolarHBondContact O-CE 3.43Å; V669-M671 HydrophobicContact CG1-CE 3.74Å; V669-M671 HydrophobicContact CG1-SD 4.01Å; M671-K673 PolarHBondContact O-N 2.7Å; M671-K673 VanDerWaalsContact O-N 3.11Å
672	C	83.9	Confident	87.9	Confident	10 Å²	10	36.8 Å²	36.8	7%	0.068	19%	0.191	C	C	.	.			trans	-72.1	104	177.8	-176.4	0	0	0	0	110.2	E313 Y316 K674 A675 A676	E313-C672 WeakPolarHBondContact OE2-CA 3.49Å; E313-C672 WeakPolarHBondContact OE2-CB 3.14Å; E313-C672 PolarHBondContact OE2-N 2.68Å; Y316-C672 HydrophobicContact CD1-CB 4.39Å; Y316-C672 HydrophobicContact CD2-CB 4.32Å; Y316-C672 HydrophobicContact CG-CB 3.94Å; C672-K674 PolarHBondContact O-N 2.58Å; C672-K674 VanDerWaalsContact O-N 3.17Å; C672-A675 HydrophobicContact CB-CB 4.02Å; C672-A675 PolarHBondContact O-N 2.85Å; C672-A676 PolarHBondContact O-N 3.03Å
673	K	85.7	Confident	88.2	Confident	167 Å²	167	36.8 Å²	36.8	73%	0.726	19%	0.191	S	C	*	.	H	α-helix	trans	-61.2	-26	-177.3	-66.7	176.1	-175.5	168	0	113.8	M671 K677	M671-K673 PolarHBondContact O-N 2.7Å; M671-K673 VanDerWaalsContact O-N 3.11Å; K673-K677 WeakPolarHBondContact O-CB 3.27Å; K673-K677 VanDerWaalsContact O-CG 3.28Å; K673-K677 WeakPolarHBondContact O-CG 3.45Å; K673-K677 PolarHBondContact O-N 2.97Å; K673-K677 VanDerWaalsContact O-N 3.14Å
674	K	86.3	Confident	88.7	Confident	67 Å²	67	34.6 Å²	34.6	29%	0.291	18%	0.181	S	C	.	.	H	α-helix	trans	-67.6	-51.4	170.9	-71.5	-162.2	174.9	-146	0	110.9	D286 E288 C672 A676 K677 A678	D286-K674 IonicContact OD1-NZ 3.08Å; D286-K674 PolarHBondContact OD1-NZ 2.89Å; E288-K674 VanDerWaalsContact OE1-CE 3.22Å; E288-K674 WeakPolarHBondContact OE1-CE 3.31Å; E288-K674 IonicContact OE1-NZ 3.52Å; E288-K674 PolarHBondContact OE1-NZ 3.17Å; C672-K674 PolarHBondContact O-N 2.58Å; C672-K674 VanDerWaalsContact O-N 3.17Å; K674-A676 PolarHBondContact O-N 3.41Å; K674-K677 PolarHBondContact O-N 3.07Å; K674-A678 PolarHBondContact O-N 2.84Å
675	A	90	Very high	89.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-39.7	178.3	0	0	0	0	0	112.8	L309 L312 V670 C672 A678 G679 L680	L309-A675 HydrophobicContact CD2-CB 4.4Å; L312-A675 HydrophobicContact CB-CB 4.19Å; V670-A675 HydrophobicContact CG1-CB 4.33Å; C672-A675 HydrophobicContact CB-CB 4.02Å; C672-A675 PolarHBondContact O-N 2.85Å; A675-A678 PolarHBondContact O-N 2.9Å; A675-G679 PolarHBondContact O-N 2.58Å; A675-L680 HydrophobicContact CB-CB 4.31Å; A675-L680 HydrophobicContact CB-CD2 3.89Å; A675-L680 VanDerWaalsContact O-CB 3.23Å; A675-L680 WeakPolarHBondContact O-CB 3.39Å; A675-L680 PolarHBondContact O-N 3.04Å
676	A	88.1	Confident	89.5	Confident	23 Å²	23	35.7 Å²	35.7	19%	0.19	19%	0.186	C	C	.	.	I	π-helix	trans	-61	-47.3	175.3	0	0	0	0	0	112.1	V670 C672 K674 A678 G679 S681	V670-A676 HydrophobicContact CB-CB 4.03Å; V670-A676 HydrophobicContact CG1-CB 3.82Å; C672-A676 PolarHBondContact O-N 3.03Å; K674-A676 PolarHBondContact O-N 3.41Å; A676-A678 PolarHBondContact O-N 2.89Å; A676-G679 PolarHBondContact O-N 2.81Å; A676-S681 PolarHBondContact O-OG 2.81Å; A676-S681 VanDerWaalsContact O-OG 3.11Å
677	K	87.4	Confident	90.1	Very high	159 Å²	159	35.4 Å²	35.4	69%	0.691	18%	0.184	S	C	*	.	I	π-helix	trans	-59.8	-42.4	175.9	-83	178.5	172.8	-169.8	0	112.9	H291 K673 K674 G679	H291-K677 PolarHBondContact NE2-O 3.44Å; K673-K677 WeakPolarHBondContact O-CB 3.27Å; K673-K677 VanDerWaalsContact O-CG 3.28Å; K673-K677 WeakPolarHBondContact O-CG 3.45Å; K673-K677 PolarHBondContact O-N 2.97Å; K673-K677 VanDerWaalsContact O-N 3.14Å; K674-K677 PolarHBondContact O-N 3.07Å; K677-G679 PolarHBondContact O-N 3.12Å
678	A	90.1	Very high	90.6	Very high	6 Å²	6	35 Å²	35	5%	0.05	18%	0.18	C	C	.	.	I	π-helix	trans	-74.3	2.9	-179	0	0	0	0	0	113.8	P289 H291 V292 L309 K674 A675 A676	P289-A678 HydrophobicContact CG-CB 3.95Å; H291-A678 WeakPolarHBondContact CA-O 3.41Å; V292-A678 WeakPolarHBondContact CG2-O 3.49Å; V292-A678 PolarHBondContact N-O 3.02Å; L309-A678 HydrophobicContact CD2-CB 3.58Å; K674-A678 PolarHBondContact O-N 2.84Å; A675-A678 PolarHBondContact O-N 2.9Å; A676-A678 PolarHBondContact O-N 2.89Å
679	G	92.3	Very high	90.9	Very high	9 Å²	9	36.1 Å²	36.1	9%	0.093	19%	0.187	C	C	.	.	I	π-helix	trans	110.2	-0.7	169.1	0	0	0	0	0	115.9	A675 A676 K677 S681 Q682	A675-G679 PolarHBondContact O-N 2.58Å; A676-G679 PolarHBondContact O-N 2.81Å; K677-G679 PolarHBondContact O-N 3.12Å; G679-S681 PolarHBondContact O-N 3.41Å; G679-S681 VanDerWaalsContact O-N 3.08Å; G679-Q682 WeakPolarHBondContact O-CB 3.37Å; G679-Q682 PolarHBondContact O-N 3.11Å
680	L	94.8	Very high	91.3	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	18%	0.178	C	C	.	.	I	π-helix	trans	-61.9	-19.7	178	-170.8	62.9	0	0	0	112.9	F306 L309 V310 E313 T642 P644 V670 A675 Q682	F306-L680 HydrophobicContact CD1-CD1 4.26Å; L309-L680 HydrophobicContact CB-CB 4.35Å; L309-L680 HydrophobicContact CB-CD1 4.32Å; L309-L680 HydrophobicContact CB-CD2 4.27Å; V310-L680 HydrophobicContact CG2-CD1 4.43Å; E313-L680 HydrophobicContact CB-CD2 3.98Å; T642-L680 HydrophobicContact CG2-CG 4.38Å; P644-L680 HydrophobicContact CG-CD1 4.03Å; V670-L680 HydrophobicContact CG1-CB 4.47Å; V670-L680 HydrophobicContact CG1-CD2 4.08Å; V670-L680 HydrophobicContact CG1-CG 4.45Å; V670-L680 HydrophobicContact CG2-CG 4.31Å; A675-L680 HydrophobicContact CB-CB 4.31Å; A675-L680 HydrophobicContact CB-CD2 3.89Å; A675-L680 VanDerWaalsContact O-CB 3.23Å; A675-L680 WeakPolarHBondContact O-CB 3.39Å; A675-L680 PolarHBondContact O-N 3.04Å; L680-Q682 VanDerWaalsContact C-N 3.29Å
681	S	92.2	Very high	91.5	Very high	49 Å²	49	35.7 Å²	35.7	34%	0.343	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	2.1	173.5	62	0	0	0	0	114.7	P668 A676 G679	P668-S681 WeakPolarHBondContact CD-O 3.35Å; A676-S681 PolarHBondContact O-OG 2.81Å; A676-S681 VanDerWaalsContact O-OG 3.11Å; G679-S681 PolarHBondContact O-N 3.41Å; G679-S681 VanDerWaalsContact O-N 3.08Å
682	Q	93.3	Very high	92	Very high	39 Å²	39	35.8 Å²	35.8	18%	0.182	20%	0.196	C	C	.	.	S	Bend	trans	-87.2	130.3	167.8	-173.5	172.8	42.6	0	0	109.3	G679 L680 E686 R687	G679-Q682 WeakPolarHBondContact O-CB 3.37Å; G679-Q682 PolarHBondContact O-N 3.11Å; L680-Q682 VanDerWaalsContact C-N 3.29Å; Q682-E686 HydrophobicContact CG-CB 3.94Å; Q682-R687 HydrophobicContact CG-CB 4.28Å
683	S	96.6	Very high	92.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.			trans	-80.5	153.5	171.6	66.2	0	0	0	0	111.6	A641 F685 E686 R687	A641-S683 WeakPolarHBondContact O-CB 3.35Å; S683-F685 PolarHBondContact O-N 3.08Å; S683-F685 VanDerWaalsContact O-N 3.15Å; S683-E686 VanDerWaalsContact CB-OE2 3.31Å; S683-E686 WeakPolarHBondContact CB-OE2 3.35Å; S683-E686 PolarHBondContact N-OE2 3.21Å; S683-E686 PolarHBondContact O-N 3.24Å; S683-E686 WeakPolarHBondContact OG-CG 3.42Å; S683-E686 PolarHBondContact OG-N 3.17Å; S683-E686 PolarHBondContact OG-OE2 3.47Å; S683-R687 PolarHBondContact O-N 3.44Å
684	L	97.8	Very high	92.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-53	-37.2	173.8	173.7	61.9	0	0	0	111.9	L445 E643 C646 M647 L659 L688	L445-L684 HydrophobicContact CD2-CD1 3.67Å; L445-L684 HydrophobicContact CD2-CD2 4.04Å; L445-L684 HydrophobicContact CD2-CG 4.41Å; E643-L684 HydrophobicContact CB-CB 4.14Å; E643-L684 HydrophobicContact CG-CB 3.99Å; E643-L684 HydrophobicContact CG-CD1 4.22Å; E643-L684 WeakPolarHBondContact OE1-CD1 3.24Å; C646-L684 HydrophobicContact CB-CB 4.07Å; C646-L684 HydrophobicContact CB-CD2 3.95Å; M647-L684 HydrophobicContact SD-CD2 4.5Å; L659-L684 HydrophobicContact CD1-CD2 3.82Å; L659-L684 HydrophobicContact CD1-CG 3.91Å; L684-L688 HydrophobicContact CD1-CD1 3.83Å; L684-L688 HydrophobicContact CD1-CG 3.98Å; L684-L688 HydrophobicContact CG-CD1 3.96Å; L684-L688 HydrophobicContact CG-CG 4.49Å; L684-L688 WeakPolarHBondContact O-CB 3.19Å; L684-L688 VanDerWaalsContact O-CG 3.24Å; L684-L688 WeakPolarHBondContact O-CG 3.47Å; L684-L688 PolarHBondContact O-N 2.93Å; L684-L688 VanDerWaalsContact O-N 3.09Å
685	F	97.4	Very high	93.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-46.4	176.1	-172.1	-70.8	0	0	0	111.3	L489 I490 Q491 S638 T639 L659 H663 S683 V689 P695	L489-F685 HydrophobicContact CB-CD2 4.42Å; L489-F685 HydrophobicContact CB-CE2 3.85Å; L489-F685 HydrophobicContact CB-CZ 4.04Å; L489-F685 HydrophobicContact CD2-CD2 4.22Å; L489-F685 HydrophobicContact CD2-CE2 4.48Å; I490-F685 WeakPolarHBondContact O-CE2 3.38Å; Q491-F685 HydrophobicContact CB-CZ 4.4Å; S638-F685 WeakPolarHBondContact OG-CD2 3.34Å; T639-F685 HydrophobicContact CG2-CB 3.72Å; T639-F685 HydrophobicContact CG2-CD1 3.68Å; T639-F685 HydrophobicContact CG2-CD2 4.35Å; T639-F685 HydrophobicContact CG2-CE1 4.4Å; T639-F685 HydrophobicContact CG2-CG 3.67Å; L659-F685 HydrophobicContact CB-CD2 3.94Å; H663-F685 AromaticContact ND1-CE1 3.9Å; S683-F685 PolarHBondContact O-N 3.08Å; S683-F685 VanDerWaalsContact O-N 3.15Å; F685-V689 HydrophobicContact CD1-CG2 3.99Å; F685-V689 HydrophobicContact CE1-CG2 3.82Å; F685-V689 WeakPolarHBondContact O-CG2 3.27Å; F685-V689 PolarHBondContact O-N 3.33Å; F685-V689 VanDerWaalsContact O-N 3.08Å; F685-P695 HydrophobicContact CE1-CG 4.11Å; F685-P695 HydrophobicContact CZ-CB 4.16Å; F685-P695 HydrophobicContact CZ-CG 4.11Å
686	E	94.6	Very high	93.5	Very high	31 Å²	31	37.4 Å²	37.4	15%	0.145	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-42.8	179	-73.9	161.1	125.6	0	0	112.1	H663 Q682 S683 L688 V689 V690	H663-E686 HydrophobicContact CB-CG 3.61Å; Q682-E686 HydrophobicContact CG-CB 3.94Å; S683-E686 VanDerWaalsContact CB-OE2 3.31Å; S683-E686 WeakPolarHBondContact CB-OE2 3.35Å; S683-E686 PolarHBondContact N-OE2 3.21Å; S683-E686 PolarHBondContact O-N 3.24Å; S683-E686 WeakPolarHBondContact OG-CG 3.42Å; S683-E686 PolarHBondContact OG-N 3.17Å; S683-E686 PolarHBondContact OG-OE2 3.47Å; E686-L688 PolarHBondContact O-N 3.43Å; E686-V689 PolarHBondContact O-N 3.08Å; E686-V690 WeakPolarHBondContact O-CG2 3.44Å; E686-V690 PolarHBondContact O-N 2.79Å
687	R	96.4	Very high	93.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-44.9	178.1	-167.6	178.7	61.9	80.6	2.4	111.7	L293 L294 L445 E643 Q682 S683 V689 V690 L691	L293-R687 WeakPolarHBondContact O-CD 3.43Å; L294-R687 HydrophobicContact CD2-CG 4.22Å; L294-R687 PolarHBondContact O-NH1 3.02Å; L445-R687 PolarHBondContact O-NH1 3.43Å; L445-R687 PolarHBondContact O-NH2 3.14Å; E643-R687 VanDerWaalsContact CD-NE 3.32Å; E643-R687 IonicContact OE1-CZ 3.64Å; E643-R687 IonicContact OE1-NE 3.72Å; E643-R687 PolarHBondContact OE1-NE 3.13Å; E643-R687 IonicContact OE1-NH2 2.9Å; E643-R687 PolarHBondContact OE1-NH2 2.87Å; E643-R687 WeakPolarHBondContact OE2-CD 3.48Å; E643-R687 IonicContact OE2-CZ 2.82Å; E643-R687 IonicContact OE2-NE 3.82Å; E643-R687 PolarHBondContact OE2-NE 3.05Å; E643-R687 IonicContact OE2-NH2 3.27Å; Q682-R687 HydrophobicContact CG-CB 4.28Å; S683-R687 PolarHBondContact O-N 3.44Å; R687-V689 VanDerWaalsContact C-N 3.32Å; R687-V689 PolarHBondContact O-N 3.24Å; R687-V690 PolarHBondContact O-N 3.22Å; R687-L691 WeakPolarHBondContact O-CB 3.24Å; R687-L691 PolarHBondContact O-N 3.44Å
688	L	95.9	Very high	94.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.3	-31.4	176.8	-67.2	173.3	0	0	0	113.1	K444 L445 L487 L489 L659 L684 E686 L691 I693	K444-L688 WeakPolarHBondContact O-CD2 3.22Å; L445-L688 HydrophobicContact CD2-CD1 4.41Å; L487-L688 HydrophobicContact CD2-CD1 4.45Å; L489-L688 HydrophobicContact CD1-CB 3.96Å; L489-L688 HydrophobicContact CD2-CD1 4.15Å; L659-L688 HydrophobicContact CD1-CD1 3.95Å; L684-L688 HydrophobicContact CD1-CD1 3.83Å; L684-L688 HydrophobicContact CD1-CG 3.98Å; L684-L688 HydrophobicContact CG-CD1 3.96Å; L684-L688 HydrophobicContact CG-CG 4.49Å; L684-L688 WeakPolarHBondContact O-CB 3.19Å; L684-L688 VanDerWaalsContact O-CG 3.24Å; L684-L688 WeakPolarHBondContact O-CG 3.47Å; L684-L688 PolarHBondContact O-N 2.93Å; L684-L688 VanDerWaalsContact O-N 3.09Å; E686-L688 PolarHBondContact O-N 3.43Å; L688-L691 PolarHBondContact O-N 2.76Å; L688-I693 HydrophobicContact CB-CD1 4.27Å; L688-I693 HydrophobicContact CD2-CD1 4Å; L688-I693 VanDerWaalsContact O-CB 3.3Å; L688-I693 WeakPolarHBondContact O-CB 3.44Å; L688-I693 PolarHBondContact O-N 2.96Å
689	V	94.4	Very high	94.4	Very high	40 Å²	40	35.6 Å²	35.6	24%	0.242	19%	0.188	C	C	.	.	H	α-helix	trans	-68.8	-44.2	172.2	169.5	0	0	0	0	111.7	L489 F685 E686 R687 L691 G692 P695	L489-V689 HydrophobicContact CD1-CG2 3.72Å; F685-V689 HydrophobicContact CD1-CG2 3.99Å; F685-V689 HydrophobicContact CE1-CG2 3.82Å; F685-V689 WeakPolarHBondContact O-CG2 3.27Å; F685-V689 PolarHBondContact O-N 3.33Å; F685-V689 VanDerWaalsContact O-N 3.08Å; E686-V689 PolarHBondContact O-N 3.08Å; R687-V689 VanDerWaalsContact C-N 3.32Å; R687-V689 PolarHBondContact O-N 3.24Å; V689-L691 PolarHBondContact O-N 3.3Å; V689-G692 WeakPolarHBondContact O-CA 3.36Å; V689-G692 PolarHBondContact O-N 3.1Å; V689-P695 HydrophobicContact CG2-CG 3.44Å; V689-P695 VanDerWaalsContact CG2-CG 3.44Å
690	V	91.9	Very high	94.7	Very high	52 Å²	52	35.8 Å²	35.8	32%	0.315	19%	0.187	S	C	.	.	H	α-helix	trans	-63.1	-31.8	175.5	176	0	0	0	0	111.1	L294 E686 R687 G692	L294-V690 HydrophobicContact CD1-CG1 3.92Å; L294-V690 HydrophobicContact CD2-CB 4.17Å; L294-V690 HydrophobicContact CD2-CG1 3.64Å; L294-V690 HydrophobicContact CG-CG1 4.46Å; E686-V690 WeakPolarHBondContact O-CG2 3.44Å; E686-V690 PolarHBondContact O-N 2.79Å; R687-V690 PolarHBondContact O-N 3.22Å; V690-G692 PolarHBondContact O-N 3.01Å
691	L	91.1	Very high	94.7	Very high	44 Å²	44	35.6 Å²	35.6	23%	0.23	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	4.5	171.2	-152.5	86.6	0	0	0	114.3	L294 R295 R687 L688 V689	L294-L691 HydrophobicContact CB-CD1 4.11Å; L294-L691 WeakPolarHBondContact O-CD1 3.4Å; R295-L691 HydrophobicContact CG-CD1 3.96Å; R687-L691 WeakPolarHBondContact O-CB 3.24Å; R687-L691 PolarHBondContact O-N 3.44Å; L688-L691 PolarHBondContact O-N 2.76Å; V689-L691 PolarHBondContact O-N 3.3Å
692	G	91	Very high	94.9	Very high	51 Å²	51	37.4 Å²	37.4	53%	0.526	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	3.1	174.4	0	0	0	0	0	115.9	V689 V690 R694	V689-G692 WeakPolarHBondContact O-CA 3.36Å; V689-G692 PolarHBondContact O-N 3.1Å; V690-G692 PolarHBondContact O-N 3.01Å; G692-R694 PolarHBondContact O-N 3.43Å
693	I	92.8	Very high	95	Very high	39 Å²	39	36.5 Å²	36.5	20%	0.2	18%	0.181	C	C	.	.			trans	-72.4	99	174	-54.4	-171.6	0	0	0	109.1	L487 L489 L688 P695	L487-I693 HydrophobicContact CD2-CD1 3.87Å; L489-I693 HydrophobicContact CD1-CB 4.07Å; L489-I693 HydrophobicContact CD1-CG2 3.87Å; L489-I693 HydrophobicContact CG-CG2 3.98Å; L688-I693 HydrophobicContact CB-CD1 4.27Å; L688-I693 HydrophobicContact CD2-CD1 4Å; L688-I693 VanDerWaalsContact O-CB 3.3Å; L688-I693 WeakPolarHBondContact O-CB 3.44Å; L688-I693 PolarHBondContact O-N 2.96Å; I693-P695 VanDerWaalsContact O-CD 3.27Å; I693-P695 WeakPolarHBondContact O-CD 3.47Å
694	R	93.3	Very high	95.1	Very high	193 Å²	193	36.5 Å²	36.5	73%	0.728	18%	0.181	S	C	*	.			trans	-67	118.7	-176.3	-59.8	-178.4	-173.2	168.3	3.6	111.4	G692	G692-R694 PolarHBondContact O-N 3.43Å
695	P	95.7	Very high	95.1	Very high	33 Å²	33	37.1 Å²	37.1	21%	0.214	18%	0.184	C	C	.	.			trans	-68.1	149.6	175.7	-21.2	34.5	0	0	0	113	L489 Q491 F685 V689 I693 R697	L489-P695 HydrophobicContact CB-CB 4.03Å; L489-P695 HydrophobicContact CB-CG 4.18Å; L489-P695 HydrophobicContact CD1-CG 4.37Å; L489-P695 WeakPolarHBondContact O-CA 3.35Å; Q491-P695 HydrophobicContact CB-CB 3.8Å; F685-P695 HydrophobicContact CE1-CG 4.11Å; F685-P695 HydrophobicContact CZ-CB 4.16Å; F685-P695 HydrophobicContact CZ-CG 4.11Å; V689-P695 HydrophobicContact CG2-CG 3.44Å; V689-P695 VanDerWaalsContact CG2-CG 3.44Å; I693-P695 VanDerWaalsContact O-CD 3.27Å; I693-P695 WeakPolarHBondContact O-CD 3.47Å; P695-R697 PolarHBondContact O-N 2.78Å
696	I	97	Very high	95.1	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.067	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	107.6	166.5	-55	164.1	0	0	0	107.3	Y477 A478 T481 V482 L489 I490 Q491	Y477-I696 HydrophobicContact CD1-CG2 3.79Å; Y477-I696 HydrophobicContact CE1-CG2 3.92Å; A478-I696 HydrophobicContact CB-CG2 3.74Å; T481-I696 HydrophobicContact CG2-CD1 3.76Å; V482-I696 HydrophobicContact CG2-CD1 3.86Å; L489-I696 PolarHBondContact O-N 3.31Å; I490-I696 WeakPolarHBondContact CA-O 3.41Å; Q491-I696 PolarHBondContact N-O 3.23Å
697	R	95.3	Very high	95.3	Very high	75 Å²	75	38.2 Å²	38.2	28%	0.283	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	121.7	-179.3	-166.4	-176.3	-73.3	170.7	1.1	110.8	Q491 P695 E718 S720	Q491-R697 WeakPolarHBondContact O-CA 3.45Å; P695-R697 PolarHBondContact O-N 2.78Å; R697-E718 IonicContact CZ-OE2 2.81Å; R697-E718 VanDerWaalsContact CZ-OE2 3.27Å; R697-E718 IonicContact NH1-OE2 3.54Å; R697-E718 PolarHBondContact NH1-OE2 3.16Å; R697-E718 IonicContact NH2-OE2 3.95Å; R697-E718 PolarHBondContact NH2-OE2 2.96Å; R697-S720 PolarHBondContact NH1-OG 2.6Å
698	L	96.6	Very high	95.4	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.197	C	C	.	.			trans	-74.9	128.9	168.2	-57.2	-177.5	0	0	0	109.1	Q475 A478 I490 Q491 P493 T496 K498 T501	Q475-L698 HydrophobicContact CG-CD2 4.03Å; A478-L698 HydrophobicContact CB-CD2 3.96Å; I490-L698 HydrophobicContact CG2-CD1 4.22Å; I490-L698 HydrophobicContact CG2-CD2 4.36Å; I490-L698 HydrophobicContact CG2-CG 3.98Å; Q491-L698 PolarHBondContact O-N 2.78Å; P493-L698 WeakPolarHBondContact CD-O 3.48Å; T496-L698 HydrophobicContact CG2-CB 4.42Å; K498-L698 HydrophobicContact CG-CD1 4.36Å; T501-L698 HydrophobicContact CG2-CD2 4.47Å
699	Q	93	Very high	95.4	Very high	75 Å²	75	38.7 Å²	38.7	35%	0.35	20%	0.198	S	C	.	.			trans	-104.3	-20.7	-163.7	-63.1	-171.5	3.2	0	0	115.7	S474 Q722	S474-Q699 PolarHBondContact OG-N 3.09Å; Q699-Q722 PolarHBondContact O-N 2.98Å
700	V	97	Very high	95.5	Very high	12 Å²	12	38.1 Å²	38.1	7%	0.073	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.4	-170	-171	0	0	0	0	110.5	T496 Y702 Q722	T496-V700 WeakPolarHBondContact CA-O 3.32Å; V700-Y702 HydrophobicContact CB-CE2 4.05Å; V700-Y702 HydrophobicContact CG1-CE1 4.18Å; V700-Y702 HydrophobicContact CG1-CE2 3.93Å; V700-Y702 WeakPolarHBondContact O-CD2 3.22Å; V700-Y702 VanDerWaalsContact O-CE2 3.26Å; V700-Y702 WeakPolarHBondContact O-CE2 3.31Å; V700-Q722 CarbonylContact C-O 3.23Å; V700-Q722 WeakPolarHBondContact CA-O 3.31Å; V700-Q722 HydrophobicContact CG2-CB 4.26Å
701	Q	96.3	Very high	95.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	141	178.6	80.3	81.2	19.8	0	0	112.3	T496 M704 L721 Q722 N723 G724	T496-Q701 HydrophobicContact CG2-CB 4.28Å; Q701-M704 HydrophobicContact CG-CE 4.49Å; Q701-M704 PolarHBondContact NE2-O 3.32Å; Q701-L721 HydrophobicContact CB-CD1 4.04Å; Q701-L721 HydrophobicContact CB-CD2 4.13Å; Q701-L721 HydrophobicContact CB-CG 4.08Å; Q701-L721 HydrophobicContact CG-CD2 4.12Å; Q701-L721 HydrophobicContact CG-CG 4.15Å; Q701-Q722 PolarHBondContact N-O 3.04Å; Q701-N723 PolarHBondContact NE2-OD1 3.31Å; Q701-G724 WeakPolarHBondContact O-CA 3.45Å; Q701-G724 PolarHBondContact O-N 3.46Å
702	Y	96.2	Very high	95.9	Very high	88 Å²	88	34.2 Å²	34.2	35%	0.345	17%	0.174	S	C	.	.			trans	-121.6	8	-177.4	-59.9	-87.7	0	0	0	113.9	N472 G495 V700 G724 V725 R730	N472-Y702 WeakPolarHBondContact CB-OH 3.44Å; N472-Y702 WeakPolarHBondContact ND2-CE2 3.4Å; N472-Y702 PolarHBondContact ND2-OH 3.38Å; G495-Y702 PolarHBondContact O-N 3.43Å; V700-Y702 HydrophobicContact CB-CE2 4.05Å; V700-Y702 HydrophobicContact CG1-CE1 4.18Å; V700-Y702 HydrophobicContact CG1-CE2 3.93Å; V700-Y702 WeakPolarHBondContact O-CD2 3.22Å; V700-Y702 VanDerWaalsContact O-CE2 3.26Å; V700-Y702 WeakPolarHBondContact O-CE2 3.31Å; Y702-G724 WeakPolarHBondContact CD1-O 3.35Å; Y702-V725 HydrophobicContact CD1-CG1 4.33Å; Y702-R730 PolarHBondContact O-NH2 3.25Å
703	R	95.4	Very high	96.1	Very high	20 Å²	20	32 Å²	32	8%	0.075	15%	0.151	C	C	.	.	S	Bend	trans	-89.2	-58.9	-176	178.4	-179.3	-72.6	-178.3	-10	112.1	R730 E833 T864 A866 R867	R703-R730 PolarHBondContact O-NE 3.18Å; R703-E833 IonicContact CZ-OE2 2.64Å; R703-E833 IonicContact NE-OE2 3.54Å; R703-E833 PolarHBondContact NE-OE2 3.35Å; R703-E833 IonicContact NH2-OE2 3.13Å; R703-E833 PolarHBondContact NH2-OE2 2.92Å; R703-T864 VanDerWaalsContact CD-O 3.29Å; R703-T864 WeakPolarHBondContact CD-O 3.43Å; R703-T864 PolarHBondContact NH1-O 3.4Å; R703-A866 WeakPolarHBondContact CG-O 3.19Å; R703-R867 HydrophobicContact CG-CG 3.88Å; R703-R867 WeakPolarHBondContact O-CA 3.17Å; R703-R867 WeakPolarHBondContact O-CB 3.42Å
704	M	97.4	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-96	149.7	-160	-72.9	167.5	-74.8	0	0	113.3	P494 Q701 L708 V725 T864 A866 R867	P494-M704 HydrophobicContact CB-CE 4.19Å; Q701-M704 HydrophobicContact CG-CE 4.49Å; Q701-M704 PolarHBondContact NE2-O 3.32Å; M704-L708 HydrophobicContact CB-CB 4.18Å; M704-L708 HydrophobicContact CG-CB 4.44Å; M704-V725 WeakPolarHBondContact O-CG2 3.36Å; M704-T864 HydrophobicContact CE-CG2 4.17Å; M704-T864 HydrophobicContact SD-CG2 3.93Å; M704-A866 WeakPolarHBondContact CG-O 3.38Å; M704-R867 CarbonylContact C-O 3.52Å
705	H	98.3	Very high	95.9	Very high	12 Å²	12	27.1 Å²	27.1	6%	0.056	14%	0.14	C	C	.	.			trans	-55.5	138.2	159.6	-175.5	-90.5	0	0	0	110.5	A707 L708 S709 A727 R730 D743 P745 R867	H705-A707 VanDerWaalsContact C-N 3.25Å; H705-A707 WeakPolarHBondContact ND1-CB 3.19Å; H705-A707 PolarHBondContact ND1-N 2.91Å; H705-A707 PolarHBondContact O-N 2.99Å; H705-A707 VanDerWaalsContact O-N 3.08Å; H705-L708 HydrophobicContact CB-CD1 3.94Å; H705-L708 HydrophobicContact CB-CG 4.07Å; H705-L708 WeakPolarHBondContact O-CB 3.27Å; H705-L708 PolarHBondContact O-N 2.79Å; H705-S709 PolarHBondContact O-N 2.51Å; H705-A727 WeakPolarHBondContact NE2-CA 3.19Å; H705-A727 WeakPolarHBondContact NE2-CB 3.25Å; H705-R730 HydrophobicContact CB-CB 3.68Å; H705-R730 HydrophobicContact CB-CG 4.35Å; H705-D743 PolarHBondContact CE1-O 3.43Å; H705-D743 VanDerWaalsContact CE1-O 3.3Å; H705-P745 HydrophobicContact CB-CG 4.09Å; H705-P745 WeakPolarHBondContact ND1-CD 3.23Å; H705-R867 PolarHBondContact N-O 2.88Å
706	P	98.1	Very high	95.6	Very high	34 Å²	34	26 Å²	26	22%	0.221	13%	0.131	C	C	.	.	H	α-helix	trans	-52.9	-33.2	-175.2	-32	37.6	0	0	0	116.2	L708 S709 A710 N723	P706-L708 VanDerWaalsContact C-N 3.26Å; P706-L708 PolarHBondContact O-N 3Å; P706-S709 PolarHBondContact O-N 2.86Å; P706-S709 PolarHBondContact O-OG 3.28Å; P706-S709 VanDerWaalsContact O-OG 3.09Å; P706-A710 PolarHBondContact O-N 2.82Å; P706-N723 HydrophobicContact CG-CB 4.33Å
707	A	98	Very high	95.3	Very high	20 Å²	20	25.4 Å²	25.4	17%	0.165	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-28.9	175.9	0	0	0	0	0	113.5	H705 K744 M746	H705-A707 VanDerWaalsContact C-N 3.25Å; H705-A707 WeakPolarHBondContact ND1-CB 3.19Å; H705-A707 PolarHBondContact ND1-N 2.91Å; H705-A707 PolarHBondContact O-N 2.99Å; H705-A707 VanDerWaalsContact O-N 3.08Å; A707-K744 HydrophobicContact CB-CB 4.45Å; A707-K744 HydrophobicContact CB-CG 4.26Å; A707-M746 HydrophobicContact CB-CE 4.3Å
708	L	97.9	Very high	94.9	Very high	9 Å²	9	26.8 Å²	26.8	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-81.5	-35.8	-178.9	-51.8	174.8	0	0	0	111.7	M704 H705 P706 P712 M746 A866 V870	M704-L708 HydrophobicContact CB-CB 4.18Å; M704-L708 HydrophobicContact CG-CB 4.44Å; H705-L708 HydrophobicContact CB-CD1 3.94Å; H705-L708 HydrophobicContact CB-CG 4.07Å; H705-L708 WeakPolarHBondContact O-CB 3.27Å; H705-L708 PolarHBondContact O-N 2.79Å; P706-L708 VanDerWaalsContact C-N 3.26Å; P706-L708 PolarHBondContact O-N 3Å; L708-P712 WeakPolarHBondContact O-CD 3.4Å; L708-M746 HydrophobicContact CD2-CB 3.69Å; L708-M746 HydrophobicContact CD2-CG 4.21Å; L708-M746 HydrophobicContact CD2-SD 4.05Å; L708-A866 HydrophobicContact CD1-CB 4.4Å; L708-V870 HydrophobicContact CD1-CG2 4.29Å; L708-V870 HydrophobicContact CD2-CB 4.12Å; L708-V870 HydrophobicContact CD2-CG2 3.95Å
709	S	96.9	Very high	94.6	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.007	16%	0.157	C	C	.	.	H	α-helix	trans	-77.3	-20.8	-178.9	58.4	0	0	0	0	113.3	H705 P706 P712 S713 N723	H705-S709 PolarHBondContact O-N 2.51Å; P706-S709 PolarHBondContact O-N 2.86Å; P706-S709 PolarHBondContact O-OG 3.28Å; P706-S709 VanDerWaalsContact O-OG 3.09Å; S709-P712 WeakPolarHBondContact O-CD 3.42Å; S709-S713 WeakPolarHBondContact O-CB 3.46Å; S709-S713 PolarHBondContact O-N 3.27Å; S709-N723 PolarHBondContact OG-OD1 2.87Å
710	A	96.9	Very high	94.4	Very high	29 Å²	29	26.9 Å²	26.9	24%	0.24	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-52.6	-175.7	0	0	0	0	0	113.8	P706 S713 N714	P706-A710 PolarHBondContact O-N 2.82Å; A710-S713 PolarHBondContact O-N 2.86Å; A710-N714 WeakPolarHBondContact O-CB 3.4Å; A710-N714 PolarHBondContact O-N 3.01Å; A710-N714 PolarHBondContact O-OD1 3.32Å
711	F	96.2	Very high	94.2	Very high	11 Å²	11	26.8 Å²	26.8	5%	0.048	15%	0.152	C	C	.	.	H	α-helix	trans	-65.1	-49.3	179.4	178.1	-83.5	0	0	0	112.5	S713 N714 I715 L863 L884 H887 L888 Y891	F711-S713 VanDerWaalsContact C-N 3.33Å; F711-S713 PolarHBondContact O-N 2.87Å; F711-N714 PolarHBondContact O-N 3.36Å; F711-I715 HydrophobicContact CD1-CG1 4.26Å; F711-I715 HydrophobicContact CD2-CG1 4.02Å; F711-I715 HydrophobicContact CE1-CB 4.38Å; F711-I715 HydrophobicContact CE1-CG1 3.99Å; F711-I715 HydrophobicContact CE2-CD1 4.29Å; F711-I715 HydrophobicContact CE2-CG1 3.74Å; F711-I715 HydrophobicContact CG-CG1 4.27Å; F711-I715 HydrophobicContact CZ-CD1 4.48Å; F711-I715 HydrophobicContact CZ-CG1 3.74Å; F711-I715 WeakPolarHBondContact O-CB 3.42Å; F711-I715 WeakPolarHBondContact O-CG1 3.49Å; F711-I715 PolarHBondContact O-N 3.49Å; F711-L863 HydrophobicContact CD1-CD1 3.84Å; F711-L863 HydrophobicContact CE1-CD1 4Å; F711-L884 HydrophobicContact CZ-CD1 4.45Å; F711-H887 HydrophobicContact CE2-CB 4.12Å; F711-H887 HydrophobicContact CZ-CB 4.36Å; F711-L888 HydrophobicContact CD1-CD1 3.7Å; F711-L888 HydrophobicContact CD2-CD1 4.11Å; F711-L888 HydrophobicContact CE1-CB 4.31Å; F711-L888 HydrophobicContact CE1-CD1 3.61Å; F711-L888 HydrophobicContact CE2-CB 4.09Å; F711-L888 HydrophobicContact CE2-CD1 4.01Å; F711-L888 HydrophobicContact CG-CD1 3.96Å; F711-L888 HydrophobicContact CZ-CB 3.73Å; F711-L888 HydrophobicContact CZ-CD1 3.76Å; F711-L888 HydrophobicContact CZ-CG 4.37Å; F711-Y891 HydrophobicContact CB-CD1 3.83Å; F711-Y891 HydrophobicContact CB-CE1 3.71Å; F711-Y891 HydrophobicContact CB-CG 4.47Å; F711-Y891 AromaticContact CD2-CD1 3.79Å; F711-Y891 HydrophobicContact CD2-CD1 3.79Å; F711-Y891 AromaticContact CD2-CG 3.83Å; F711-Y891 HydrophobicContact CD2-CG 3.83Å; F711-Y891 HydrophobicContact CG-CD1 4.16Å
