A0A077ZDG3_TRITR Loading...

Rho guanine nucleotide exchange factor 17

AlphaFold DB , UniProt , Accession A0A077ZDG3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,418 aa.

						>A0A077ZDG3_TRITR|A0A077ZDG3
MDVTSSGKMSSRRRRRERHSRSFTLSPSAESRYYFTNECSRPKFAVGSSNSSQEWLYRRKTLSPLNKRGVHIKPSLPSFVSNGRRLRKTYSEPTEINDDDDVFVERYRSEESPGLFYPTLRGPSASRISSPGQSASSSFSPSSNSPPVAMHPSSEDIVWSTPRGSFANDGHKAEDEPEPSLLTVYPDGYRDTQIRELQGAAQSIEALSRRNRRRLSDFTAGMRITDGNGPQMDSTALRRRSGITTRLGGQPRGIIQFLPSVKRSDMSRSLHQSYIADKIRRERLYSDHSDPERSKAVKRDPFCEGEKTGFVEPVEPRSYAAYRKMDAADFVKMAPEREVHQRSRSAQRRMTNAVDRDNLQAYHHHRMDLESLRNLDALDSVNRFTSLLKSLRSSDGRTSDQADEINGFNSQEDDAHLSSPDVSESSTTSAEFSQHNNLRQSELISDSDSFLQADMLLWRRRSKGSIRKHQDTRTHIVKELVETENSYVENLKLLVHKYLRPLKRPELCSLVELGTLNEIFFQVPEMLAYHEAFLKALKSRIDLWDNKQKIGDILLANFTKQCVIDTYMAFINNWKNARLAIRKACSAKPAFAKYLERCSREHMNKLSLDALLIMPVQRIPRYELLLKELLKHTSVEHPDHALLLRAGKVLHELANKIDQTQQETGFSDQMQQKLREIEAIVEGLDDLVSPERIYYRCDLVQVDVSILCSGLVFLMFMQIFQTANGIRDRCLFLFSDLLLITTVTAKAGAALTKATQNATPGITRNFFETRKFKLLLKLSLQDLCVVDNNKQLIMKVKEEIANLQEDLRVAGKLAELTMLLKVDHRTVSKEVENLVDFIKVTLGSRHEELIKDRSLTSLNLLVTTEFGNEPLLVTFKSTDNRLTWERNFEEAKCAFAVSQSQRQPPVFVKFIAANRTRSGFHVSKHESTNHVWFLMERFQFTCATSSWSMNGICDVWMCSSDQMSGQVFLLSLHPEVDVLNVNFLCNSRISCLCYISPRKLGPRKPKVTYESSKENKQQIVCPKGCLSLCQHVLVSSIELDSDSSCGESSAESTSASETIRINGSIPDGIQETAILDPNDRLFHCTTWVGTENGAIQIYDRDDCNHPGRCKLETQLGTPIRCMTYYDEKIFIALGNGTIGFYECNEDNKGTLGDLRMLQIEHKFPPVSAMTVATNKLWCGTRNHLLVINLNSLKIEVKKNPKPNIGNIRTLQCLFAVNNDRESYVACLAANALAVWLSMYNSAVVKLYHAGKFECLMEISISPTVTKTLAGCDDIIRQHKLACLRITTMMCCKDMLWIGTSAGVLCYLSTPQVAHQTSKISATPNLFSTRIGHMGPCRFLVSIDVPDHTVDDYTSGKRSKSNDLSRRRMSLNVANLHQRNVYVISGGEGLEDYQEGTNDENDDSFGMEDSTNYLIIWKV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	32.7	Very low	227 Å²	227	137.7 Å²	137.7	100%	1.118	82%	0.817	S	S	*	*				0	106.7	0	-72.8	165.3	172.2	0	0	107.5
2	D	33.2	Very low	32.5	Very low	143 Å²	143	143.5 Å²	143.5	77%	0.765	81%	0.814	S	S	*	*			trans	56.1	115.8	132.7	-44.7	-52.7	0	0	0	122.5
3	V	36.1	Very low	32.5	Very low	124 Å²	124	146.8 Å²	146.8	75%	0.752	81%	0.805	S	S	*	*				65.9	94.1	123.3	-174.7	0	0	0	0	118.9
4	T	36.1	Very low	32.4	Very low	129 Å²	129	149.9 Å²	149.9	79%	0.791	80%	0.799	S	S	*	*			trans	34.4	120	136.8	62.8	0	0	0	0	121.2
5	S	33.1	Very low	32.4	Very low	116 Å²	116	153.2 Å²	153.2	81%	0.811	80%	0.796	S	S	*	*			trans	-66.2	165.3	155.2	67.9	0	0	0	0	112.4