712	P	95.1	Very high	94.2	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.013	17%	0.172	C	C	.	.	H	α-helix	trans	-58.9	-39.9	174.8	-26.2	35.7	0	0	0	113.7	L708 S709 F716 Y717 L863 T864	L708-P712 WeakPolarHBondContact O-CD 3.4Å; S709-P712 WeakPolarHBondContact O-CD 3.42Å; P712-F716 HydrophobicContact CB-CD2 4.1Å; P712-F716 WeakPolarHBondContact O-CB 3.26Å; P712-F716 WeakPolarHBondContact O-CD2 3.43Å; P712-F716 PolarHBondContact O-N 3.11Å; P712-Y717 WeakPolarHBondContact O-CD2 3.37Å; P712-L863 HydrophobicContact CG-CB 4.12Å; P712-L863 HydrophobicContact CG-CD1 4.43Å; P712-T864 HydrophobicContact CB-CG2 3.75Å; P712-T864 HydrophobicContact CG-CG2 3.74Å
713	S	94.4	Very high	94.2	Very high	6 Å²	6	30.2 Å²	30.2	4%	0.042	17%	0.173	C	C	.	.	H	α-helix	trans	-57.5	-54.1	175.2	-176	0	0	0	0	111.3	S709 A710 F711 I715 Y717 E718 G719 L721	S709-S713 WeakPolarHBondContact O-CB 3.46Å; S709-S713 PolarHBondContact O-N 3.27Å; A710-S713 PolarHBondContact O-N 2.86Å; F711-S713 VanDerWaalsContact C-N 3.33Å; F711-S713 PolarHBondContact O-N 2.87Å; S713-I715 PolarHBondContact O-N 3.09Å; S713-Y717 CarbonylContact O-C 3.38Å; S713-Y717 WeakPolarHBondContact O-CA 3.36Å; S713-Y717 PolarHBondContact O-N 3.12Å; S713-E718 PolarHBondContact O-N 3.3Å; S713-E718 VanDerWaalsContact O-N 3.16Å; S713-G719 PolarHBondContact O-N 3.18Å; S713-G719 VanDerWaalsContact OG-C 3.3Å; S713-G719 WeakPolarHBondContact OG-CA 3.17Å; S713-G719 PolarHBondContact OG-O 3.22Å; S713-L721 VanDerWaalsContact OG-CB 3.32Å; S713-L721 WeakPolarHBondContact OG-CB 3.37Å; S713-L721 PolarHBondContact OG-N 2.76Å; S713-L721 PolarHBondContact OG-O 2.8Å
714	N	92.9	Very high	94.2	Very high	100 Å²	100	30.8 Å²	30.8	54%	0.535	19%	0.185	S	C	.	.	H	α-helix	trans	-67.4	-36.1	-174.1	-66.6	-4.9	0	0	0	112.7	A710 F711	A710-N714 WeakPolarHBondContact O-CB 3.4Å; A710-N714 PolarHBondContact O-N 3.01Å; A710-N714 PolarHBondContact O-OD1 3.32Å; F711-N714 PolarHBondContact O-N 3.36Å
715	I	90.2	Very high	94.2	Very high	28 Å²	28	31.6 Å²	31.6	14%	0.144	19%	0.191	C	C	.	.	H	α-helix	trans	-91.2	-37.5	-172.9	-61.8	-65.6	0	0	0	113.3	F711 S713 L884 L919	F711-I715 HydrophobicContact CD1-CG1 4.26Å; F711-I715 HydrophobicContact CD2-CG1 4.02Å; F711-I715 HydrophobicContact CE1-CB 4.38Å; F711-I715 HydrophobicContact CE1-CG1 3.99Å; F711-I715 HydrophobicContact CE2-CD1 4.29Å; F711-I715 HydrophobicContact CE2-CG1 3.74Å; F711-I715 HydrophobicContact CG-CG1 4.27Å; F711-I715 HydrophobicContact CZ-CD1 4.48Å; F711-I715 HydrophobicContact CZ-CG1 3.74Å; F711-I715 WeakPolarHBondContact O-CB 3.42Å; F711-I715 WeakPolarHBondContact O-CG1 3.49Å; F711-I715 PolarHBondContact O-N 3.49Å; S713-I715 PolarHBondContact O-N 3.09Å; I715-L884 HydrophobicContact CG2-CD1 3.6Å; I715-L919 HydrophobicContact CD1-CD1 4.31Å; I715-L919 HydrophobicContact CG2-CD1 4.15Å
716	F	88.6	Confident	94.1	Very high	9 Å²	9	34.5 Å²	34.5	4%	0.039	21%	0.209	C	C	.	.	H	α-helix	trans	-107.8	-16.8	-175.3	-51.9	-67.1	0	0	0	114.1	C664 P712 P856 N860 L884 F929	C664-F716 HydrophobicContact CB-CB 4.34Å; C664-F716 PolarHBondContact SG-O 3.08Å; C664-F716 VanDerWaalsContact SG-O 3.39Å; P712-F716 HydrophobicContact CB-CD2 4.1Å; P712-F716 WeakPolarHBondContact O-CB 3.26Å; P712-F716 WeakPolarHBondContact O-CD2 3.43Å; P712-F716 PolarHBondContact O-N 3.11Å; F716-P856 HydrophobicContact CE1-CB 3.98Å; F716-N860 HydrophobicContact CD1-CB 4.22Å; F716-N860 HydrophobicContact CD2-CB 3.59Å; F716-N860 WeakPolarHBondContact CD2-OD1 3.4Å; F716-N860 HydrophobicContact CE1-CB 4.11Å; F716-N860 HydrophobicContact CE2-CB 3.49Å; F716-N860 VanDerWaalsContact CE2-CB 3.49Å; F716-N860 HydrophobicContact CG-CB 3.98Å; F716-N860 HydrophobicContact CZ-CB 3.76Å; F716-L884 HydrophobicContact CE1-CD1 4.22Å; F716-L884 HydrophobicContact CE1-CD2 4.26Å; F716-L884 HydrophobicContact CZ-CD1 4.12Å; F716-L884 HydrophobicContact CZ-CD2 4.24Å; F716-F929 HydrophobicContact CB-CE1 4.48Å; F716-F929 HydrophobicContact CD1-CE1 4.06Å
717	Y	90.1	Very high	94	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	22%	0.217	C	C	.	.	S	Bend	trans	-133	24.2	-173.6	-52.9	-74.2	0	0	0	113.4	P493 P494 D662 C664 P712 S713 G719 S720 N860	P493-Y717 HydrophobicContact CB-CD1 3.96Å; P493-Y717 HydrophobicContact CB-CD2 4.35Å; P493-Y717 HydrophobicContact CB-CE1 3.67Å; P493-Y717 HydrophobicContact CB-CE2 4.12Å; P493-Y717 HydrophobicContact CB-CG 4.29Å; P493-Y717 HydrophobicContact CG-CD1 3.63Å; P493-Y717 HydrophobicContact CG-CE1 3.65Å; P493-Y717 HydrophobicContact CG-CG 4.23Å; P494-Y717 WeakPolarHBondContact CD-OH 3.49Å; D662-Y717 PolarHBondContact OD2-OH 2.84Å; C664-Y717 HydrophobicContact CB-CD1 4.44Å; C664-Y717 HydrophobicContact CB-CE1 3.54Å; C664-Y717 WeakPolarHBondContact CB-OH 3.49Å; P712-Y717 WeakPolarHBondContact O-CD2 3.37Å; S713-Y717 CarbonylContact O-C 3.38Å; S713-Y717 WeakPolarHBondContact O-CA 3.36Å; S713-Y717 PolarHBondContact O-N 3.12Å; Y717-G719 PolarHBondContact O-N 3.03Å; Y717-G719 VanDerWaalsContact O-N 3.08Å; Y717-S720 WeakPolarHBondContact O-CB 3.23Å; Y717-S720 PolarHBondContact O-N 2.83Å; Y717-S720 PolarHBondContact O-OG 3.1Å; Y717-N860 PolarHBondContact OH-ND2 3.09Å
718	E	87.4	Confident	93.9	Very high	105 Å²	105	37.9 Å²	37.9	49%	0.491	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	22.2	171.6	-50.6	160.7	114.9	0	0	113.8	R697 S713 S720	R697-E718 IonicContact CZ-OE2 2.81Å; R697-E718 VanDerWaalsContact CZ-OE2 3.27Å; R697-E718 IonicContact NH1-OE2 3.54Å; R697-E718 PolarHBondContact NH1-OE2 3.16Å; R697-E718 IonicContact NH2-OE2 3.95Å; R697-E718 PolarHBondContact NH2-OE2 2.96Å; S713-E718 PolarHBondContact O-N 3.3Å; S713-E718 VanDerWaalsContact O-N 3.16Å; E718-S720 PolarHBondContact O-N 2.89Å
719	G	89.4	Confident	93.8	Very high	38 Å²	38	41.4 Å²	41.4	39%	0.392	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	1.7	-172.1	0	0	0	0	0	114.5	S713 Y717 L721	S713-G719 PolarHBondContact O-N 3.18Å; S713-G719 VanDerWaalsContact OG-C 3.3Å; S713-G719 WeakPolarHBondContact OG-CA 3.17Å; S713-G719 PolarHBondContact OG-O 3.22Å; Y717-G719 PolarHBondContact O-N 3.03Å; Y717-G719 VanDerWaalsContact O-N 3.08Å; G719-L721 VanDerWaalsContact C-N 3.28Å; G719-L721 PolarHBondContact O-N 3.13Å
720	S	90.5	Very high	93.8	Very high	39 Å²	39	43 Å²	43	27%	0.273	26%	0.264	S	S	.	.			trans	-76.4	-5.5	-172.9	68.6	0	0	0	0	115.4	R697 Y717 E718 Q722	R697-S720 PolarHBondContact NH1-OG 2.6Å; Y717-S720 WeakPolarHBondContact O-CB 3.23Å; Y717-S720 PolarHBondContact O-N 2.83Å; Y717-S720 PolarHBondContact O-OG 3.1Å; E718-S720 PolarHBondContact O-N 2.89Å; S720-Q722 PolarHBondContact O-N 3.36Å
721	L	92.4	Very high	93.7	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.058	28%	0.282	C	S	.	.			trans	-83.4	111.1	-179.6	-167.1	67	0	0	0	111.2	P493 T496 Q701 S713 G719	P493-L721 HydrophobicContact CB-CD1 3.69Å; P493-L721 HydrophobicContact CB-CD2 4.39Å; P493-L721 HydrophobicContact CG-CD1 4.08Å; T496-L721 HydrophobicContact CG2-CD1 3.52Å; Q701-L721 HydrophobicContact CB-CD1 4.04Å; Q701-L721 HydrophobicContact CB-CD2 4.13Å; Q701-L721 HydrophobicContact CB-CG 4.08Å; Q701-L721 HydrophobicContact CG-CD2 4.12Å; Q701-L721 HydrophobicContact CG-CG 4.15Å; S713-L721 VanDerWaalsContact OG-CB 3.32Å; S713-L721 WeakPolarHBondContact OG-CB 3.37Å; S713-L721 PolarHBondContact OG-N 2.76Å; S713-L721 PolarHBondContact OG-O 2.8Å; G719-L721 VanDerWaalsContact C-N 3.28Å; G719-L721 PolarHBondContact O-N 3.13Å
722	Q	95.3	Very high	93.5	Very high	90 Å²	90	47.9 Å²	47.9	42%	0.421	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	151.1	178.6	-59.3	170.3	30.5	0	0	111.1	Q699 V700 Q701 S720	Q699-Q722 PolarHBondContact O-N 2.98Å; V700-Q722 CarbonylContact C-O 3.23Å; V700-Q722 WeakPolarHBondContact CA-O 3.31Å; V700-Q722 HydrophobicContact CG2-CB 4.26Å; Q701-Q722 PolarHBondContact N-O 3.04Å; S720-Q722 PolarHBondContact O-N 3.36Å
723	N	96.9	Very high	93.3	Very high	69 Å²	69	57.3 Å²	57.3	37%	0.369	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.4	177.5	-67.6	-53.6	0	0	0	111	Q701 P706 S709 V725	Q701-N723 PolarHBondContact NE2-OD1 3.31Å; P706-N723 HydrophobicContact CG-CB 4.33Å; S709-N723 PolarHBondContact OG-OD1 2.87Å; N723-V725 VanDerWaalsContact C-N 3.28Å
724	G	95.8	Very high	93.2	Very high	32 Å²	32	60.2 Å²	60.2	33%	0.33	36%	0.36	S	S	.	.	S	Bend	trans	-88.2	8.2	173.7	0	0	0	0	0	114.1	Q701 Y702	Q701-G724 WeakPolarHBondContact O-CA 3.45Å; Q701-G724 PolarHBondContact O-N 3.46Å; Y702-G724 WeakPolarHBondContact CD1-O 3.35Å
725	V	96.6	Very high	93.2	Very high	18 Å²	18	56.7 Å²	56.7	11%	0.109	34%	0.34	C	S	.	.	S	Bend	trans	-138.4	142	175.2	-68.8	0	0	0	0	108.9	Y702 M704 N723 D729 R730	Y702-V725 HydrophobicContact CD1-CG1 4.33Å; M704-V725 WeakPolarHBondContact O-CG2 3.36Å; N723-V725 VanDerWaalsContact C-N 3.28Å; V725-D729 HydrophobicContact CB-CB 4.15Å; V725-R730 HydrophobicContact CG2-CG 4.25Å
726	T	97.5	Very high	93.4	Very high	73 Å²	73	62.6 Å²	62.6	45%	0.448	37%	0.372	S	S	.	.			trans	-84.6	176	-178.7	69.3	0	0	0	0	111.9	A728 D729	T726-A728 VanDerWaalsContact C-N 3.33Å; T726-A728 PolarHBondContact OG1-N 2.84Å; T726-D729 VanDerWaalsContact CB-OD2 3.3Å; T726-D729 WeakPolarHBondContact CB-OD2 3.28Å; T726-D729 WeakPolarHBondContact CG2-OD2 3.23Å; T726-D729 PolarHBondContact N-OD2 2.9Å; T726-D729 VanDerWaalsContact OG1-CG 3.27Å; T726-D729 PolarHBondContact OG1-N 3.22Å; T726-D729 VanDerWaalsContact OG1-N 3.14Å; T726-D729 PolarHBondContact OG1-OD2 3.2Å
727	A	96.2	Very high	93.7	Very high	47 Å²	47	63 Å²	63	39%	0.388	37%	0.374	S	S	.	.	S	Bend	trans	-59.3	-44.6	166.9	0	0	0	0	0	111.5	H705 D729 R730 V731	H705-A727 WeakPolarHBondContact NE2-CA 3.19Å; H705-A727 WeakPolarHBondContact NE2-CB 3.25Å; A727-D729 PolarHBondContact O-N 3.2Å; A727-R730 CarbonylContact O-C 3.58Å; A727-R730 VanDerWaalsContact O-C 3.23Å; A727-R730 WeakPolarHBondContact O-CA 3.48Å; A727-R730 PolarHBondContact O-N 2.91Å; A727-V731 PolarHBondContact O-N 3.35Å; A727-V731 VanDerWaalsContact O-N 3.11Å
728	A	95.4	Very high	93.9	Very high	77 Å²	77	69.3 Å²	69.3	64%	0.636	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-62.8	-38.1	-179.2	0	0	0	0	0	112.9	T726 R730 V731	T726-A728 VanDerWaalsContact C-N 3.33Å; T726-A728 PolarHBondContact OG1-N 2.84Å; A728-R730 PolarHBondContact O-N 3.23Å; A728-R730 VanDerWaalsContact O-N 3.11Å; A728-V731 PolarHBondContact O-N 3.08Å
729	D	95.6	Very high	94.3	Very high	83 Å²	83	65.3 Å²	65.3	44%	0.444	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-63.5	-14.1	173.5	-61.4	-58.7	0	0	0	113.2	V725 T726 A727	V725-D729 HydrophobicContact CB-CB 4.15Å; T726-D729 VanDerWaalsContact CB-OD2 3.3Å; T726-D729 WeakPolarHBondContact CB-OD2 3.28Å; T726-D729 WeakPolarHBondContact CG2-OD2 3.23Å; T726-D729 PolarHBondContact N-OD2 2.9Å; T726-D729 VanDerWaalsContact OG1-CG 3.27Å; T726-D729 PolarHBondContact OG1-N 3.22Å; T726-D729 VanDerWaalsContact OG1-N 3.14Å; T726-D729 PolarHBondContact OG1-OD2 3.2Å; A727-D729 PolarHBondContact O-N 3.2Å
730	R	96.9	Very high	94.6	Very high	34 Å²	34	65.1 Å²	65.1	13%	0.128	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-126.1	24.7	-177.5	-65	-65.5	179.1	-85.4	1.1	112.9	Y702 R703 H705 V725 A727 A728 Y868	Y702-R730 PolarHBondContact O-NH2 3.25Å; R703-R730 PolarHBondContact O-NE 3.18Å; H705-R730 HydrophobicContact CB-CB 3.68Å; H705-R730 HydrophobicContact CB-CG 4.35Å; V725-R730 HydrophobicContact CG2-CG 4.25Å; A727-R730 CarbonylContact O-C 3.58Å; A727-R730 VanDerWaalsContact O-C 3.23Å; A727-R730 WeakPolarHBondContact O-CA 3.48Å; A727-R730 PolarHBondContact O-N 2.91Å; A728-R730 PolarHBondContact O-N 3.23Å; A728-R730 VanDerWaalsContact O-N 3.11Å; R730-Y868 VanDerWaalsContact O-CD1 3.26Å; R730-Y868 WeakPolarHBondContact O-CD1 3.41Å
731	V	94.6	Very high	94.9	Very high	101 Å²	101	65.5 Å²	65.5	61%	0.612	37%	0.373	S	S	*	.	S	Bend	trans	-90.1	127.3	154	179.6	0	0	0	0	108.3	A727 A728	A727-V731 PolarHBondContact O-N 3.35Å; A727-V731 VanDerWaalsContact O-N 3.11Å; A728-V731 PolarHBondContact O-N 3.08Å
732	K	92.3	Very high	95	Very high	43 Å²	43	69.8 Å²	69.8	19%	0.187	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-77.6	128	178.3	-175	77.6	169.6	-171.5	0	109	F735 D835 F836 Y868	K732-F735 HydrophobicContact CB-CB 3.66Å; K732-F735 HydrophobicContact CB-CD1 3.95Å; K732-F735 HydrophobicContact CB-CG 3.93Å; K732-F735 HydrophobicContact CG-CB 3.56Å; K732-F735 HydrophobicContact CG-CD1 4.41Å; K732-F735 HydrophobicContact CG-CD2 4.48Å; K732-F735 HydrophobicContact CG-CG 3.91Å; K732-D835 IonicContact NZ-OD2 3.74Å; K732-D835 PolarHBondContact NZ-OD2 2.66Å; K732-F836 HydrophobicContact CB-CZ 4.34Å; K732-F836 HydrophobicContact CG-CZ 4.33Å; K732-Y868 HydrophobicContact CB-CD1 3.79Å; K732-Y868 HydrophobicContact CB-CE1 4.06Å; K732-Y868 HydrophobicContact CB-CG 4.38Å; K732-Y868 HydrophobicContact CD-CD1 4.36Å; K732-Y868 HydrophobicContact CD-CE1 4.18Å; K732-Y868 HydrophobicContact CD-CE2 4.32Å
733	K	91	Very high	95	Very high	200 Å²	200	70.2 Å²	70.2	87%	0.87	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	133.4	177.5	-64.9	-175	178.9	-176.6	0	110.5
734	G	91.1	Very high	95	Very high	67 Å²	67	68.4 Å²	68.4	69%	0.691	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	50.7	-179.2	0	0	0	0	0	112.3
735	F	94.6	Very high	95.1	Very high	26 Å²	26	67.5 Å²	67.5	11%	0.114	38%	0.384	C	S	.	.			trans	-138	90.9	-174.5	178.6	-110	0	0	0	111.6	K732 F737 W739 L780 A783 A785 F836	K732-F735 HydrophobicContact CB-CB 3.66Å; K732-F735 HydrophobicContact CB-CD1 3.95Å; K732-F735 HydrophobicContact CB-CG 3.93Å; K732-F735 HydrophobicContact CG-CB 3.56Å; K732-F735 HydrophobicContact CG-CD1 4.41Å; K732-F735 HydrophobicContact CG-CD2 4.48Å; K732-F735 HydrophobicContact CG-CG 3.91Å; F735-F737 VanDerWaalsContact C-N 3.31Å; F735-F737 HydrophobicContact CD1-CB 4.13Å; F735-F737 HydrophobicContact CE1-CB 3.45Å; F735-F737 VanDerWaalsContact CE1-CB 3.45Å; F735-F737 HydrophobicContact CE1-CG 4.27Å; F735-F737 HydrophobicContact CE2-CB 4.04Å; F735-F737 HydrophobicContact CZ-CB 3.39Å; F735-F737 HydrophobicContact CZ-CD2 4.36Å; F735-F737 AromaticContact CZ-CG 3.98Å; F735-F737 HydrophobicContact CZ-CG 3.98Å; F735-F737 PolarHBondContact O-N 3.46Å; F735-F737 VanDerWaalsContact O-N 3.08Å; F735-W739 HydrophobicContact CE1-CZ2 4.29Å; F735-L780 HydrophobicContact CE2-CD2 4.23Å; F735-L780 HydrophobicContact CZ-CD2 3.74Å; F735-A783 VanDerWaalsContact CA-O 3.28Å; F735-A783 WeakPolarHBondContact CA-O 3.39Å; F735-A783 HydrophobicContact CD2-CB 4.06Å; F735-A783 WeakPolarHBondContact CD2-O 3.42Å; F735-A783 HydrophobicContact CE2-CB 3.85Å; F735-A785 HydrophobicContact CD2-CB 4.44Å; F735-A785 HydrophobicContact CE2-CB 4Å; F735-F836 HydrophobicContact CD1-CE1 4.36Å; F735-F836 AromaticContact CD1-CZ 3.88Å; F735-F836 HydrophobicContact CD1-CZ 3.88Å; F735-F836 HydrophobicContact CD2-CE2 4.34Å; F735-F836 HydrophobicContact CD2-CZ 4.06Å; F735-F836 AromaticContact CE1-CE1 3.55Å; F735-F836 HydrophobicContact CE1-CE1 3.55Å; F735-F836 HydrophobicContact CE1-CE2 4.43Å; F735-F836 AromaticContact CE1-CZ 3.41Å; F735-F836 HydrophobicContact CE1-CZ 3.41Å; F735-F836 VanDerWaalsContact CE1-CZ 3.41Å; F735-F836 HydrophobicContact CE2-CE1 4.32Å; F735-F836 AromaticContact CE2-CE2 3.86Å; F735-F836 HydrophobicContact CE2-CE2 3.86Å; F735-F836 AromaticContact CE2-CZ 3.63Å; F735-F836 HydrophobicContact CE2-CZ 3.63Å; F735-F836 HydrophobicContact CG-CZ 4.18Å; F735-F836 HydrophobicContact CZ-CD1 4.33Å; F735-F836 AromaticContact CZ-CE1 3.53Å; F735-F836 HydrophobicContact CZ-CE1 3.53Å; F735-F836 AromaticContact CZ-CE2 3.9Å; F735-F836 HydrophobicContact CZ-CE2 3.9Å; F735-F836 AromaticContact CZ-CZ 3.27Å; F735-F836 HydrophobicContact CZ-CZ 3.27Å
736	D	93.1	Very high	95.1	Very high	152 Å²	152	66.8 Å²	66.8	81%	0.813	38%	0.379	S	S	*	.			trans	-92.4	60.7	-168.3	-60.9	-31.8	0	0	0	111.6	A783	D736-A783 PolarHBondContact N-O 2.86Å
737	F	94.7	Very high	95.2	Very high	18 Å²	18	63.3 Å²	63.3	8%	0.079	36%	0.358	C	S	.	.			trans	-103.8	114	176.8	-172	-82.6	0	0	0	111.4	F735 W739 F747 K779 L780 A783 I871	F735-F737 VanDerWaalsContact C-N 3.31Å; F735-F737 HydrophobicContact CD1-CB 4.13Å; F735-F737 HydrophobicContact CE1-CB 3.45Å; F735-F737 VanDerWaalsContact CE1-CB 3.45Å; F735-F737 HydrophobicContact CE1-CG 4.27Å; F735-F737 HydrophobicContact CE2-CB 4.04Å; F735-F737 HydrophobicContact CZ-CB 3.39Å; F735-F737 HydrophobicContact CZ-CD2 4.36Å; F735-F737 AromaticContact CZ-CG 3.98Å; F735-F737 HydrophobicContact CZ-CG 3.98Å; F735-F737 PolarHBondContact O-N 3.46Å; F735-F737 VanDerWaalsContact O-N 3.08Å; F737-W739 AromaticContact CD1-CD2 3.74Å; F737-W739 HydrophobicContact CD1-CD2 3.74Å; F737-W739 AromaticContact CD1-CE2 3.59Å; F737-W739 HydrophobicContact CD1-CE3 4.28Å; F737-W739 HydrophobicContact CD1-CG 4.03Å; F737-W739 HydrophobicContact CD1-CZ2 4Å; F737-W739 AromaticContact CD1-NE1 3.79Å; F737-W739 AromaticContact CE1-CD2 3.83Å; F737-W739 HydrophobicContact CE1-CD2 3.83Å; F737-W739 AromaticContact CE1-CE3 3.9Å; F737-W739 HydrophobicContact CE1-CE3 3.9Å; F737-W739 HydrophobicContact CE1-CG 4.37Å; F737-W739 HydrophobicContact CE1-CH2 4.3Å; F737-W739 HydrophobicContact CE1-CZ2 4.25Å; F737-W739 HydrophobicContact CE1-CZ3 4.14Å; F737-W739 VanDerWaalsContact O-CD1 3.27Å; F737-W739 PolarHBondContact O-N 3.49Å; F737-W739 VanDerWaalsContact O-N 3.15Å; F737-F747 HydrophobicContact CE1-CE1 4.05Å; F737-F747 HydrophobicContact CZ-CE1 4.13Å; F737-F747 HydrophobicContact CZ-CZ 4.38Å; F737-K779 HydrophobicContact CD2-CB 4.3Å; F737-K779 HydrophobicContact CE2-CB 3.82Å; F737-K779 HydrophobicContact CE2-CD 4.49Å; F737-L780 HydrophobicContact CD2-CD2 3.79Å; F737-L780 HydrophobicContact CE2-CD2 3.77Å; F737-L780 HydrophobicContact CE2-CG 4.25Å; F737-L780 HydrophobicContact CG-CD2 4.39Å; F737-L780 HydrophobicContact CZ-CD2 4.39Å; F737-A783 HydrophobicContact CB-CB 3.91Å; F737-A783 HydrophobicContact CD2-CB 4.34Å; F737-I871 HydrophobicContact CZ-CD1 4.05Å
738	Q	94.2	Very high	95.3	Very high	132 Å²	132	61.1 Å²	61.1	62%	0.617	34%	0.34	S	S	*	.			trans	-71.6	107.2	173.3	-173.4	60.6	53.8	0	0	111.3
739	W	97	Very high	95.4	Very high	22 Å²	22	58.1 Å²	58.1	8%	0.083	31%	0.312	C	S	.	.			trans	-78.5	154	167.8	-61.6	95.9	0	0	0	111.1	F735 F737 Q741 P745 F747 F836 I871	F735-W739 HydrophobicContact CE1-CZ2 4.29Å; F737-W739 AromaticContact CD1-CD2 3.74Å; F737-W739 HydrophobicContact CD1-CD2 3.74Å; F737-W739 AromaticContact CD1-CE2 3.59Å; F737-W739 HydrophobicContact CD1-CE3 4.28Å; F737-W739 HydrophobicContact CD1-CG 4.03Å; F737-W739 HydrophobicContact CD1-CZ2 4Å; F737-W739 AromaticContact CD1-NE1 3.79Å; F737-W739 AromaticContact CE1-CD2 3.83Å; F737-W739 HydrophobicContact CE1-CD2 3.83Å; F737-W739 AromaticContact CE1-CE3 3.9Å; F737-W739 HydrophobicContact CE1-CE3 3.9Å; F737-W739 HydrophobicContact CE1-CG 4.37Å; F737-W739 HydrophobicContact CE1-CH2 4.3Å; F737-W739 HydrophobicContact CE1-CZ2 4.25Å; F737-W739 HydrophobicContact CE1-CZ3 4.14Å; F737-W739 VanDerWaalsContact O-CD1 3.27Å; F737-W739 PolarHBondContact O-N 3.49Å; F737-W739 VanDerWaalsContact O-N 3.15Å; W739-Q741 VanDerWaalsContact C-N 3.28Å; W739-Q741 PolarHBondContact O-N 2.69Å; W739-P745 HydrophobicContact CD2-CB 4.06Å; W739-P745 VanDerWaalsContact CE3-C 3.47Å; W739-P745 HydrophobicContact CE3-CB 4.44Å; W739-P745 HydrophobicContact CH2-CB 4.24Å; W739-P745 WeakPolarHBondContact CH2-O 3Å; W739-P745 HydrophobicContact CZ2-CB 3.81Å; W739-P745 WeakPolarHBondContact CZ3-O 2.88Å; W739-F747 AromaticContact CE3-CD1 3.72Å; W739-F747 HydrophobicContact CE3-CD1 3.72Å; W739-F747 AromaticContact CE3-CE1 3.88Å; W739-F747 HydrophobicContact CE3-CE1 3.88Å; W739-F747 AromaticContact CZ3-CD1 3.78Å; W739-F747 HydrophobicContact CZ3-CD1 3.78Å; W739-F747 AromaticContact CZ3-CE1 3.8Å; W739-F747 HydrophobicContact CZ3-CE1 3.8Å; W739-F836 HydrophobicContact CZ2-CD1 4.46Å; W739-F836 HydrophobicContact CZ2-CE1 4.25Å; W739-I871 HydrophobicContact CH2-CD1 4.11Å; W739-I871 HydrophobicContact CH2-CG1 4.08Å; W739-I871 HydrophobicContact CZ3-CD1 4.05Å; W739-I871 HydrophobicContact CZ3-CG1 3.8Å
740	P	95.5	Very high	95.5	Very high	34 Å²	34	54.8 Å²	54.8	22%	0.221	30%	0.295	C	S	.	.	S	Bend	trans	-62.8	-33.6	175.4	-23.9	35.4	0	0	0	113.7	F747 V899 L906	P740-F747 HydrophobicContact CG-CB 3.96Å; P740-F747 HydrophobicContact CG-CD1 4.13Å; P740-F747 HydrophobicContact CG-CG 3.99Å; P740-V899 HydrophobicContact CB-CG1 3.89Å; P740-V899 HydrophobicContact CG-CG1 4.04Å; P740-V899 HydrophobicContact CG-CG2 4.13Å; P740-L906 HydrophobicContact CG-CD1 3.98Å
741	Q	96.4	Very high	95.4	Very high	47 Å²	47	53.3 Å²	53.3	22%	0.22	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-123.1	112.9	169.1	-62.1	-60.2	-30.8	0	0	107	W739 D743 K744 K896 V897	W739-Q741 VanDerWaalsContact C-N 3.28Å; W739-Q741 PolarHBondContact O-N 2.69Å; Q741-D743 PolarHBondContact O-N 2.92Å; Q741-D743 VanDerWaalsContact O-N 3.13Å; Q741-K744 HydrophobicContact CB-CB 4.16Å; Q741-K744 HydrophobicContact CB-CD 4.27Å; Q741-K744 HydrophobicContact CB-CG 4.49Å; Q741-K744 CarbonylContact O-C 3.53Å; Q741-K744 PolarHBondContact O-N 3.17Å; Q741-K744 VanDerWaalsContact O-O 3.1Å; Q741-K896 HydrophobicContact CG-CB 4.14Å; Q741-K896 VanDerWaalsContact CG-O 3.3Å; Q741-K896 WeakPolarHBondContact CG-O 3.2Å; Q741-K896 VanDerWaalsContact NE2-CB 3.29Å; Q741-K896 PolarHBondContact NE2-O 3.36Å; Q741-V897 HydrophobicContact CB-CG1 3.9Å; Q741-V897 HydrophobicContact CG-CG1 3.6Å
742	P	93.9	Very high	95	Very high	100 Å²	100	54.3 Å²	54.3	65%	0.649	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.9	-171.6	-27.5	35.7	0	0	0	115.3
743	D	95.1	Very high	94.6	Very high	99 Å²	99	52.6 Å²	52.6	53%	0.529	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.5	177.8	67.3	-45.6	0	0	0	113.7	H705 Q741	H705-D743 PolarHBondContact CE1-O 3.43Å; H705-D743 VanDerWaalsContact CE1-O 3.3Å; Q741-D743 PolarHBondContact O-N 2.92Å; Q741-D743 VanDerWaalsContact O-N 3.13Å
744	K	96.9	Very high	94.2	Very high	32 Å²	32	50.2 Å²	50.2	14%	0.139	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-126.2	98.6	-174.4	-61.6	169.6	-147.2	-176.9	0	109.4	A707 Q741 M746 Q895 V897	A707-K744 HydrophobicContact CB-CB 4.45Å; A707-K744 HydrophobicContact CB-CG 4.26Å; Q741-K744 HydrophobicContact CB-CB 4.16Å; Q741-K744 HydrophobicContact CB-CD 4.27Å; Q741-K744 HydrophobicContact CB-CG 4.49Å; Q741-K744 CarbonylContact O-C 3.53Å; Q741-K744 PolarHBondContact O-N 3.17Å; Q741-K744 VanDerWaalsContact O-O 3.1Å; K744-M746 HydrophobicContact CB-CG 4.49Å; K744-M746 PolarHBondContact O-N 2.69Å; K744-Q895 HydrophobicContact CD-CB 4.29Å; K744-Q895 PolarHBondContact NZ-O 2.83Å; K744-V897 HydrophobicContact CB-CG1 4.25Å; K744-V897 HydrophobicContact CD-CG1 4.35Å
745	P	97.7	Very high	93.9	Very high	13 Å²	13	48.8 Å²	48.8	8%	0.084	25%	0.249	C	C	.	.			trans	-77.5	52.6	179.8	33.6	-37	0	0	0	112.1	H705 W739 Y868 G869 V870	H705-P745 HydrophobicContact CB-CG 4.09Å; H705-P745 WeakPolarHBondContact ND1-CD 3.23Å; W739-P745 HydrophobicContact CD2-CB 4.06Å; W739-P745 VanDerWaalsContact CE3-C 3.47Å; W739-P745 HydrophobicContact CE3-CB 4.44Å; W739-P745 HydrophobicContact CH2-CB 4.24Å; W739-P745 WeakPolarHBondContact CH2-O 3Å; W739-P745 HydrophobicContact CZ2-CB 3.81Å; W739-P745 WeakPolarHBondContact CZ3-O 2.88Å; P745-Y868 WeakPolarHBondContact CB-O 3.5Å; P745-Y868 WeakPolarHBondContact CG-O 3.42Å; P745-G869 CarbonylContact O-C 3.58Å; P745-G869 WeakPolarHBondContact O-CA 3.32Å; P745-V870 PolarHBondContact O-N 3.31Å; P745-V870 VanDerWaalsContact O-N 3.08Å
746	M	98.3	Very high	93.4	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	149.7	174.9	61.8	-174.7	-177.6	0	0	111.7	A707 L708 K744 V870 Y891 Y892 V897	A707-M746 HydrophobicContact CB-CE 4.3Å; L708-M746 HydrophobicContact CD2-CB 3.69Å; L708-M746 HydrophobicContact CD2-CG 4.21Å; L708-M746 HydrophobicContact CD2-SD 4.05Å; K744-M746 HydrophobicContact CB-CG 4.49Å; K744-M746 PolarHBondContact O-N 2.69Å; M746-V870 WeakPolarHBondContact CA-O 3.47Å; M746-V870 WeakPolarHBondContact CB-O 3.25Å; M746-Y891 HydrophobicContact CE-CE1 3.89Å; M746-Y892 HydrophobicContact CB-CE1 4.23Å; M746-Y892 HydrophobicContact CG-CE1 4.24Å; M746-Y892 HydrophobicContact SD-CE1 4.41Å; M746-Y892 HydrophobicContact SD-CE2 4.38Å; M746-V897 HydrophobicContact CE-CG2 4.36Å; M746-V897 HydrophobicContact CG-CG2 4.38Å; M746-V897 WeakPolarHBondContact O-CB 3.44Å; M746-V897 WeakPolarHBondContact O-CG1 3.42Å
747	F	98.5	Very high	92.7	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	155.7	164.4	61.2	-81.2	0	0	0	112.7	F737 W739 P740 Y749 V870 I871 I872 V897 V899 L906	F737-F747 HydrophobicContact CE1-CE1 4.05Å; F737-F747 HydrophobicContact CZ-CE1 4.13Å; F737-F747 HydrophobicContact CZ-CZ 4.38Å; W739-F747 AromaticContact CE3-CD1 3.72Å; W739-F747 HydrophobicContact CE3-CD1 3.72Å; W739-F747 AromaticContact CE3-CE1 3.88Å; W739-F747 HydrophobicContact CE3-CE1 3.88Å; W739-F747 AromaticContact CZ3-CD1 3.78Å; W739-F747 HydrophobicContact CZ3-CD1 3.78Å; W739-F747 AromaticContact CZ3-CE1 3.8Å; W739-F747 HydrophobicContact CZ3-CE1 3.8Å; P740-F747 HydrophobicContact CG-CB 3.96Å; P740-F747 HydrophobicContact CG-CD1 4.13Å; P740-F747 HydrophobicContact CG-CG 3.99Å; F747-Y749 HydrophobicContact CE2-CD2 4.39Å; F747-Y749 HydrophobicContact CE2-CG 4.22Å; F747-V870 PolarHBondContact N-O 3.06Å; F747-I871 HydrophobicContact CD1-CG1 4.08Å; F747-I871 HydrophobicContact CD1-CG2 4.43Å; F747-I871 HydrophobicContact CD2-CG2 4.16Å; F747-I871 HydrophobicContact CE1-CB 4.39Å; F747-I871 HydrophobicContact CE1-CD1 3.6Å; F747-I871 HydrophobicContact CE1-CG1 3.59Å; F747-I871 HydrophobicContact CE1-CG2 3.97Å; F747-I871 HydrophobicContact CE2-CG2 3.69Å; F747-I871 HydrophobicContact CZ-CB 4.44Å; F747-I871 HydrophobicContact CZ-CD1 3.84Å; F747-I871 HydrophobicContact CZ-CG1 4.02Å; F747-I871 HydrophobicContact CZ-CG2 3.57Å; F747-I872 PolarHBondContact O-N 3.46Å; F747-V897 CarbonylContact C-O 3.48Å; F747-V897 VanDerWaalsContact CA-O 3.23Å; F747-V897 WeakPolarHBondContact CA-O 3.06Å; F747-V897 HydrophobicContact CB-CB 4.22Å; F747-V897 VanDerWaalsContact CB-O 3.28Å; F747-V897 WeakPolarHBondContact CB-O 3.47Å; F747-V899 HydrophobicContact CB-CG2 4.01Å; F747-V899 HydrophobicContact CD2-CG2 3.5Å; F747-V899 VanDerWaalsContact CD2-CG2 3.5Å; F747-V899 HydrophobicContact CE2-CG2 4.31Å; F747-V899 HydrophobicContact CG-CG2 4.09Å; F747-L906 HydrophobicContact CE2-CD1 4.16Å; F747-L906 HydrophobicContact CZ-CD1 4.38Å