6	S	34.1	Very low	32.5	Very low	118 Å²	118	154.9 Å²	154.9	83%	0.825	79%	0.789	S	S	*	*			cis	-157.1	162.2	23.1	67.1	0	0	0	0	113.7
7	G	28.7	Very low	32.5	Very low	73 Å²	73	152.6 Å²	152.6	75%	0.753	77%	0.774	S	S	*	*			trans	-152.8	60.6	-174.8	0	0	0	0	0	116.5
8	K	31.4	Very low	32.6	Very low	206 Å²	206	154.4 Å²	154.4	90%	0.896	77%	0.77	S	S	*	*			trans	70.5	161.9	163.9	-63.6	179.2	175.6	175	0	119.9
9	M	31.4	Very low	32.6	Very low	181 Å²	181	154.9 Å²	154.9	89%	0.892	77%	0.77	S	S	*	*			trans	76.6	87.8	157	-80	174.4	142.6	0	0	122.7
10	S	31.3	Very low	32.7	Very low	103 Å²	103	153.1 Å²	153.1	72%	0.72	77%	0.772	S	S	*	*				69.9	111.9	111.6	-154.1	0	0	0	0	123.2
11	S	32.2	Very low	32.7	Very low	95 Å²	95	156.8 Å²	156.8	66%	0.664	78%	0.777	S	S	*	*				82	116.9	126.5	65.3	0	0	0	0	124.3
12	R	31	Very low	32.7	Very low	207 Å²	207	150.7 Å²	150.7	78%	0.781	76%	0.756	S	S	*	*			trans	81.6	115.1	131.5	-74.1	176.7	171.4	-171.5	0.9	122.3
13	R	32	Very low	32.7	Very low	186 Å²	186	153.4 Å²	153.4	70%	0.702	76%	0.762	S	S	*	*			trans	68.4	153.4	130.3	-66.5	179.4	172.6	179.3	-1.7	117.1
14	R	31.4	Very low	32.5	Very low	191 Å²	191	153.1 Å²	153.1	72%	0.721	76%	0.76	S	S	*	*			cis	-160.2	157.1	0.8	-124.8	170.7	-177.9	-178.5	-2	109.9
15	R	32.4	Very low	32.3	Very low	199 Å²	199	155.4 Å²	155.4	75%	0.751	77%	0.767	S	S	*	*			trans	15.9	146.8	138.6	-74.7	-174.8	172.6	178.9	-1	119.6
16	R	33.4	Very low	32.2	Very low	180 Å²	180	154.9 Å²	154.9	68%	0.679	76%	0.764	S	S	*	*			cis	-174.4	174.3	24.7	-132.6	171.7	174.7	-158.5	9.7	114.7
17	E	34	Very low	32.6	Very low	116 Å²	116	154.5 Å²	154.5	54%	0.542	76%	0.758	S	S	.	*			trans	74.7	146.8	152.7	-78.1	169.3	-131.8	0	0	117.7
18	R	33	Very low	32.7	Very low	185 Å²	185	156.4 Å²	156.4	70%	0.698	76%	0.76	S	S	*	*			cis	-154.7	145.3	15.3	-134.9	174	-126.8	-164.9	0.1	115
19	H	32.8	Very low	32.8	Very low	165 Å²	165	151.3 Å²	151.3	76%	0.764	76%	0.756	S	S	*	*			trans	58.8	153.5	159.1	-55.3	-34.8	0	0	0	119.4
20	S	34.5	Very low	32.8	Very low	117 Å²	117	149.8 Å²	149.8	82%	0.818	75%	0.747	S	S	*	*			cis	-139.8	167.5	22.6	-71.4	0	0	0	0	115.9
21	R	34	Very low	32.7	Very low	232 Å²	232	148.1 Å²	148.1	88%	0.875	74%	0.735	S	S	*	*			trans	-37.1	146.7	176.8	-59.1	163.9	-175.8	168.5	-0.5	116.3
22	S	30.6	Very low	32.5	Very low	98 Å²	98	151.5 Å²	151.5	69%	0.685	73%	0.734	S	S	*	*			cis	87.5	112.5	23.2	82	0	0	0	0	117.8