748	F	98.6	Very high	91.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.1	167.8	-170.8	-67.4	0	0	0	107.5	V750 I872 G874 P876 L879 W885 L889 Y892 V897 L898 V899	F748-V750 HydrophobicContact CD1-CG2 4.23Å; F748-V750 HydrophobicContact CE1-CG2 4.48Å; F748-I872 CarbonylContact C-O 3.58Å; F748-I872 WeakPolarHBondContact CA-O 3.07Å; F748-I872 HydrophobicContact CD2-CB 3.75Å; F748-I872 HydrophobicContact CD2-CD1 4.35Å; F748-I872 HydrophobicContact CD2-CG2 3.57Å; F748-I872 HydrophobicContact CE2-CB 4.2Å; F748-I872 HydrophobicContact CE2-CG2 3.5Å; F748-I872 VanDerWaalsContact CE2-CG2 3.5Å; F748-I872 HydrophobicContact CG-CB 4.33Å; F748-I872 HydrophobicContact CG-CG2 4.49Å; F748-I872 HydrophobicContact CZ-CG2 4.35Å; F748-G874 WeakPolarHBondContact CE1-O 3.4Å; F748-P876 HydrophobicContact CD1-CG 4.43Å; F748-P876 HydrophobicContact CE1-CG 3.76Å; F748-P876 HydrophobicContact CZ-CG 4.36Å; F748-L879 HydrophobicContact CE2-CD1 3.99Å; F748-L879 HydrophobicContact CZ-CD1 3.72Å; F748-W885 HydrophobicContact CE2-CZ3 4.33Å; F748-L889 HydrophobicContact CD1-CD2 4.23Å; F748-L889 HydrophobicContact CD2-CD2 3.87Å; F748-L889 HydrophobicContact CE1-CD2 4.17Å; F748-L889 HydrophobicContact CE2-CD2 3.78Å; F748-L889 HydrophobicContact CG-CD2 4.12Å; F748-L889 HydrophobicContact CZ-CD2 3.96Å; F748-Y892 HydrophobicContact CB-CD1 3.63Å; F748-Y892 HydrophobicContact CB-CE1 4.26Å; F748-Y892 HydrophobicContact CB-CG 4.23Å; F748-V897 PolarHBondContact N-O 2.97Å; F748-L898 HydrophobicContact CB-CD1 3.82Å; F748-L898 HydrophobicContact CD1-CD1 3.53Å; F748-L898 HydrophobicContact CE1-CD1 4.44Å; F748-L898 HydrophobicContact CG-CD1 3.87Å; F748-V899 PolarHBondContact O-N 3.14Å
749	Y	98.3	Very high	90.4	Very high	14 Å²	14	37.2 Å²	37.2	6%	0.055	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	101.5	-177.5	-171	-136.7	0	0	0	110.4	F747 T751 N772 I776 I872 V873 G874 V899 G901 L903 L906	F747-Y749 HydrophobicContact CE2-CD2 4.39Å; F747-Y749 HydrophobicContact CE2-CG 4.22Å; Y749-T751 PolarHBondContact O-N 2.99Å; Y749-T751 VanDerWaalsContact O-N 3.13Å; Y749-T751 PolarHBondContact O-OG1 3.36Å; Y749-N772 HydrophobicContact CD1-CB 4.17Å; Y749-N772 HydrophobicContact CE1-CB 3.72Å; Y749-N772 VanDerWaalsContact CE1-CG 3.47Å; Y749-N772 WeakPolarHBondContact CE1-ND2 3.13Å; Y749-I776 HydrophobicContact CD1-CD1 4.01Å; Y749-I872 PolarHBondContact N-O 3.32Å; Y749-V873 HydrophobicContact CD1-CG1 4.3Å; Y749-V873 HydrophobicContact CD1-CG2 4.46Å; Y749-G874 PolarHBondContact O-N 2.73Å; Y749-V899 WeakPolarHBondContact CA-O 3.45Å; Y749-G901 VanDerWaalsContact CE2-O 3.24Å; Y749-G901 WeakPolarHBondContact CE2-O 3.5Å; Y749-G901 PolarHBondContact OH-O 2.83Å; Y749-G901 VanDerWaalsContact OH-O 3.06Å; Y749-L903 HydrophobicContact CD1-CD2 4.16Å; Y749-L903 HydrophobicContact CD2-CD2 4.29Å; Y749-L903 HydrophobicContact CE1-CD2 3.68Å; Y749-L903 HydrophobicContact CE1-CG 4.31Å; Y749-L903 HydrophobicContact CE2-CD2 3.85Å; Y749-L903 HydrophobicContact CG-CD2 4.45Å; Y749-L906 HydrophobicContact CD2-CD2 3.89Å; Y749-L906 HydrophobicContact CE2-CD2 3.53Å
750	V	97.3	Very high	88.6	Confident	14 Å²	14	37 Å²	37	9%	0.085	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	111.5	-176.7	177.2	0	0	0	0	110	F748 Q752 P876 L898 V899 E900 M911	F748-V750 HydrophobicContact CD1-CG2 4.23Å; F748-V750 HydrophobicContact CE1-CG2 4.48Å; V750-Q752 HydrophobicContact CG1-CG 4.43Å; V750-P876 HydrophobicContact CB-CG 4.36Å; V750-P876 HydrophobicContact CG1-CG 4.02Å; V750-P876 HydrophobicContact CG2-CG 3.79Å; V750-L898 HydrophobicContact CG2-CD1 3.61Å; V750-L898 HydrophobicContact CG2-CG 4.2Å; V750-V899 WeakPolarHBondContact CG2-O 3.48Å; V750-V899 PolarHBondContact N-O 2.8Å; V750-E900 HydrophobicContact CB-CB 4.15Å; V750-M911 HydrophobicContact CG1-SD 3.73Å
751	T	94	Very high	87	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.012	19%	0.189	C	C	.	.			trans	-120.6	114.8	178.8	-62.1	0	0	0	0	109.7	Y749 T768 E769 N772 V873 G874 N875	Y749-T751 PolarHBondContact O-N 2.99Å; Y749-T751 VanDerWaalsContact O-N 3.13Å; Y749-T751 PolarHBondContact O-OG1 3.36Å; T751-T768 HydrophobicContact CG2-CG2 3.68Å; T751-E769 HydrophobicContact CG2-CG 3.85Å; T751-N772 PolarHBondContact OG1-ND2 3.4Å; T751-V873 WeakPolarHBondContact OG1-CG1 3.41Å; T751-G874 PolarHBondContact N-O 3.05Å; T751-G874 CarbonylContact O-C 3.56Å; T751-N875 WeakPolarHBondContact O-CA 3.28Å; T751-N875 WeakPolarHBondContact O-CB 3.35Å
752	Q	86.9	Confident	85.6	Confident	122 Å²	122	36.5 Å²	36.5	57%	0.57	20%	0.198	S	C	*	.			trans	-101.1	72.9	177.2	-61.1	-174.9	26.8	0	0	109.6	V750	V750-Q752 HydrophobicContact CG1-CG 4.43Å
753	G	83.5	Confident	84.7	Confident	7 Å²	7	32.2 Å²	32.2	7%	0.072	17%	0.17	C	C	.	.			trans	-113.7	148	168.8	0	0	0	0	0	110.6	N766 T768 A844	G753-N766 PolarHBondContact O-ND2 3.35Å; G753-T768 WeakPolarHBondContact CA-OG1 3.22Å; G753-A844 WeakPolarHBondContact O-CB 3.08Å
754	Q	82.6	Confident	84.2	Confident	150 Å²	150	28.9 Å²	28.9	70%	0.701	15%	0.15	S	C	*	.			trans	-69.6	150.9	176.4	-70.9	171.8	-31.3	0	0	111.6	N766	Q754-N766 PolarHBondContact O-ND2 3.07Å
755	E	85.6	Confident	83.8	Confident	37 Å²	37	27.7 Å²	27.7	17%	0.173	15%	0.145	C	C	.	.			trans	-85.5	140.2	170.4	67.9	-173.4	-126	0	0	110	Y764 R843 A844 N845	E755-Y764 HydrophobicContact CG-CD1 4.39Å; E755-R843 IonicContact OE1-CZ 2.78Å; E755-R843 VanDerWaalsContact OE1-CZ 3.27Å; E755-R843 IonicContact OE1-NE 2.74Å; E755-R843 PolarHBondContact OE1-NE 3.43Å; E755-R843 IonicContact OE1-NH2 2.8Å; E755-R843 PolarHBondContact OE1-NH2 3.34Å; E755-R843 VanDerWaalsContact OE2-CA 3.25Å; E755-R843 WeakPolarHBondContact OE2-CA 3.41Å; E755-R843 IonicContact OE2-CZ 2.77Å; E755-R843 IonicContact OE2-NE 2.74Å; E755-R843 PolarHBondContact OE2-NE 3.3Å; E755-R843 IonicContact OE2-NH2 2.73Å; E755-A844 HydrophobicContact CB-CB 4.48Å; E755-A844 PolarHBondContact OE2-N 3.09Å; E755-N845 HydrophobicContact CG-CB 4.42Å; E755-N845 PolarHBondContact OE1-ND2 3.22Å; E755-N845 PolarHBondContact OE2-N 3.49Å
756	E	82.9	Confident	83.5	Confident	28 Å²	28	27.1 Å²	27.1	13%	0.131	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	150.5	174.8	-53.2	169.3	-90.1	0	0	109.7	R210 Y764 L765 R767	R210-E756 IonicContact CZ-OE1 2.1Å; R210-E756 IonicContact CZ-OE2 2.76Å; R210-E756 IonicContact NH1-OE1 3.99Å; R210-E756 PolarHBondContact NH1-OE1 3.42Å; R210-E756 VanDerWaalsContact NH1-OE1 3.09Å; R210-E756 IonicContact NH1-OE2 3.17Å; R210-E756 PolarHBondContact NH1-OE2 3.08Å; R210-E756 IonicContact NH2-OE1 3.11Å; R210-E756 PolarHBondContact NH2-OE1 2.97Å; R210-E756 IonicContact NH2-OE2 2.71Å; E756-Y764 CarbonylContact O-C 3.58Å; E756-Y764 VanDerWaalsContact O-CA 3.3Å; E756-Y764 WeakPolarHBondContact O-CA 3.33Å; E756-L765 HydrophobicContact CB-CD1 3.73Å; E756-L765 HydrophobicContact CB-CG 4.44Å; E756-L765 HydrophobicContact CG-CD1 4.19Å; E756-L765 PolarHBondContact N-O 3.05Å; E756-L765 PolarHBondContact O-N 2.91Å; E756-L765 WeakPolarHBondContact OE1-CD1 3.48Å; E756-R767 VanDerWaalsContact OE1-CG 3.28Å; E756-R767 WeakPolarHBondContact OE1-CG 3.42Å; E756-R767 IonicContact OE1-CZ 2.94Å; E756-R767 IonicContact OE1-NE 2.87Å; E756-R767 PolarHBondContact OE1-NE 3.33Å; E756-R767 IonicContact OE1-NH2 2.66Å; E756-R767 IonicContact OE2-CZ 2.8Å; E756-R767 IonicContact OE2-NE 3.88Å; E756-R767 PolarHBondContact OE2-NE 3.39Å; E756-R767 IonicContact OE2-NH2 2.59Å; E756-R767 PolarHBondContact OE2-NH2 3.14Å
757	I	79.1	Confident	83.1	Confident	25 Å²	25	30.4 Å²	30.4	13%	0.128	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.3	169.5	-57.1	174.2	0	0	0	108.3	F192 I233 R236 G761 Y764	F192-I757 HydrophobicContact CD1-CB 4.42Å; F192-I757 HydrophobicContact CD1-CG2 3.69Å; F192-I757 HydrophobicContact CE1-CG2 4.2Å; F192-I757 HydrophobicContact CG-CG2 4.43Å; I233-I757 HydrophobicContact CG2-CD1 4.05Å; R236-I757 HydrophobicContact CG-CD1 4.36Å; I757-G761 VanDerWaalsContact CG2-O 3.28Å; I757-G761 WeakPolarHBondContact CG2-O 3.5Å; I757-Y764 HydrophobicContact CG1-CE1 4.38Å
758	A	75.2	Confident	82.8	Confident	3 Å²	3	33.4 Å²	33.4	3%	0.025	17%	0.173	C	C	.	.			trans	-75.8	161.7	176.6	0	0	0	0	0	111.6	F192 S760 G761 S763 L765	F192-A758 WeakPolarHBondContact CB-O 3.48Å; A758-S760 WeakPolarHBondContact CB-OG 3.01Å; A758-S760 PolarHBondContact O-N 3.12Å; A758-G761 PolarHBondContact O-N 3.39Å; A758-S763 PolarHBondContact N-O 3.14Å; A758-L765 HydrophobicContact CB-CD2 4.4Å
759	S	64.6	Low	82.7	Confident	30 Å²	30	33.4 Å²	33.4	21%	0.21	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-12	179.6	57.5	0	0	0	0	115.3	N190	N190-S759 PolarHBondContact ND2-O 3.28Å
760	S	60.3	Low	82.5	Confident	18 Å²	18	32.8 Å²	32.8	13%	0.126	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-13.4	-179.7	32.7	0	0	0	0	114.1	K349 D351 A758 T762	K349-S760 WeakPolarHBondContact O-CB 3.01Å; D351-S760 VanDerWaalsContact CG-CB 3.48Å; D351-S760 VanDerWaalsContact N-CB 3.32Å; D351-S760 WeakPolarHBondContact OD2-CB 3.38Å; D351-S760 PolarHBondContact OD2-OG 3.32Å; A758-S760 WeakPolarHBondContact CB-OG 3.01Å; A758-S760 PolarHBondContact O-N 3.12Å; S760-T762 PolarHBondContact O-N 3.3Å
761	G	61.5	Low	82.3	Confident	5 Å²	5	32.9 Å²	32.9	5%	0.052	17%	0.172	C	C	.	.	S	Bend	trans	91.9	-37.4	171.2	0	0	0	0	0	116.6	V161 I757 A758	V161-G761 WeakPolarHBondContact CG2-O 3.45Å; I757-G761 VanDerWaalsContact CG2-O 3.28Å; I757-G761 WeakPolarHBondContact CG2-O 3.5Å; A758-G761 PolarHBondContact O-N 3.39Å
762	T	67.1	Low	82.4	Confident	64 Å²	64	33.6 Å²	33.6	39%	0.393	18%	0.176	S	C	.	.	S	Bend	trans	-101.6	-15.3	-173.7	39.4	0	0	0	0	115.2	V161 D351 S760	V161-T762 HydrophobicContact CG1-CG2 3.59Å; V161-T762 WeakPolarHBondContact O-CG2 3.33Å; D351-T762 WeakPolarHBondContact CB-OG1 3.38Å; D351-T762 PolarHBondContact O-OG1 3.42Å; S760-T762 PolarHBondContact O-N 3.3Å
763	S	76	Confident	82.9	Confident	10 Å²	10	27.8 Å²	27.8	7%	0.07	15%	0.149	C	C	.	.			trans	-111.7	176.9	177.5	-163	0	0	0	0	113.2	D351 A758 Y796 E797 G798	D351-S763 WeakPolarHBondContact OD1-CB 3.05Å; D351-S763 WeakPolarHBondContact OD2-CA 3.42Å; D351-S763 WeakPolarHBondContact OD2-CB 3.47Å; D351-S763 PolarHBondContact OD2-N 2.92Å; A758-S763 PolarHBondContact N-O 3.14Å; S763-Y796 WeakPolarHBondContact OG-CB 3.31Å; S763-Y796 WeakPolarHBondContact OG-CD1 3.4Å; S763-E797 PolarHBondContact OG-N 2.8Å; S763-G798 PolarHBondContact OG-N 2.89Å
764	Y	84.3	Confident	83.5	Confident	30 Å²	30	28 Å²	28	12%	0.118	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.1	-165.8	-63.1	-102.4	0	0	0	111.3	R236 E755 E756 I757 Y796 Q799	R236-Y764 PolarHBondContact NE-OH 3.31Å; R236-Y764 PolarHBondContact NH2-OH 2.87Å; E755-Y764 HydrophobicContact CG-CD1 4.39Å; E756-Y764 CarbonylContact O-C 3.58Å; E756-Y764 VanDerWaalsContact O-CA 3.3Å; E756-Y764 WeakPolarHBondContact O-CA 3.33Å; I757-Y764 HydrophobicContact CG1-CE1 4.38Å; Y764-Y796 AromaticContact CD2-CD1 3.78Å; Y764-Y796 HydrophobicContact CD2-CD1 3.78Å; Y764-Y796 AromaticContact CD2-CE1 3.49Å; Y764-Y796 HydrophobicContact CD2-CE1 3.49Å; Y764-Y796 VanDerWaalsContact CD2-CE1 3.49Å; Y764-Y796 HydrophobicContact CE2-CE1 4.36Å; Y764-Y796 HydrophobicContact CG-CD1 4.27Å; Y764-Y796 HydrophobicContact CG-CE1 4.14Å; Y764-Y796 VanDerWaalsContact O-CB 3.25Å; Y764-Y796 WeakPolarHBondContact O-CB 3.28Å; Y764-Q799 PolarHBondContact O-N 3.19Å; Y764-Q799 VanDerWaalsContact O-N 3.1Å
765	L	88.4	Confident	84.2	Confident	7 Å²	7	25.4 Å²	25.4	4%	0.037	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	170.1	171.9	58.9	74.1	0	0	0	110.6	E756 A758 Q799 Y802 V842	E756-L765 HydrophobicContact CB-CD1 3.73Å; E756-L765 HydrophobicContact CB-CG 4.44Å; E756-L765 HydrophobicContact CG-CD1 4.19Å; E756-L765 PolarHBondContact N-O 3.05Å; E756-L765 PolarHBondContact O-N 2.91Å; E756-L765 WeakPolarHBondContact OE1-CD1 3.48Å; A758-L765 HydrophobicContact CB-CD2 4.4Å; L765-Q799 HydrophobicContact CB-CB 4.3Å; L765-Y802 HydrophobicContact CD2-CG 4.2Å; L765-V842 VanDerWaalsContact C-CG1 3.48Å
766	N	91.4	Very high	84.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.126	C	C	.	.			trans	-148.2	111.4	177.1	-170.9	-44.8	0	0	0	109.8	G753 Q754 T768 E769 A770 Q799 V842	G753-N766 PolarHBondContact O-ND2 3.35Å; Q754-N766 PolarHBondContact O-ND2 3.07Å; N766-T768 PolarHBondContact O-N 3.37Å; N766-T768 PolarHBondContact OD1-N 3.34Å; N766-E769 HydrophobicContact CB-CB 4.09Å; N766-E769 HydrophobicContact CB-CG 4.09Å; N766-E769 PolarHBondContact O-N 3.22Å; N766-E769 PolarHBondContact OD1-N 2.84Å; N766-E769 VanDerWaalsContact OD1-N 3.17Å; N766-A770 WeakPolarHBondContact O-CB 3.36Å; N766-A770 PolarHBondContact O-N 3.36Å; N766-Q799 PolarHBondContact O-NE2 2.86Å; N766-Q799 VanDerWaalsContact O-NE2 3.13Å; N766-Q799 PolarHBondContact O-OE1 3.21Å; N766-V842 HydrophobicContact CB-CG1 4.14Å; N766-V842 PolarHBondContact ND2-O 3.01Å
767	R	89.9	Confident	85.5	Confident	71 Å²	71	22.4 Å²	22.4	27%	0.268	12%	0.12	S	C	.	.	H	α-helix	trans	-61.9	-42.4	-176.7	-63.6	179.5	-155.8	-148.4	-0.6	112.6	R210 E756 E769 A770 A771 Y802	R210-R767 VanDerWaalsContact NH2-CG 3.31Å; R210-R767 VanDerWaalsContact NH2-NE 3.13Å; E756-R767 VanDerWaalsContact OE1-CG 3.28Å; E756-R767 WeakPolarHBondContact OE1-CG 3.42Å; E756-R767 IonicContact OE1-CZ 2.94Å; E756-R767 IonicContact OE1-NE 2.87Å; E756-R767 PolarHBondContact OE1-NE 3.33Å; E756-R767 IonicContact OE1-NH2 2.66Å; E756-R767 IonicContact OE2-CZ 2.8Å; E756-R767 IonicContact OE2-NE 3.88Å; E756-R767 PolarHBondContact OE2-NE 3.39Å; E756-R767 IonicContact OE2-NH2 2.59Å; E756-R767 PolarHBondContact OE2-NH2 3.14Å; R767-E769 VanDerWaalsContact C-N 3.34Å; R767-A770 PolarHBondContact O-N 2.94Å; R767-A771 WeakPolarHBondContact O-CB 3.26Å; R767-A771 PolarHBondContact O-N 2.81Å; R767-Y802 HydrophobicContact CB-CE1 4.48Å; R767-Y802 HydrophobicContact CG-CE1 4.13Å
768	T	91.8	Very high	86.3	Confident	65 Å²	65	21.7 Å²	21.7	40%	0.399	12%	0.117	S	C	.	.	H	α-helix	trans	-68.7	-37.9	-175.8	-42.9	0	0	0	0	110.5	T751 G753 N766 N772	T751-T768 HydrophobicContact CG2-CG2 3.68Å; G753-T768 WeakPolarHBondContact CA-OG1 3.22Å; N766-T768 PolarHBondContact O-N 3.37Å; N766-T768 PolarHBondContact OD1-N 3.34Å; T768-N772 WeakPolarHBondContact O-CB 3.48Å; T768-N772 VanDerWaalsContact O-CG 3.24Å; T768-N772 PolarHBondContact O-N 3.46Å; T768-N772 VanDerWaalsContact O-N 3.16Å; T768-N772 PolarHBondContact O-ND2 3.22Å
769	E	95.4	Very high	87.3	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-47.5	168.9	-68.9	-167.3	-156.1	0	0	111.7	T751 N766 R767 A771 N772 V773 S840 C841 V842 V873 G874	T751-E769 HydrophobicContact CG2-CG 3.85Å; N766-E769 HydrophobicContact CB-CB 4.09Å; N766-E769 HydrophobicContact CB-CG 4.09Å; N766-E769 PolarHBondContact O-N 3.22Å; N766-E769 PolarHBondContact OD1-N 2.84Å; N766-E769 VanDerWaalsContact OD1-N 3.17Å; R767-E769 VanDerWaalsContact C-N 3.34Å; E769-A771 PolarHBondContact O-N 3.21Å; E769-N772 CarbonylContact O-C 3.6Å; E769-N772 WeakPolarHBondContact O-CA 3.39Å; E769-N772 WeakPolarHBondContact O-CB 3.17Å; E769-N772 PolarHBondContact O-N 2.98Å; E769-V773 VanDerWaalsContact O-CG2 3.28Å; E769-V773 WeakPolarHBondContact O-CG2 3.5Å; E769-V773 PolarHBondContact O-N 3.29Å; E769-S840 WeakPolarHBondContact OE2-CA 3.38Å; E769-S840 WeakPolarHBondContact OE2-CB 3.46Å; E769-S840 PolarHBondContact OE2-OG 3.11Å; E769-C841 PolarHBondContact OE2-N 3.27Å; E769-V842 VanDerWaalsContact OE1-CA 3.26Å; E769-V842 WeakPolarHBondContact OE1-CA 3.45Å; E769-V842 PolarHBondContact OE1-N 2.83Å; E769-V842 PolarHBondContact OE2-N 3.48Å; E769-V873 HydrophobicContact CB-CG1 4.1Å; E769-V873 HydrophobicContact CG-CG1 4.01Å; E769-G874 WeakPolarHBondContact OE1-CA 3.45Å
770	A	94.3	Very high	88.9	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.7	-43.7	-177.5	0	0	0	0	0	112.8	N766 R767 N772 V773 E774 Y802 L803	N766-A770 WeakPolarHBondContact O-CB 3.36Å; N766-A770 PolarHBondContact O-N 3.36Å; R767-A770 PolarHBondContact O-N 2.94Å; A770-N772 VanDerWaalsContact C-N 3.26Å; A770-N772 PolarHBondContact O-N 3.17Å; A770-V773 PolarHBondContact O-N 2.87Å; A770-E774 PolarHBondContact O-N 3.38Å; A770-Y802 HydrophobicContact CB-CD1 3.78Å; A770-Y802 HydrophobicContact CB-CE1 3.72Å; A770-L803 HydrophobicContact CB-CD2 3.79Å; A770-L803 HydrophobicContact CB-CG 4.39Å
771	A	93.6	Very high	90.6	Very high	16 Å²	16	23.2 Å²	23.2	13%	0.132	12%	0.118	C	C	.	.	H	α-helix	trans	-66.6	-25.4	174.2	0	0	0	0	0	113.2	R767 E769 K775 Y806	R767-A771 WeakPolarHBondContact O-CB 3.26Å; R767-A771 PolarHBondContact O-N 2.81Å; E769-A771 PolarHBondContact O-N 3.21Å; A771-K775 WeakPolarHBondContact O-CD 3.49Å; A771-K775 WeakPolarHBondContact O-CE 3.45Å; A771-K775 WeakPolarHBondContact O-CG 3.32Å; A771-Y806 HydrophobicContact CB-CE1 4.14Å
772	N	96.6	Very high	92.2	Very high	17 Å²	17	29.3 Å²	29.3	9%	0.091	14%	0.143	C	C	.	.	H	α-helix	trans	-80	-37.8	172.9	-80.5	-13.9	0	0	0	111.8	Y749 T751 T768 E769 A770 K775 I776 V873	Y749-N772 HydrophobicContact CD1-CB 4.17Å; Y749-N772 HydrophobicContact CE1-CB 3.72Å; Y749-N772 VanDerWaalsContact CE1-CG 3.47Å; Y749-N772 WeakPolarHBondContact CE1-ND2 3.13Å; T751-N772 PolarHBondContact OG1-ND2 3.4Å; T768-N772 WeakPolarHBondContact O-CB 3.48Å; T768-N772 VanDerWaalsContact O-CG 3.24Å; T768-N772 PolarHBondContact O-N 3.46Å; T768-N772 VanDerWaalsContact O-N 3.16Å; T768-N772 PolarHBondContact O-ND2 3.22Å; E769-N772 CarbonylContact O-C 3.6Å; E769-N772 WeakPolarHBondContact O-CA 3.39Å; E769-N772 WeakPolarHBondContact O-CB 3.17Å; E769-N772 PolarHBondContact O-N 2.98Å; A770-N772 VanDerWaalsContact C-N 3.26Å; A770-N772 PolarHBondContact O-N 3.17Å; N772-K775 PolarHBondContact O-N 3.18Å; N772-I776 WeakPolarHBondContact O-CD1 3.33Å; N772-I776 VanDerWaalsContact O-CG1 3.25Å; N772-I776 WeakPolarHBondContact O-CG1 2.92Å; N772-I776 PolarHBondContact O-N 2.89Å; N772-V873 HydrophobicContact CB-CG1 4.14Å
773	V	97.6	Very high	93.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65	-40.7	176.2	170.7	0	0	0	0	111.4	E769 A770 I776 T777 I792 L803 M807 I838 V873	E769-V773 VanDerWaalsContact O-CG2 3.28Å; E769-V773 WeakPolarHBondContact O-CG2 3.5Å; E769-V773 PolarHBondContact O-N 3.29Å; A770-V773 PolarHBondContact O-N 2.87Å; V773-I776 PolarHBondContact O-N 3.01Å; V773-T777 PolarHBondContact O-N 3.31Å; V773-T777 PolarHBondContact O-OG1 2.89Å; V773-I792 HydrophobicContact CG1-CD1 3.89Å; V773-I792 HydrophobicContact CG1-CG2 3.87Å; V773-L803 HydrophobicContact CB-CD2 3.91Å; V773-L803 HydrophobicContact CG1-CD2 3.73Å; V773-M807 HydrophobicContact CG1-CE 3.72Å; V773-I838 HydrophobicContact CG1-CD1 4.47Å; V773-I838 HydrophobicContact CG1-CG2 4.09Å; V773-I838 HydrophobicContact CG2-CG2 3.97Å; V773-V873 HydrophobicContact CG2-CB 4.2Å; V773-V873 HydrophobicContact CG2-CG1 4.41Å; V773-V873 HydrophobicContact CG2-CG2 3.92Å
774	E	96.3	Very high	94.4	Very high	12 Å²	12	28.5 Å²	28.5	6%	0.056	15%	0.148	C	C	.	.	H	α-helix	trans	-56.4	-51.7	170.1	-177.6	-76.3	147.1	0	0	111.2	A770 I776 T777 T778 Y806 M807 S812 Y818	A770-E774 PolarHBondContact O-N 3.38Å; E774-I776 VanDerWaalsContact C-N 3.27Å; E774-I776 PolarHBondContact O-N 2.9Å; E774-T777 WeakPolarHBondContact O-CB 3.2Å; E774-T777 PolarHBondContact O-N 3.47Å; E774-T777 VanDerWaalsContact O-N 3.11Å; E774-T778 WeakPolarHBondContact O-CB 3.3Å; E774-T778 PolarHBondContact O-N 3.43Å; E774-T778 PolarHBondContact O-OG1 3.4Å; E774-T778 PolarHBondContact OE1-OG1 3.05Å; E774-Y806 HydrophobicContact CB-CD1 4.13Å; E774-Y806 HydrophobicContact CB-CE1 3.91Å; E774-Y806 HydrophobicContact CG-CE1 4.31Å; E774-M807 HydrophobicContact CB-CE 4.38Å; E774-M807 HydrophobicContact CB-CG 4.28Å; E774-M807 HydrophobicContact CG-CG 4.3Å; E774-S812 PolarHBondContact OE1-N 3.34Å; E774-Y818 PolarHBondContact OE1-OH 3.01Å
775	K	96.1	Very high	95	Very high	96 Å²	96	27.3 Å²	27.3	42%	0.417	15%	0.145	S	C	.	.	H	α-helix	trans	-62.7	-34.6	-176.8	-65.1	164.5	-166	162.9	0	112.2	A771 N772 K779 L903	A771-K775 WeakPolarHBondContact O-CD 3.49Å; A771-K775 WeakPolarHBondContact O-CE 3.45Å; A771-K775 WeakPolarHBondContact O-CG 3.32Å; N772-K775 PolarHBondContact O-N 3.18Å; K775-K779 PolarHBondContact O-N 3.32Å; K775-L903 HydrophobicContact CB-CD1 3.56Å
776	I	97.8	Very high	95.3	Very high	1 Å²	1	33 Å²	33	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-51.4	173.1	-67.4	158.7	0	0	0	110.2	Y749 N772 V773 E774 T778 K779 L780 I838 I871 V873 L903	Y749-I776 HydrophobicContact CD1-CD1 4.01Å; N772-I776 WeakPolarHBondContact O-CD1 3.33Å; N772-I776 VanDerWaalsContact O-CG1 3.25Å; N772-I776 WeakPolarHBondContact O-CG1 2.92Å; N772-I776 PolarHBondContact O-N 2.89Å; V773-I776 PolarHBondContact O-N 3.01Å; E774-I776 VanDerWaalsContact C-N 3.27Å; E774-I776 PolarHBondContact O-N 2.9Å; I776-T778 VanDerWaalsContact C-N 3.31Å; I776-T778 PolarHBondContact O-N 3.14Å; I776-K779 PolarHBondContact O-N 2.79Å; I776-K779 VanDerWaalsContact O-N 3.09Å; I776-L780 HydrophobicContact CG2-CD1 4.18Å; I776-L780 HydrophobicContact CG2-CG 4.46Å; I776-L780 WeakPolarHBondContact O-CG 3.4Å; I776-L780 PolarHBondContact O-N 3.09Å; I776-I838 HydrophobicContact CB-CD1 4.14Å; I776-I838 HydrophobicContact CG2-CD1 3.59Å; I776-I838 HydrophobicContact CG2-CG1 3.97Å; I776-I871 HydrophobicContact CD1-CG2 3.82Å; I776-I871 HydrophobicContact CG1-CG2 4.5Å; I776-I871 HydrophobicContact CG2-CB 4.44Å; I776-I871 HydrophobicContact CG2-CD1 3.47Å; I776-I871 VanDerWaalsContact CG2-CD1 3.47Å; I776-I871 HydrophobicContact CG2-CG2 4.23Å; I776-V873 HydrophobicContact CD1-CG2 3.47Å; I776-V873 VanDerWaalsContact CD1-CG2 3.47Å; I776-L903 HydrophobicContact CG1-CD1 3.74Å; I776-L903 HydrophobicContact CG1-CD2 4Å
777	T	97.6	Very high	95.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-55.7	-46.4	176.6	-58.5	0	0	0	0	111.3	V773 E774 K779 L780 L781 I790 M807 Y818 V821 I838	V773-T777 PolarHBondContact O-N 3.31Å; V773-T777 PolarHBondContact O-OG1 2.89Å; E774-T777 WeakPolarHBondContact O-CB 3.2Å; E774-T777 PolarHBondContact O-N 3.47Å; E774-T777 VanDerWaalsContact O-N 3.11Å; T777-K779 PolarHBondContact O-N 2.72Å; T777-L780 PolarHBondContact O-N 2.85Å; T777-L781 HydrophobicContact CG2-CD1 4.06Å; T777-L781 HydrophobicContact CG2-CG 4.47Å; T777-L781 WeakPolarHBondContact O-CG 3.26Å; T777-L781 PolarHBondContact O-N 2.98Å; T777-I790 HydrophobicContact CG2-CD1 4.39Å; T777-M807 HydrophobicContact CG2-SD 4.48Å; T777-Y818 HydrophobicContact CG2-CD1 4.16Å; T777-Y818 HydrophobicContact CG2-CE1 4.29Å; T777-V821 HydrophobicContact CG2-CG1 4.17Å; T777-V821 HydrophobicContact CG2-CG2 4Å; T777-I838 WeakPolarHBondContact OG1-CD1 3.4Å
778	T	96.6	Very high	95.6	Very high	10 Å²	10	34.5 Å²	34.5	6%	0.061	18%	0.183	C	C	.	.	H	α-helix	trans	-57.7	-43.8	173.9	-82.1	0	0	0	0	112.6	E774 I776 K782 S812 Y818	E774-T778 WeakPolarHBondContact O-CB 3.3Å; E774-T778 PolarHBondContact O-N 3.43Å; E774-T778 PolarHBondContact O-OG1 3.4Å; E774-T778 PolarHBondContact OE1-OG1 3.05Å; I776-T778 VanDerWaalsContact C-N 3.31Å; I776-T778 PolarHBondContact O-N 3.14Å; T778-K782 HydrophobicContact CG2-CD 3.89Å; T778-K782 VanDerWaalsContact O-CB 3.32Å; T778-K782 WeakPolarHBondContact O-CB 3.38Å; T778-K782 VanDerWaalsContact O-CG 3.3Å; T778-K782 WeakPolarHBondContact O-CG 3.42Å; T778-K782 PolarHBondContact O-N 2.9Å; T778-S812 WeakPolarHBondContact CG2-OG 3.36Å; T778-S812 PolarHBondContact OG1-OG 2.83Å; T778-Y818 PolarHBondContact OG1-OH 2.57Å
779	K	96.5	Very high	95.8	Very high	61 Å²	61	33.1 Å²	33.1	27%	0.265	17%	0.172	S	C	.	.	H	α-helix	trans	-65.3	-40.4	174.3	-84.2	-166.4	73.6	-168	0	112.2	F737 K775 I776 T777 K782 A783 L903	F737-K779 HydrophobicContact CD2-CB 4.3Å; F737-K779 HydrophobicContact CE2-CB 3.82Å; F737-K779 HydrophobicContact CE2-CD 4.49Å; K775-K779 PolarHBondContact O-N 3.32Å; I776-K779 PolarHBondContact O-N 2.79Å; I776-K779 VanDerWaalsContact O-N 3.09Å; T777-K779 PolarHBondContact O-N 2.72Å; K779-K782 PolarHBondContact O-N 2.84Å; K779-A783 WeakPolarHBondContact O-CB 3.42Å; K779-A783 PolarHBondContact O-N 3.11Å; K779-L903 HydrophobicContact CD-CB 3.79Å; K779-L903 HydrophobicContact CD-CD1 4.26Å; K779-L903 PolarHBondContact NZ-O 2.73Å
780	L	97.1	Very high	95.9	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-63.7	-46.3	178.1	-68.1	172.3	0	0	0	111.3	F735 F737 I776 T777 A783 G784 A785 I790 F836 I838 I871	F735-L780 HydrophobicContact CE2-CD2 4.23Å; F735-L780 HydrophobicContact CZ-CD2 3.74Å; F737-L780 HydrophobicContact CD2-CD2 3.79Å; F737-L780 HydrophobicContact CE2-CD2 3.77Å; F737-L780 HydrophobicContact CE2-CG 4.25Å; F737-L780 HydrophobicContact CG-CD2 4.39Å; F737-L780 HydrophobicContact CZ-CD2 4.39Å; I776-L780 HydrophobicContact CG2-CD1 4.18Å; I776-L780 HydrophobicContact CG2-CG 4.46Å; I776-L780 WeakPolarHBondContact O-CG 3.4Å; I776-L780 PolarHBondContact O-N 3.09Å; T777-L780 PolarHBondContact O-N 2.85Å; L780-A783 PolarHBondContact O-N 3.17Å; L780-G784 PolarHBondContact O-N 3.23Å; L780-A785 HydrophobicContact CB-CB 4.25Å; L780-A785 VanDerWaalsContact O-CB 3.26Å; L780-A785 WeakPolarHBondContact O-CB 3.5Å; L780-A785 PolarHBondContact O-N 3.44Å; L780-I790 HydrophobicContact CB-CD1 3.83Å; L780-I790 HydrophobicContact CD1-CD1 4.28Å; L780-I790 HydrophobicContact CD1-CG1 4.48Å; L780-I790 HydrophobicContact CD1-CG2 4.48Å; L780-F836 HydrophobicContact CD1-CB 4.12Å; L780-F836 HydrophobicContact CD2-CD1 4.33Å; L780-F836 HydrophobicContact CD2-CG 4.29Å; L780-I838 HydrophobicContact CD1-CD1 4.11Å; L780-I838 HydrophobicContact CD1-CG1 4.3Å; L780-I871 HydrophobicContact CD2-CD1 4.48Å