23	F	32.4	Very low	32.6	Very low	200 Å²	200	149.6 Å²	149.6	88%	0.877	73%	0.727	S	S	*	*			trans	-173.9	171.1	131.2	-110.6	-71.9	0	0	0	112.3
24	T	32.7	Very low	32.7	Very low	118 Å²	118	149.6 Å²	149.6	72%	0.724	73%	0.729	S	S	*	*			trans	-150	143.7	-172.1	51.3	0	0	0	0	111.7
25	L	31.9	Very low	32.9	Very low	177 Å²	177	148.3 Å²	148.3	93%	0.927	73%	0.729	S	S	*	*			trans	170	170.8	141.7	-93.5	160.3	0	0	0	112.8
26	S	31	Very low	33	Very low	106 Å²	106	144.3 Å²	144.3	74%	0.741	73%	0.726	S	S	*	*			trans	-133.9	-172.5	-175.9	-27.4	0	0	0	0	109.7
27	P	41.9	Very low	33	Very low	110 Å²	110	141.4 Å²	141.4	71%	0.714	73%	0.725	S	S	*	*			cis	-139.4	179.8	-18.4	39.3	-20.6	0	0	0	116.4
28	S	31.3	Very low	33	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	73%	0.734	S	S	*	*			trans	76.7	147.3	143.8	66.2	0	0	0	0	125.2
29	A	33.8	Very low	32.9	Very low	100 Å²	100	139.6 Å²	139.6	83%	0.826	73%	0.734	S	S	*	*			trans	72.2	147.1	163.9	0	0	0	0	0	119
30	E	30.9	Very low	32.9	Very low	148 Å²	148	136.4 Å²	136.4	69%	0.692	73%	0.731	S	S	*	*			cis	-140.8	-143	-5.9	-139.7	-58.1	73.2	0	0	111.1	R32	E30-R32 IonicContact OE2-CZ 2.7Å; E30-R32 IonicContact OE2-NE 2.93Å; E30-R32 IonicContact OE2-NH2 3.89Å; E30-R32 PolarHBondContact OE2-NH2 3.18Å
31	S	29.3	Very low	32.6	Very low	68 Å²	68	142.4 Å²	142.4	48%	0.476	74%	0.735	S	S	.	*			trans	-144	-179.6	-159.1	74.6	0	0	0	0	117.6
32	R	29.2	Very low	32.8	Very low	166 Å²	166	137 Å²	137	63%	0.626	73%	0.73	S	S	*	*			trans	83.1	158.4	159.6	-83.7	170.6	-81.3	170.7	-4.5	119.6	E30	E30-R32 IonicContact OE2-CZ 2.7Å; E30-R32 IonicContact OE2-NE 2.93Å; E30-R32 IonicContact OE2-NH2 3.89Å; E30-R32 PolarHBondContact OE2-NH2 3.18Å
33	Y	32.9	Very low	32.7	Very low	167 Å²	167	142 Å²	142	66%	0.655	74%	0.739	S	S	*	*			cis	-116.6	-132.8	1.3	-92	-76.5	0	0	0	111
34	Y	34.3	Very low	32.8	Very low	187 Å²	187	142 Å²	142	73%	0.733	74%	0.74	S	S	*	*			cis	-163.2	101.9	-0.9	-132.3	-48.1	0	0	0	114.9
35	F	34.3	Very low	32.9	Very low	164 Å²	164	140.5 Å²	140.5	72%	0.719	74%	0.739	S	S	*	*			trans	61.4	163.3	149.2	-77.2	-128.1	0	0	0	120.4
36	T	35	Very low	32.8	Very low	114 Å²	114	139 Å²	139	70%	0.699	74%	0.736	S	S	*	*			cis	-138.4	151.4	9.4	17.6	0	0	0	0	112.1
37	N	33.6	Very low	32.8	Very low	120 Å²	120	137.6 Å²	137.6	64%	0.642	74%	0.739	S	S	*	*			trans	42.9	146.7	141.8	-61.4	41.6	0	0	0	121
38	E	33	Very low	32.3	Very low	157 Å²	157	137.5 Å²	137.5	73%	0.734	74%	0.741	S	S	*	*			cis	-175.9	177.8	-3.3	-113.9	-168.7	-77.1	0	0	108
39	C	32.3	Very low	32.6	Very low	105 Å²	105	137.1 Å²	137.1	71%	0.709	74%	0.739	S	S	*	*			cis	-161.1	-177.6	-24.1	-137.3	0	0	0	0	105.4
40	S	32.4	Very low	32.5	Very low	98 Å²	98	139.6 Å²	139.6	69%	0.685	74%	0.738	S	S	*	*			cis	-153.7	173.3	-6.1	69.9	0	0	0	0	108.9
41	R	27.5	Very low	32.7	Very low	244 Å²	244	137.8 Å²	137.8	92%	0.921	74%	0.742	S	S	*	*			trans	-154.1	132.8	158	-94.2	-171	177.5	-175.9	-1.5	109.3
42	P	38.9	Very low	32.9	Very low	117 Å²	117	139.7 Å²	139.7	76%	0.76	76%	0.755	S	S	*	*			trans	-81.8	155.4	-176.8	32.5	-35.2	0	0	0	113.5
43	K	28.5	Very low	33	Very low	203 Å²	203	139 Å²	139	88%	0.883	76%	0.759	S	S	*	*			trans	-122.8	132.6	161	-69.9	-179.2	178.7	178.6	0	108.6
44	F	34.8	Very low	32.9	Very low	202 Å²	202	138.4 Å²	138.4	89%	0.886	76%	0.762	S	S	*	*			trans	-97.3	125.5	151.1	-77.6	-89.6	0	0	0	106.1
45	A	34.4	Very low	32.6	Very low	85 Å²	85	139.9 Å²	139.9	70%	0.702	77%	0.766	S	S	*	*			cis	110.7	104.5	43.8	0	0	0	0	0	107.2
46	V	29.8	Very low	32.3	Very low	145 Å²	145	138.4 Å²	138.4	88%	0.879	77%	0.765	S	S	*	*			trans	-91.3	123.1	175.6	174.6	0	0	0	0	108.3
47	G	31.5	Very low	32	Very low	77 Å²	77	142.1 Å²	142.1	79%	0.794	77%	0.768	S	S	*	*			trans	-101.4	141.1	165.1	0	0	0	0	0	110.5
48	S	30	Very low	31.8	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	77%	0.774	S	S	*	*			trans	-148.7	174.9	172.4	68.9	0	0	0	0	110.5
49	S	38	Very low	31.5	Very low	104 Å²	104	149.5 Å²	149.5	73%	0.727	78%	0.78	S	S	*	*			trans	85.4	142	-166.4	83.4	0	0	0	0	114.2
50	N	32.4	Very low	31.5	Very low	152 Å²	152	154.4 Å²	154.4	81%	0.813	79%	0.789	S	S	*	*			cis	-157.8	176.2	-15.7	-116.2	-14.6	0	0	0	111.1
51	S	34	Very low	31.4	Very low	110 Å²	110	155.9 Å²	155.9	77%	0.769	79%	0.794	S	S	*	*			trans	74.4	134.7	-175.9	77.9	0	0	0	0	114.9
52	S	33.4	Very low	31.5	Very low	108 Å²	108	151.3 Å²	151.3	76%	0.755	79%	0.787	S	S	*	*			cis	-150.8	165.2	-6.9	-104.3	0	0	0	0	114.2
53	Q	31.2	Very low	31	Very low	151 Å²	151	150.5 Å²	150.5	71%	0.706	79%	0.785	S	S	*	*			trans	-44	164.6	166.5	-68.5	159.8	-77.4	0	0	114.9
54	E	30.6	Very low	31.9	Very low	154 Å²	154	145.9 Å²	145.9	72%	0.72	78%	0.775	S	S	*	*			cis	-156.9	172.4	7	-133.4	152.6	-147	0	0	116.6