781	L	96.1	Very high	95.9	Very high	21 Å²	21	33.1 Å²	33.1	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-62.2	-46.5	176.2	-68.1	172	0	0	0	111.5	T777 A783 G784 A785 P787 I790 L813 L817 Y818	T777-L781 HydrophobicContact CG2-CD1 4.06Å; T777-L781 HydrophobicContact CG2-CG 4.47Å; T777-L781 WeakPolarHBondContact O-CG 3.26Å; T777-L781 PolarHBondContact O-N 2.98Å; L781-A783 PolarHBondContact O-N 3.06Å; L781-G784 PolarHBondContact O-N 2.73Å; L781-A785 WeakPolarHBondContact CD2-O 2.99Å; L781-P787 HydrophobicContact CD2-CG 3.92Å; L781-I790 HydrophobicContact CD2-CD1 3.84Å; L781-I790 HydrophobicContact CG-CD1 4Å; L781-L813 HydrophobicContact CB-CD1 3.8Å; L781-L813 HydrophobicContact CD1-CD1 3.84Å; L781-L813 HydrophobicContact CG-CD1 4.5Å; L781-L817 HydrophobicContact CD1-CB 4.38Å; L781-Y818 HydrophobicContact CD1-CD1 4.5Å; L781-Y818 HydrophobicContact CD1-CE1 4.26Å
782	K	95.7	Very high	96.1	Very high	133 Å²	133	32.4 Å²	32.4	58%	0.578	17%	0.166	S	C	*	.	H	α-helix	trans	-65.4	-25.4	176.4	-73.3	173.7	-178.5	169	0	113.3	T778 K779 G784 S812 L813	T778-K782 HydrophobicContact CG2-CD 3.89Å; T778-K782 VanDerWaalsContact O-CB 3.32Å; T778-K782 WeakPolarHBondContact O-CB 3.38Å; T778-K782 VanDerWaalsContact O-CG 3.3Å; T778-K782 WeakPolarHBondContact O-CG 3.42Å; T778-K782 PolarHBondContact O-N 2.9Å; K779-K782 PolarHBondContact O-N 2.84Å; K782-G784 VanDerWaalsContact C-N 3.29Å; K782-S812 PolarHBondContact NZ-OG 3.04Å; K782-L813 HydrophobicContact CG-CD1 4.43Å; K782-L813 HydrophobicContact CG-CD2 4.46Å
783	A	95.4	Very high	96	Very high	12 Å²	12	31.6 Å²	31.6	10%	0.099	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	2.2	172.9	0	0	0	0	0	113.8	F735 D736 F737 K779 L780 L781	F735-A783 VanDerWaalsContact CA-O 3.28Å; F735-A783 WeakPolarHBondContact CA-O 3.39Å; F735-A783 HydrophobicContact CD2-CB 4.06Å; F735-A783 WeakPolarHBondContact CD2-O 3.42Å; F735-A783 HydrophobicContact CE2-CB 3.85Å; D736-A783 PolarHBondContact N-O 2.86Å; F737-A783 HydrophobicContact CB-CB 3.91Å; F737-A783 HydrophobicContact CD2-CB 4.34Å; K779-A783 WeakPolarHBondContact O-CB 3.42Å; K779-A783 PolarHBondContact O-N 3.11Å; L780-A783 PolarHBondContact O-N 3.17Å; L781-A783 PolarHBondContact O-N 3.06Å
784	G	94.4	Very high	95.7	Very high	45 Å²	45	31.6 Å²	31.6	46%	0.464	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.3	6.2	175.8	0	0	0	0	0	115.9	L780 L781 K782	L780-G784 PolarHBondContact O-N 3.23Å; L781-G784 PolarHBondContact O-N 2.73Å; K782-G784 VanDerWaalsContact C-N 3.29Å
785	A	95.8	Very high	95.1	Very high	6 Å²	6	32 Å²	32	5%	0.05	17%	0.165	C	C	.	.			trans	-69.2	145.7	166.2	0	0	0	0	0	110.5	F735 L780 L781 I790 F836	F735-A785 HydrophobicContact CD2-CB 4.44Å; F735-A785 HydrophobicContact CE2-CB 4Å; L780-A785 HydrophobicContact CB-CB 4.25Å; L780-A785 VanDerWaalsContact O-CB 3.26Å; L780-A785 WeakPolarHBondContact O-CB 3.5Å; L780-A785 PolarHBondContact O-N 3.44Å; L781-A785 WeakPolarHBondContact CD2-O 2.99Å; A785-I790 HydrophobicContact CB-CD1 4.23Å; A785-I790 HydrophobicContact CB-CG1 4.35Å; A785-F836 HydrophobicContact CB-CD2 3.9Å; A785-F836 HydrophobicContact CB-CE2 3.74Å
786	K	96	Very high	94.5	Very high	127 Å²	127	28.1 Å²	28.1	55%	0.552	15%	0.148	S	C	*	.			trans	-90.3	156	172.3	-64.3	-169.7	178.3	-171.6	0	111.6	D788 Q789	K786-D788 WeakPolarHBondContact CB-OD1 3.25Å; K786-D788 PolarHBondContact O-N 3.24Å; K786-Q789 HydrophobicContact CB-CB 4.5Å; K786-Q789 HydrophobicContact CB-CG 4.32Å; K786-Q789 WeakPolarHBondContact O-CB 3.46Å; K786-Q789 PolarHBondContact O-N 3.09Å
787	P	94	Very high	93.6	Very high	13 Å²	13	31.8 Å²	31.8	8%	0.084	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-55.4	-45.9	176.8	-30.3	38.2	0	0	0	114.9	L781 Q789 I790 L817 E820 V821	L781-P787 HydrophobicContact CD2-CG 3.92Å; P787-Q789 PolarHBondContact O-N 3.46Å; P787-Q789 VanDerWaalsContact O-N 3.13Å; P787-I790 PolarHBondContact O-N 3.03Å; P787-L817 WeakPolarHBondContact CB-O 3.2Å; P787-L817 HydrophobicContact CG-CB 4.25Å; P787-L817 HydrophobicContact CG-CD2 3.83Å; P787-L817 WeakPolarHBondContact CG-O 3.22Å; P787-E820 HydrophobicContact CB-CB 3.33Å; P787-E820 HydrophobicContact CG-CB 4.14Å; P787-V821 HydrophobicContact CB-CG2 3.91Å
788	D	92.9	Very high	92.9	Very high	89 Å²	89	32.1 Å²	32.1	48%	0.476	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-58	-28.4	179.4	69.2	-51.6	0	0	0	113.1	K786 K834	K786-D788 WeakPolarHBondContact CB-OD1 3.25Å; K786-D788 PolarHBondContact O-N 3.24Å; D788-K834 VanDerWaalsContact O-CD 3.28Å; D788-K834 WeakPolarHBondContact O-CD 3.32Å; D788-K834 PolarHBondContact O-NZ 3.06Å
789	Q	95.6	Very high	92.5	Very high	36 Å²	36	31.7 Å²	31.7	17%	0.168	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-84.2	-10.6	-178.1	-72.2	164.7	22.1	0	0	113.7	K786 P787 D835 F836	K786-Q789 HydrophobicContact CB-CB 4.5Å; K786-Q789 HydrophobicContact CB-CG 4.32Å; K786-Q789 WeakPolarHBondContact O-CB 3.46Å; K786-Q789 PolarHBondContact O-N 3.09Å; P787-Q789 PolarHBondContact O-N 3.46Å; P787-Q789 VanDerWaalsContact O-N 3.13Å; Q789-D835 HydrophobicContact CB-CB 4.04Å; Q789-D835 PolarHBondContact O-N 2.99Å; Q789-F836 PolarHBondContact O-N 2.96Å
790	I	97.3	Very high	92	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142.8	176.7	-55.7	171.2	0	0	0	109.3	T777 L780 L781 A785 P787 V821 K834 I838	T777-I790 HydrophobicContact CG2-CD1 4.39Å; L780-I790 HydrophobicContact CB-CD1 3.83Å; L780-I790 HydrophobicContact CD1-CD1 4.28Å; L780-I790 HydrophobicContact CD1-CG1 4.48Å; L780-I790 HydrophobicContact CD1-CG2 4.48Å; L781-I790 HydrophobicContact CD2-CD1 3.84Å; L781-I790 HydrophobicContact CG-CD1 4Å; A785-I790 HydrophobicContact CB-CD1 4.23Å; A785-I790 HydrophobicContact CB-CG1 4.35Å; P787-I790 PolarHBondContact O-N 3.03Å; I790-V821 HydrophobicContact CB-CG1 4.04Å; I790-V821 HydrophobicContact CB-CG2 4.26Å; I790-V821 HydrophobicContact CD1-CG2 4.34Å; I790-V821 HydrophobicContact CG2-CG1 3.72Å; I790-K834 WeakPolarHBondContact O-CD 3.15Å; I790-K834 WeakPolarHBondContact O-CE 3.36Å; I790-K834 PolarHBondContact O-NZ 2.93Å; I790-I838 HydrophobicContact CG2-CD1 4.48Å
791	G	95.9	Very high	91.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.2	165.7	0	0	0	0	0	111.3	E822 F836 I837 I838	G791-E822 CarbonylContact C-O 3.54Å; G791-E822 WeakPolarHBondContact CA-O 3.14Å; G791-F836 PolarHBondContact N-O 3.46Å; G791-I837 WeakPolarHBondContact O-CA 3.38Å; G791-I838 PolarHBondContact O-N 2.84Å
792	I	96.7	Very high	90.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	110.6	178.3	-54	-178.5	0	0	0	107.8	V773 L803 M807 V821 E822 I823 A824 I838	V773-I792 HydrophobicContact CG1-CD1 3.89Å; V773-I792 HydrophobicContact CG1-CG2 3.87Å; I792-L803 HydrophobicContact CG2-CD1 3.99Å; I792-M807 HydrophobicContact CD1-CE 3.43Å; I792-M807 VanDerWaalsContact CD1-CE 3.43Å; I792-M807 HydrophobicContact CD1-SD 4.18Å; I792-V821 HydrophobicContact CD1-CG1 3.72Å; I792-V821 HydrophobicContact CG1-CG1 3.86Å; I792-E822 PolarHBondContact N-O 3.34Å; I792-I823 HydrophobicContact CB-CB 4.4Å; I792-I823 HydrophobicContact CB-CG1 4.19Å; I792-I823 HydrophobicContact CB-CG2 4.08Å; I792-I823 HydrophobicContact CD1-CD1 4.04Å; I792-I823 HydrophobicContact CD1-CG1 4.14Å; I792-I823 HydrophobicContact CG1-CG1 4.49Å; I792-I823 HydrophobicContact CG2-CG2 4.11Å; I792-I823 WeakPolarHBondContact O-CA 3.47Å; I792-A824 PolarHBondContact O-N 3.42Å; I792-I838 CarbonylContact C-O 3.57Å; I792-I838 WeakPolarHBondContact CA-O 3.33Å; I792-I838 HydrophobicContact CD1-CD1 4.45Å; I792-I838 HydrophobicContact CG1-CB 4.4Å; I792-I838 HydrophobicContact CG1-CD1 4.26Å
793	I	94.1	Very high	90.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.1	175.1	-53.6	-177.2	0	0	0	107.4	A824 V826 F829 I837 I838 L839 S840 A862 R865	I793-A824 WeakPolarHBondContact CA-O 3.39Å; I793-V826 HydrophobicContact CG2-CB 3.94Å; I793-F829 HydrophobicContact CD1-CB 4.4Å; I793-F829 HydrophobicContact CD1-CD2 4.33Å; I793-F829 HydrophobicContact CD1-CG 4.34Å; I793-F829 HydrophobicContact CG1-CD2 3.69Å; I793-F829 HydrophobicContact CG1-CE2 3.91Å; I793-F829 HydrophobicContact CG1-CG 4.15Å; I793-I837 HydrophobicContact CD1-CD1 4.26Å; I793-I837 HydrophobicContact CD1-CG2 3.75Å; I793-I837 HydrophobicContact CG1-CD1 4.4Å; I793-I837 HydrophobicContact CG1-CG2 4Å; I793-I838 PolarHBondContact N-O 3.28Å; I793-L839 HydrophobicContact CB-CD1 4.03Å; I793-L839 HydrophobicContact CG2-CD1 3.89Å; I793-L839 WeakPolarHBondContact O-CA 3.4Å; I793-S840 PolarHBondContact O-N 3.15Å; I793-A862 HydrophobicContact CD1-CB 4.32Å; I793-R865 HydrophobicContact CD1-CB 4.24Å; I793-R865 HydrophobicContact CD1-CG 3.79Å
794	T	91.8	Very high	89.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.			trans	-134.1	131.4	159.3	-169.5	0	0	0	0	109.4	Q799 R800 L803 A824 S825 S840	T794-Q799 HydrophobicContact CG2-CB 3.92Å; T794-Q799 HydrophobicContact CG2-CG 3.89Å; T794-Q799 WeakPolarHBondContact OG1-CG 3.3Å; T794-R800 HydrophobicContact CG2-CB 3.87Å; T794-L803 HydrophobicContact CG2-CD1 3.86Å; T794-A824 PolarHBondContact N-O 2.59Å; T794-A824 VanDerWaalsContact N-O 3.1Å; T794-S825 WeakPolarHBondContact O-CA 3.48Å; T794-S840 PolarHBondContact OG1-O 3.4Å
795	P	84.6	Confident	89.3	Confident	21 Å²	21	24.5 Å²	24.5	14%	0.136	12%	0.121	C	C	.	.	S	Bend	trans	-102.5	7.2	-168.9	6	19.4	0	0	0	112.7	V826 F852	P795-V826 HydrophobicContact CB-CG1 4.13Å; P795-F852 VanDerWaalsContact C-CE1 3.47Å; P795-F852 HydrophobicContact CB-CD2 3.9Å; P795-F852 HydrophobicContact CB-CE1 4.02Å; P795-F852 HydrophobicContact CB-CE2 3.31Å; P795-F852 HydrophobicContact CB-CZ 3.38Å; P795-F852 HydrophobicContact CG-CD2 4.3Å; P795-F852 HydrophobicContact CG-CE2 3.38Å; P795-F852 HydrophobicContact CG-CZ 3.61Å; P795-F852 WeakPolarHBondContact O-CE1 3.29Å
796	Y	83.7	Confident	88.8	Confident	15 Å²	15	26.8 Å²	26.8	6%	0.059	13%	0.129	C	C	.	.	S	Bend	trans	-97.1	121.9	160.4	-70.2	-78.7	0	0	0	109.9	S763 Y764 G798 Q799 R800 V842 R843 I850 F852	S763-Y796 WeakPolarHBondContact OG-CB 3.31Å; S763-Y796 WeakPolarHBondContact OG-CD1 3.4Å; Y764-Y796 AromaticContact CD2-CD1 3.78Å; Y764-Y796 HydrophobicContact CD2-CD1 3.78Å; Y764-Y796 AromaticContact CD2-CE1 3.49Å; Y764-Y796 HydrophobicContact CD2-CE1 3.49Å; Y764-Y796 VanDerWaalsContact CD2-CE1 3.49Å; Y764-Y796 HydrophobicContact CE2-CE1 4.36Å; Y764-Y796 HydrophobicContact CG-CD1 4.27Å; Y764-Y796 HydrophobicContact CG-CE1 4.14Å; Y764-Y796 VanDerWaalsContact O-CB 3.25Å; Y764-Y796 WeakPolarHBondContact O-CB 3.28Å; Y796-G798 VanDerWaalsContact C-N 3.29Å; Y796-G798 PolarHBondContact O-N 3.34Å; Y796-Q799 PolarHBondContact O-N 3.48Å; Y796-Q799 VanDerWaalsContact O-N 3.13Å; Y796-R800 PolarHBondContact O-N 2.82Å; Y796-V842 HydrophobicContact CD2-CB 3.65Å; Y796-V842 HydrophobicContact CD2-CG1 4Å; Y796-V842 HydrophobicContact CD2-CG2 3.8Å; Y796-V842 HydrophobicContact CE2-CB 4.13Å; Y796-V842 HydrophobicContact CG-CG1 4.48Å; Y796-R843 HydrophobicContact CE2-CG 3.58Å; Y796-R843 VanDerWaalsContact CZ-CD 3.47Å; Y796-R843 VanDerWaalsContact OH-CD 3.31Å; Y796-R843 WeakPolarHBondContact OH-CD 3.49Å; Y796-R843 WeakPolarHBondContact OH-CG 3.16Å; Y796-R843 PolarHBondContact OH-NH1 3.23Å; Y796-I850 PolarHBondContact OH-O 2.91Å; Y796-F852 AromaticContact CD1-CE1 3.68Å; Y796-F852 HydrophobicContact CD1-CE1 3.68Å; Y796-F852 HydrophobicContact CD1-CZ 4.47Å; Y796-F852 AromaticContact CD2-CE1 3.51Å; Y796-F852 HydrophobicContact CD2-CE1 3.51Å; Y796-F852 AromaticContact CD2-CZ 3.45Å; Y796-F852 HydrophobicContact CD2-CZ 3.45Å; Y796-F852 VanDerWaalsContact CD2-CZ 3.45Å; Y796-F852 HydrophobicContact CE1-CD1 4.12Å; Y796-F852 AromaticContact CE1-CE1 3.46Å; Y796-F852 HydrophobicContact CE1-CE1 3.46Å; Y796-F852 VanDerWaalsContact CE1-CE1 3.46Å; Y796-F852 HydrophobicContact CE1-CZ 4.29Å; Y796-F852 HydrophobicContact CE2-CD1 4.4Å; Y796-F852 AromaticContact CE2-CE1 3.27Å; Y796-F852 HydrophobicContact CE2-CE1 3.27Å; Y796-F852 HydrophobicContact CE2-CE2 4.38Å; Y796-F852 AromaticContact CE2-CZ 3.2Å; Y796-F852 HydrophobicContact CE2-CZ 3.2Å; Y796-F852 AromaticContact CG-CE1 3.69Å; Y796-F852 HydrophobicContact CG-CE1 3.69Å; Y796-F852 HydrophobicContact CG-CZ 4.08Å; Y796-F852 AromaticContact CZ-CE1 3.22Å; Y796-F852 AromaticContact CZ-CZ 3.65Å
797	E	78.7	Confident	88.4	Confident	77 Å²	77	20.9 Å²	20.9	36%	0.36	10%	0.103	S	C	.	.	H	α-helix	trans	-61.8	-34.4	179.8	179.7	54.9	-152.7	0	0	112.9	S763 Q799 R800 S801	S763-E797 PolarHBondContact OG-N 2.8Å; E797-Q799 VanDerWaalsContact C-N 3.33Å; E797-Q799 PolarHBondContact O-N 2.96Å; E797-R800 WeakPolarHBondContact O-CB 3.41Å; E797-R800 PolarHBondContact O-N 3.12Å; E797-R800 VanDerWaalsContact O-N 3.08Å; E797-R800 IonicContact OE1-CZ 2.74Å; E797-R800 IonicContact OE1-NE 3.21Å; E797-R800 PolarHBondContact OE1-NE 3.28Å; E797-R800 IonicContact OE1-NH2 2.72Å; E797-R800 PolarHBondContact OE1-NH2 3.46Å; E797-R800 WeakPolarHBondContact OE2-CD 3.49Å; E797-R800 IonicContact OE2-CZ 2.73Å; E797-R800 IonicContact OE2-NE 3.69Å; E797-R800 PolarHBondContact OE2-NE 3.42Å; E797-S801 PolarHBondContact O-N 3.16Å
798	G	81.4	Confident	87.9	Confident	8 Å²	8	22.8 Å²	22.8	8%	0.082	11%	0.111	C	C	.	.	H	α-helix	trans	-55.8	-44.6	171.7	0	0	0	0	0	113	S763 Y796 Y802	S763-G798 PolarHBondContact OG-N 2.89Å; Y796-G798 VanDerWaalsContact C-N 3.29Å; Y796-G798 PolarHBondContact O-N 3.34Å; G798-Y802 VanDerWaalsContact O-CB 3.23Å; G798-Y802 WeakPolarHBondContact O-CB 3.35Å; G798-Y802 PolarHBondContact O-N 2.85Å
799	Q	88.2	Confident	87.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-69	-36.8	173.8	-172.7	76	-27.9	0	0	111.9	Y764 L765 N766 T794 Y796 E797 Y802 L803 S840 V842	Y764-Q799 PolarHBondContact O-N 3.19Å; Y764-Q799 VanDerWaalsContact O-N 3.1Å; L765-Q799 HydrophobicContact CB-CB 4.3Å; N766-Q799 PolarHBondContact O-NE2 2.86Å; N766-Q799 VanDerWaalsContact O-NE2 3.13Å; N766-Q799 PolarHBondContact O-OE1 3.21Å; T794-Q799 HydrophobicContact CG2-CB 3.92Å; T794-Q799 HydrophobicContact CG2-CG 3.89Å; T794-Q799 WeakPolarHBondContact OG1-CG 3.3Å; Y796-Q799 PolarHBondContact O-N 3.48Å; Y796-Q799 VanDerWaalsContact O-N 3.13Å; E797-Q799 VanDerWaalsContact C-N 3.33Å; E797-Q799 PolarHBondContact O-N 2.96Å; Q799-Y802 PolarHBondContact O-N 2.78Å; Q799-L803 HydrophobicContact CG-CD1 3.96Å; Q799-L803 HydrophobicContact CG-CG 4.27Å; Q799-L803 VanDerWaalsContact O-CB 3.3Å; Q799-L803 WeakPolarHBondContact O-CB 3.35Å; Q799-L803 VanDerWaalsContact O-CG 3.25Å; Q799-L803 WeakPolarHBondContact O-CG 3.47Å; Q799-L803 PolarHBondContact O-N 3.06Å; Q799-S840 PolarHBondContact NE2-OG 2.94Å; Q799-V842 HydrophobicContact CB-CG2 3.62Å; Q799-V842 HydrophobicContact CG-CG2 3.54Å
800	R	86.8	Confident	86.6	Confident	21 Å²	21	27.3 Å²	27.3	8%	0.079	13%	0.134	C	C	.	.	H	α-helix	trans	-59.7	-53.1	177.3	-169.3	-156.4	66.4	82.7	2.7	110.7	T794 Y796 E797 L803 V804 I823	T794-R800 HydrophobicContact CG2-CB 3.87Å; Y796-R800 PolarHBondContact O-N 2.82Å; E797-R800 WeakPolarHBondContact O-CB 3.41Å; E797-R800 PolarHBondContact O-N 3.12Å; E797-R800 VanDerWaalsContact O-N 3.08Å; E797-R800 IonicContact OE1-CZ 2.74Å; E797-R800 IonicContact OE1-NE 3.21Å; E797-R800 PolarHBondContact OE1-NE 3.28Å; E797-R800 IonicContact OE1-NH2 2.72Å; E797-R800 PolarHBondContact OE1-NH2 3.46Å; E797-R800 WeakPolarHBondContact OE2-CD 3.49Å; E797-R800 IonicContact OE2-CZ 2.73Å; E797-R800 IonicContact OE2-NE 3.69Å; E797-R800 PolarHBondContact OE2-NE 3.42Å; R800-L803 PolarHBondContact O-N 3.04Å; R800-V804 WeakPolarHBondContact O-CG2 3.39Å; R800-V804 PolarHBondContact O-N 3.07Å; R800-V804 VanDerWaalsContact O-N 3.14Å; R800-I823 WeakPolarHBondContact CD-O 3.44Å; R800-I823 HydrophobicContact CG-CB 4.42Å; R800-I823 HydrophobicContact CG-CG2 3.88Å; R800-I823 WeakPolarHBondContact CG-O 3.34Å
801	S	81.3	Confident	85.8	Confident	10 Å²	10	28.3 Å²	28.3	7%	0.07	14%	0.144	C	C	.	.	H	α-helix	trans	-67.1	-37.5	-179.7	-166.1	0	0	0	0	111.8	K349 E797 Q805	K349-S801 WeakPolarHBondContact CE-OG 3.25Å; K349-S801 PolarHBondContact NZ-OG 3.17Å; E797-S801 PolarHBondContact O-N 3.16Å; S801-Q805 WeakPolarHBondContact O-CB 3.45Å; S801-Q805 PolarHBondContact O-N 2.95Å; S801-Q805 VanDerWaalsContact O-N 3.12Å
802	Y	84.9	Confident	85.3	Confident	30 Å²	30	31.6 Å²	31.6	12%	0.118	17%	0.167	C	C	.	.	H	α-helix	trans	-65.9	-37.5	174.6	-173.9	-110.4	0	0	0	112.8	L765 R767 A770 G798 Q799 Y806	L765-Y802 HydrophobicContact CD2-CG 4.2Å; R767-Y802 HydrophobicContact CB-CE1 4.48Å; R767-Y802 HydrophobicContact CG-CE1 4.13Å; A770-Y802 HydrophobicContact CB-CD1 3.78Å; A770-Y802 HydrophobicContact CB-CE1 3.72Å; G798-Y802 VanDerWaalsContact O-CB 3.23Å; G798-Y802 WeakPolarHBondContact O-CB 3.35Å; G798-Y802 PolarHBondContact O-N 2.85Å; Q799-Y802 PolarHBondContact O-N 2.78Å; Y802-Y806 WeakPolarHBondContact O-CB 3.25Å; Y802-Y806 PolarHBondContact O-N 2.68Å
803	L	89.5	Confident	84.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64	-47.2	175.2	-81.4	167	0	0	0	112.4	A770 V773 I792 T794 Q799 R800 Q805 Y806 M807 I823	A770-L803 HydrophobicContact CB-CD2 3.79Å; A770-L803 HydrophobicContact CB-CG 4.39Å; V773-L803 HydrophobicContact CB-CD2 3.91Å; V773-L803 HydrophobicContact CG1-CD2 3.73Å; I792-L803 HydrophobicContact CG2-CD1 3.99Å; T794-L803 HydrophobicContact CG2-CD1 3.86Å; Q799-L803 HydrophobicContact CG-CD1 3.96Å; Q799-L803 HydrophobicContact CG-CG 4.27Å; Q799-L803 VanDerWaalsContact O-CB 3.3Å; Q799-L803 WeakPolarHBondContact O-CB 3.35Å; Q799-L803 VanDerWaalsContact O-CG 3.25Å; Q799-L803 WeakPolarHBondContact O-CG 3.47Å; Q799-L803 PolarHBondContact O-N 3.06Å; R800-L803 PolarHBondContact O-N 3.04Å; L803-Q805 VanDerWaalsContact C-N 3.34Å; L803-Q805 PolarHBondContact O-N 2.81Å; L803-Y806 PolarHBondContact O-N 3.27Å; L803-M807 HydrophobicContact CD2-CE 4.12Å; L803-M807 WeakPolarHBondContact O-CG 3.41Å; L803-M807 PolarHBondContact O-N 3.4Å; L803-I823 HydrophobicContact CB-CD1 3.99Å; L803-I823 HydrophobicContact CB-CG2 4.18Å; L803-I823 HydrophobicContact CD1-CG2 4.05Å
804	V	84.3	Confident	84.5	Confident	10 Å²	10	39.9 Å²	39.9	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-57.1	-50.4	176.9	172.7	0	0	0	0	109.9	R800 Q808 I823	R800-V804 WeakPolarHBondContact O-CG2 3.39Å; R800-V804 PolarHBondContact O-N 3.07Å; R800-V804 VanDerWaalsContact O-N 3.14Å; V804-Q808 VanDerWaalsContact O-CG 3.29Å; V804-Q808 WeakPolarHBondContact O-CG 3.46Å; V804-Q808 PolarHBondContact O-N 3.02Å; V804-Q808 VanDerWaalsContact O-N 3.16Å; V804-I823 HydrophobicContact CG2-CB 4.2Å; V804-I823 HydrophobicContact CG2-CD1 3.96Å; V804-I823 HydrophobicContact CG2-CG1 4.34Å
805	Q	81.1	Confident	84.2	Confident	51 Å²	51	42.6 Å²	42.6	24%	0.238	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-46.4	178.3	-172.9	172.3	-1.8	0	0	112.1	S801 L803 M807 Q808 F809	S801-Q805 WeakPolarHBondContact O-CB 3.45Å; S801-Q805 PolarHBondContact O-N 2.95Å; S801-Q805 VanDerWaalsContact O-N 3.12Å; L803-Q805 VanDerWaalsContact C-N 3.34Å; L803-Q805 PolarHBondContact O-N 2.81Å; Q805-M807 PolarHBondContact O-N 3.43Å; Q805-Q808 PolarHBondContact O-N 2.88Å; Q805-F809 HydrophobicContact CG-CD2 3.79Å; Q805-F809 HydrophobicContact CG-CE2 3.92Å; Q805-F809 VanDerWaalsContact O-CD2 3.3Å; Q805-F809 WeakPolarHBondContact O-CD2 3.5Å; Q805-F809 PolarHBondContact O-N 2.77Å; Q805-F809 VanDerWaalsContact O-N 3.14Å
806	Y	86.6	Confident	84.3	Confident	55 Å²	55	47.8 Å²	47.8	22%	0.216	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-43.1	-177.9	-174.4	-95.4	0	0	0	112.5	A771 E774 Y802 L803 Q808 F809 S810	A771-Y806 HydrophobicContact CB-CE1 4.14Å; E774-Y806 HydrophobicContact CB-CD1 4.13Å; E774-Y806 HydrophobicContact CB-CE1 3.91Å; E774-Y806 HydrophobicContact CG-CE1 4.31Å; Y802-Y806 WeakPolarHBondContact O-CB 3.25Å; Y802-Y806 PolarHBondContact O-N 2.68Å; L803-Y806 PolarHBondContact O-N 3.27Å; Y806-Q808 VanDerWaalsContact C-N 3.34Å; Y806-Q808 PolarHBondContact O-N 2.88Å; Y806-F809 PolarHBondContact O-N 2.86Å; Y806-S810 WeakPolarHBondContact O-CA 3.45Å; Y806-S810 WeakPolarHBondContact O-CB 3.49Å; Y806-S810 PolarHBondContact O-N 3.49Å
807	M	87.7	Confident	84.6	Confident	3 Å²	3	50 Å²	50	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-32.7	177.3	-66.5	-165.1	-170	0	0	112.8	V773 E774 T777 I792 L803 Q805 G811 Y818 I823	V773-M807 HydrophobicContact CG1-CE 3.72Å; E774-M807 HydrophobicContact CB-CE 4.38Å; E774-M807 HydrophobicContact CB-CG 4.28Å; E774-M807 HydrophobicContact CG-CG 4.3Å; T777-M807 HydrophobicContact CG2-SD 4.48Å; I792-M807 HydrophobicContact CD1-CE 3.43Å; I792-M807 VanDerWaalsContact CD1-CE 3.43Å; I792-M807 HydrophobicContact CD1-SD 4.18Å; L803-M807 HydrophobicContact CD2-CE 4.12Å; L803-M807 WeakPolarHBondContact O-CG 3.41Å; L803-M807 PolarHBondContact O-N 3.4Å; Q805-M807 PolarHBondContact O-N 3.43Å; M807-G811 WeakPolarHBondContact O-CA 3.25Å; M807-G811 PolarHBondContact O-N 3.38Å; M807-G811 VanDerWaalsContact O-N 3.12Å; M807-Y818 HydrophobicContact CB-CD1 4.07Å; M807-Y818 HydrophobicContact CB-CD2 4.49Å; M807-Y818 HydrophobicContact CB-CG 3.9Å; M807-Y818 HydrophobicContact CG-CD1 4.31Å; M807-Y818 HydrophobicContact SD-CD1 3.76Å; M807-Y818 HydrophobicContact SD-CG 4.4Å; M807-I823 HydrophobicContact CE-CD1 4.45Å; M807-I823 HydrophobicContact SD-CD1 4.27Å
808	Q	82.5	Confident	85.2	Confident	52 Å²	52	46.5 Å²	46.5	24%	0.243	24%	0.24	C	C	.	.	H	α-helix	trans	-68	-39.5	176.6	-73.6	177.4	0	0	0	113	N386 V804 Q805 Y806 T815	N386-Q808 PolarHBondContact O-NE2 2.98Å; V804-Q808 VanDerWaalsContact O-CG 3.29Å; V804-Q808 WeakPolarHBondContact O-CG 3.46Å; V804-Q808 PolarHBondContact O-N 3.02Å; V804-Q808 VanDerWaalsContact O-N 3.16Å; Q805-Q808 PolarHBondContact O-N 2.88Å; Y806-Q808 VanDerWaalsContact C-N 3.34Å; Y806-Q808 PolarHBondContact O-N 2.88Å; Q808-T815 HydrophobicContact CB-CG2 4.14Å; Q808-T815 HydrophobicContact CG-CG2 4.01Å
809	F	79.3	Confident	85.3	Confident	154 Å²	154	47.9 Å²	47.9	68%	0.675	25%	0.245	S	C	*	.	H	α-helix	trans	-96.6	-20.4	-176.2	-72.1	-69.4	0	0	0	115.4	Q805 Y806	Q805-F809 HydrophobicContact CG-CD2 3.79Å; Q805-F809 HydrophobicContact CG-CE2 3.92Å; Q805-F809 VanDerWaalsContact O-CD2 3.3Å; Q805-F809 WeakPolarHBondContact O-CD2 3.5Å; Q805-F809 PolarHBondContact O-N 2.77Å; Q805-F809 VanDerWaalsContact O-N 3.14Å; Y806-F809 PolarHBondContact O-N 2.86Å
810	S	81.8	Confident	85.3	Confident	66 Å²	66	52.2 Å²	52.2	46%	0.462	27%	0.265	S	S	.	.	H	α-helix	trans	-129.9	1.2	-174.5	-57.6	0	0	0	0	114.4	Y806	Y806-S810 WeakPolarHBondContact O-CA 3.45Å; Y806-S810 WeakPolarHBondContact O-CB 3.49Å; Y806-S810 PolarHBondContact O-N 3.49Å
811	G	82.2	Confident	85.5	Confident	21 Å²	21	51.2 Å²	51.2	22%	0.216	26%	0.261	C	S	.	.			trans	-67.6	135.8	177	0	0	0	0	0	112.8	M807 L813	M807-G811 WeakPolarHBondContact O-CA 3.25Å; M807-G811 PolarHBondContact O-N 3.38Å; M807-G811 VanDerWaalsContact O-N 3.12Å; G811-L813 PolarHBondContact O-N 3.04Å; G811-L813 VanDerWaalsContact O-N 3.14Å
812	S	83.5	Confident	85.8	Confident	69 Å²	69	52.7 Å²	52.7	48%	0.483	27%	0.267	S	S	.	.	S	Bend	trans	-79.5	12.4	-176	72.1	0	0	0	0	116	E774 T778 K782 Y818	E774-S812 PolarHBondContact OE1-N 3.34Å; T778-S812 WeakPolarHBondContact CG2-OG 3.36Å; T778-S812 PolarHBondContact OG1-OG 2.83Å; K782-S812 PolarHBondContact NZ-OG 3.04Å; S812-Y818 PolarHBondContact N-OH 2.82Å
813	L	88.4	Confident	86	Confident	48 Å²	48	51.6 Å²	51.6	25%	0.251	26%	0.263	S	S	.	.	S	Bend	trans	-134.6	171	-176.6	-66.7	174	0	0	0	109	L781 K782 G811 T815 L817 Y818	L781-L813 HydrophobicContact CB-CD1 3.8Å; L781-L813 HydrophobicContact CD1-CD1 3.84Å; L781-L813 HydrophobicContact CG-CD1 4.5Å; K782-L813 HydrophobicContact CG-CD1 4.43Å; K782-L813 HydrophobicContact CG-CD2 4.46Å; G811-L813 PolarHBondContact O-N 3.04Å; G811-L813 VanDerWaalsContact O-N 3.14Å; L813-T815 PolarHBondContact O-N 3.36Å; L813-L817 HydrophobicContact CB-CD1 4.27Å; L813-Y818 HydrophobicContact CB-CE2 3.89Å; L813-Y818 WeakPolarHBondContact CB-OH 3.1Å; L813-Y818 PolarHBondContact N-OH 3.1Å; L813-Y818 VanDerWaalsContact N-OH 3.09Å; L813-Y818 WeakPolarHBondContact O-CE2 3.33Å
814	H	85.8	Confident	85.7	Confident	127 Å²	127	52.3 Å²	52.3	59%	0.588	27%	0.269	S	S	*	.			trans	-61.7	125.3	-179.3	-177.9	-91.5	0	0	0	112.3	K816 L817	H814-K816 VanDerWaalsContact C-N 3.29Å; H814-K816 PolarHBondContact O-N 2.93Å; H814-L817 WeakPolarHBondContact O-CB 3.47Å; H814-L817 PolarHBondContact O-N 3.17Å
815	T	85.8	Confident	85.7	Confident	57 Å²	57	52.6 Å²	52.6	35%	0.35	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-41	-168.2	-52.8	0	0	0	0	115.2	Q808 L813 L817 Y818 Q819	Q808-T815 HydrophobicContact CB-CG2 4.14Å; Q808-T815 HydrophobicContact CG-CG2 4.01Å; L813-T815 PolarHBondContact O-N 3.36Å; T815-L817 PolarHBondContact O-N 2.74Å; T815-L817 VanDerWaalsContact O-N 3.16Å; T815-Y818 PolarHBondContact O-N 3.16Å; T815-Q819 HydrophobicContact CG2-CG 4.4Å; T815-Q819 PolarHBondContact O-N 3.47Å
816	K	86.8	Confident	85.7	Confident	129 Å²	129	50.3 Å²	50.3	56%	0.561	26%	0.261	S	S	*	.	H	α-helix	trans	-54.9	-34	178.6	-68	-175.3	-175.7	179.9	0	113.4	H814 Y818 Q819 E820	H814-K816 VanDerWaalsContact C-N 3.29Å; H814-K816 PolarHBondContact O-N 2.93Å; K816-Y818 VanDerWaalsContact C-N 3.28Å; K816-Y818 PolarHBondContact O-N 3.04Å; K816-Q819 PolarHBondContact O-N 3.05Å; K816-Q819 VanDerWaalsContact O-N 3.13Å; K816-E820 PolarHBondContact O-N 3.07Å; K816-E820 VanDerWaalsContact O-N 3.09Å
817	L	90.8	Very high	85.3	Confident	61 Å²	61	48.8 Å²	48.8	32%	0.319	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-33.8	178.4	-63.7	173.2	0	0	0	112.1	L781 P787 L813 H814 T815 V821	L781-L817 HydrophobicContact CD1-CB 4.38Å; P787-L817 WeakPolarHBondContact CB-O 3.2Å; P787-L817 HydrophobicContact CG-CB 4.25Å; P787-L817 HydrophobicContact CG-CD2 3.83Å; P787-L817 WeakPolarHBondContact CG-O 3.22Å; L813-L817 HydrophobicContact CB-CD1 4.27Å; H814-L817 WeakPolarHBondContact O-CB 3.47Å; H814-L817 PolarHBondContact O-N 3.17Å; T815-L817 PolarHBondContact O-N 2.74Å; T815-L817 VanDerWaalsContact O-N 3.16Å; L817-V821 WeakPolarHBondContact O-CG2 3.5Å