55	W	29.4	Very low	32	Very low	219 Å²	219	142.6 Å²	142.6	83%	0.83	77%	0.766	S	S	*	*			trans	-48.8	144	179.2	-71.7	61.5	0	0	0	120.6
56	L	26.9	Very low	32.1	Very low	133 Å²	133	144.5 Å²	144.5	70%	0.696	76%	0.764	S	S	*	*				25.5	138	124.6	-76.4	162.3	0	0	0	122.6
57	Y	30.2	Very low	32.5	Very low	192 Å²	192	145.7 Å²	145.7	75%	0.753	76%	0.758	S	S	*	*			trans	91	105.3	144	-97.9	-70.6	0	0	0	123.1
58	R	28.3	Very low	32.8	Very low	206 Å²	206	154.2 Å²	154.2	78%	0.777	77%	0.766	S	S	*	*			trans	72.7	131.4	140.2	-98.4	177.2	-177.3	-178.1	2.2	122.8
59	R	26.5	Very low	32.9	Very low	226 Å²	226	152.5 Å²	152.5	85%	0.853	77%	0.765	S	S	*	*			trans	71.7	117.6	150.4	-71.2	-177	170.5	-179.8	-2.4	119.4
60	K	33.1	Very low	32.9	Very low	207 Å²	207	154.2 Å²	154.2	90%	0.9	77%	0.771	S	S	*	*				-157	146.4	115.6	-104.2	160.4	-174.5	175.4	0	111.1
61	T	30.1	Very low	32.9	Very low	130 Å²	130	155 Å²	155	80%	0.798	77%	0.77	S	S	*	*			trans	-142.9	155.2	171.1	51.1	0	0	0	0	105.5
62	L	30.1	Very low	33.1	Very low	148 Å²	148	157.3 Å²	157.3	78%	0.775	77%	0.772	S	S	*	*				-170.2	149.7	55.6	-97.7	171.5	0	0	0	111.4
63	S	28.4	Very low	33	Very low	100 Å²	100	161.5 Å²	161.5	70%	0.699	78%	0.777	S	S	*	*			trans	58.6	-173.1	132.9	94.1	0	0	0	0	118.5
64	P	47.4	Very low	33.6	Very low	105 Å²	105	160.3 Å²	160.3	68%	0.682	78%	0.782	S	S	*	*			cis	-110.6	-161.6	7.6	46.1	-34.3	0	0	0	112.8
65	L	35.1	Very low	33.6	Very low	134 Å²	134	158.9 Å²	158.9	70%	0.702	79%	0.789	S	S	*	*			cis	-158	178.2	-0.2	-136.8	151.5	0	0	0	109.8
66	N	37.5	Very low	33.6	Very low	124 Å²	124	156.5 Å²	156.5	66%	0.663	79%	0.792	S	S	*	*			trans	73.7	128.7	165.4	-73.6	-23.7	0	0	0	120
67	K	38.3	Very low	34.2	Very low	171 Å²	171	155.2 Å²	155.2	74%	0.743	79%	0.791	S	S	*	*			cis	-166	160.6	-21.7	-131.3	173.4	-155.5	162.8	0	112.2
68	R	37.3	Very low	34.1	Very low	255 Å²	255	150.6 Å²	150.6	96%	0.962	79%	0.787	S	S	*	*			trans	70.9	132.8	-176.1	-46.5	-179.8	-174.3	-160.8	1.5	112.5
69	G	32.4	Very low	34.2	Very low	73 Å²	73	150 Å²	150	75%	0.753	79%	0.79	S	S	*	*			cis	135.9	123.7	3.2	0	0	0	0	0	107.9
70	V	39	Very low	34.4	Very low	140 Å²	140	144.9 Å²	144.9	85%	0.848	78%	0.784	S	S	*	*				-158.4	141.3	51.9	165.1	0	0	0	0	111
71	H	32.3	Very low	34.4	Very low	168 Å²	168	139.5 Å²	139.5	78%	0.778	77%	0.772	S	S	*	*			trans	5.7	151.2	142.3	-71.4	-110.8	0	0	0	120.8
72	I	37	Very low	34.5	Very low	160 Å²	160	141.1 Å²	141.1	82%	0.821	78%	0.776	S	S	*	*			cis	-149.1	-175.9	31.6	-118.5	139	0	0	0	113.4
73	K	32.3	Very low	34.6	Very low	196 Å²	196	137.7 Å²	137.7	85%	0.852	78%	0.776	S	S	*	*			trans	-89.3	169.1	-167.2	-80.3	-179.6	177	177.7	0	117.6
74	P	42.5	Very low	34.8	Very low	125 Å²	125	144.2 Å²	144.2	81%	0.812	79%	0.785	S	S	*	*			trans	-107.4	173.9	-177.5	42	-36.3	0	0	0	116.3
75	S	31.6	Very low	34	Very low	124 Å²	124	150.4 Å²	150.4	87%	0.867	80%	0.795	S	S	*	*			trans	-153	178.6	167.5	61.3	0	0	0	0	114.1
76	L	28.3	Very low	33.9	Very low	170 Å²	170	151 Å²	151	89%	0.89	80%	0.798	S	S	*	*			trans	-106.1	-176.6	-164.4	-89	166.2	0	0	0	113.7
77	P	40.1	Very low	33.6	Very low	106 Å²	106	156.1 Å²	156.1	69%	0.688	81%	0.808	S	S	*	*			trans	-114	179.4	-139.8	44.4	-40.8	0	0	0	118.8
78	S	29.4	Very low	33.4	Very low	94 Å²	94	157.5 Å²	157.5	66%	0.657	81%	0.814	S	S	*	*			trans	97.4	150.2	142.9	79.3	0	0	0	0	120.6
79	F	30.1	Very low	33.1	Very low	193 Å²	193	150.7 Å²	150.7	85%	0.846	80%	0.801	S	S	*	*			trans	63.4	157.2	176.3	-73.1	-100.5	0	0	0	117.5
80	V	30.9	Very low	33.2	Very low	119 Å²	119	157.8 Å²	157.8	72%	0.721	81%	0.807	S	S	*	*			cis	-168.5	159.6	-45.2	113	0	0	0	0	110.5
81	S	33	Very low	32.8	Very low	94 Å²	94	156.5 Å²	156.5	66%	0.657	80%	0.804	S	S	*	*			trans	119.4	123.7	147.1	78.4	0	0	0	0	121.3
82	N	30.9	Very low	32.7	Very low	165 Å²	165	157.4 Å²	157.4	88%	0.882	81%	0.809	S	S	*	*			trans	58.8	120.2	132.2	-59.7	-21.7	0	0	0	123
83	G	32.5	Very low	32.9	Very low	75 Å²	75	155.3 Å²	155.3	77%	0.773	81%	0.806	S	S	*	*			trans	-153.5	7.5	176.8	0	0	0	0	0	120.7
84	R	33.2	Very low	32.8	Very low	237 Å²	237	153 Å²	153	89%	0.894	81%	0.808	S	S	*	*			trans	56.3	111.4	171.4	-61.1	-179	177.4	-168.3	-0.6	117.8
85	R	29.7	Very low	32.1	Very low	236 Å²	236	155.8 Å²	155.8	89%	0.891	81%	0.81	S	S	*	*				66.1	123	80.2	-81	-168.3	172.4	-161.9	-0.5	116.9
86	L	33.7	Very low	32.1	Very low	145 Å²	145	157 Å²	157	76%	0.759	81%	0.805	S	S	*	*				178.1	125.5	112.1	-97.8	168.1	0	0	0	115.4
87	R	31.2	Very low	32.1	Very low	233 Å²	233	155.7 Å²	155.7	88%	0.879	80%	0.799	S	S	*	*			trans	59.1	155.3	154.5	-69.9	172.5	173	167.3	-4.2	118.5
88	K	33.8	Very low	31.8	Very low	200 Å²	200	157.8 Å²	157.8	87%	0.87	81%	0.805	S	S	*	*			cis	-117.6	-179.5	7.4	-68.7	-179.5	177.8	178.9	0	112.9