818	Y	89.6	Confident	84.7	Confident	5 Å²	5	50.5 Å²	50.5	2%	0.02	27%	0.271	C	S	.	.	H	α-helix	trans	-79.8	-29.6	174.4	-56.4	-72.9	0	0	0	112.3	E774 T777 T778 L781 M807 S812 L813 T815 K816 E820 V821	E774-Y818 PolarHBondContact OE1-OH 3.01Å; T777-Y818 HydrophobicContact CG2-CD1 4.16Å; T777-Y818 HydrophobicContact CG2-CE1 4.29Å; T778-Y818 PolarHBondContact OG1-OH 2.57Å; L781-Y818 HydrophobicContact CD1-CD1 4.5Å; L781-Y818 HydrophobicContact CD1-CE1 4.26Å; M807-Y818 HydrophobicContact CB-CD1 4.07Å; M807-Y818 HydrophobicContact CB-CD2 4.49Å; M807-Y818 HydrophobicContact CB-CG 3.9Å; M807-Y818 HydrophobicContact CG-CD1 4.31Å; M807-Y818 HydrophobicContact SD-CD1 3.76Å; M807-Y818 HydrophobicContact SD-CG 4.4Å; S812-Y818 PolarHBondContact N-OH 2.82Å; L813-Y818 HydrophobicContact CB-CE2 3.89Å; L813-Y818 WeakPolarHBondContact CB-OH 3.1Å; L813-Y818 PolarHBondContact N-OH 3.1Å; L813-Y818 VanDerWaalsContact N-OH 3.09Å; L813-Y818 WeakPolarHBondContact O-CE2 3.33Å; T815-Y818 PolarHBondContact O-N 3.16Å; K816-Y818 VanDerWaalsContact C-N 3.28Å; K816-Y818 PolarHBondContact O-N 3.04Å; Y818-E820 VanDerWaalsContact C-N 3.27Å; Y818-E820 PolarHBondContact O-N 3.14Å; Y818-V821 PolarHBondContact O-N 3.06Å; Y818-V821 VanDerWaalsContact O-N 3.16Å
819	Q	83.9	Confident	84.4	Confident	37 Å²	37	48 Å²	48	17%	0.173	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-34.3	175.1	-62.1	179.8	-52.2	0	0	111.6	N386 Y387 T815 K816	N386-Q819 WeakPolarHBondContact CB-O 3Å; N386-Q819 PolarHBondContact ND2-O 3.22Å; Y387-Q819 HydrophobicContact CD1-CB 3.7Å; Y387-Q819 HydrophobicContact CD1-CG 4.3Å; Y387-Q819 HydrophobicContact CE1-CB 3.61Å; Y387-Q819 HydrophobicContact CG-CB 4.46Å; T815-Q819 HydrophobicContact CG2-CG 4.4Å; T815-Q819 PolarHBondContact O-N 3.47Å; K816-Q819 PolarHBondContact O-N 3.05Å; K816-Q819 VanDerWaalsContact O-N 3.13Å
820	E	89.1	Confident	84.2	Confident	91 Å²	91	41.6 Å²	41.6	43%	0.425	23%	0.231	S	C	.	.	S	Bend	trans	-76.7	-16.5	174.5	-68.3	169.1	-148	0	0	113.9	P787 K816 Y818 E822	P787-E820 HydrophobicContact CB-CB 3.33Å; P787-E820 HydrophobicContact CG-CB 4.14Å; K816-E820 PolarHBondContact O-N 3.07Å; K816-E820 VanDerWaalsContact O-N 3.09Å; Y818-E820 VanDerWaalsContact C-N 3.27Å; Y818-E820 PolarHBondContact O-N 3.14Å; E820-E822 PolarHBondContact O-N 3.16Å
821	V	90.7	Very high	83.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-79.7	108.8	175.8	171.8	0	0	0	0	110.2	N386 T777 P787 I790 I792 L817 Y818 I823	N386-V821 VanDerWaalsContact ND2-C 3.32Å; N386-V821 PolarHBondContact ND2-O 3.16Å; T777-V821 HydrophobicContact CG2-CG1 4.17Å; T777-V821 HydrophobicContact CG2-CG2 4Å; P787-V821 HydrophobicContact CB-CG2 3.91Å; I790-V821 HydrophobicContact CB-CG1 4.04Å; I790-V821 HydrophobicContact CB-CG2 4.26Å; I790-V821 HydrophobicContact CD1-CG2 4.34Å; I790-V821 HydrophobicContact CG2-CG1 3.72Å; I792-V821 HydrophobicContact CD1-CG1 3.72Å; I792-V821 HydrophobicContact CG1-CG1 3.86Å; L817-V821 WeakPolarHBondContact O-CG2 3.5Å; Y818-V821 PolarHBondContact O-N 3.06Å; Y818-V821 VanDerWaalsContact O-N 3.16Å; V821-I823 WeakPolarHBondContact O-CG1 3.28Å; V821-I823 PolarHBondContact O-N 3.04Å
822	E	88.4	Confident	83.6	Confident	40 Å²	40	41 Å²	41	19%	0.187	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	121.7	-172	-170.8	-178.8	172.4	0	0	114	N386 G791 I792 E820 F829 R832 K834	N386-E822 WeakPolarHBondContact ND2-CA 3.49Å; G791-E822 CarbonylContact C-O 3.54Å; G791-E822 WeakPolarHBondContact CA-O 3.14Å; I792-E822 PolarHBondContact N-O 3.34Å; E820-E822 PolarHBondContact O-N 3.16Å; E822-F829 HydrophobicContact CB-CZ 4.22Å; E822-F829 HydrophobicContact CG-CE1 4.31Å; E822-F829 HydrophobicContact CG-CZ 3.82Å; E822-R832 IonicContact OE1-CZ 2.64Å; E822-R832 IonicContact OE1-NH1 3.14Å; E822-R832 PolarHBondContact OE1-NH1 3.39Å; E822-R832 IonicContact OE1-NH2 3.2Å; E822-R832 PolarHBondContact OE1-NH2 2.85Å; E822-R832 IonicContact OE2-NH1 3.09Å; E822-R832 PolarHBondContact OE2-NH1 3.38Å; E822-K834 WeakPolarHBondContact OE2-CE 3.49Å; E822-K834 IonicContact OE2-NZ 3.67Å; E822-K834 PolarHBondContact OE2-NZ 2.74Å
823	I	88.3	Confident	83.9	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.041	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	113.1	177.7	-41.6	-167	0	0	0	110.5	N386 I792 R800 L803 V804 M807 V821	N386-I823 PolarHBondContact OD1-N 2.87Å; I792-I823 HydrophobicContact CB-CB 4.4Å; I792-I823 HydrophobicContact CB-CG1 4.19Å; I792-I823 HydrophobicContact CB-CG2 4.08Å; I792-I823 HydrophobicContact CD1-CD1 4.04Å; I792-I823 HydrophobicContact CD1-CG1 4.14Å; I792-I823 HydrophobicContact CG1-CG1 4.49Å; I792-I823 HydrophobicContact CG2-CG2 4.11Å; I792-I823 WeakPolarHBondContact O-CA 3.47Å; R800-I823 WeakPolarHBondContact CD-O 3.44Å; R800-I823 HydrophobicContact CG-CB 4.42Å; R800-I823 HydrophobicContact CG-CG2 3.88Å; R800-I823 WeakPolarHBondContact CG-O 3.34Å; L803-I823 HydrophobicContact CB-CD1 3.99Å; L803-I823 HydrophobicContact CB-CG2 4.18Å; L803-I823 HydrophobicContact CD1-CG2 4.05Å; V804-I823 HydrophobicContact CG2-CB 4.2Å; V804-I823 HydrophobicContact CG2-CD1 3.96Å; V804-I823 HydrophobicContact CG2-CG1 4.34Å; M807-I823 HydrophobicContact CE-CD1 4.45Å; M807-I823 HydrophobicContact SD-CD1 4.27Å; V821-I823 WeakPolarHBondContact O-CG1 3.28Å; V821-I823 PolarHBondContact O-N 3.04Å
824	A	84.3	Confident	84.2	Confident	14 Å²	14	40.8 Å²	40.8	12%	0.116	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	172.8	-176.5	0	0	0	0	0	114.2	I792 I793 T794 A828 F829	I792-A824 PolarHBondContact O-N 3.42Å; I793-A824 WeakPolarHBondContact CA-O 3.39Å; T794-A824 PolarHBondContact N-O 2.59Å; T794-A824 VanDerWaalsContact N-O 3.1Å; A824-A828 HydrophobicContact CB-CB 4Å; A824-F829 HydrophobicContact CB-CD2 4.03Å; A824-F829 HydrophobicContact CB-CE2 3.68Å
825	S	83.3	Confident	84.8	Confident	17 Å²	17	35.1 Å²	35.1	12%	0.119	18%	0.182	C	C	.	.			trans	-75.6	158.1	174.6	67.6	0	0	0	0	112.7	T794 D827 A828 F829	T794-S825 WeakPolarHBondContact O-CA 3.48Å; S825-D827 PolarHBondContact O-N 2.9Å; S825-A828 WeakPolarHBondContact O-CB 3.37Å; S825-A828 PolarHBondContact O-N 2.96Å; S825-A828 VanDerWaalsContact O-N 3.09Å; S825-F829 PolarHBondContact O-N 2.76Å
826	V	81.9	Confident	85.3	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.018	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-35.3	-178.6	64	0	0	0	0	113.4	I793 P795 F829 Q830 R858 V861 A862	I793-V826 HydrophobicContact CG2-CB 3.94Å; P795-V826 HydrophobicContact CB-CG1 4.13Å; V826-F829 PolarHBondContact O-N 2.71Å; V826-Q830 PolarHBondContact O-N 3.47Å; V826-R858 HydrophobicContact CG1-CB 4.22Å; V826-R858 HydrophobicContact CG1-CG 4.13Å; V826-R858 WeakPolarHBondContact CG2-O 3.16Å; V826-V861 HydrophobicContact CG2-CB 3.96Å; V826-V861 HydrophobicContact CG2-CG1 3.73Å; V826-A862 HydrophobicContact CG2-CB 3.89Å
827	D	77.9	Confident	85.9	Confident	22 Å²	22	26.5 Å²	26.5	12%	0.118	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-42.8	179.1	-54.4	-11.8	0	0	0	111.2	R355 L666 S825 F829 Q830 R858	R355-D827 IonicContact CZ-OD2 3.32Å; R355-D827 VanDerWaalsContact NH1-CB 3.3Å; R355-D827 IonicContact NH1-OD2 2.72Å; R355-D827 PolarHBondContact NH1-OD2 3.43Å; R355-D827 IonicContact NH2-OD2 2.79Å; R355-D827 PolarHBondContact NH2-OD2 3.28Å; L666-D827 HydrophobicContact CD1-CB 4.22Å; L666-D827 VanDerWaalsContact CD1-OD1 3.28Å; L666-D827 WeakPolarHBondContact CD1-OD1 3.44Å; S825-D827 PolarHBondContact O-N 2.9Å; D827-F829 PolarHBondContact O-N 3.25Å; D827-Q830 WeakPolarHBondContact O-CB 3.38Å; D827-Q830 PolarHBondContact O-N 3.38Å; D827-Q830 VanDerWaalsContact O-N 3.16Å; D827-R858 VanDerWaalsContact CG-NH1 3.25Å; D827-R858 IonicContact OD1-CZ 2.77Å; D827-R858 IonicContact OD1-NH1 2.65Å; D827-R858 PolarHBondContact OD1-NH1 3.2Å; D827-R858 IonicContact OD1-NH2 3.06Å; D827-R858 PolarHBondContact OD1-NH2 3.21Å; D827-R858 IonicContact OD2-CZ 2.84Å; D827-R858 IonicContact OD2-NH1 2.67Å; D827-R858 PolarHBondContact OD2-NH1 3.41Å; D827-R858 IonicContact OD2-NH2 2.66Å; D827-R858 PolarHBondContact OD2-NH2 2.83Å; D827-R858 VanDerWaalsContact OD2-NH2 3.09Å
828	A	74.3	Confident	86.3	Confident	40 Å²	40	23.6 Å²	23.6	33%	0.331	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-27.9	177.2	0	0	0	0	0	112	A824 S825 R832	A824-A828 HydrophobicContact CB-CB 4Å; S825-A828 WeakPolarHBondContact O-CB 3.37Å; S825-A828 PolarHBondContact O-N 2.96Å; S825-A828 VanDerWaalsContact O-N 3.09Å; A828-R832 VanDerWaalsContact O-CZ 3.27Å; A828-R832 PolarHBondContact O-NE 2.9Å; A828-R832 PolarHBondContact O-NH2 2.8Å
829	F	76.3	Confident	86.6	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.2	176.9	-85.2	-76.3	0	0	0	114.5	I793 E822 A824 S825 V826 D827 R832 K834 R865	I793-F829 HydrophobicContact CD1-CB 4.4Å; I793-F829 HydrophobicContact CD1-CD2 4.33Å; I793-F829 HydrophobicContact CD1-CG 4.34Å; I793-F829 HydrophobicContact CG1-CD2 3.69Å; I793-F829 HydrophobicContact CG1-CE2 3.91Å; I793-F829 HydrophobicContact CG1-CG 4.15Å; E822-F829 HydrophobicContact CB-CZ 4.22Å; E822-F829 HydrophobicContact CG-CE1 4.31Å; E822-F829 HydrophobicContact CG-CZ 3.82Å; A824-F829 HydrophobicContact CB-CD2 4.03Å; A824-F829 HydrophobicContact CB-CE2 3.68Å; S825-F829 PolarHBondContact O-N 2.76Å; V826-F829 PolarHBondContact O-N 2.71Å; D827-F829 PolarHBondContact O-N 3.25Å; F829-R832 PolarHBondContact O-N 3.46Å; F829-K834 HydrophobicContact CE1-CG 4.19Å; F829-R865 HydrophobicContact CB-CG 4.12Å; F829-R865 WeakPolarHBondContact O-CD 3.38Å
830	Q	75.2	Confident	87.2	Confident	18 Å²	18	21.9 Å²	21.9	8%	0.084	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	150.4	172.8	-166.5	168.4	4	0	0	111.3	E637 Q640 V826 D827 R832	E637-Q830 PolarHBondContact OE2-NE2 3.13Å; Q640-Q830 VanDerWaalsContact CD-CD 3.4Å; Q640-Q830 VanDerWaalsContact CG-NE2 3.3Å; Q640-Q830 VanDerWaalsContact NE2-NE2 3.1Å; V826-Q830 PolarHBondContact O-N 3.47Å; D827-Q830 WeakPolarHBondContact O-CB 3.38Å; D827-Q830 PolarHBondContact O-N 3.38Å; D827-Q830 VanDerWaalsContact O-N 3.16Å; Q830-R832 PolarHBondContact O-N 3.03Å
831	G	69.3	Low	87.4	Confident	17 Å²	17	17.5 Å²	17.5	18%	0.175	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	-18.8	-170.8	0	0	0	0	0	115.7	Q529	Q529-G831 PolarHBondContact NE2-O 3.1Å; Q529-G831 PolarHBondContact OE1-O 3.17Å
832	R	82.1	Confident	87.5	Confident	59 Å²	59	17.5 Å²	17.5	22%	0.223	10%	0.096	C	C	.	.			trans	-102.8	169	-172.8	-57.9	-168.1	-70.8	144	6.3	112.8	I525 E822 A828 F829 Q830 R865	I525-R832 HydrophobicContact CG2-CG 4.18Å; E822-R832 IonicContact OE1-CZ 2.64Å; E822-R832 IonicContact OE1-NH1 3.14Å; E822-R832 PolarHBondContact OE1-NH1 3.39Å; E822-R832 IonicContact OE1-NH2 3.2Å; E822-R832 PolarHBondContact OE1-NH2 2.85Å; E822-R832 IonicContact OE2-NH1 3.09Å; E822-R832 PolarHBondContact OE2-NH1 3.38Å; A828-R832 VanDerWaalsContact O-CZ 3.27Å; A828-R832 PolarHBondContact O-NE 2.9Å; A828-R832 PolarHBondContact O-NH2 2.8Å; F829-R832 PolarHBondContact O-N 3.46Å; Q830-R832 PolarHBondContact O-N 3.03Å; R832-R865 PolarHBondContact O-NH1 2.9Å
833	E	89.8	Confident	87.5	Confident	85 Å²	85	15.9 Å²	15.9	40%	0.397	9%	0.088	S	C	.	.			trans	-149.1	158.6	176.9	60.8	-174.3	-109.9	0	0	112.2	R703 R865 R867	R703-E833 IonicContact CZ-OE2 2.64Å; R703-E833 IonicContact NE-OE2 3.54Å; R703-E833 PolarHBondContact NE-OE2 3.35Å; R703-E833 IonicContact NH2-OE2 3.13Å; R703-E833 PolarHBondContact NH2-OE2 2.92Å; E833-R865 CarbonylContact C-O 3.36Å; E833-R865 WeakPolarHBondContact CA-O 3.35Å; E833-R865 WeakPolarHBondContact CB-O 3.47Å; E833-R867 VanDerWaalsContact OE1-CD 3.26Å; E833-R867 WeakPolarHBondContact OE1-CD 3.39Å; E833-R867 IonicContact OE1-NE 3.56Å
834	K	94.8	Very high	87.2	Confident	26 Å²	26	16.4 Å²	16.4	11%	0.113	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	165.2	178.3	-68.5	-73.6	-173.9	150.9	0	109.5	D788 I790 E822 F829 I837 R865 A866 R867	D788-K834 VanDerWaalsContact O-CD 3.28Å; D788-K834 WeakPolarHBondContact O-CD 3.32Å; D788-K834 PolarHBondContact O-NZ 3.06Å; I790-K834 WeakPolarHBondContact O-CD 3.15Å; I790-K834 WeakPolarHBondContact O-CE 3.36Å; I790-K834 PolarHBondContact O-NZ 2.93Å; E822-K834 WeakPolarHBondContact OE2-CE 3.49Å; E822-K834 IonicContact OE2-NZ 3.67Å; E822-K834 PolarHBondContact OE2-NZ 2.74Å; F829-K834 HydrophobicContact CE1-CG 4.19Å; K834-I837 HydrophobicContact CB-CD1 3.77Å; K834-I837 HydrophobicContact CB-CG1 4.33Å; K834-I837 HydrophobicContact CG-CD1 4Å; K834-R865 PolarHBondContact N-O 2.87Å; K834-A866 CarbonylContact O-C 3.57Å; K834-A866 WeakPolarHBondContact O-CA 3.29Å; K834-R867 WeakPolarHBondContact O-CG 3.39Å; K834-R867 PolarHBondContact O-N 2.89Å
835	D	97.4	Very high	86.9	Confident	9 Å²	9	17 Å²	17	5%	0.048	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-46.2	174.2	-74.1	-3.7	0	0	0	110.7	K732 Q789 R867 Y868 G869	K732-D835 IonicContact NZ-OD2 3.74Å; K732-D835 PolarHBondContact NZ-OD2 2.66Å; Q789-D835 HydrophobicContact CB-CB 4.04Å; Q789-D835 PolarHBondContact O-N 2.99Å; D835-R867 PolarHBondContact O-N 3.34Å; D835-R867 WeakPolarHBondContact OD1-CD 3.36Å; D835-R867 IonicContact OD1-CZ 3.09Å; D835-R867 IonicContact OD1-NE 3.7Å; D835-R867 IonicContact OD1-NH1 3.84Å; D835-R867 PolarHBondContact OD1-NH1 2.98Å; D835-Y868 HydrophobicContact CB-CD2 3.57Å; D835-Y868 HydrophobicContact CB-CE2 4.19Å; D835-Y868 HydrophobicContact CB-CG 4.47Å; D835-Y868 VanDerWaalsContact CG-CD2 3.43Å; D835-Y868 WeakPolarHBondContact O-CA 3.37Å; D835-Y868 PolarHBondContact O-N 2.8Å; D835-Y868 WeakPolarHBondContact OD1-CE2 3.29Å; D835-G869 PolarHBondContact O-N 3.34Å; D835-G869 VanDerWaalsContact O-N 3.15Å
836	F	98.2	Very high	85.8	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.018	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.8	178.2	-54.9	-73.2	0	0	0	111.2	K732 F735 W739 L780 A785 Q789 G791 G869	K732-F836 HydrophobicContact CB-CZ 4.34Å; K732-F836 HydrophobicContact CG-CZ 4.33Å; F735-F836 HydrophobicContact CD1-CE1 4.36Å; F735-F836 AromaticContact CD1-CZ 3.88Å; F735-F836 HydrophobicContact CD1-CZ 3.88Å; F735-F836 HydrophobicContact CD2-CE2 4.34Å; F735-F836 HydrophobicContact CD2-CZ 4.06Å; F735-F836 AromaticContact CE1-CE1 3.55Å; F735-F836 HydrophobicContact CE1-CE1 3.55Å; F735-F836 HydrophobicContact CE1-CE2 4.43Å; F735-F836 AromaticContact CE1-CZ 3.41Å; F735-F836 HydrophobicContact CE1-CZ 3.41Å; F735-F836 VanDerWaalsContact CE1-CZ 3.41Å; F735-F836 HydrophobicContact CE2-CE1 4.32Å; F735-F836 AromaticContact CE2-CE2 3.86Å; F735-F836 HydrophobicContact CE2-CE2 3.86Å; F735-F836 AromaticContact CE2-CZ 3.63Å; F735-F836 HydrophobicContact CE2-CZ 3.63Å; F735-F836 HydrophobicContact CG-CZ 4.18Å; F735-F836 HydrophobicContact CZ-CD1 4.33Å; F735-F836 AromaticContact CZ-CE1 3.53Å; F735-F836 HydrophobicContact CZ-CE1 3.53Å; F735-F836 AromaticContact CZ-CE2 3.9Å; F735-F836 HydrophobicContact CZ-CE2 3.9Å; F735-F836 AromaticContact CZ-CZ 3.27Å; F735-F836 HydrophobicContact CZ-CZ 3.27Å; W739-F836 HydrophobicContact CZ2-CD1 4.46Å; W739-F836 HydrophobicContact CZ2-CE1 4.25Å; L780-F836 HydrophobicContact CD1-CB 4.12Å; L780-F836 HydrophobicContact CD2-CD1 4.33Å; L780-F836 HydrophobicContact CD2-CG 4.29Å; A785-F836 HydrophobicContact CB-CD2 3.9Å; A785-F836 HydrophobicContact CB-CE2 3.74Å; Q789-F836 PolarHBondContact O-N 2.96Å; G791-F836 PolarHBondContact N-O 3.46Å; F836-G869 WeakPolarHBondContact CA-O 3.4Å
837	I	98.2	Very high	84.5	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.5	175.2	-67.6	-70.3	0	0	0	110	G791 I793 K834 R865 A866 G869 V870 I871	G791-I837 WeakPolarHBondContact O-CA 3.38Å; I793-I837 HydrophobicContact CD1-CD1 4.26Å; I793-I837 HydrophobicContact CD1-CG2 3.75Å; I793-I837 HydrophobicContact CG1-CD1 4.4Å; I793-I837 HydrophobicContact CG1-CG2 4Å; K834-I837 HydrophobicContact CB-CD1 3.77Å; K834-I837 HydrophobicContact CB-CG1 4.33Å; K834-I837 HydrophobicContact CG-CD1 4Å; I837-R865 HydrophobicContact CD1-CB 3.77Å; I837-R865 HydrophobicContact CG1-CB 3.82Å; I837-A866 HydrophobicContact CB-CB 4.06Å; I837-A866 HydrophobicContact CG1-CB 3.76Å; I837-G869 PolarHBondContact N-O 3.07Å; I837-V870 WeakPolarHBondContact O-CA 3.23Å; I837-I871 PolarHBondContact O-N 3.41Å
838	I	98.4	Very high	83.5	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.4	167.4	-48.7	171	0	0	0	107.9	V773 I776 T777 L780 I790 G791 I792 I793 I871 V873	V773-I838 HydrophobicContact CG1-CD1 4.47Å; V773-I838 HydrophobicContact CG1-CG2 4.09Å; V773-I838 HydrophobicContact CG2-CG2 3.97Å; I776-I838 HydrophobicContact CB-CD1 4.14Å; I776-I838 HydrophobicContact CG2-CD1 3.59Å; I776-I838 HydrophobicContact CG2-CG1 3.97Å; T777-I838 WeakPolarHBondContact OG1-CD1 3.4Å; L780-I838 HydrophobicContact CD1-CD1 4.11Å; L780-I838 HydrophobicContact CD1-CG1 4.3Å; I790-I838 HydrophobicContact CG2-CD1 4.48Å; G791-I838 PolarHBondContact O-N 2.84Å; I792-I838 CarbonylContact C-O 3.57Å; I792-I838 WeakPolarHBondContact CA-O 3.33Å; I792-I838 HydrophobicContact CD1-CD1 4.45Å; I792-I838 HydrophobicContact CG1-CB 4.4Å; I792-I838 HydrophobicContact CG1-CD1 4.26Å; I793-I838 PolarHBondContact N-O 3.28Å; I838-I871 CarbonylContact C-O 3.43Å; I838-I871 VanDerWaalsContact CA-O 3.3Å; I838-I871 WeakPolarHBondContact CA-O 3.48Å; I838-V873 HydrophobicContact CG2-CG2 4.08Å
839	L	97.1	Very high	82.8	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.026	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	118.4	177.3	175.4	60.4	0	0	0	109.6	I793 A862 I871 I872 V873 W885	I793-L839 HydrophobicContact CB-CD1 4.03Å; I793-L839 HydrophobicContact CG2-CD1 3.89Å; I793-L839 WeakPolarHBondContact O-CA 3.4Å; L839-A862 HydrophobicContact CD1-CB 4.39Å; L839-A862 HydrophobicContact CD2-CB 4.25Å; L839-I871 PolarHBondContact N-O 2.91Å; L839-I872 HydrophobicContact CB-CG1 4.47Å; L839-I872 HydrophobicContact CB-CG2 4.42Å; L839-I872 HydrophobicContact CD2-CG1 4.41Å; L839-I872 HydrophobicContact CD2-CG2 4.16Å; L839-I872 HydrophobicContact CG-CG2 4.34Å; L839-V873 PolarHBondContact O-N 2.53Å; L839-W885 HydrophobicContact CD2-CH2 4.2Å
840	S	96.2	Very high	82.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120	171.3	171.2	0	0	0	0	109.8	E769 I793 T794 Q799	E769-S840 WeakPolarHBondContact OE2-CA 3.38Å; E769-S840 WeakPolarHBondContact OE2-CB 3.46Å; E769-S840 PolarHBondContact OE2-OG 3.11Å; I793-S840 PolarHBondContact O-N 3.15Å; T794-S840 PolarHBondContact OG1-O 3.4Å; Q799-S840 PolarHBondContact NE2-OG 2.94Å
841	C	93.7	Very high	82	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.			trans	-81.5	-26.9	-177.3	-67.4	0	0	0	0	113.4	E769 R843 L853 V873 L879	E769-C841 PolarHBondContact OE2-N 3.27Å; C841-R843 PolarHBondContact O-N 3.5Å; C841-L853 WeakPolarHBondContact O-CD1 3.29Å; C841-V873 PolarHBondContact N-O 3.07Å; C841-L879 HydrophobicContact CB-CD1 4.01Å; C841-L879 HydrophobicContact CB-CD2 4.31Å
842	V	91.9	Very high	81.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.			trans	66.9	-45.8	-179.5	-175.6	0	0	0	0	115.3	L765 N766 E769 Y796 Q799	L765-V842 VanDerWaalsContact C-CG1 3.48Å; N766-V842 HydrophobicContact CB-CG1 4.14Å; N766-V842 PolarHBondContact ND2-O 3.01Å; E769-V842 VanDerWaalsContact OE1-CA 3.26Å; E769-V842 WeakPolarHBondContact OE1-CA 3.45Å; E769-V842 PolarHBondContact OE1-N 2.83Å; E769-V842 PolarHBondContact OE2-N 3.48Å; Y796-V842 HydrophobicContact CD2-CB 3.65Å; Y796-V842 HydrophobicContact CD2-CG1 4Å; Y796-V842 HydrophobicContact CD2-CG2 3.8Å; Y796-V842 HydrophobicContact CE2-CB 4.13Å; Y796-V842 HydrophobicContact CG-CG1 4.48Å; Q799-V842 HydrophobicContact CB-CG2 3.62Å; Q799-V842 HydrophobicContact CG-CG2 3.54Å
843	R	88.4	Confident	81.3	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.019	18%	0.18	C	C	.	.			trans	-78.5	135.1	-165.8	-54.9	-56.3	-63.3	-68.1	9.1	112.9	E755 Y796 C841 N845 G849 I850 L853	E755-R843 IonicContact OE1-CZ 2.78Å; E755-R843 VanDerWaalsContact OE1-CZ 3.27Å; E755-R843 IonicContact OE1-NE 2.74Å; E755-R843 PolarHBondContact OE1-NE 3.43Å; E755-R843 IonicContact OE1-NH2 2.8Å; E755-R843 PolarHBondContact OE1-NH2 3.34Å; E755-R843 VanDerWaalsContact OE2-CA 3.25Å; E755-R843 WeakPolarHBondContact OE2-CA 3.41Å; E755-R843 IonicContact OE2-CZ 2.77Å; E755-R843 IonicContact OE2-NE 2.74Å; E755-R843 PolarHBondContact OE2-NE 3.3Å; E755-R843 IonicContact OE2-NH2 2.73Å; Y796-R843 HydrophobicContact CE2-CG 3.58Å; Y796-R843 VanDerWaalsContact CZ-CD 3.47Å; Y796-R843 VanDerWaalsContact OH-CD 3.31Å; Y796-R843 WeakPolarHBondContact OH-CD 3.49Å; Y796-R843 WeakPolarHBondContact OH-CG 3.16Å; Y796-R843 PolarHBondContact OH-NH1 3.23Å; C841-R843 PolarHBondContact O-N 3.5Å; R843-N845 PolarHBondContact NH2-ND2 2.88Å; R843-G849 PolarHBondContact NH1-O 2.96Å; R843-I850 HydrophobicContact CB-CG2 4.3Å; R843-I850 VanDerWaalsContact NH1-C 3.29Å; R843-L853 HydrophobicContact CB-CD1 4.37Å; R843-L853 HydrophobicContact CG-CD1 3.96Å
844	A	82.4	Confident	80.8	Confident	20 Å²	20	32.6 Å²	32.6	17%	0.165	18%	0.18	C	C	.	.			trans	-147	11.1	-164.6	0	0	0	0	0	114.4	G753 E755 N875	G753-A844 WeakPolarHBondContact O-CB 3.08Å; E755-A844 HydrophobicContact CB-CB 4.48Å; E755-A844 PolarHBondContact OE2-N 3.09Å; A844-N875 HydrophobicContact CB-CB 4.01Å; A844-N875 PolarHBondContact O-ND2 2.85Å
845	N	78.1	Confident	80.1	Confident	25 Å²	25	33 Å²	33	13%	0.134	18%	0.183	C	C	.	.			trans	-91.1	161.6	-168.4	59.8	5	0	0	0	116.4	E755 R843 Q848 K881	E755-N845 HydrophobicContact CG-CB 4.42Å; E755-N845 PolarHBondContact OE1-ND2 3.22Å; E755-N845 PolarHBondContact OE2-N 3.49Å; R843-N845 PolarHBondContact NH2-ND2 2.88Å; N845-Q848 PolarHBondContact OD1-O 3.49Å; N845-K881 PolarHBondContact O-NZ 3.15Å
846	E	59.7	Low	79.6	Confident	137 Å²	137	34.5 Å²	34.5	64%	0.64	19%	0.194	S	C	*	.	S	Bend	trans	-89.3	-36.1	-170.9	-160	123.4	-118.5	0	0	114	K881	E846-K881 VanDerWaalsContact C-NZ 3.26Å; E846-K881 PolarHBondContact O-NZ 3.21Å
847	H	55.5	Low	79.1	Confident	174 Å²	174	37.6 Å²	37.6	81%	0.806	21%	0.205	S	C	*	.	S	Bend	trans	-120.3	9.9	-167.6	-59.8	-66.6	0	0	0	116.5
848	Q	56.5	Low	78.6	Confident	54 Å²	54	40 Å²	40	25%	0.252	21%	0.214	S	C	.	.	S	Bend	trans	-137	159.8	-170.4	-69.4	169.2	8.3	0	0	113.6	S152 R236 N845	S152-Q848 PolarHBondContact O-NE2 3.1Å; S152-Q848 VanDerWaalsContact O-NE2 3.1Å; R236-Q848 VanDerWaalsContact NH2-OE1 3.12Å; N845-Q848 PolarHBondContact OD1-O 3.49Å
849	G	60	Low	78.2	Confident	48 Å²	48	40.2 Å²	40.2	50%	0.495	22%	0.216	S	C	.	.			trans	-71.4	148.7	178	0	0	0	0	0	113.9	R843 G851	R843-G849 PolarHBondContact NH1-O 2.96Å; G849-G851 PolarHBondContact O-N 2.1Å
850	I	65.5	Low	78	Confident	3 Å²	3	40 Å²	40	2%	0.015	21%	0.214	C	C	.	.			trans	-74.7	15.3	-176.4	61.1	172.3	0	0	0	114.5	Y796 R843 L853 N854 A878 L879 Q882 W885	Y796-I850 PolarHBondContact OH-O 2.91Å; R843-I850 HydrophobicContact CB-CG2 4.3Å; R843-I850 VanDerWaalsContact NH1-C 3.29Å; I850-L853 HydrophobicContact CB-CB 3.99Å; I850-L853 HydrophobicContact CB-CD1 3.97Å; I850-L853 HydrophobicContact CD1-CB 3.52Å; I850-L853 HydrophobicContact CD1-CD1 4.37Å; I850-L853 HydrophobicContact CG1-CB 3.66Å; I850-L853 WeakPolarHBondContact O-CB 3.49Å; I850-L853 PolarHBondContact O-N 2.62Å; I850-N854 WeakPolarHBondContact CG1-OD1 3.13Å; I850-A878 HydrophobicContact CG2-CB 4.49Å; I850-L879 HydrophobicContact CD1-CD2 4.01Å; I850-L879 HydrophobicContact CG2-CD2 4.39Å; I850-Q882 HydrophobicContact CD1-CB 4Å; I850-Q882 HydrophobicContact CD1-CG 3.59Å; I850-Q882 HydrophobicContact CG1-CG 3.79Å; I850-W885 VanDerWaalsContact CD1-CD1 3.5Å; I850-W885 HydrophobicContact CD1-CG 4.21Å
851	G	67.9	Low	77.8	Confident	34 Å²	34	40 Å²	40	35%	0.351	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	69.2	-134.8	173.9	0	0	0	0	0	112.9	G849 L853 N854	G849-G851 PolarHBondContact O-N 2.1Å; G851-L853 PolarHBondContact O-N 3.27Å; G851-L853 VanDerWaalsContact O-N 3.12Å; G851-N854 WeakPolarHBondContact O-CB 3.38Å; G851-N854 PolarHBondContact O-N 2.92Å; G851-N854 PolarHBondContact O-ND2 3.11Å
852	F	64	Low	77.7	Confident	53 Å²	53	40.3 Å²	40.3	23%	0.232	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-61.6	-18.5	178.5	65	-104.2	0	0	0	112.9	P795 Y796 N854 D855	P795-F852 VanDerWaalsContact C-CE1 3.47Å; P795-F852 HydrophobicContact CB-CD2 3.9Å; P795-F852 HydrophobicContact CB-CE1 4.02Å; P795-F852 HydrophobicContact CB-CE2 3.31Å; P795-F852 HydrophobicContact CB-CZ 3.38Å; P795-F852 HydrophobicContact CG-CD2 4.3Å; P795-F852 HydrophobicContact CG-CE2 3.38Å; P795-F852 HydrophobicContact CG-CZ 3.61Å; P795-F852 WeakPolarHBondContact O-CE1 3.29Å; Y796-F852 AromaticContact CD1-CE1 3.68Å; Y796-F852 HydrophobicContact CD1-CE1 3.68Å; Y796-F852 HydrophobicContact CD1-CZ 4.47Å; Y796-F852 AromaticContact CD2-CE1 3.51Å; Y796-F852 HydrophobicContact CD2-CE1 3.51Å; Y796-F852 AromaticContact CD2-CZ 3.45Å; Y796-F852 HydrophobicContact CD2-CZ 3.45Å; Y796-F852 VanDerWaalsContact CD2-CZ 3.45Å; Y796-F852 HydrophobicContact CE1-CD1 4.12Å; Y796-F852 AromaticContact CE1-CE1 3.46Å; Y796-F852 HydrophobicContact CE1-CE1 3.46Å; Y796-F852 VanDerWaalsContact CE1-CE1 3.46Å; Y796-F852 HydrophobicContact CE1-CZ 4.29Å; Y796-F852 HydrophobicContact CE2-CD1 4.4Å; Y796-F852 AromaticContact CE2-CE1 3.27Å; Y796-F852 HydrophobicContact CE2-CE1 3.27Å; Y796-F852 HydrophobicContact CE2-CE2 4.38Å; Y796-F852 AromaticContact CE2-CZ 3.2Å; Y796-F852 HydrophobicContact CE2-CZ 3.2Å; Y796-F852 AromaticContact CG-CE1 3.69Å; Y796-F852 HydrophobicContact CG-CE1 3.69Å; Y796-F852 HydrophobicContact CG-CZ 4.08Å; Y796-F852 AromaticContact CZ-CE1 3.22Å; Y796-F852 AromaticContact CZ-CZ 3.65Å; F852-N854 PolarHBondContact O-N 2.94Å; F852-D855 PolarHBondContact O-N 3.01Å
853	L	73.1	Confident	77.9	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.063	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-62.7	-10.7	177.9	-68.6	167.5	0	0	0	112.2	C841 R843 I850 G851 L879 W885	C841-L853 WeakPolarHBondContact O-CD1 3.29Å; R843-L853 HydrophobicContact CB-CD1 4.37Å; R843-L853 HydrophobicContact CG-CD1 3.96Å; I850-L853 HydrophobicContact CB-CB 3.99Å; I850-L853 HydrophobicContact CB-CD1 3.97Å; I850-L853 HydrophobicContact CD1-CB 3.52Å; I850-L853 HydrophobicContact CD1-CD1 4.37Å; I850-L853 HydrophobicContact CG1-CB 3.66Å; I850-L853 WeakPolarHBondContact O-CB 3.49Å; I850-L853 PolarHBondContact O-N 2.62Å; G851-L853 PolarHBondContact O-N 3.27Å; G851-L853 VanDerWaalsContact O-N 3.12Å; L853-L879 HydrophobicContact CD1-CD2 3.97Å; L853-W885 HydrophobicContact CD2-CZ2 3.74Å; L853-W885 PolarHBondContact O-NE1 2.92Å