89	T	31	Very low	32	Very low	112 Å²	112	159.7 Å²	159.7	69%	0.687	81%	0.807	S	S	*	*			trans	-137.4	179.8	-178.1	49.4	0	0	0	0	110.9
90	Y	33.7	Very low	32	Very low	221 Å²	221	157.4 Å²	157.4	87%	0.867	80%	0.804	S	S	*	*			trans	79.8	143.6	176.9	-57.4	-79.4	0	0	0	115.5
91	S	31.7	Very low	32.1	Very low	113 Å²	113	158.8 Å²	158.8	79%	0.79	81%	0.807	S	S	*	*			cis	-162	179.7	-7.8	41.2	0	0	0	0	112.6
92	E	29.5	Very low	31.8	Very low	187 Å²	187	159.4 Å²	159.4	87%	0.874	81%	0.807	S	S	*	*			trans	-71.6	174.1	177.3	-89.2	179.4	152.4	0	0	115.1
93	P	41.8	Very low	31.7	Very low	117 Å²	117	160.7 Å²	160.7	76%	0.76	81%	0.805	S	S	*	*			trans	-107.4	167.9	-153.9	41.1	-36.6	0	0	0	116.6
94	T	30.6	Very low	31.4	Very low	148 Å²	148	162.7 Å²	162.7	91%	0.908	80%	0.802	S	S	*	*			trans	-153	164.4	154.8	7.6	0	0	0	0	111.9
95	E	26.8	Very low	31.1	Very low	182 Å²	182	158 Å²	158	85%	0.85	79%	0.79	S	S	*	*			trans	-79.2	154.5	177.6	-58.4	159.2	137.3	0	0	112.2
96	I	32.6	Very low	30.9	Very low	150 Å²	150	155.9 Å²	155.9	77%	0.769	78%	0.783	S	S	*	*			trans	-137.8	126.6	153.4	-63.7	-176.6	0	0	0	107.2
97	N	27	Very low	30.6	Very low	143 Å²	143	157.9 Å²	157.9	77%	0.765	78%	0.781	S	S	*	*			trans	-96.7	144	159.7	-69.1	-30	0	0	0	108
98	D	35.3	Very low	30.4	Very low	149 Å²	149	156.3 Å²	156.3	80%	0.797	78%	0.775	S	S	*	*			trans	-158.6	151.2	155.9	-76.5	-54	0	0	0	106.2
99	D	32	Very low	30.1	Very low	134 Å²	134	150.4 Å²	150.4	72%	0.717	76%	0.759	S	S	*	*				-147.6	170.1	-69.7	-133.3	-15.5	0	0	0	107.2
100	D	31.7	Very low	30	Very low	145 Å²	145	152.7 Å²	152.7	78%	0.775	76%	0.762	S	S	*	*			trans	60.6	146.6	175.9	-60.3	-39.7	0	0	0	116.4
101	D	31.5	Very low	29.8	Very low	148 Å²	148	150.8 Å²	150.8	79%	0.791	76%	0.761	S	S	*	*			cis	-146.1	166.7	29.6	-153.8	-14.6	0	0	0	112.8
102	V	28.1	Very low	29.6	Very low	108 Å²	108	150.8 Å²	150.8	66%	0.655	76%	0.761	S	S	*	*			trans	-96.3	152.4	-176.9	170.6	0	0	0	0	110.1
103	F	28.8	Very low	30	Very low	192 Å²	192	147.9 Å²	147.9	84%	0.842	76%	0.758	S	S	*	*				179.9	157.6	123.9	-110.9	-86.8	0	0	0	115.2
104	V	26	Very low	29.5	Very low	117 Å²	117	145.6 Å²	145.6	71%	0.709	76%	0.756	S	S	*	*			trans	-137.5	146.2	-178.6	164.1	0	0	0	0	109.3
105	E	26.4	Very low	29.5	Very low	138 Å²	138	145.6 Å²	145.6	65%	0.645	75%	0.749	S	S	*	*			trans	72.5	119.4	170.8	-78.4	-166.5	111.6	0	0	121.5