854	N	78.9	Confident	78.2	Confident	74 Å²	74	40.4 Å²	40.4	40%	0.396	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-66.6	-27.4	171	-67.8	-5.5	0	0	0	113.7	I850 G851 F852 P856 Q882	I850-N854 WeakPolarHBondContact CG1-OD1 3.13Å; G851-N854 WeakPolarHBondContact O-CB 3.38Å; G851-N854 PolarHBondContact O-N 2.92Å; G851-N854 PolarHBondContact O-ND2 3.11Å; F852-N854 PolarHBondContact O-N 2.94Å; N854-P856 VanDerWaalsContact O-CD 3.27Å; N854-P856 WeakPolarHBondContact O-CD 3.15Å; N854-Q882 WeakPolarHBondContact OD1-CG 3.28Å; N854-Q882 PolarHBondContact OD1-NE2 2.68Å
855	D	81.3	Confident	78.8	Confident	34 Å²	34	39.6 Å²	39.6	18%	0.182	21%	0.21	C	C	.	.			trans	-74.5	116.4	-175.4	-171.2	-27.1	0	0	0	110.9	F852 R857 R858 L859	F852-D855 PolarHBondContact O-N 3.01Å; D855-R857 PolarHBondContact O-N 3.27Å; D855-R857 WeakPolarHBondContact OD1-CB 3.17Å; D855-R857 WeakPolarHBondContact OD1-CG 3.35Å; D855-R857 IonicContact OD1-CZ 3.42Å; D855-R857 PolarHBondContact OD1-N 2.91Å; D855-R857 IonicContact OD1-NE 3.69Å; D855-R857 PolarHBondContact OD1-NE 2.82Å; D855-R857 IonicContact OD1-NH2 2.85Å; D855-R857 IonicContact OD2-CZ 2.82Å; D855-R857 IonicContact OD2-NE 3.42Å; D855-R857 PolarHBondContact OD2-NE 2.92Å; D855-R857 IonicContact OD2-NH2 3.85Å; D855-R857 PolarHBondContact OD2-NH2 3.29Å; D855-R858 HydrophobicContact CB-CB 4.16Å; D855-R858 HydrophobicContact CB-CG 3.95Å; D855-R858 PolarHBondContact O-N 3.18Å; D855-L859 PolarHBondContact O-N 3.34Å
856	P	87.6	Confident	79.7	Confident	42 Å²	42	38.4 Å²	38.4	27%	0.273	20%	0.204	S	C	.	.	H	α-helix	trans	-58.4	-33.7	-179.8	-24.8	36.1	0	0	0	113.5	F716 N854 L859 N860 L884	F716-P856 HydrophobicContact CE1-CB 3.98Å; N854-P856 VanDerWaalsContact O-CD 3.27Å; N854-P856 WeakPolarHBondContact O-CD 3.15Å; P856-L859 PolarHBondContact O-N 2.68Å; P856-N860 PolarHBondContact O-N 3.28Å; P856-L884 VanDerWaalsContact CA-CD2 3.5Å; P856-L884 HydrophobicContact CB-CD2 3.67Å; P856-L884 HydrophobicContact CG-CD2 4.15Å
857	R	87	Confident	81.5	Confident	68 Å²	68	35.4 Å²	35.4	26%	0.257	19%	0.187	S	C	.	.	H	α-helix	trans	-70.1	-35.1	-177	-57.6	169.8	-60.2	175	6.6	111.2	Q665 D855 N860 V861	Q665-R857 WeakPolarHBondContact O-CB 3.28Å; Q665-R857 WeakPolarHBondContact O-CD 3.48Å; D855-R857 PolarHBondContact O-N 3.27Å; D855-R857 WeakPolarHBondContact OD1-CB 3.17Å; D855-R857 WeakPolarHBondContact OD1-CG 3.35Å; D855-R857 IonicContact OD1-CZ 3.42Å; D855-R857 PolarHBondContact OD1-N 2.91Å; D855-R857 IonicContact OD1-NE 3.69Å; D855-R857 PolarHBondContact OD1-NE 2.82Å; D855-R857 IonicContact OD1-NH2 2.85Å; D855-R857 IonicContact OD2-CZ 2.82Å; D855-R857 IonicContact OD2-NE 3.42Å; D855-R857 PolarHBondContact OD2-NE 2.92Å; D855-R857 IonicContact OD2-NH2 3.85Å; D855-R857 PolarHBondContact OD2-NH2 3.29Å; R857-N860 PolarHBondContact O-N 3.26Å; R857-V861 WeakPolarHBondContact O-CG2 3.42Å; R857-V861 PolarHBondContact O-N 2.93Å
858	R	86.6	Confident	83.5	Confident	51 Å²	51	28.8 Å²	28.8	19%	0.192	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-45.8	172.8	-73.2	177.3	-179.8	-90.1	-17	110.8	L666 V826 D827 D855 V861 A862	L666-R858 HydrophobicContact CD2-CG 3.62Å; L666-R858 HydrophobicContact CG-CG 4.35Å; V826-R858 HydrophobicContact CG1-CB 4.22Å; V826-R858 HydrophobicContact CG1-CG 4.13Å; V826-R858 WeakPolarHBondContact CG2-O 3.16Å; D827-R858 VanDerWaalsContact CG-NH1 3.25Å; D827-R858 IonicContact OD1-CZ 2.77Å; D827-R858 IonicContact OD1-NH1 2.65Å; D827-R858 PolarHBondContact OD1-NH1 3.2Å; D827-R858 IonicContact OD1-NH2 3.06Å; D827-R858 PolarHBondContact OD1-NH2 3.21Å; D827-R858 IonicContact OD2-CZ 2.84Å; D827-R858 IonicContact OD2-NH1 2.67Å; D827-R858 PolarHBondContact OD2-NH1 3.41Å; D827-R858 IonicContact OD2-NH2 2.66Å; D827-R858 PolarHBondContact OD2-NH2 2.83Å; D827-R858 VanDerWaalsContact OD2-NH2 3.09Å; D855-R858 HydrophobicContact CB-CB 4.16Å; D855-R858 HydrophobicContact CB-CG 3.95Å; D855-R858 PolarHBondContact O-N 3.18Å; R858-V861 PolarHBondContact O-N 2.81Å; R858-A862 WeakPolarHBondContact O-CB 3.47Å; R858-A862 PolarHBondContact O-N 3.12Å
859	L	91	Very high	85.5	Confident	6 Å²	6	26.3 Å²	26.3	3%	0.031	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-43.3	176.9	-177.1	59.1	0	0	0	111.9	D855 P856 V861 A862 L863 L884 W885 L888	D855-L859 PolarHBondContact O-N 3.34Å; P856-L859 PolarHBondContact O-N 2.68Å; L859-V861 PolarHBondContact O-N 3.14Å; L859-A862 PolarHBondContact O-N 3.11Å; L859-L863 HydrophobicContact CD1-CD1 3.96Å; L859-L863 HydrophobicContact CD1-CD2 4.34Å; L859-L863 HydrophobicContact CD1-CG 3.88Å; L859-L863 HydrophobicContact CD2-CD1 4.48Å; L859-L863 HydrophobicContact CG-CD1 3.87Å; L859-L863 HydrophobicContact CG-CG 4.23Å; L859-L863 WeakPolarHBondContact O-CG 3.27Å; L859-L863 PolarHBondContact O-N 3.38Å; L859-L884 HydrophobicContact CB-CD2 4.34Å; L859-L884 HydrophobicContact CD2-CD2 3.77Å; L859-L884 HydrophobicContact CD2-CG 3.78Å; L859-W885 HydrophobicContact CD1-CH2 3.74Å; L859-W885 HydrophobicContact CD1-CZ2 3.61Å; L859-W885 HydrophobicContact CD1-CZ3 4.43Å; L859-W885 HydrophobicContact CD2-CD2 4.41Å; L859-W885 HydrophobicContact CD2-CZ2 4.38Å; L859-W885 HydrophobicContact CG-CZ2 4.49Å; L859-L888 HydrophobicContact CD1-CD2 4.28Å; L859-L888 HydrophobicContact CD2-CD2 4.32Å
860	N	93	Very high	87.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.4	-48	175.4	-173.5	16.1	0	0	0	112	C664 F716 Y717 P856 R857 A862 T864	C664-N860 PolarHBondContact O-ND2 3.16Å; F716-N860 HydrophobicContact CD1-CB 4.22Å; F716-N860 HydrophobicContact CD2-CB 3.59Å; F716-N860 WeakPolarHBondContact CD2-OD1 3.4Å; F716-N860 HydrophobicContact CE1-CB 4.11Å; F716-N860 HydrophobicContact CE2-CB 3.49Å; F716-N860 VanDerWaalsContact CE2-CB 3.49Å; F716-N860 HydrophobicContact CG-CB 3.98Å; F716-N860 HydrophobicContact CZ-CB 3.76Å; Y717-N860 PolarHBondContact OH-ND2 3.09Å; P856-N860 PolarHBondContact O-N 3.28Å; R857-N860 PolarHBondContact O-N 3.26Å; N860-A862 PolarHBondContact O-N 3.09Å; N860-T864 WeakPolarHBondContact O-CB 3.43Å; N860-T864 VanDerWaalsContact O-CG2 3.24Å; N860-T864 WeakPolarHBondContact O-CG2 3.44Å; N860-T864 PolarHBondContact O-N 3.14Å; N860-T864 PolarHBondContact O-OG1 3.06Å
861	V	91.6	Very high	88.9	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.5	-51.9	174.8	171.8	0	0	0	0	110.4	Q665 L666 V826 R857 R858 L859 L863 T864 R865	Q665-V861 HydrophobicContact CB-CG2 3.77Å; Q665-V861 HydrophobicContact CG-CG2 3.74Å; L666-V861 HydrophobicContact CB-CG2 4.41Å; L666-V861 HydrophobicContact CD1-CG1 4.43Å; L666-V861 HydrophobicContact CD1-CG2 4.19Å; L666-V861 HydrophobicContact CG-CG2 4.14Å; V826-V861 HydrophobicContact CG2-CB 3.96Å; V826-V861 HydrophobicContact CG2-CG1 3.73Å; R857-V861 WeakPolarHBondContact O-CG2 3.42Å; R857-V861 PolarHBondContact O-N 2.93Å; R858-V861 PolarHBondContact O-N 2.81Å; L859-V861 PolarHBondContact O-N 3.14Å; V861-L863 PolarHBondContact O-N 3.09Å; V861-T864 PolarHBondContact O-N 2.61Å; V861-T864 VanDerWaalsContact O-N 3.14Å; V861-T864 PolarHBondContact O-OG1 2.94Å; V861-R865 WeakPolarHBondContact O-CD 3.17Å; V861-R865 VanDerWaalsContact O-CG 3.31Å; V861-R865 WeakPolarHBondContact O-CG 3.29Å; V861-R865 PolarHBondContact O-NE 3.02Å
862	A	92.4	Very high	90.3	Very high	6 Å²	6	22.5 Å²	22.5	5%	0.05	10%	0.104	C	C	.	.	H	α-helix	trans	-58.1	-47.3	-176.9	0	0	0	0	0	113.4	I793 V826 L839 R858 L859 N860 T864	I793-A862 HydrophobicContact CD1-CB 4.32Å; V826-A862 HydrophobicContact CG2-CB 3.89Å; L839-A862 HydrophobicContact CD1-CB 4.39Å; L839-A862 HydrophobicContact CD2-CB 4.25Å; R858-A862 WeakPolarHBondContact O-CB 3.47Å; R858-A862 PolarHBondContact O-N 3.12Å; L859-A862 PolarHBondContact O-N 3.11Å; N860-A862 PolarHBondContact O-N 3.09Å; A862-T864 PolarHBondContact O-N 3.14Å
863	L	95.4	Very high	91.9	Very high	7 Å²	7	20 Å²	20	4%	0.037	9%	0.093	C	C	.	.	H	α-helix	trans	-65.1	-21.9	179.9	-67.4	175.6	0	0	0	113.2	F711 P712 L859 V861 I872 L888	F711-L863 HydrophobicContact CD1-CD1 3.84Å; F711-L863 HydrophobicContact CE1-CD1 4Å; P712-L863 HydrophobicContact CG-CB 4.12Å; P712-L863 HydrophobicContact CG-CD1 4.43Å; L859-L863 HydrophobicContact CD1-CD1 3.96Å; L859-L863 HydrophobicContact CD1-CD2 4.34Å; L859-L863 HydrophobicContact CD1-CG 3.88Å; L859-L863 HydrophobicContact CD2-CD1 4.48Å; L859-L863 HydrophobicContact CG-CD1 3.87Å; L859-L863 HydrophobicContact CG-CG 4.23Å; L859-L863 WeakPolarHBondContact O-CG 3.27Å; L859-L863 PolarHBondContact O-N 3.38Å; V861-L863 PolarHBondContact O-N 3.09Å; L863-I872 HydrophobicContact CD2-CD1 3.77Å; L863-L888 HydrophobicContact CD1-CD1 4.01Å; L863-L888 HydrophobicContact CD2-CD1 4.47Å
864	T	95.2	Very high	93	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	17.7	-169	60.9	0	0	0	0	114.3	P494 R703 M704 P712 N860 V861 A862	P494-T864 VanDerWaalsContact CB-CB 3.49Å; P494-T864 HydrophobicContact CB-CG2 4.03Å; P494-T864 HydrophobicContact CG-CG2 3.88Å; P494-T864 VanDerWaalsContact CG-OG1 3.31Å; P494-T864 WeakPolarHBondContact CG-OG1 3.41Å; R703-T864 VanDerWaalsContact CD-O 3.29Å; R703-T864 WeakPolarHBondContact CD-O 3.43Å; R703-T864 PolarHBondContact NH1-O 3.4Å; M704-T864 HydrophobicContact CE-CG2 4.17Å; M704-T864 HydrophobicContact SD-CG2 3.93Å; P712-T864 HydrophobicContact CB-CG2 3.75Å; P712-T864 HydrophobicContact CG-CG2 3.74Å; N860-T864 WeakPolarHBondContact O-CB 3.43Å; N860-T864 VanDerWaalsContact O-CG2 3.24Å; N860-T864 WeakPolarHBondContact O-CG2 3.44Å; N860-T864 PolarHBondContact O-N 3.14Å; N860-T864 PolarHBondContact O-OG1 3.06Å; V861-T864 PolarHBondContact O-N 2.61Å; V861-T864 VanDerWaalsContact O-N 3.14Å; V861-T864 PolarHBondContact O-OG1 2.94Å; A862-T864 PolarHBondContact O-N 3.14Å
865	R	94.3	Very high	93.7	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.008	7%	0.074	C	C	.	.	S	Bend	trans	-87.9	-23.7	175.4	-59.8	-49.3	87	177.1	12.8	114	I793 F829 R832 E833 K834 I837 V861	I793-R865 HydrophobicContact CD1-CB 4.24Å; I793-R865 HydrophobicContact CD1-CG 3.79Å; F829-R865 HydrophobicContact CB-CG 4.12Å; F829-R865 WeakPolarHBondContact O-CD 3.38Å; R832-R865 PolarHBondContact O-NH1 2.9Å; E833-R865 CarbonylContact C-O 3.36Å; E833-R865 WeakPolarHBondContact CA-O 3.35Å; E833-R865 WeakPolarHBondContact CB-O 3.47Å; K834-R865 PolarHBondContact N-O 2.87Å; I837-R865 HydrophobicContact CD1-CB 3.77Å; I837-R865 HydrophobicContact CG1-CB 3.82Å; V861-R865 WeakPolarHBondContact O-CD 3.17Å; V861-R865 VanDerWaalsContact O-CG 3.31Å; V861-R865 WeakPolarHBondContact O-CG 3.29Å; V861-R865 PolarHBondContact O-NE 3.02Å
866	A	97	Very high	94.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	160	-177.8	0	0	0	0	0	113	R703 M704 L708 K834 I837 G869 V870	R703-A866 WeakPolarHBondContact CG-O 3.19Å; M704-A866 WeakPolarHBondContact CG-O 3.38Å; L708-A866 HydrophobicContact CD1-CB 4.4Å; K834-A866 CarbonylContact O-C 3.57Å; K834-A866 WeakPolarHBondContact O-CA 3.29Å; I837-A866 HydrophobicContact CB-CB 4.06Å; I837-A866 HydrophobicContact CG1-CB 3.76Å; A866-G869 VanDerWaalsContact CB-O 3.26Å; A866-G869 WeakPolarHBondContact CB-O 3.16Å; A866-V870 HydrophobicContact CB-CG2 3.44Å; A866-V870 VanDerWaalsContact CB-CG2 3.44Å
867	R	97.3	Very high	94.4	Very high	74 Å²	74	18.2 Å²	18.2	28%	0.279	8%	0.076	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-50.1	168.5	-61.4	163.5	72.7	-156.4	14.4	111.3	R703 M704 H705 E833 K834 D835	R703-R867 HydrophobicContact CG-CG 3.88Å; R703-R867 WeakPolarHBondContact O-CA 3.17Å; R703-R867 WeakPolarHBondContact O-CB 3.42Å; M704-R867 CarbonylContact C-O 3.52Å; H705-R867 PolarHBondContact N-O 2.88Å; E833-R867 VanDerWaalsContact OE1-CD 3.26Å; E833-R867 WeakPolarHBondContact OE1-CD 3.39Å; E833-R867 IonicContact OE1-NE 3.56Å; K834-R867 WeakPolarHBondContact O-CG 3.39Å; K834-R867 PolarHBondContact O-N 2.89Å; D835-R867 PolarHBondContact O-N 3.34Å; D835-R867 WeakPolarHBondContact OD1-CD 3.36Å; D835-R867 IonicContact OD1-CZ 3.09Å; D835-R867 IonicContact OD1-NE 3.7Å; D835-R867 IonicContact OD1-NH1 3.84Å; D835-R867 PolarHBondContact OD1-NH1 2.98Å
868	Y	97.8	Very high	94.4	Very high	36 Å²	36	15 Å²	15	14%	0.141	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-39.5	-173.2	-66.4	-94.3	0	0	0	112.9	R730 K732 P745 D835	R730-Y868 VanDerWaalsContact O-CD1 3.26Å; R730-Y868 WeakPolarHBondContact O-CD1 3.41Å; K732-Y868 HydrophobicContact CB-CD1 3.79Å; K732-Y868 HydrophobicContact CB-CE1 4.06Å; K732-Y868 HydrophobicContact CB-CG 4.38Å; K732-Y868 HydrophobicContact CD-CD1 4.36Å; K732-Y868 HydrophobicContact CD-CE1 4.18Å; K732-Y868 HydrophobicContact CD-CE2 4.32Å; P745-Y868 WeakPolarHBondContact CB-O 3.5Å; P745-Y868 WeakPolarHBondContact CG-O 3.42Å; D835-Y868 HydrophobicContact CB-CD2 3.57Å; D835-Y868 HydrophobicContact CB-CE2 4.19Å; D835-Y868 HydrophobicContact CB-CG 4.47Å; D835-Y868 VanDerWaalsContact CG-CD2 3.43Å; D835-Y868 WeakPolarHBondContact O-CA 3.37Å; D835-Y868 PolarHBondContact O-N 2.8Å; D835-Y868 WeakPolarHBondContact OD1-CE2 3.29Å
869	G	97.9	Very high	94.6	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.01	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	157.6	177.7	0	0	0	0	0	117.8	P745 D835 F836 I837 A866	P745-G869 CarbonylContact O-C 3.58Å; P745-G869 WeakPolarHBondContact O-CA 3.32Å; D835-G869 PolarHBondContact O-N 3.34Å; D835-G869 VanDerWaalsContact O-N 3.15Å; F836-G869 WeakPolarHBondContact CA-O 3.4Å; I837-G869 PolarHBondContact N-O 3.07Å; A866-G869 VanDerWaalsContact CB-O 3.26Å; A866-G869 WeakPolarHBondContact CB-O 3.16Å
870	V	98.6	Very high	94.6	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.018	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.2	-176.3	177.6	0	0	0	0	110.8	L708 P745 M746 F747 I837 A866 I872	L708-V870 HydrophobicContact CD1-CG2 4.29Å; L708-V870 HydrophobicContact CD2-CB 4.12Å; L708-V870 HydrophobicContact CD2-CG2 3.95Å; P745-V870 PolarHBondContact O-N 3.31Å; P745-V870 VanDerWaalsContact O-N 3.08Å; M746-V870 WeakPolarHBondContact CA-O 3.47Å; M746-V870 WeakPolarHBondContact CB-O 3.25Å; F747-V870 PolarHBondContact N-O 3.06Å; I837-V870 WeakPolarHBondContact O-CA 3.23Å; A866-V870 HydrophobicContact CB-CG2 3.44Å; A866-V870 VanDerWaalsContact CB-CG2 3.44Å; V870-I872 HydrophobicContact CG1-CG1 4.07Å
871	I	98.7	Very high	94.3	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.01	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117.7	177.3	-56	174.2	0	0	0	108.6	F737 W739 F747 I776 L780 I837 I838 L839 V873	F737-I871 HydrophobicContact CZ-CD1 4.05Å; W739-I871 HydrophobicContact CH2-CD1 4.11Å; W739-I871 HydrophobicContact CH2-CG1 4.08Å; W739-I871 HydrophobicContact CZ3-CD1 4.05Å; W739-I871 HydrophobicContact CZ3-CG1 3.8Å; F747-I871 HydrophobicContact CD1-CG1 4.08Å; F747-I871 HydrophobicContact CD1-CG2 4.43Å; F747-I871 HydrophobicContact CD2-CG2 4.16Å; F747-I871 HydrophobicContact CE1-CB 4.39Å; F747-I871 HydrophobicContact CE1-CD1 3.6Å; F747-I871 HydrophobicContact CE1-CG1 3.59Å; F747-I871 HydrophobicContact CE1-CG2 3.97Å; F747-I871 HydrophobicContact CE2-CG2 3.69Å; F747-I871 HydrophobicContact CZ-CB 4.44Å; F747-I871 HydrophobicContact CZ-CD1 3.84Å; F747-I871 HydrophobicContact CZ-CG1 4.02Å; F747-I871 HydrophobicContact CZ-CG2 3.57Å; I776-I871 HydrophobicContact CD1-CG2 3.82Å; I776-I871 HydrophobicContact CG1-CG2 4.5Å; I776-I871 HydrophobicContact CG2-CB 4.44Å; I776-I871 HydrophobicContact CG2-CD1 3.47Å; I776-I871 VanDerWaalsContact CG2-CD1 3.47Å; I776-I871 HydrophobicContact CG2-CG2 4.23Å; L780-I871 HydrophobicContact CD2-CD1 4.48Å; I837-I871 PolarHBondContact O-N 3.41Å; I838-I871 CarbonylContact C-O 3.43Å; I838-I871 VanDerWaalsContact CA-O 3.3Å; I838-I871 WeakPolarHBondContact CA-O 3.48Å; L839-I871 PolarHBondContact N-O 2.91Å; I871-V873 HydrophobicContact CG2-CG2 4.48Å
872	I	98.4	Very high	93.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.6	179.3	-50.2	178.7	0	0	0	108.2	F747 F748 Y749 L839 L863 V870 W885 L888 Y892	F747-I872 PolarHBondContact O-N 3.46Å; F748-I872 CarbonylContact C-O 3.58Å; F748-I872 WeakPolarHBondContact CA-O 3.07Å; F748-I872 HydrophobicContact CD2-CB 3.75Å; F748-I872 HydrophobicContact CD2-CD1 4.35Å; F748-I872 HydrophobicContact CD2-CG2 3.57Å; F748-I872 HydrophobicContact CE2-CB 4.2Å; F748-I872 HydrophobicContact CE2-CG2 3.5Å; F748-I872 VanDerWaalsContact CE2-CG2 3.5Å; F748-I872 HydrophobicContact CG-CB 4.33Å; F748-I872 HydrophobicContact CG-CG2 4.49Å; F748-I872 HydrophobicContact CZ-CG2 4.35Å; Y749-I872 PolarHBondContact N-O 3.32Å; L839-I872 HydrophobicContact CB-CG1 4.47Å; L839-I872 HydrophobicContact CB-CG2 4.42Å; L839-I872 HydrophobicContact CD2-CG1 4.41Å; L839-I872 HydrophobicContact CD2-CG2 4.16Å; L839-I872 HydrophobicContact CG-CG2 4.34Å; L863-I872 HydrophobicContact CD2-CD1 3.77Å; V870-I872 HydrophobicContact CG1-CG1 4.07Å; I872-W885 HydrophobicContact CG2-CZ3 4.45Å; I872-L888 HydrophobicContact CD1-CD2 3.97Å; I872-Y892 HydrophobicContact CD1-CE1 4.3Å
873	V	98.1	Very high	93.7	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.6	178.3	-170.7	0	0	0	0	107.5	Y749 T751 E769 N772 V773 I776 I838 L839 C841 I871	Y749-V873 HydrophobicContact CD1-CG1 4.3Å; Y749-V873 HydrophobicContact CD1-CG2 4.46Å; T751-V873 WeakPolarHBondContact OG1-CG1 3.41Å; E769-V873 HydrophobicContact CB-CG1 4.1Å; E769-V873 HydrophobicContact CG-CG1 4.01Å; N772-V873 HydrophobicContact CB-CG1 4.14Å; V773-V873 HydrophobicContact CG2-CB 4.2Å; V773-V873 HydrophobicContact CG2-CG1 4.41Å; V773-V873 HydrophobicContact CG2-CG2 3.92Å; I776-V873 HydrophobicContact CD1-CG2 3.47Å; I776-V873 VanDerWaalsContact CD1-CG2 3.47Å; I838-V873 HydrophobicContact CG2-CG2 4.08Å; L839-V873 PolarHBondContact O-N 2.53Å; C841-V873 PolarHBondContact N-O 3.07Å; I871-V873 HydrophobicContact CG2-CG2 4.48Å
874	G	95.4	Very high	93.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	173.6	-176.3	0	0	0	0	0	115.1	F748 Y749 T751 E769 P876	F748-G874 WeakPolarHBondContact CE1-O 3.4Å; Y749-G874 PolarHBondContact O-N 2.73Å; T751-G874 PolarHBondContact N-O 3.05Å; T751-G874 CarbonylContact O-C 3.56Å; E769-G874 WeakPolarHBondContact OE1-CA 3.45Å; G874-P876 WeakPolarHBondContact O-CD 3.44Å
875	N	93.7	Very high	93.3	Very high	13 Å²	13	24.7 Å²	24.7	7%	0.07	12%	0.117	C	C	.	.			trans	-96.7	109.8	174.9	-176.2	-12.8	0	0	0	111.1	T751 A844 K877 A878 L879	T751-N875 WeakPolarHBondContact O-CA 3.28Å; T751-N875 WeakPolarHBondContact O-CB 3.35Å; A844-N875 HydrophobicContact CB-CB 4.01Å; A844-N875 PolarHBondContact O-ND2 2.85Å; N875-K877 VanDerWaalsContact C-N 3.26Å; N875-K877 PolarHBondContact O-N 2.99Å; N875-K877 WeakPolarHBondContact OD1-CB 3.44Å; N875-K877 PolarHBondContact OD1-N 2.75Å; N875-A878 PolarHBondContact O-N 2.93Å; N875-L879 WeakPolarHBondContact O-CG 3.31Å; N875-L879 PolarHBondContact O-N 3.05Å
876	P	92.9	Very high	93.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.3	-30.3	-179.7	-23.1	33.4	0	0	0	114.2	F748 V750 G874 A878 L879 S880 L889 M911 F913	F748-P876 HydrophobicContact CD1-CG 4.43Å; F748-P876 HydrophobicContact CE1-CG 3.76Å; F748-P876 HydrophobicContact CZ-CG 4.36Å; V750-P876 HydrophobicContact CB-CG 4.36Å; V750-P876 HydrophobicContact CG1-CG 4.02Å; V750-P876 HydrophobicContact CG2-CG 3.79Å; G874-P876 WeakPolarHBondContact O-CD 3.44Å; P876-A878 VanDerWaalsContact C-N 3.31Å; P876-A878 PolarHBondContact O-N 3.45Å; P876-L879 PolarHBondContact O-N 2.92Å; P876-S880 VanDerWaalsContact O-CB 3.26Å; P876-S880 WeakPolarHBondContact O-CB 3.49Å; P876-S880 PolarHBondContact O-N 3.3Å; P876-S880 PolarHBondContact O-OG 2.77Å; P876-S880 VanDerWaalsContact O-OG 3.14Å; P876-L889 HydrophobicContact CB-CD1 3.97Å; P876-L889 HydrophobicContact CB-CD2 3.95Å; P876-L889 HydrophobicContact CG-CD2 4.22Å; P876-M911 HydrophobicContact CB-CE 3.81Å; P876-M911 HydrophobicContact CB-SD 4.3Å; P876-M911 HydrophobicContact CG-CE 4.17Å; P876-M911 HydrophobicContact CG-SD 4.04Å; P876-F913 HydrophobicContact CB-CE1 3.6Å; P876-F913 HydrophobicContact CB-CZ 3.76Å
877	K	89.5	Confident	93.1	Very high	112 Å²	112	26.6 Å²	26.6	49%	0.487	13%	0.127	S	C	.	.	H	α-helix	trans	-63.1	-35.6	-177.7	-65	-169.2	178.6	-178.1	0	112.7	N875 K881 M911	N875-K877 VanDerWaalsContact C-N 3.26Å; N875-K877 PolarHBondContact O-N 2.99Å; N875-K877 WeakPolarHBondContact OD1-CB 3.44Å; N875-K877 PolarHBondContact OD1-N 2.75Å; K877-K881 WeakPolarHBondContact O-CE 3.42Å; K877-M911 HydrophobicContact CG-CE 3.56Å
878	A	88.4	Confident	93	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.008	11%	0.114	C	C	.	.	H	α-helix	trans	-78.6	-42.6	177.5	0	0	0	0	0	111	I850 N875 P876	I850-A878 HydrophobicContact CG2-CB 4.49Å; N875-A878 PolarHBondContact O-N 2.93Å; P876-A878 VanDerWaalsContact C-N 3.31Å; P876-A878 PolarHBondContact O-N 3.45Å
879	L	90.5	Very high	92.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-71.8	-38.5	-175.1	-62.3	168.6	0	0	0	112.9	F748 C841 I850 L853 N875 P876 K881 Q882 W885 L889	F748-L879 HydrophobicContact CE2-CD1 3.99Å; F748-L879 HydrophobicContact CZ-CD1 3.72Å; C841-L879 HydrophobicContact CB-CD1 4.01Å; C841-L879 HydrophobicContact CB-CD2 4.31Å; I850-L879 HydrophobicContact CD1-CD2 4.01Å; I850-L879 HydrophobicContact CG2-CD2 4.39Å; L853-L879 HydrophobicContact CD1-CD2 3.97Å; N875-L879 WeakPolarHBondContact O-CG 3.31Å; N875-L879 PolarHBondContact O-N 3.05Å; P876-L879 PolarHBondContact O-N 2.92Å; L879-K881 PolarHBondContact O-N 3.19Å; L879-Q882 PolarHBondContact O-N 3.01Å; L879-W885 HydrophobicContact CB-CB 4.12Å; L879-W885 HydrophobicContact CB-CD2 4.29Å; L879-W885 HydrophobicContact CB-CE3 4.15Å; L879-W885 HydrophobicContact CB-CG 4.3Å; L879-W885 HydrophobicContact CD1-CE3 3.94Å; L879-W885 HydrophobicContact CD1-CZ3 4.01Å; L879-W885 HydrophobicContact CD2-CD2 3.93Å; L879-W885 HydrophobicContact CD2-CE3 4.05Å; L879-W885 HydrophobicContact CD2-CG 4.36Å; L879-W885 HydrophobicContact CD2-CZ2 4.47Å; L879-W885 HydrophobicContact CD2-CZ3 4.37Å; L879-W885 HydrophobicContact CG-CE3 4.27Å; L879-W885 WeakPolarHBondContact O-CB 3.38Å; L879-L889 HydrophobicContact CB-CD1 4.18Å
880	S	90.4	Very high	92.8	Very high	25 Å²	25	22.5 Å²	22.5	18%	0.175	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5.9	-176.2	69.1	0	0	0	0	115.1	P876 N886	P876-S880 VanDerWaalsContact O-CB 3.26Å; P876-S880 WeakPolarHBondContact O-CB 3.49Å; P876-S880 PolarHBondContact O-N 3.3Å; P876-S880 PolarHBondContact O-OG 2.77Å; P876-S880 VanDerWaalsContact O-OG 3.14Å; S880-N886 PolarHBondContact O-ND2 2.75Å; S880-N886 VanDerWaalsContact O-ND2 3.14Å
881	K	85.9	Confident	92.7	Very high	104 Å²	104	24 Å²	24	45%	0.452	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-28.1	173.3	-62.9	170.1	-173.6	166.4	0	112.3	N845 E846 K877 L879	N845-K881 PolarHBondContact O-NZ 3.15Å; E846-K881 VanDerWaalsContact C-NZ 3.26Å; E846-K881 PolarHBondContact O-NZ 3.21Å; K877-K881 WeakPolarHBondContact O-CE 3.42Å; L879-K881 PolarHBondContact O-N 3.19Å
882	Q	85	Confident	92.6	Very high	58 Å²	58	24.3 Å²	24.3	27%	0.271	12%	0.119	S	C	.	.	S	Bend	trans	-87	130	172.9	-81.9	-63	-6.2	0	0	110.6	I850 N854 L879 L884 W885 N886	I850-Q882 HydrophobicContact CD1-CB 4Å; I850-Q882 HydrophobicContact CD1-CG 3.59Å; I850-Q882 HydrophobicContact CG1-CG 3.79Å; N854-Q882 WeakPolarHBondContact OD1-CG 3.28Å; N854-Q882 PolarHBondContact OD1-NE2 2.68Å; L879-Q882 PolarHBondContact O-N 3.01Å; Q882-L884 VanDerWaalsContact C-N 3.3Å; Q882-L884 PolarHBondContact O-N 2.84Å; Q882-W885 HydrophobicContact CB-CB 4.3Å; Q882-W885 PolarHBondContact O-N 2.86Å; Q882-N886 WeakPolarHBondContact O-CB 3.49Å; Q882-N886 PolarHBondContact O-N 3.47Å
883	P	88.2	Confident	92.5	Very high	66 Å²	66	27.6 Å²	27.6	43%	0.429	13%	0.133	S	C	.	.	H	α-helix	trans	-54	-42.6	-176.8	-29.5	36.6	0	0	0	113.8	N886 H887 L919	P883-N886 WeakPolarHBondContact O-CB 3.45Å; P883-N886 PolarHBondContact O-N 3.47Å; P883-H887 PolarHBondContact O-N 2.84Å; P883-H887 PolarHBondContact O-ND1 3.5Å; P883-L919 HydrophobicContact CB-CD2 3.71Å
884	L	89.9	Confident	92.4	Very high	18 Å²	18	34.1 Å²	34.1	9%	0.094	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-43.5	-179.3	180	63.1	0	0	0	112.8	F711 I715 F716 P856 L859 Q882 N886 H887 L888 L919	F711-L884 HydrophobicContact CZ-CD1 4.45Å; I715-L884 HydrophobicContact CG2-CD1 3.6Å; F716-L884 HydrophobicContact CE1-CD1 4.22Å; F716-L884 HydrophobicContact CE1-CD2 4.26Å; F716-L884 HydrophobicContact CZ-CD1 4.12Å; F716-L884 HydrophobicContact CZ-CD2 4.24Å; P856-L884 VanDerWaalsContact CA-CD2 3.5Å; P856-L884 HydrophobicContact CB-CD2 3.67Å; P856-L884 HydrophobicContact CG-CD2 4.15Å; L859-L884 HydrophobicContact CB-CD2 4.34Å; L859-L884 HydrophobicContact CD2-CD2 3.77Å; L859-L884 HydrophobicContact CD2-CG 3.78Å; Q882-L884 VanDerWaalsContact C-N 3.3Å; Q882-L884 PolarHBondContact O-N 2.84Å; L884-N886 VanDerWaalsContact C-N 3.34Å; L884-H887 PolarHBondContact O-N 3.3Å; L884-L888 PolarHBondContact O-N 3.35Å; L884-L888 VanDerWaalsContact O-N 3.09Å; L884-L919 HydrophobicContact CD1-CD1 4.42Å
885	W	92.4	Very high	92.4	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.015	18%	0.176	C	C	.	.	H	α-helix	trans	-69.8	-32.3	176.1	-80.4	95.8	0	0	0	112.2	F748 L839 I850 L853 L859 I872 L879 Q882 L888 L889	F748-W885 HydrophobicContact CE2-CZ3 4.33Å; L839-W885 HydrophobicContact CD2-CH2 4.2Å; I850-W885 VanDerWaalsContact CD1-CD1 3.5Å; I850-W885 HydrophobicContact CD1-CG 4.21Å; L853-W885 HydrophobicContact CD2-CZ2 3.74Å; L853-W885 PolarHBondContact O-NE1 2.92Å; L859-W885 HydrophobicContact CD1-CH2 3.74Å; L859-W885 HydrophobicContact CD1-CZ2 3.61Å; L859-W885 HydrophobicContact CD1-CZ3 4.43Å; L859-W885 HydrophobicContact CD2-CD2 4.41Å; L859-W885 HydrophobicContact CD2-CZ2 4.38Å; L859-W885 HydrophobicContact CG-CZ2 4.49Å; I872-W885 HydrophobicContact CG2-CZ3 4.45Å; L879-W885 HydrophobicContact CB-CB 4.12Å; L879-W885 HydrophobicContact CB-CD2 4.29Å; L879-W885 HydrophobicContact CB-CE3 4.15Å; L879-W885 HydrophobicContact CB-CG 4.3Å; L879-W885 HydrophobicContact CD1-CE3 3.94Å; L879-W885 HydrophobicContact CD1-CZ3 4.01Å; L879-W885 HydrophobicContact CD2-CD2 3.93Å; L879-W885 HydrophobicContact CD2-CE3 4.05Å; L879-W885 HydrophobicContact CD2-CG 4.36Å; L879-W885 HydrophobicContact CD2-CZ2 4.47Å; L879-W885 HydrophobicContact CD2-CZ3 4.37Å; L879-W885 HydrophobicContact CG-CE3 4.27Å; L879-W885 WeakPolarHBondContact O-CB 3.38Å; Q882-W885 HydrophobicContact CB-CB 4.3Å; Q882-W885 PolarHBondContact O-N 2.86Å; W885-L888 HydrophobicContact CE3-CD2 3.78Å; W885-L888 HydrophobicContact CH2-CD2 4.45Å; W885-L888 HydrophobicContact CZ3-CD2 3.69Å; W885-L888 PolarHBondContact O-N 3.1Å; W885-L889 WeakPolarHBondContact O-CB 3.42Å; W885-L889 VanDerWaalsContact O-CG 3.31Å; W885-L889 WeakPolarHBondContact O-CG 3.48Å; W885-L889 PolarHBondContact O-N 3.36Å
886	N	93	Very high	92.6	Very high	8 Å²	8	41.4 Å²	41.4	4%	0.043	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-41.6	171	-175.2	-68.5	0	0	0	111.9	S880 Q882 P883 L884 N890 S914	S880-N886 PolarHBondContact O-ND2 2.75Å; S880-N886 VanDerWaalsContact O-ND2 3.14Å; Q882-N886 WeakPolarHBondContact O-CB 3.49Å; Q882-N886 PolarHBondContact O-N 3.47Å; P883-N886 WeakPolarHBondContact O-CB 3.45Å; P883-N886 PolarHBondContact O-N 3.47Å; L884-N886 VanDerWaalsContact C-N 3.34Å; N886-N890 WeakPolarHBondContact O-CB 3.49Å; N886-N890 PolarHBondContact O-N 3.33Å; N886-N890 PolarHBondContact O-ND2 2.8Å; N886-N890 PolarHBondContact OD1-ND2 3.31Å; N886-S914 PolarHBondContact ND2-O 2.78Å; N886-S914 PolarHBondContact ND2-OG 3.31Å; N886-S914 VanDerWaalsContact ND2-OG 3.08Å; N886-S914 PolarHBondContact OD1-O 2.72Å
887	H	93.3	Very high	92.9	Very high	34 Å²	34	41.4 Å²	41.4	16%	0.157	20%	0.196	C	C	.	.	H	α-helix	trans	-63.8	-43.2	171.8	-71.4	69.8	0	0	0	111.8	F711 P883 L884 N890 Y891 R917 L919	F711-H887 HydrophobicContact CE2-CB 4.12Å; F711-H887 HydrophobicContact CZ-CB 4.36Å; P883-H887 PolarHBondContact O-N 2.84Å; P883-H887 PolarHBondContact O-ND1 3.5Å; L884-H887 PolarHBondContact O-N 3.3Å; H887-N890 PolarHBondContact O-N 2.86Å; H887-Y891 WeakPolarHBondContact O-CB 3.48Å; H887-Y891 PolarHBondContact O-N 3.5Å; H887-R917 PolarHBondContact CE1-O 3.28Å; H887-L919 VanDerWaalsContact CE1-CG 3.48Å; H887-L919 WeakPolarHBondContact CE1-CG 3.21Å
888	L	95.6	Very high	93.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-45.2	178.7	-174	70.7	0	0	0	111.6	F711 L859 L863 I872 L884 W885 Y891 Y892	F711-L888 HydrophobicContact CD1-CD1 3.7Å; F711-L888 HydrophobicContact CD2-CD1 4.11Å; F711-L888 HydrophobicContact CE1-CB 4.31Å; F711-L888 HydrophobicContact CE1-CD1 3.61Å; F711-L888 HydrophobicContact CE2-CB 4.09Å; F711-L888 HydrophobicContact CE2-CD1 4.01Å; F711-L888 HydrophobicContact CG-CD1 3.96Å; F711-L888 HydrophobicContact CZ-CB 3.73Å; F711-L888 HydrophobicContact CZ-CD1 3.76Å; F711-L888 HydrophobicContact CZ-CG 4.37Å; L859-L888 HydrophobicContact CD1-CD2 4.28Å; L859-L888 HydrophobicContact CD2-CD2 4.32Å; L863-L888 HydrophobicContact CD1-CD1 4.01Å; L863-L888 HydrophobicContact CD2-CD1 4.47Å; I872-L888 HydrophobicContact CD1-CD2 3.97Å; L884-L888 PolarHBondContact O-N 3.35Å; L884-L888 VanDerWaalsContact O-N 3.09Å; W885-L888 HydrophobicContact CE3-CD2 3.78Å; W885-L888 HydrophobicContact CH2-CD2 4.45Å; W885-L888 HydrophobicContact CZ3-CD2 3.69Å; W885-L888 PolarHBondContact O-N 3.1Å; L888-Y891 PolarHBondContact O-N 3.05Å; L888-Y892 HydrophobicContact CD1-CD2 3.85Å; L888-Y892 HydrophobicContact CD1-CE2 3.53Å; L888-Y892 HydrophobicContact CG-CD2 4.13Å; L888-Y892 HydrophobicContact CG-CE2 4.17Å; L888-Y892 WeakPolarHBondContact O-CB 3.47Å; L888-Y892 VanDerWaalsContact O-CD2 3.29Å; L888-Y892 WeakPolarHBondContact O-CD2 3.49Å; L888-Y892 PolarHBondContact O-N 2.95Å
889	L	95.9	Very high	93.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.8	-42.4	178.9	-73.2	167.8	0	0	0	112.3	F748 P876 L879 W885 Y892 K893 L898 F913	F748-L889 HydrophobicContact CD1-CD2 4.23Å; F748-L889 HydrophobicContact CD2-CD2 3.87Å; F748-L889 HydrophobicContact CE1-CD2 4.17Å; F748-L889 HydrophobicContact CE2-CD2 3.78Å; F748-L889 HydrophobicContact CG-CD2 4.12Å; F748-L889 HydrophobicContact CZ-CD2 3.96Å; P876-L889 HydrophobicContact CB-CD1 3.97Å; P876-L889 HydrophobicContact CB-CD2 3.95Å; P876-L889 HydrophobicContact CG-CD2 4.22Å; L879-L889 HydrophobicContact CB-CD1 4.18Å; W885-L889 WeakPolarHBondContact O-CB 3.42Å; W885-L889 VanDerWaalsContact O-CG 3.31Å; W885-L889 WeakPolarHBondContact O-CG 3.48Å; W885-L889 PolarHBondContact O-N 3.36Å; L889-Y892 PolarHBondContact O-N 3.46Å; L889-K893 WeakPolarHBondContact O-CB 3.44Å; L889-K893 PolarHBondContact O-N 2.86Å; L889-L898 HydrophobicContact CD2-CD1 4.18Å; L889-F913 HydrophobicContact CB-CD2 4.25Å; L889-F913 HydrophobicContact CB-CE2 3.96Å; L889-F913 HydrophobicContact CB-CZ 4.21Å; L889-F913 HydrophobicContact CD1-CE1 4.27Å; L889-F913 HydrophobicContact CD1-CZ 4.4Å; L889-F913 HydrophobicContact CD2-CZ 4.44Å
890	N	95.1	Very high	94	Very high	23 Å²	23	38.1 Å²	38.1	12%	0.123	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-45.4	174.4	-79.7	-62.2	0	0	0	111.4	N886 H887 Y892 K893 E894 S914	N886-N890 WeakPolarHBondContact O-CB 3.49Å; N886-N890 PolarHBondContact O-N 3.33Å; N886-N890 PolarHBondContact O-ND2 2.8Å; N886-N890 PolarHBondContact OD1-ND2 3.31Å; H887-N890 PolarHBondContact O-N 2.86Å; N890-Y892 PolarHBondContact O-N 3.42Å; N890-K893 WeakPolarHBondContact O-CB 3.16Å; N890-K893 PolarHBondContact O-N 2.92Å; N890-K893 VanDerWaalsContact O-N 3.1Å; N890-E894 WeakPolarHBondContact O-CG 3.31Å; N890-E894 PolarHBondContact O-N 3.15Å; N890-S914 PolarHBondContact ND2-O 2.92Å
891	Y	96.2	Very high	94.2	Very high	36 Å²	36	38 Å²	38	14%	0.141	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-46.8	174.8	175	-105	0	0	0	112.4	F711 M746 H887 L888 K893 E894 Q895	F711-Y891 HydrophobicContact CB-CD1 3.83Å; F711-Y891 HydrophobicContact CB-CE1 3.71Å; F711-Y891 HydrophobicContact CB-CG 4.47Å; F711-Y891 AromaticContact CD2-CD1 3.79Å; F711-Y891 HydrophobicContact CD2-CD1 3.79Å; F711-Y891 AromaticContact CD2-CG 3.83Å; F711-Y891 HydrophobicContact CD2-CG 3.83Å; F711-Y891 HydrophobicContact CG-CD1 4.16Å; M746-Y891 HydrophobicContact CE-CE1 3.89Å; H887-Y891 WeakPolarHBondContact O-CB 3.48Å; H887-Y891 PolarHBondContact O-N 3.5Å; L888-Y891 PolarHBondContact O-N 3.05Å; Y891-K893 VanDerWaalsContact C-N 3.26Å; Y891-K893 PolarHBondContact O-N 2.9Å; Y891-E894 PolarHBondContact O-N 2.86Å; Y891-Q895 HydrophobicContact CD2-CG 4.08Å; Y891-Q895 HydrophobicContact CE1-CG 4.14Å; Y891-Q895 HydrophobicContact CE2-CG 3.68Å; Y891-Q895 HydrophobicContact CG-CG 4.47Å; Y891-Q895 WeakPolarHBondContact O-CB 3.33Å; Y891-Q895 VanDerWaalsContact O-CG 3.27Å; Y891-Q895 WeakPolarHBondContact O-CG 3.04Å; Y891-Q895 PolarHBondContact O-N 2.86Å
892	Y	97.4	Very high	94.5	Very high	8 Å²	8	36.2 Å²	36.2	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-63.9	-31.7	176.8	-88.8	-116.3	0	0	0	112.3	M746 F748 I872 L888 L889 N890 K896 V897 L898	M746-Y892 HydrophobicContact CB-CE1 4.23Å; M746-Y892 HydrophobicContact CG-CE1 4.24Å; M746-Y892 HydrophobicContact SD-CE1 4.41Å; M746-Y892 HydrophobicContact SD-CE2 4.38Å; F748-Y892 HydrophobicContact CB-CD1 3.63Å; F748-Y892 HydrophobicContact CB-CE1 4.26Å; F748-Y892 HydrophobicContact CB-CG 4.23Å; I872-Y892 HydrophobicContact CD1-CE1 4.3Å; L888-Y892 HydrophobicContact CD1-CD2 3.85Å; L888-Y892 HydrophobicContact CD1-CE2 3.53Å; L888-Y892 HydrophobicContact CG-CD2 4.13Å; L888-Y892 HydrophobicContact CG-CE2 4.17Å; L888-Y892 WeakPolarHBondContact O-CB 3.47Å; L888-Y892 VanDerWaalsContact O-CD2 3.29Å; L888-Y892 WeakPolarHBondContact O-CD2 3.49Å; L888-Y892 PolarHBondContact O-N 2.95Å; L889-Y892 PolarHBondContact O-N 3.46Å; N890-Y892 PolarHBondContact O-N 3.42Å; Y892-K896 PolarHBondContact O-N 2.91Å; Y892-V897 HydrophobicContact CD1-CG2 3.65Å; Y892-V897 HydrophobicContact CE1-CG2 4.3Å; Y892-V897 HydrophobicContact CG-CG2 4.01Å; Y892-V897 CarbonylContact O-C 3.59Å; Y892-V897 WeakPolarHBondContact O-CG2 3.34Å; Y892-V897 PolarHBondContact O-N 2.65Å; Y892-L898 PolarHBondContact O-N 3.03Å; Y892-L898 VanDerWaalsContact O-N 3.11Å
893	K	95.9	Very high	94.9	Very high	69 Å²	69	34.4 Å²	34.4	30%	0.3	18%	0.176	S	C	.	.	H	α-helix	trans	-71.5	-48.1	174.1	-166.2	175.2	-175.1	177.8	0	112.3	L889 N890 Y891 Q895 K896 L898 M911 F913	L889-K893 WeakPolarHBondContact O-CB 3.44Å; L889-K893 PolarHBondContact O-N 2.86Å; N890-K893 WeakPolarHBondContact O-CB 3.16Å; N890-K893 PolarHBondContact O-N 2.92Å; N890-K893 VanDerWaalsContact O-N 3.1Å; Y891-K893 VanDerWaalsContact C-N 3.26Å; Y891-K893 PolarHBondContact O-N 2.9Å; K893-Q895 PolarHBondContact O-N 3.33Å; K893-K896 WeakPolarHBondContact O-CA 3.2Å; K893-K896 PolarHBondContact O-N 3.47Å; K893-L898 HydrophobicContact CB-CB 4.21Å; K893-L898 HydrophobicContact CB-CD2 3.92Å; K893-L898 HydrophobicContact CD-CD2 4.23Å; K893-L898 HydrophobicContact CG-CD2 4.14Å; K893-M911 PolarHBondContact NZ-O 2.93Å; K893-F913 HydrophobicContact CD-CE2 4.4Å
894	E	95.6	Very high	95.1	Very high	136 Å²	136	37.9 Å²	37.9	64%	0.636	19%	0.191	S	C	*	.	H	α-helix	trans	-57.3	-38.1	174.9	-72.2	166.5	-169.2	0	0	112.1	N890 Y891 K896	N890-E894 WeakPolarHBondContact O-CG 3.31Å; N890-E894 PolarHBondContact O-N 3.15Å; Y891-E894 PolarHBondContact O-N 2.86Å; E894-K896 PolarHBondContact O-N 2.61Å
895	Q	96.5	Very high	95.3	Very high	57 Å²	57	42.9 Å²	42.9	27%	0.266	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.6	176.6	-67.1	-52.9	-42.3	0	0	114.6	K744 Y891 K893 V897	K744-Q895 HydrophobicContact CD-CB 4.29Å; K744-Q895 PolarHBondContact NZ-O 2.83Å; Y891-Q895 HydrophobicContact CD2-CG 4.08Å; Y891-Q895 HydrophobicContact CE1-CG 4.14Å; Y891-Q895 HydrophobicContact CE2-CG 3.68Å; Y891-Q895 HydrophobicContact CG-CG 4.47Å; Y891-Q895 WeakPolarHBondContact O-CB 3.33Å; Y891-Q895 VanDerWaalsContact O-CG 3.27Å; Y891-Q895 WeakPolarHBondContact O-CG 3.04Å; Y891-Q895 PolarHBondContact O-N 2.86Å; K893-Q895 PolarHBondContact O-N 3.33Å; Q895-V897 HydrophobicContact CB-CG2 3.91Å
896	K	97.6	Very high	95.5	Very high	109 Å²	109	44.6 Å²	44.6	47%	0.474	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	35.5	-176.5	-58.3	-171.7	167.4	-157.7	0	115	Q741 Y892 K893 E894 E908	Q741-K896 HydrophobicContact CG-CB 4.14Å; Q741-K896 VanDerWaalsContact CG-O 3.3Å; Q741-K896 WeakPolarHBondContact CG-O 3.2Å; Q741-K896 VanDerWaalsContact NE2-CB 3.29Å; Q741-K896 PolarHBondContact NE2-O 3.36Å; Y892-K896 PolarHBondContact O-N 2.91Å; K893-K896 WeakPolarHBondContact O-CA 3.2Å; K893-K896 PolarHBondContact O-N 3.47Å; E894-K896 PolarHBondContact O-N 2.61Å; K896-E908 IonicContact NZ-OE1 3.74Å
897	V	97.9	Very high	95.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.			trans	-125.4	16.5	-178.9	-63.6	0	0	0	0	113.1	Q741 K744 M746 F747 F748 Y892 Q895	Q741-V897 HydrophobicContact CB-CG1 3.9Å; Q741-V897 HydrophobicContact CG-CG1 3.6Å; K744-V897 HydrophobicContact CB-CG1 4.25Å; K744-V897 HydrophobicContact CD-CG1 4.35Å; M746-V897 HydrophobicContact CE-CG2 4.36Å; M746-V897 HydrophobicContact CG-CG2 4.38Å; M746-V897 WeakPolarHBondContact O-CB 3.44Å; M746-V897 WeakPolarHBondContact O-CG1 3.42Å; F747-V897 CarbonylContact C-O 3.48Å; F747-V897 VanDerWaalsContact CA-O 3.23Å; F747-V897 WeakPolarHBondContact CA-O 3.06Å; F747-V897 HydrophobicContact CB-CB 4.22Å; F747-V897 VanDerWaalsContact CB-O 3.28Å; F747-V897 WeakPolarHBondContact CB-O 3.47Å; F748-V897 PolarHBondContact N-O 2.97Å; Y892-V897 HydrophobicContact CD1-CG2 3.65Å; Y892-V897 HydrophobicContact CE1-CG2 4.3Å; Y892-V897 HydrophobicContact CG-CG2 4.01Å; Y892-V897 CarbonylContact O-C 3.59Å; Y892-V897 WeakPolarHBondContact O-CG2 3.34Å; Y892-V897 PolarHBondContact O-N 2.65Å; Q895-V897 HydrophobicContact CB-CG2 3.91Å
898	L	98	Very high	95.8	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.016	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	109.3	164.3	177.4	67	0	0	0	108.7	F748 V750 L889 Y892 K893 E908 S909 F913	F748-L898 HydrophobicContact CB-CD1 3.82Å; F748-L898 HydrophobicContact CD1-CD1 3.53Å; F748-L898 HydrophobicContact CE1-CD1 4.44Å; F748-L898 HydrophobicContact CG-CD1 3.87Å; V750-L898 HydrophobicContact CG2-CD1 3.61Å; V750-L898 HydrophobicContact CG2-CG 4.2Å; L889-L898 HydrophobicContact CD2-CD1 4.18Å; Y892-L898 PolarHBondContact O-N 3.03Å; Y892-L898 VanDerWaalsContact O-N 3.11Å; K893-L898 HydrophobicContact CB-CB 4.21Å; K893-L898 HydrophobicContact CB-CD2 3.92Å; K893-L898 HydrophobicContact CD-CD2 4.23Å; K893-L898 HydrophobicContact CG-CD2 4.14Å; L898-E908 WeakPolarHBondContact O-CA 3.31Å; L898-S909 PolarHBondContact O-N 2.84Å; L898-F913 HydrophobicContact CD2-CE2 3.54Å; L898-F913 HydrophobicContact CD2-CZ 3.79Å
899	V	97.9	Very high	95.7	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.3	-165.3	-63.7	0	0	0	0	114.3	P740 F747 F748 Y749 V750 L906 R907	P740-V899 HydrophobicContact CB-CG1 3.89Å; P740-V899 HydrophobicContact CG-CG1 4.04Å; P740-V899 HydrophobicContact CG-CG2 4.13Å; F747-V899 HydrophobicContact CB-CG2 4.01Å; F747-V899 HydrophobicContact CD2-CG2 3.5Å; F747-V899 VanDerWaalsContact CD2-CG2 3.5Å; F747-V899 HydrophobicContact CE2-CG2 4.31Å; F747-V899 HydrophobicContact CG-CG2 4.09Å; F748-V899 PolarHBondContact O-N 3.14Å; Y749-V899 WeakPolarHBondContact CA-O 3.45Å; V750-V899 WeakPolarHBondContact CG2-O 3.48Å; V750-V899 PolarHBondContact N-O 2.8Å; V899-L906 HydrophobicContact CB-CB 4.41Å; V899-L906 HydrophobicContact CG2-CD1 4.28Å; V899-L906 HydrophobicContact CG2-CD2 4.23Å; V899-R907 CarbonylContact C-O 3.45Å; V899-R907 WeakPolarHBondContact CA-O 3.3Å; V899-R907 WeakPolarHBondContact CB-O 3.46Å
900	E	95.9	Very high	95.5	Very high	39 Å²	39	61 Å²	61	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	-177.9	179.8	62.2	173.7	-113.8	0	0	110.6	V750 R907 S909	V750-E900 HydrophobicContact CB-CB 4.15Å; E900-R907 HydrophobicContact CG-CG 3.69Å; E900-R907 PolarHBondContact N-O 2.94Å; E900-R907 PolarHBondContact O-N 3.33Å; E900-R907 IonicContact OE1-CZ 3.11Å; E900-R907 IonicContact OE1-NE 3.77Å; E900-R907 PolarHBondContact OE1-NE 2.83Å; E900-R907 IonicContact OE1-NH2 2.86Å; E900-R907 PolarHBondContact OE1-NH2 3.17Å; E900-S909 WeakPolarHBondContact OE2-CA 3.12Å; E900-S909 WeakPolarHBondContact OE2-CB 3.49Å; E900-S909 PolarHBondContact OE2-OG 3.04Å
901	G	94	Very high	95.2	Very high	22 Å²	22	61.6 Å²	61.6	23%	0.227	30%	0.304	C	S	.	.	S	Bend	trans	84.3	-174.8	-174.2	0	0	0	0	0	112.4	Y749	Y749-G901 VanDerWaalsContact CE2-O 3.24Å; Y749-G901 WeakPolarHBondContact CE2-O 3.5Å; Y749-G901 PolarHBondContact OH-O 2.83Å; Y749-G901 VanDerWaalsContact OH-O 3.06Å
902	P	94	Very high	94.6	Very high	68 Å²	68	68.2 Å²	68.2	44%	0.442	34%	0.337	S	S	.	.			trans	-77.4	150.2	-177.5	33.5	-36.6	0	0	0	112	N904 N905 L906	P902-N904 WeakPolarHBondContact CB-OD1 3.42Å; P902-N904 WeakPolarHBondContact CG-OD1 3.48Å; P902-N904 PolarHBondContact O-N 2.97Å; P902-N905 HydrophobicContact CG-CB 4.29Å; P902-N905 CarbonylContact O-C 3.53Å; P902-N905 PolarHBondContact O-N 3.38Å; P902-L906 PolarHBondContact O-N 3.2Å
903	L	92.5	Very high	94	Very high	19 Å²	19	69.6 Å²	69.6	10%	0.099	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-7.8	-175.4	-62.6	177.7	0	0	0	116	Y749 K775 I776 K779 L906	Y749-L903 HydrophobicContact CD1-CD2 4.16Å; Y749-L903 HydrophobicContact CD2-CD2 4.29Å; Y749-L903 HydrophobicContact CE1-CD2 3.68Å; Y749-L903 HydrophobicContact CE1-CG 4.31Å; Y749-L903 HydrophobicContact CE2-CD2 3.85Å; Y749-L903 HydrophobicContact CG-CD2 4.45Å; K775-L903 HydrophobicContact CB-CD1 3.56Å; I776-L903 HydrophobicContact CG1-CD1 3.74Å; I776-L903 HydrophobicContact CG1-CD2 4Å; K779-L903 HydrophobicContact CD-CB 3.79Å; K779-L903 HydrophobicContact CD-CD1 4.26Å; K779-L903 PolarHBondContact NZ-O 2.73Å; L903-L906 HydrophobicContact CD2-CD2 4.35Å
904	N	92.6	Very high	93.3	Very high	140 Å²	140	70.1 Å²	70.1	75%	0.749	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-12.7	173.1	65.5	-27	0	0	0	113.4	P902	P902-N904 WeakPolarHBondContact CB-OD1 3.42Å; P902-N904 WeakPolarHBondContact CG-OD1 3.48Å; P902-N904 PolarHBondContact O-N 2.97Å
905	N	94.6	Very high	92.4	Very high	122 Å²	122	72.7 Å²	72.7	65%	0.652	36%	0.364	S	S	*	.	S	Bend	trans	-149.7	68.8	178.8	-172	20.8	0	0	0	109.5	P902	P902-N905 HydrophobicContact CG-CB 4.29Å; P902-N905 CarbonylContact O-C 3.53Å; P902-N905 PolarHBondContact O-N 3.38Å
906	L	95.9	Very high	91.4	Very high	41 Å²	41	72.6 Å²	72.6	22%	0.215	37%	0.369	C	S	.	.			trans	-75.3	138.3	-179.7	-71.1	171.3	0	0	0	110.7	P740 F747 Y749 V899 P902 L903	P740-L906 HydrophobicContact CG-CD1 3.98Å; F747-L906 HydrophobicContact CE2-CD1 4.16Å; F747-L906 HydrophobicContact CZ-CD1 4.38Å; Y749-L906 HydrophobicContact CD2-CD2 3.89Å; Y749-L906 HydrophobicContact CE2-CD2 3.53Å; V899-L906 HydrophobicContact CB-CB 4.41Å; V899-L906 HydrophobicContact CG2-CD1 4.28Å; V899-L906 HydrophobicContact CG2-CD2 4.23Å; P902-L906 PolarHBondContact O-N 3.2Å; L903-L906 HydrophobicContact CD2-CD2 4.35Å
907	R	95.6	Very high	90.3	Very high	145 Å²	145	77.8 Å²	77.8	55%	0.547	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	152.4	175.8	65.2	-178.2	-178.6	-122.8	-0.6	110.9	V899 E900	V899-R907 CarbonylContact C-O 3.45Å; V899-R907 WeakPolarHBondContact CA-O 3.3Å; V899-R907 WeakPolarHBondContact CB-O 3.46Å; E900-R907 HydrophobicContact CG-CG 3.69Å; E900-R907 PolarHBondContact N-O 2.94Å; E900-R907 PolarHBondContact O-N 3.33Å; E900-R907 IonicContact OE1-CZ 3.11Å; E900-R907 IonicContact OE1-NE 3.77Å; E900-R907 PolarHBondContact OE1-NE 2.83Å; E900-R907 IonicContact OE1-NH2 2.86Å; E900-R907 PolarHBondContact OE1-NH2 3.17Å
908	E	96.3	Very high	88.8	Confident	89 Å²	89	87 Å²	87	42%	0.416	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	135.9	171.5	-65.5	-173.7	-129.8	0	0	110.3	K896 L898	K896-E908 IonicContact NZ-OE1 3.74Å; L898-E908 WeakPolarHBondContact O-CA 3.31Å
909	S	94.7	Very high	87.1	Confident	4 Å²	4	89 Å²	89	3%	0.028	44%	0.436	C	S	.	.			trans	-82.4	128.8	179.9	-172.8	0	0	0	0	111.7	L898 E900 M911	L898-S909 PolarHBondContact O-N 2.84Å; E900-S909 WeakPolarHBondContact OE2-CA 3.12Å; E900-S909 WeakPolarHBondContact OE2-CB 3.49Å; E900-S909 PolarHBondContact OE2-OG 3.04Å; S909-M911 PolarHBondContact O-N 3.14Å
910	L	91	Very high	85	Confident	150 Å²	150	94.5 Å²	94.5	79%	0.785	47%	0.469	S	S	*	.			trans	-76.5	-6.6	-178.8	-59.2	-179.2	0	0	0	113.4	Q912	L910-Q912 PolarHBondContact O-N 3.49Å
911	M	89.1	Confident	82.7	Confident	34 Å²	34	94.7 Å²	94.7	17%	0.167	47%	0.471	C	S	.	.			trans	-49.8	130.5	-180	-73.1	-174.3	66.9	0	0	112.4	V750 P876 K877 K893 S909 F913	V750-M911 HydrophobicContact CG1-SD 3.73Å; P876-M911 HydrophobicContact CB-CE 3.81Å; P876-M911 HydrophobicContact CB-SD 4.3Å; P876-M911 HydrophobicContact CG-CE 4.17Å; P876-M911 HydrophobicContact CG-SD 4.04Å; K877-M911 HydrophobicContact CG-CE 3.56Å; K893-M911 PolarHBondContact NZ-O 2.93Å; S909-M911 PolarHBondContact O-N 3.14Å; M911-F913 HydrophobicContact CB-CE1 4.39Å; M911-F913 HydrophobicContact CB-CZ 4.17Å; M911-F913 HydrophobicContact CE-CE1 4.36Å
912	Q	84.1	Confident	80.3	Confident	176 Å²	176	99.7 Å²	99.7	82%	0.822	50%	0.498	S	S	*	.			trans	-97.5	149.9	177.8	-59	-173.4	12.5	0	0	110.8	L910	L910-Q912 PolarHBondContact O-N 3.49Å
913	F	84.4	Confident	77.9	Confident	36 Å²	36	103.3 Å²	103.3	16%	0.158	51%	0.512	C	S	.	.			trans	-129	157.3	176.6	-50.2	-61.5	0	0	0	109.4	P876 L889 K893 L898 M911	P876-F913 HydrophobicContact CB-CE1 3.6Å; P876-F913 HydrophobicContact CB-CZ 3.76Å; L889-F913 HydrophobicContact CB-CD2 4.25Å; L889-F913 HydrophobicContact CB-CE2 3.96Å; L889-F913 HydrophobicContact CB-CZ 4.21Å; L889-F913 HydrophobicContact CD1-CE1 4.27Å; L889-F913 HydrophobicContact CD1-CZ 4.4Å; L889-F913 HydrophobicContact CD2-CZ 4.44Å; K893-F913 HydrophobicContact CD-CE2 4.4Å; L898-F913 HydrophobicContact CD2-CE2 3.54Å; L898-F913 HydrophobicContact CD2-CZ 3.79Å; M911-F913 HydrophobicContact CB-CE1 4.39Å; M911-F913 HydrophobicContact CB-CZ 4.17Å; M911-F913 HydrophobicContact CE-CE1 4.36Å
914	S	81.6	Confident	75.6	Confident	81 Å²	81	104.5 Å²	104.5	57%	0.566	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-60.6	147.7	164.4	47.6	0	0	0	0	110.4	N886 N890	N886-S914 PolarHBondContact ND2-O 2.78Å; N886-S914 PolarHBondContact ND2-OG 3.31Å; N886-S914 VanDerWaalsContact ND2-OG 3.08Å; N886-S914 PolarHBondContact OD1-O 2.72Å; N890-S914 PolarHBondContact ND2-O 2.92Å
915	K	77.1	Confident	72.9	Confident	189 Å²	189	102.5 Å²	102.5	82%	0.822	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-59.8	139.8	172.5	-69.6	-176	179.1	178.5	0	109.7	R917	K915-R917 PolarHBondContact O-N 3.11Å
916	P	75.6	Confident	70.2	Confident	56 Å²	56	99.5 Å²	99.5	36%	0.364	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-63.5	125.6	179.2	23.8	-31.7	0	0	0	111
917	R	73.2	Confident	67.6	Low	217 Å²	217	99.2 Å²	99.2	82%	0.819	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-79.2	148.2	169.8	-63.6	-176.3	177.3	-167.6	-2	109.4	H887 K915 L919	H887-R917 PolarHBondContact CE1-O 3.28Å; K915-R917 PolarHBondContact O-N 3.11Å; R917-L919 PolarHBondContact O-N 3.39Å
918	K	66.4	Low	65.4	Low	194 Å²	194	98.8 Å²	98.8	84%	0.843	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-50.1	131.4	176.9	-72.1	-174	179	178.8	0	111.2	V920	K918-V920 PolarHBondContact O-N 3.42Å
919	L	62	Low	62.9	Low	44 Å²	44	97.6 Å²	97.6	23%	0.23	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-71.8	119.8	174.6	-65.5	172.5	0	0	0	109.8	I715 P883 L884 H887 R917	I715-L919 HydrophobicContact CD1-CD1 4.31Å; I715-L919 HydrophobicContact CG2-CD1 4.15Å; P883-L919 HydrophobicContact CB-CD2 3.71Å; L884-L919 HydrophobicContact CD1-CD1 4.42Å; H887-L919 VanDerWaalsContact CE1-CG 3.48Å; H887-L919 WeakPolarHBondContact CE1-CG 3.21Å; R917-L919 PolarHBondContact O-N 3.39Å
920	V	54.1	Low	60.1	Low	119 Å²	119	102.4 Å²	102.4	72%	0.721	53%	0.53	S	S	*	.			trans	-113	129.3	172.4	-177.7	0	0	0	0	107.9	K918 T922	K918-V920 PolarHBondContact O-N 3.42Å; V920-T922 PolarHBondContact O-N 3.47Å
921	N	48.5	Very low	57.2	Low	42 Å²	42	100.8 Å²	100.8	23%	0.225	53%	0.526	C	S	.	.			trans	-82.3	103.5	176	-174.7	7.4	0	0	0	110.2	I923 A927 F929	N921-I923 PolarHBondContact OD1-N 2.8Å; N921-A927 PolarHBondContact ND2-O 2.93Å; N921-F929 HydrophobicContact CB-CD2 4.02Å
922	T	42.5	Very low	54.4	Low	127 Å²	127	105.9 Å²	105.9	78%	0.779	56%	0.56	S	S	*	*			trans	-82.5	-13.6	178	52.2	0	0	0	0	113.9	V920	V920-T922 PolarHBondContact O-N 3.47Å
923	I	43.6	Very low	51.7	Low	144 Å²	144	101.4 Å²	101.4	74%	0.738	55%	0.552	S	S	*	*	S	Bend	trans	-84.8	-28.2	-172.3	-62.8	175.3	0	0	0	111.8	N921	N921-I923 PolarHBondContact OD1-N 2.8Å
924	N	44.7	Very low	49.3	Very low	45 Å²	45	106.9 Å²	106.9	24%	0.241	58%	0.58	C	S	.	*			trans	-151.3	101.5	-177.9	-175.6	-18.4	0	0	0	110.5	G926 A927	N924-G926 PolarHBondContact O-N 2.94Å; N924-G926 VanDerWaalsContact O-N 3.08Å; N924-G926 PolarHBondContact OD1-N 3.05Å; N924-A927 HydrophobicContact CB-CB 3.94Å; N924-A927 PolarHBondContact O-N 3.39Å; N924-A927 PolarHBondContact OD1-N 3.32Å
925	P	36.2	Very low	46.8	Very low	97 Å²	97	109.8 Å²	109.8	63%	0.63	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-19.4	-174.9	-27.6	36.1	0	0	0	115.9	R928	P925-R928 VanDerWaalsContact O-CG 3.32Å; P925-R928 WeakPolarHBondContact O-CG 3.36Å; P925-R928 PolarHBondContact O-NE 3.29Å
926	G	37.4	Very low	44.6	Very low	59 Å²	59	105.1 Å²	105.1	61%	0.608	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-27.5	174.5	0	0	0	0	0	114	N924 R928	N924-G926 PolarHBondContact O-N 2.94Å; N924-G926 VanDerWaalsContact O-N 3.08Å; N924-G926 PolarHBondContact OD1-N 3.05Å; G926-R928 PolarHBondContact O-N 2.59Å
927	A	42.7	Very low	42.8	Very low	36 Å²	36	105.8 Å²	105.8	30%	0.298	57%	0.574	S	S	.	*	S	Bend	trans	-85.9	61.1	177.1	0	0	0	0	0	111.1	N921 N924 F929	N921-A927 PolarHBondContact ND2-O 2.93Å; N924-A927 HydrophobicContact CB-CB 3.94Å; N924-A927 PolarHBondContact O-N 3.39Å; N924-A927 PolarHBondContact OD1-N 3.32Å; A927-F929 PolarHBondContact O-N 3.49Å
928	R	47.4	Very low	41	Very low	136 Å²	136	104.9 Å²	104.9	51%	0.513	57%	0.571	S	S	.	*			trans	-73.1	115.4	-177.1	-60.9	-170.7	179.7	-166.6	3.3	110.1	P925 G926 M930 Y935	P925-R928 VanDerWaalsContact O-CG 3.32Å; P925-R928 WeakPolarHBondContact O-CG 3.36Å; P925-R928 PolarHBondContact O-NE 3.29Å; G926-R928 PolarHBondContact O-N 2.59Å; R928-M930 PolarHBondContact O-N 2.9Å; R928-Y935 VanDerWaalsContact CZ-CE2 3.41Å; R928-Y935 VanDerWaalsContact NH2-CZ 3.31Å; R928-Y935 PolarHBondContact NH2-OH 3.04Å
929	F	44.5	Very low	39.4	Very low	63 Å²	63	102.1 Å²	102.1	28%	0.276	56%	0.561	S	S	.	*	S	Bend	trans	-67	-0.9	-178.3	-92.4	-93.2	0	0	0	115	F716 N921 A927	F716-F929 HydrophobicContact CB-CE1 4.48Å; F716-F929 HydrophobicContact CD1-CE1 4.06Å; N921-F929 HydrophobicContact CB-CD2 4.02Å; A927-F929 PolarHBondContact O-N 3.49Å
930	M	36.5	Very low	38.3	Very low	106 Å²	106	104.3 Å²	104.3	52%	0.522	59%	0.585	S	S	.	*	S	Bend	trans	-149.3	146.8	169.6	-59.3	-176.8	-163.4	0	0	110.9	R928	R928-M930 PolarHBondContact O-N 2.9Å
931	T	29.6	Very low	37.3	Very low	115 Å²	115	105.3 Å²	105.3	71%	0.706	59%	0.585	S	S	*	*			trans	89.3	128.7	165.3	-27.9	0	0	0	0	117.1	A933	T931-A933 VanDerWaalsContact C-N 3.27Å; T931-A933 PolarHBondContact O-N 3.43Å; T931-A933 VanDerWaalsContact O-N 3.15Å
932	T	30.4	Very low	36.6	Very low	142 Å²	142	110 Å²	110	87%	0.871	61%	0.609	S	S	*	*			trans	-78.6	14.5	-171.2	-11.7	0	0	0	0	116.1
933	A	28.4	Very low	35.8	Very low	81 Å²	81	110 Å²	110	67%	0.669	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-78.1	126.4	-175	0	0	0	0	0	111.4	T931	T931-A933 VanDerWaalsContact C-N 3.27Å; T931-A933 PolarHBondContact O-N 3.43Å; T931-A933 VanDerWaalsContact O-N 3.15Å
934	M	33.5	Very low	35.4	Very low	151 Å²	151	106.6 Å²	106.6	74%	0.744	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-76.7	139.9	174.7	-57	-172.7	-165	0	0	110.3
935	Y	28.1	Very low	34.6	Very low	142 Å²	142	109 Å²	109	56%	0.557	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-85.7	134.3	151.6	-90.2	-102.6	0	0	0	108.3	R928 E939	R928-Y935 VanDerWaalsContact CZ-CE2 3.41Å; R928-Y935 VanDerWaalsContact NH2-CZ 3.31Å; R928-Y935 PolarHBondContact NH2-OH 3.04Å; Y935-E939 HydrophobicContact CD1-CB 4.32Å; Y935-E939 VanDerWaalsContact CD1-OE2 3.3Å; Y935-E939 WeakPolarHBondContact CD1-OE2 3.5Å; Y935-E939 WeakPolarHBondContact CE1-OE2 3.35Å
936	D	30.7	Very low	34.4	Very low	91 Å²	91	110.9 Å²	110.9	49%	0.487	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-72	142.3	161.7	-170.4	-3.8	0	0	0	108.1	R938 E939	D936-R938 PolarHBondContact O-N 2.99Å; D936-R938 WeakPolarHBondContact OD2-CD 3.2Å; D936-R938 IonicContact OD2-NH1 3.09Å; D936-E939 PolarHBondContact O-N 3.34Å
937	A	38.5	Very low	34.1	Very low	71 Å²	71	118.5 Å²	118.5	59%	0.587	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-64.8	-8.6	-178.6	0	0	0	0	0	113.2
938	R	36	Very low	33.5	Very low	197 Å²	197	123.7 Å²	123.7	74%	0.743	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-73.7	-21.1	177.6	-70.3	179.6	165.4	157.7	-8.5	115.4	D936 I941	D936-R938 PolarHBondContact O-N 2.99Å; D936-R938 WeakPolarHBondContact OD2-CD 3.2Å; D936-R938 IonicContact OD2-NH1 3.09Å; R938-I941 WeakPolarHBondContact O-CG1 3.31Å
939	E	33	Very low	32.6	Very low	137 Å²	137	129 Å²	129	64%	0.64	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-85.9	-7.6	-178.1	-65.8	-172.4	163	0	0	113.5	Y935 D936 I941	Y935-E939 HydrophobicContact CD1-CB 4.32Å; Y935-E939 VanDerWaalsContact CD1-OE2 3.3Å; Y935-E939 WeakPolarHBondContact CD1-OE2 3.5Å; Y935-E939 WeakPolarHBondContact CE1-OE2 3.35Å; D936-E939 PolarHBondContact O-N 3.34Å; E939-I941 PolarHBondContact O-N 2.97Å
940	A	37.7	Very low	31.9	Very low	89 Å²	89	131.1 Å²	131.1	74%	0.736	72%	0.718	S	S	*	*			trans	-84.9	53.4	177.9	0	0	0	0	0	112.6
941	I	32.5	Very low	31.4	Very low	141 Å²	141	131.4 Å²	131.4	72%	0.723	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-88.2	125.2	179.8	-60.3	178.3	0	0	0	110.4	R938 E939	R938-I941 WeakPolarHBondContact O-CG1 3.31Å; E939-I941 PolarHBondContact O-N 2.97Å
942	I	33.8	Very low	31.4	Very low	141 Å²	141	135.1 Å²	135.1	72%	0.723	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-84.5	133.4	172	-57.9	175.3	0	0	0	108.8	G944	I942-G944 PolarHBondContact O-N 2.79Å
943	P	25.6	Very low	31.2	Very low	127 Å²	127	132.1 Å²	132.1	83%	0.825	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	133.4	172.8	-22.4	33.5	0	0	0	112
944	G	37.2	Very low	31	Very low	71 Å²	71	139.4 Å²	139.4	73%	0.732	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	104.8	14.1	170.6	0	0	0	0	0	117.4	I942 V946	I942-G944 PolarHBondContact O-N 2.79Å; G944-V946 PolarHBondContact O-N 3.47Å
945	S	27.9	Very low	31.1	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	75%	0.751	S	S	*	*			trans	-64.1	132.5	170.4	-173.9	0	0	0	0	111.7	Y947	S945-Y947 VanDerWaalsContact C-N 3.28Å; S945-Y947 PolarHBondContact O-N 3.36Å
946	V	31.3	Very low	31	Very low	136 Å²	136	136 Å²	136	82%	0.824	76%	0.756	S	S	*	*			trans	-81.1	-4.8	-172.7	178.8	0	0	0	0	113	G944 D948	G944-V946 PolarHBondContact O-N 3.47Å; V946-D948 PolarHBondContact O-N 2.78Å
947	Y	30.8	Very low	30.7	Very low	220 Å²	220	137.3 Å²	137.3	86%	0.863	77%	0.773	S	S	*	*			trans	-93	67.4	-174.4	-71.9	-79.3	0	0	0	114.3	S945	S945-Y947 VanDerWaalsContact C-N 3.28Å; S945-Y947 PolarHBondContact O-N 3.36Å
948	D	29.3	Very low	30.1	Very low	144 Å²	144	141.3 Å²	141.3	77%	0.77	78%	0.781	S	S	*	*			trans	-144	99.3	152.9	-164.8	-6.1	0	0	0	112.3	V946	V946-D948 PolarHBondContact O-N 2.78Å
949	R	29	Very low	29.7	Very low	249 Å²	249	141.2 Å²	141.2	94%	0.94	78%	0.782	S	S	*	*			trans	-154.4	76.3	170.8	-85.5	-159.7	170.6	-168.9	-1.9	112.1
950	S	29.3	Very low	29.3	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	79%	0.785	S	S	*	*			trans	-151.3	61.6	160.4	67.5	0	0	0	0	115.6
951	S	27.1	Very low	28.7	Very low	112 Å²	112	145.2 Å²	145.2	78%	0.783	78%	0.784	S	S	*	*			trans	42.1	145.8	135.1	-155.3	0	0	0	0	122.8
952	Q	29.8	Very low	28.3	Very low	193 Å²	193	143.7 Å²	143.7	90%	0.902	78%	0.781	S	S	*	*			trans	87.5	124	167.9	-49.2	-170.4	16.6	0	0	116.4
953	G	25.3	Very low	27.9	Very low	80 Å²	80	144.4 Å²	144.4	83%	0.825	78%	0.781	S	S	*	*			cis	-164.7	165.5	-0.4	0	0	0	0	0	115.5
954	R	24.5	Very low	28	Very low	233 Å²	233	144.6 Å²	144.6	88%	0.879	78%	0.775	S	S	*	*			trans	-82.8	167.9	174.9	-100.4	-175.2	-174	-171.1	2.9	110.6
955	P	36.2	Very low	27.4	Very low	125 Å²	125	149.8 Å²	149.8	81%	0.812	78%	0.78	S	S	*	*			cis	-141.3	175.9	36.5	41.8	-22.2	0	0	0	119.1
956	S	25.2	Very low	27.6	Very low	96 Å²	96	152.6 Å²	152.6	67%	0.671	79%	0.786	S	S	*	*			trans	-67.1	163.2	-176.9	-33.7	0	0	0	0	116.2
957	S	24.8	Very low	27.4	Very low	120 Å²	120	149.4 Å²	149.4	84%	0.839	78%	0.781	S	S	*	*				-146.3	150.8	120.6	-163.1	0	0	0	0	111
958	M	25.8	Very low	27.3	Very low	154 Å²	154	147.4 Å²	147.4	76%	0.759	78%	0.781	S	S	*	*			trans	-102.7	161.2	167.9	-63.9	177.7	-176.2	0	0	109.4
959	Y	27.5	Very low	27.3	Very low	196 Å²	196	148 Å²	148	77%	0.769	78%	0.783	S	S	*	*				162.8	131.4	116.8	-102.1	-98.8	0	0	0	113
960	F	24.4	Very low	27.2	Very low	159 Å²	159	141.5 Å²	141.5	70%	0.697	78%	0.776	S	S	*	*			trans	58.9	109.8	146.3	-87.3	-121.9	0	0	0	124
961	Q	24.5	Very low	27.2	Very low	151 Å²	151	141.2 Å²	141.2	71%	0.706	78%	0.779	S	S	*	*				64.7	136.2	111.8	-89.7	-169.7	-24.5	0	0	125.5
962	T	24.6	Very low	27.3	Very low	108 Å²	108	139.3 Å²	139.3	66%	0.663	78%	0.777	S	S	*	*			trans	79.4	118.2	139.9	52.2	0	0	0	0	124.5
963	H	26.4	Very low	27.8	Very low	156 Å²	156	135.9 Å²	135.9	72%	0.722	77%	0.772	S	S	*	*			trans	64.6	118.1	137.4	-74.1	-76.2	0	0	0	125.2
964	D	26.6	Very low	27.9	Very low	132 Å²	132	137.5 Å²	137.5	71%	0.706	77%	0.771	S	S	*	*				56.7	136.3	125.8	-57.8	-18.9	0	0	0	125.3
965	Q	26.1	Very low	28.3	Very low	179 Å²	179	135.4 Å²	135.4	84%	0.836	77%	0.771	S	S	*	*				-156.6	123.3	110.7	-98.9	179	26.2	0	0	110.1
966	I	31.1	Very low	27.9	Very low	156 Å²	156	136.7 Å²	136.7	80%	0.8	78%	0.776	S	S	*	*				63.2	129.6	96.2	-61.8	179.7	0	0	0	114.2
967	G	26.3	Very low	28	Very low	69 Å²	69	136.7 Å²	136.7	71%	0.711	78%	0.782	S	S	*	*			cis	-153.7	-162.5	1.2	0	0	0	0	0	110.7
968	M	29	Very low	28.2	Very low	177 Å²	177	135.5 Å²	135.5	87%	0.872	78%	0.779	S	S	*	*			cis	-151.7	160.6	19.8	-90.5	-78.6	-78.4	0	0	113.4
969	I	30.4	Very low	28.3	Very low	156 Å²	156	136 Å²	136	80%	0.8	78%	0.782	S	S	*	*			trans	-62	160.3	177.2	-65.1	158.7	0	0	0	113.5
970	S	26.8	Very low	28.4	Very low	114 Å²	114	133 Å²	133	80%	0.797	78%	0.779	S	S	*	*			cis	178.6	173	-25.2	-172.1	0	0	0	0	109.9
971	A	28.4	Very low	28.8	Very low	99 Å²	99	132.9 Å²	132.9	82%	0.818	78%	0.783	S	S	*	*			trans	111.2	135.9	164	0	0	0	0	0	118.9
972	G	28.7	Very low	29.5	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	79%	0.788	S	S	*	*			trans	-93.1	-157.9	168.8	0	0	0	0	0	112.7
973	P	40.9	Very low	29.9	Very low	122 Å²	122	133.5 Å²	133.5	79%	0.792	79%	0.793	S	S	*	*			cis	-148.4	-163.9	28.5	37.3	-12.6	0	0	0	117
974	S	26.8	Very low	30.5	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	80%	0.796	S	S	*	*			trans	92.7	125.2	144.9	-60.9	0	0	0	0	123.6
975	H	32.8	Very low	30.7	Very low	189 Å²	189	134.4 Å²	134.4	88%	0.875	80%	0.801	S	S	*	*			trans	-87	148.9	146.5	-83	-102.8	0	0	0	110.8
976	V	28.1	Very low	30.8	Very low	152 Å²	152	132 Å²	132	92%	0.921	79%	0.794	S	S	*	*			trans	-152.2	165.1	140.3	-166.2	0	0	0	0	109.1
977	A	27.9	Very low	30.7	Very low	96 Å²	96	131.7 Å²	131.7	79%	0.793	79%	0.793	S	S	*	*			trans	-121.7	164.2	-172.2	0	0	0	0	0	115.5
978	A	29.2	Very low	30.9	Very low	94 Å²	94	135 Å²	135	78%	0.777	80%	0.799	S	S	*	*			trans	-172.2	122.8	161.8	0	0	0	0	0	109.4
979	M	28.3	Very low	31	Very low	166 Å²	166	134.5 Å²	134.5	82%	0.818	80%	0.797	S	S	*	*				95.8	113.9	73.4	-77.9	-77.5	-172.3	0	0	116.1
980	N	30	Very low	31.6	Very low	132 Å²	132	132.7 Å²	132.7	71%	0.706	80%	0.795	S	S	*	*			trans	48.8	119.5	143.6	-63.9	-15.4	0	0	0	124.6
981	I	30.9	Very low	32.1	Very low	156 Å²	156	132.7 Å²	132.7	80%	0.8	79%	0.793	S	S	*	*				47.4	130.9	113.6	-68.8	168.1	0	0	0	118.3
982	P	39.5	Very low	32.3	Very low	122 Å²	122	136.3 Å²	136.3	79%	0.792	80%	0.795	S	S	*	*			cis	-143.5	-175.5	47.4	33.7	-10.2	0	0	0	118.7
983	I	34.4	Very low	32.9	Very low	151 Å²	151	137.6 Å²	137.6	77%	0.774	79%	0.79	S	S	*	*			trans	-90.6	159.4	176.8	-27.5	175.8	0	0	0	111
984	P	38.3	Very low	32.9	Very low	122 Å²	122	137.3 Å²	137.3	79%	0.792	79%	0.788	S	S	*	*				-144	171.2	108.3	36.7	-21.2	0	0	0	116.8
985	F	30.1	Very low	33.8	Very low	185 Å²	185	138.4 Å²	138.4	81%	0.811	79%	0.792	S	S	*	*			trans	-56.4	154.5	-179.2	-76.8	-117.8	0	0	0	114.4
986	N	28.8	Very low	33.7	Very low	129 Å²	129	133 Å²	133	69%	0.69	79%	0.788	S	S	*	*				-177.3	148.6	71.4	-117.6	-23.4	0	0	0	116.2
987	L	29	Very low	34.1	Very low	148 Å²	148	136.8 Å²	136.8	78%	0.775	79%	0.787	S	S	*	*			trans	62.5	159.7	142.2	-68.4	165.6	0	0	0	124.1
988	V	30.5	Very low	34.3	Very low	139 Å²	139	142.1 Å²	142.1	84%	0.842	79%	0.793	S	S	*	*			trans	90.2	113.5	163.1	-168.9	0	0	0	0	119.1
989	M	30.8	Very low	34.4	Very low	167 Å²	167	140.5 Å²	140.5	82%	0.823	79%	0.785	S	S	*	*			trans	-90.6	165.6	160.6	-84.9	-147.7	-172.1	0	0	110.1
990	P	42.4	Very low	34.6	Very low	118 Å²	118	142.2 Å²	142.2	77%	0.766	79%	0.791	S	S	*	*			cis	-145.8	-179.4	35.2	41.6	-20.8	0	0	0	117.6
991	P	38.5	Very low	34.7	Very low	114 Å²	114	139.6 Å²	139.6	74%	0.74	79%	0.788	S	S	*	*			trans	-90	165.5	173.5	35.7	-36.4	0	0	0	115.4
992	M	31.4	Very low	34.8	Very low	175 Å²	175	139.7 Å²	139.7	86%	0.862	79%	0.791	S	S	*	*			trans	-120.8	171.1	172.4	-84.4	-101.2	-72.3	0	0	109.5
993	P	41.8	Very low	34.3	Very low	98 Å²	98	137.4 Å²	137.4	64%	0.636	79%	0.789	S	S	*	*				-130.1	172.6	-60.5	37.7	-21	0	0	0	112.4
994	P	41.2	Very low	35.1	Very low	117 Å²	117	136.6 Å²	136.6	76%	0.76	79%	0.794	S	S	*	*			trans	-80.9	163.9	170.4	33.5	-34.8	0	0	0	113.2
995	P	45.1	Very low	34.8	Very low	136 Å²	136	134.8 Å²	134.8	88%	0.883	79%	0.789	S	S	*	*			trans	-81.4	152.3	-170.5	32.6	-36.8	0	0	0	114.7
996	G	31.7	Very low	35	Very low	77 Å²	77	131.3 Å²	131.3	79%	0.794	79%	0.794	S	S	*	*			trans	-130	142.8	175.5	0	0	0	0	0	113.2
997	Y	35.8	Very low	35.1	Very low	230 Å²	230	128.5 Å²	128.5	90%	0.902	80%	0.795	S	S	*	*			trans	-84.6	148.8	174.5	-115.3	-103	0	0	0	111.3
998	F	32.5	Very low	35.3	Very low	209 Å²	209	134 Å²	134	92%	0.917	81%	0.806	S	S	*	*			trans	-143.2	163	159.4	-109.4	-88.5	0	0	0	109.9
999	G	30.4	Very low	35.3	Very low	59 Å²	59	131.1 Å²	131.1	61%	0.608	80%	0.804	S	S	*	*			trans	-155.9	-159.2	-177.3	0	0	0	0	0	112.9
1000	Q	33.2	Very low	35.3	Very low	202 Å²	202	129.8 Å²	129.8	94%	0.944	81%	0.805	S	S	*	*			trans	71.5	151.6	-172.4	-64.4	-175.3	-8.6	0	0	114.6
1001	A	31.6	Very low	35.7	Very low	78 Å²	78	128.9 Å²	128.9	65%	0.645	80%	0.8	S	S	*	*			cis	-167.4	-177.5	-19	0	0	0	0	0	111.5
1002	N	33.3	Very low	35.5	Very low	158 Å²	158	133.4 Å²	133.4	85%	0.845	81%	0.808	S	S	*	*			trans	82.5	81.4	155.3	-62.9	-13.8	0	0	0	122.2
1003	G	29.6	Very low	35.4	Very low	73 Å²	73	128.8 Å²	128.8	75%	0.753	80%	0.804	S	S	*	*				56	-176.1	122	0	0	0	0	0	122.2
1004	P	50.8	Low	35.1	Very low	135 Å²	135	133.9 Å²	133.9	88%	0.877	82%	0.817	S	S	*	*			cis	-104.5	-143.1	-7.1	43.2	-32.6	0	0	0	110.5
1005	A	31.7	Very low	34.6	Very low	84 Å²	84	135.6 Å²	135.6	69%	0.694	83%	0.825	S	S	*	*			cis	-159.1	156.8	-4.4	0	0	0	0	0	111
1006	A	34.6	Very low	33.9	Very low	112 Å²	112	132 Å²	132	93%	0.926	81%	0.813	S	S	*	*			trans	60.5	149.7	164.3	0	0	0	0	0	119.5
1007	G	31.3	Very low	33.8	Very low	69 Å²	69	141 Å²	141	71%	0.711	82%	0.823	S	S	*	*			cis	172.4	159.7	-10.5	0	0	0	0	0	114.4
1008	R	33.8	Very low	33.5	Very low	265 Å²	265	134 Å²	134	100%	1	82%	0.821	S	S	*	*			trans	71.5	144	176.2	-61.4	-178.3	169.8	-173.8	-2.8	118.7
1009	G	28.7	Very low	33.4	Very low	77 Å²	77	127.7 Å²	127.7	79%	0.794	82%	0.815	S	S	*	*			trans	132.6	84.4	154.5	0	0	0	0	0	118.4
1010	T	32.4	Very low	33.5	Very low	139 Å²	139	137.1 Å²	137.1	85%	0.853	83%	0.832	S	S	*	*			trans	-120.5	174.4	163.1	61.6	0	0	0	0	108.6
1011	P	49.9	Very low	33.5	Very low	100 Å²	100	135.7 Å²	135.7	65%	0.649	83%	0.825	S	S	*	*			cis	-146.9	-172.6	12.9	46.3	-27.2	0	0	0	118
1012	K	35	Very low	33.5	Very low	209 Å²	209	139.9 Å²	139.9	91%	0.909	83%	0.829	S	S	*	*			trans	74.2	151.4	162	-64.3	169.1	-177.4	175.8	0	117
1013	G	29.6	Very low	33.3	Very low	77 Å²	77	138.8 Å²	138.8	79%	0.794	82%	0.823	S	S	*	*			cis	-153	179.2	5.1	0	0	0	0	0	114.8
1014	K	34.8	Very low	33.3	Very low	206 Å²	206	145.8 Å²	145.8	90%	0.896	83%	0.827	S	S	*	*			trans	-106.4	151.8	-171.4	-61.9	174.8	175.8	177.4	0	113.4
1015	T	30.1	Very low	32.3	Very low	152 Å²	152	149.1 Å²	149.1	93%	0.933	83%	0.828	S	S	*	*				167	156.5	128.5	36.4	0	0	0	0	110.2
1016	G	30.1	Very low	32.1	Very low	61 Å²	61	148.1 Å²	148.1	63%	0.629	83%	0.825	S	S	*	*			cis	157	145.7	-6	0	0	0	0	0	112.7
1017	R	30.9	Very low	31.9	Very low	266 Å²	266	151.1 Å²	151.1	100%	1.004	83%	0.825	S	S	*	*			trans	72.7	147.7	-170.5	-51.9	173.4	170.9	179.2	-4.2	113.6
1018	G	29.6	Very low	32.5	Very low	84 Å²	84	154.2 Å²	154.2	87%	0.866	83%	0.833	S	S	*	*			cis	141.4	141.7	-3.3	0	0	0	0	0	110.3
1019	G	30.4	Very low	32.7	Very low	76 Å²	76	145.1 Å²	145.1	78%	0.784	82%	0.821	S	S	*	*			cis	173.8	-165.5	-0.8	0	0	0	0	0	111.1
1020	R	31.3	Very low	33.4	Very low	257 Å²	257	148.1 Å²	148.1	97%	0.97	83%	0.827	S	S	*	*			trans	76.2	147.3	172.9	-88.4	-176.2	172.2	172.3	-1.8	120.9
1021	Q	33.2	Very low	33.5	Very low	171 Å²	171	146.2 Å²	146.2	80%	0.799	82%	0.819	S	S	*	*			trans	-78.9	178.4	172.1	-56.4	164.9	-19.5	0	0	110.2
1022	K	32.5	Very low	32.7	Very low	167 Å²	167	149.7 Å²	149.7	73%	0.726	83%	0.827	S	S	*	*			cis	-173.6	157.4	37.8	-152.3	173.3	-175	179.2	0	112.4
1023	N	28.7	Very low	32.3	Very low	135 Å²	135	145 Å²	145	72%	0.722	82%	0.816	S	S	*	*			trans	49.5	111.5	159.7	-71	4.8	0	0	0	120.7
1024	R	30.7	Very low	32.4	Very low	219 Å²	219	148.8 Å²	148.8	83%	0.826	82%	0.818	S	S	*	*				83.6	111	73.9	-169.9	-170.1	-155.2	-165.4	8	115.3
1025	F	28.9	Very low	32.3	Very low	206 Å²	206	146.7 Å²	146.7	90%	0.904	82%	0.816	S	S	*	*			trans	154.2	138	148.6	-94	-69.7	0	0	0	107.5
1026	G	27.1	Very low	33.2	Very low	62 Å²	62	144.7 Å²	144.7	64%	0.639	81%	0.805	S	S	*	*			cis	-175.4	134.3	-13.7	0	0	0	0	0	107.5
1027	L	30	Very low	33.1	Very low	176 Å²	176	149.1 Å²	149.1	92%	0.921	82%	0.815	S	S	*	*				177.2	128.3	102.9	-90.1	161.4	0	0	0	109.6
1028	P	45.4	Very low	33	Very low	134 Å²	134	142.3 Å²	142.3	87%	0.87	81%	0.808	S	S	*	*			trans	-141.7	161.3	152.4	38.5	-24.7	0	0	0	114.1
1029	G	37.1	Very low	33.1	Very low	74 Å²	74	147.4 Å²	147.4	76%	0.763	81%	0.809	S	S	*	*			trans	106.6	-177.4	174.9	0	0	0	0	0	114.3
1030	P	43.9	Very low	33.1	Very low	140 Å²	140	147.9 Å²	147.9	91%	0.909	81%	0.805	S	S	*	*			cis	-116.8	-162.8	14	42.7	-32.2	0	0	0	114.2
1031	S	34.7	Very low	33.5	Very low	99 Å²	99	140.9 Å²	140.9	69%	0.692	80%	0.796	S	S	*	*			trans	-133.7	155.7	-174.3	57.2	0	0	0	0	112.9
1032	Q	32	Very low	33.6	Very low	172 Å²	172	141 Å²	141	80%	0.804	80%	0.796	S	S	*	*			trans	76.5	152.1	152.3	-78.4	-175.3	-2.6	0	0	122.2
1033	T	28.4	Very low	33.9	Very low	112 Å²	112	138.8 Å²	138.8	69%	0.687	79%	0.793	S	S	*	*			trans	70.5	113.5	149	42.9	0	0	0	0	122.7
1034	N	31.4	Very low	34	Very low	156 Å²	156	139.1 Å²	139.1	83%	0.834	80%	0.799	S	S	*	*				49.8	131.4	122.2	-59.5	2.6	0	0	0	122.8
1035	L	32.5	Very low	34	Very low	162 Å²	162	132.7 Å²	132.7	85%	0.848	79%	0.793	S	S	*	*			trans	-47.4	159.8	155.5	-76.1	161.7	0	0	0	113.7
1036	P	47.6	Very low	34.3	Very low	109 Å²	109	127.6 Å²	127.6	71%	0.708	78%	0.783	S	S	*	*			cis	-153.8	173.8	46.8	43.6	-22.8	0	0	0	121.1
1037	N	28.3	Very low	34.5	Very low	155 Å²	155	133 Å²	133	83%	0.829	79%	0.792	S	S	*	*			trans	47.7	131	145.5	-69.5	0.7	0	0	0	124
1038	S	29.7	Very low	35.8	Very low	123 Å²	123	129.2 Å²	129.2	86%	0.86	78%	0.777	S	S	*	*				-163.5	170.2	108	56.8	0	0	0	0	113.2
1039	Q	31.8	Very low	35	Very low	191 Å²	191	131.5 Å²	131.5	89%	0.893	77%	0.774	S	S	*	*			trans	-86.4	179	-164.2	-64.8	158.5	-52.3	0	0	112.7
1040	A	30.6	Very low	34.7	Very low	85 Å²	85	132.3 Å²	132.3	70%	0.702	77%	0.768	S	S	*	*			cis	-163.2	157.1	27	0	0	0	0	0	116.2
1041	S	38.3	Very low	34	Very low	111 Å²	111	135 Å²	135	78%	0.776	77%	0.768	S	S	*	*			trans	54.4	137.8	143.5	-56.1	0	0	0	0	120.7
1042	Q	36	Very low	33.6	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	77%	0.771	S	S	*	*			cis	-142.8	164.9	11.1	-71.7	-172.7	-105	0	0	110.1
1043	D	37.8	Very low	33.3	Very low	122 Å²	122	130.3 Å²	130.3	65%	0.652	77%	0.771	S	S	*	*			cis	-148.6	-131.3	-22.3	-88.4	-20.2	0	0	0	106.8
1044	V	31.1	Very low	33.2	Very low	141 Å²	141	132.6 Å²	132.6	86%	0.855	78%	0.779	S	S	*	*			cis	-150.2	171.8	7.3	179.1	0	0	0	0	108.8
1045	A	31.8	Very low	33	Very low	85 Å²	85	130.8 Å²	130.8	70%	0.702	77%	0.773	S	S	*	*			trans	-69.7	174.4	-174.8	0	0	0	0	0	118.1
1046	S	33.8	Very low	32.9	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	77%	0.773	S	S	*	*			cis	178	130.7	-43.6	63	0	0	0	0	113.2
1047	Q	32.8	Very low	31.8	Very low	176 Å²	176	129.3 Å²	129.3	82%	0.822	77%	0.769	S	S	*	*			trans	55.5	172.3	130.3	-61.6	-75.4	-51.2	0	0	121.1
1048	P	57	Low	31.8	Very low	95 Å²	95	131.5 Å²	131.5	62%	0.617	77%	0.767	S	S	*	*				-147.4	-169.3	-51	44.7	-27.7	0	0	0	118.1
1049	F	29.2	Very low	31.6	Very low	183 Å²	183	132.4 Å²	132.4	80%	0.803	76%	0.761	S	S	*	*			trans	89.8	109.9	148.3	-99.5	-95.8	0	0	0	124.2
1050	S	30.7	Very low	31.3	Very low	90 Å²	90	128.5 Å²	128.5	63%	0.629	75%	0.754	S	S	*	*				70.3	139.8	129	68.4	0	0	0	0	127.6
1051	Q	29.5	Very low	31	Very low	198 Å²	198	132.3 Å²	132.3	93%	0.925	76%	0.76	S	S	*	*			trans	73.5	139	146.1	-76.9	-173.8	17.1	0	0	123.6
1052	G	25.4	Very low	30.5	Very low	72 Å²	72	132.1 Å²	132.1	74%	0.742	76%	0.758	S	S	*	*				123.3	119.2	129.1	0	0	0	0	0	120.4
1053	A	24.9	Very low	30.3	Very low	99 Å²	99	132.7 Å²	132.7	82%	0.818	76%	0.761	S	S	*	*			trans	53	148.2	156.3	0	0	0	0	0	120.1
1054	L	26.6	Very low	30.5	Very low	161 Å²	161	131.7 Å²	131.7	84%	0.843	76%	0.761	S	S	*	*			cis	70.6	105.8	34.1	-85	171.3	0	0	0	116.8
1055	T	28.4	Very low	30.4	Very low	117 Å²	117	129.5 Å²	129.5	72%	0.718	75%	0.752	S	S	*	*				171.7	136.6	114.3	38.6	0	0	0	0	114.1
1056	Q	29.3	Very low	30.2	Very low	180 Å²	180	134.2 Å²	134.2	84%	0.841	76%	0.76	S	S	*	*			trans	52	147.5	135.9	-59.7	174.5	-8.6	0	0	122.2
1057	G	25.6	Very low	30	Very low	61 Å²	61	138 Å²	138	63%	0.629	77%	0.769	S	S	*	*			cis	166.3	-179.6	-5	0	0	0	0	0	114.7
1058	Y	26.7	Very low	29.8	Very low	201 Å²	201	135.4 Å²	135.4	79%	0.788	77%	0.77	S	S	*	*			trans	66.1	133.6	175.2	-67.5	-98.2	0	0	0	116.4
1059	I	27.5	Very low	28.8	Very low	142 Å²	142	140 Å²	140	73%	0.728	78%	0.783	S	S	*	*			cis	84.8	98	33.1	-56.7	165.2	0	0	0	114.3
1060	S	24.5	Very low	29.6	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	78%	0.779	S	S	*	*			trans	170.4	126.8	142.5	-84.6	0	0	0	0	108.6
1061	M	25.1	Very low	29.3	Very low	166 Å²	166	135.7 Å²	135.7	82%	0.818	79%	0.785	S	S	*	*				89.7	137	61.7	-79.4	-78.9	-97.7	0	0	113.7
1062	S	28	Very low	29.6	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	78%	0.784	S	S	*	*			trans	54.5	120.2	163.3	52.4	0	0	0	0	118.3
1063	Q	31.2	Very low	29.7	Very low	185 Å²	185	136.9 Å²	136.9	86%	0.864	79%	0.789	S	S	*	*				41.1	149.6	75.8	-84.6	-160.1	4.7	0	0	115.4
1064	P	42.2	Very low	30.1	Very low	100 Å²	100	141 Å²	141	65%	0.649	79%	0.791	S	S	*	*			cis	-140.4	-174.9	19.1	34.4	-11.8	0	0	0	116.4
1065	S	27.6	Very low	31.2	Very low	96 Å²	96	138.4 Å²	138.4	67%	0.671	78%	0.784	S	S	*	*			trans	65.5	153.9	141.7	61.4	0	0	0	0	120.5
1066	Q	28.3	Very low	31.1	Very low	184 Å²	184	142.3 Å²	142.3	86%	0.86	79%	0.794	S	S	*	*			cis	-153.8	-176.7	-8.3	-123.5	170.6	7.6	0	0	112.4
1067	M	30.2	Very low	31.2	Very low	178 Å²	178	141.5 Å²	141.5	88%	0.877	80%	0.795	S	S	*	*			trans	-64.4	153.5	-175.5	-60.1	152.4	53.7	0	0	115.9
1068	S	28.8	Very low	31.5	Very low	122 Å²	122	144.1 Å²	144.1	85%	0.853	80%	0.804	S	S	*	*			trans	-157.7	125.3	141.4	61.6	0	0	0	0	113.7
1069	Q	34.4	Very low	31.6	Very low	190 Å²	190	143.2 Å²	143.2	89%	0.888	81%	0.807	S	S	*	*			trans	-140.1	174.1	160.8	-111.6	-157.8	23.8	0	0	105.9
1070	P	46.1	Very low	31.7	Very low	111 Å²	111	142.8 Å²	142.8	72%	0.721	81%	0.806	S	S	*	*			cis	-128.5	-167.1	-2.3	35.7	-15.7	0	0	0	113
1071	G	25.8	Very low	31.8	Very low	73 Å²	73	142 Å²	142	75%	0.753	80%	0.8	S	S	*	*			trans	-158	142.9	165.9	0	0	0	0	0	111.5
1072	L	34.5	Very low	32.1	Very low	175 Å²	175	144.7 Å²	144.7	92%	0.916	80%	0.803	S	S	*	*			trans	-135.2	141.1	-170	-84.1	165.2	0	0	0	112.4
1073	S	28.5	Very low	32.2	Very low	119 Å²	119	147.8 Å²	147.8	83%	0.832	81%	0.81	S	S	*	*			trans	-162.4	136.9	151	53	0	0	0	0	113.3
1074	Q	32.7	Very low	32.1	Very low	186 Å²	186	142.2 Å²	142.2	87%	0.869	80%	0.802	S	S	*	*			trans	-130.7	-175.4	162.4	-81.8	-166.1	-15.2	0	0	106.1
1075	P	50.7	Low	31.4	Very low	107 Å²	107	145 Å²	145	70%	0.695	81%	0.812	S	S	*	*			cis	-126.9	-173.9	-13.6	33.8	-14.6	0	0	0	112.9
1076	E	26.1	Very low	31.5	Very low	198 Å²	198	148.2 Å²	148.2	93%	0.925	82%	0.816	S	S	*	*				-165.7	174.1	129.5	-114.6	174.1	-164.8	0	0	112.7
1077	L	31.6	Very low	31.6	Very low	163 Å²	163	147 Å²	147	85%	0.853	81%	0.808	S	S	*	*			trans	-141.3	139.7	-159.4	-84.4	149.5	0	0	0	114.1
1078	S	30.4	Very low	31.4	Very low	117 Å²	117	146.9 Å²	146.9	82%	0.818	80%	0.803	S	S	*	*			trans	169.3	162.8	153.6	47	0	0	0	0	111.8
1079	Q	29.4	Very low	31.5	Very low	182 Å²	182	145.7 Å²	145.7	85%	0.85	80%	0.795	S	S	*	*			cis	-162.1	165.1	-48.9	-142	172.8	-6.7	0	0	109.2
1080	D	28.7	Very low	31.2	Very low	132 Å²	132	145 Å²	145	71%	0.706	79%	0.792	S	S	*	*			trans	-44.2	139.7	-167	-67.2	-83.4	0	0	0	124
1081	S	28.1	Very low	30.4	Very low	91 Å²	91	145.8 Å²	145.8	64%	0.636	79%	0.788	S	S	*	*				35.4	124.3	114.9	-39.1	0	0	0	0	122.6
1082	Y	30.5	Very low	30.7	Very low	224 Å²	224	148.7 Å²	148.7	88%	0.878	79%	0.786	S	S	*	*				173.9	167.1	113.3	-115.9	-93.7	0	0	0	115.3
1083	L	30.3	Very low	30.4	Very low	171 Å²	171	146.5 Å²	146.5	90%	0.895	78%	0.78	S	S	*	*			trans	72.3	149.9	174.6	-51.7	176.1	0	0	0	116.8
1084	G	28.6	Very low	30.5	Very low	68 Å²	68	145.6 Å²	145.6	70%	0.701	78%	0.78	S	S	*	*			cis	162.4	125.6	-9.3	0	0	0	0	0	113.6
1085	D	27.5	Very low	30.4	Very low	159 Å²	159	144.6 Å²	144.6	85%	0.85	78%	0.78	S	S	*	*			trans	52.1	107.6	163.6	-61	-6.6	0	0	0	123.8
1086	E	31.2	Very low	29.4	Very low	163 Å²	163	144 Å²	144	76%	0.762	78%	0.778	S	S	*	*				57.3	136.7	122.5	-70.8	-149.3	140.2	0	0	127.2
1087	F	29.8	Very low	29.6	Very low	159 Å²	159	143.9 Å²	143.9	70%	0.697	78%	0.777	S	S	*	*			trans	76.2	120	145.9	-89.6	-67.8	0	0	0	124.6
1088	K	25.8	Very low	29.8	Very low	174 Å²	174	142.7 Å²	142.7	76%	0.757	77%	0.772	S	S	*	*			trans	83.8	102	139.7	-97.7	159.4	-174.1	170.8	0	123.1
1089	S	31.3	Very low	29.8	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	78%	0.775	S	S	*	*				84.2	146.2	114.8	71.1	0	0	0	0	123.3
1090	Q	27.8	Very low	30	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.822	77%	0.77	S	S	*	*			trans	72.5	149.3	158.3	-74.8	-178.9	-2.5	0	0	116.9
1091	I	28.3	Very low	30	Very low	126 Å²	126	144.4 Å²	144.4	65%	0.646	78%	0.777	S	S	*	*			cis	-158.4	161.2	-9.5	-131	164.3	0	0	0	111.3
1092	D	33	Very low	30	Very low	134 Å²	134	148.6 Å²	148.6	72%	0.717	79%	0.787	S	S	*	*			trans	35.4	150.4	159	-55.9	-20.7	0	0	0	124.8
1093	V	28.9	Very low	29.9	Very low	130 Å²	130	141.9 Å²	141.9	79%	0.788	79%	0.785	S	S	*	*				178.2	122.1	107.3	155.1	0	0	0	0	111.8
1094	A	29.9	Very low	29.8	Very low	100 Å²	100	141 Å²	141	83%	0.826	78%	0.777	S	S	*	*			trans	-160.6	138.6	150.1	0	0	0	0	0	108.2
1095	L	30.4	Very low	29.9	Very low	165 Å²	165	147.5 Å²	147.5	86%	0.864	78%	0.78	S	S	*	*			trans	-110.8	162.3	-156.9	-81.5	165.5	0	0	0	116.5
1096	S	30.9	Very low	29.9	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	77%	0.772	S	S	*	*			trans	-91.4	171.7	178.8	52.9	0	0	0	0	114
1097	Q	30	Very low	29.8	Very low	194 Å²	194	146.4 Å²	146.4	91%	0.907	78%	0.777	S	S	*	*			trans	-136.1	156.9	149.1	-80.3	-163.9	-26.3	0	0	110.6
1098	D	35	Very low	29.8	Very low	139 Å²	139	148.3 Å²	148.3	74%	0.743	79%	0.788	S	S	*	*			trans	-97.1	163.3	-155.2	-50.5	-93.7	0	0	0	115.8
1099	S	30.5	Very low	29.9	Very low	125 Å²	125	148.7 Å²	148.7	87%	0.874	79%	0.792	S	S	*	*				-168.4	147.8	117.9	-80.9	0	0	0	0	112.5
1100	T	32.6	Very low	29.7	Very low	123 Å²	123	147.9 Å²	147.9	76%	0.755	80%	0.799	S	S	*	*			trans	-115.8	155.7	-178	48.6	0	0	0	0	111.7
1101	Y	28.7	Very low	29.7	Very low	218 Å²	218	142.8 Å²	142.8	86%	0.855	79%	0.793	S	S	*	*				-172.7	169.6	117.3	-129.4	-106	0	0	0	114.4
1102	Q	29.8	Very low	29.8	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	80%	0.801	S	S	*	*			trans	-96.1	159.2	173.2	-62.6	172.1	-32.7	0	0	111.7
1103	G	27.2	Very low	29.8	Very low	82 Å²	82	143.1 Å²	143.1	85%	0.845	81%	0.806	S	S	*	*			trans	-171.9	137	170.9	0	0	0	0	0	113.9
1104	E	29.1	Very low	30	Very low	152 Å²	152	140.2 Å²	140.2	71%	0.71	80%	0.802	S	S	*	*			trans	-99.9	157.5	-176.3	-100.7	-158.8	112.7	0	0	113.8
1105	R	29.6	Very low	30	Very low	206 Å²	206	143.9 Å²	143.9	78%	0.777	81%	0.807	S	S	*	*			trans	77.8	137.4	141.7	-79.2	169.6	-162	-165.7	12.5	123.5
1106	A	29.2	Very low	30.2	Very low	83 Å²	83	140.3 Å²	140.3	69%	0.686	80%	0.796	S	S	*	*			trans	103.5	110.8	133.5	0	0	0	0	0	120.3
1107	Y	29.2	Very low	30.4	Very low	216 Å²	216	143.3 Å²	143.3	85%	0.847	80%	0.799	S	S	*	*			trans	38.4	120.4	137.2	-69.2	-88.6	0	0	0	120.6
1108	Q	28.6	Very low	30.8	Very low	199 Å²	199	147.6 Å²	147.6	93%	0.93	81%	0.809	S	S	*	*				-161.4	174.8	95.1	-107.4	-178.5	5	0	0	114.2
1109	H	28.9	Very low	30.6	Very low	181 Å²	181	148.1 Å²	148.1	84%	0.838	81%	0.813	S	S	*	*			trans	-87.6	150.5	-165.7	-94.5	-91.1	0	0	0	115.4
1110	G	27.1	Very low	30.6	Very low	81 Å²	81	149.3 Å²	149.3	84%	0.835	81%	0.809	S	S	*	*			trans	87.1	148.1	149.8	0	0	0	0	0	116
1111	G	27.5	Very low	30.5	Very low	69 Å²	69	150.7 Å²	150.7	71%	0.711	81%	0.812	S	S	*	*			cis	161	173.2	-3.6	0	0	0	0	0	111.8
1112	V	30.9	Very low	30.6	Very low	134 Å²	134	146.8 Å²	146.8	81%	0.812	81%	0.81	S	S	*	*			trans	67.9	90.2	166.8	-170.5	0	0	0	0	116.8
1113	T	32.7	Very low	30.7	Very low	134 Å²	134	144.7 Å²	144.7	82%	0.822	81%	0.808	S	S	*	*			trans	30.4	122.4	137.2	61.1	0	0	0	0	121.7
1114	G	32	Very low	30.9	Very low	68 Å²	68	148.9 Å²	148.9	70%	0.701	81%	0.806	S	S	*	*				114.3	148.9	94.9	0	0	0	0	0	119.1
1115	L	31.1	Very low	31.1	Very low	178 Å²	178	148.6 Å²	148.6	93%	0.932	81%	0.812	S	S	*	*			trans	66.8	155.2	169.8	-59.6	167.3	0	0	0	115.5
1116	S	33	Very low	31.2	Very low	90 Å²	90	144.2 Å²	144.2	63%	0.629	82%	0.815	S	S	*	*			cis	-170.4	162.8	-27.9	-170.7	0	0	0	0	108
1117	Q	35.1	Very low	31.4	Very low	157 Å²	157	149.3 Å²	149.3	73%	0.734	83%	0.826	S	S	*	*			trans	69.5	144.9	174.5	-49.2	169.8	-3.8	0	0	114.1
1118	Y	40.2	Very low	31.5	Very low	285 Å²	285	143.3 Å²	143.3	100%	1.118	82%	0.824	S	S	*	*			cis	-119.5	0	2	-104.2	-83.3	0	0	0	111.8

Retrieved 1,118 of 1,118 residues in 750.8 ms (Link to these results)

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