106	R	25	Very low	29.7	Very low	192 Å²	192	145.3 Å²	145.3	73%	0.725	75%	0.746	S	S	*	*				40.9	131.4	125.9	-53.7	172.6	175.1	160.1	-5.2	120.3
107	Y	28.8	Very low	29.4	Very low	186 Å²	186	148.4 Å²	148.4	73%	0.729	75%	0.749	S	S	*	*				-168.2	148.3	90.8	-110	-114.7	0	0	0	107.2
108	R	26.6	Very low	29.9	Very low	201 Å²	201	146.6 Å²	146.6	76%	0.758	75%	0.746	S	S	*	*				42.9	146.8	102.5	-77.1	-160.7	164.9	166.5	-6.9	116.3
109	S	27.8	Very low	29.6	Very low	75 Å²	75	145.1 Å²	145.1	52%	0.524	74%	0.742	S	S	.	*			cis	-171	138.2	-1	-100	0	0	0	0	108.5
110	E	27.7	Very low	29.4	Very low	161 Å²	161	146.4 Å²	146.4	75%	0.752	75%	0.748	S	S	*	*				104.2	176	100.4	-79.2	169.9	-125.5	0	0	115
111	E	30.8	Very low	29.3	Very low	181 Å²	181	150.9 Å²	150.9	85%	0.846	75%	0.754	S	S	*	*			trans	82.7	125.5	172.1	-54	-160.1	158.6	0	0	117.9
112	S	27.1	Very low	29	Very low	112 Å²	112	147.1 Å²	147.1	78%	0.783	75%	0.75	S	S	*	*			cis	110.4	167.9	24	-76.4	0	0	0	0	111.1
113	P	38.4	Very low	29.6	Very low	127 Å²	127	148.5 Å²	148.5	83%	0.825	76%	0.762	S	S	*	*			cis	-116.3	174.6	-7.1	41.3	-27.4	0	0	0	112.5
114	G	31	Very low	29.5	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	76%	0.758	S	S	*	*				116.8	158	61.9	0	0	0	0	0	109.3
115	L	30.7	Very low	29.7	Very low	147 Å²	147	143.5 Å²	143.5	77%	0.77	76%	0.761	S	S	*	*			cis	-135.7	-138.2	-1	-68.5	169.5	0	0	0	107.9
116	F	30.8	Very low	29.9	Very low	177 Å²	177	142 Å²	142	78%	0.776	77%	0.766	S	S	*	*			cis	-161	-167.1	1.3	-131.2	-33.9	0	0	0	110.9
117	Y	25.4	Very low	30	Very low	214 Å²	214	143.7 Å²	143.7	84%	0.839	77%	0.772	S	S	*	*			trans	-148.8	-175.5	-173	-90.2	-86	0	0	0	109.9
118	P	38.3	Very low	30	Very low	106 Å²	106	142.3 Å²	142.3	69%	0.688	78%	0.776	S	S	*	*			cis	-146	166.4	14.1	45	-24.9	0	0	0	120.6
119	T	28.6	Very low	30.2	Very low	117 Å²	117	137.8 Å²	137.8	72%	0.718	78%	0.775	S	S	*	*			trans	42.4	133.4	141.7	61.2	0	0	0	0	125.4
120	L	27.6	Very low	30.4	Very low	162 Å²	162	139.7 Å²	139.7	85%	0.848	79%	0.789	S	S	*	*				156.7	154.2	111.2	-101.8	165.7	0	0	0	116.6
121	R	30.8	Very low	30.8	Very low	238 Å²	238	138.3 Å²	138.3	90%	0.898	79%	0.794	S	S	*	*			trans	77.2	138.5	165.1	-67.4	-173.3	179.5	-165.6	0.4	121.6
122	G	25.4	Very low	30.6	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	78%	0.784	S	S	*	*			trans	-107.4	-147.4	156.4	0	0	0	0	0	110.8
123	P	40.1	Very low	30.8	Very low	138 Å²	138	136.8 Å²	136.8	90%	0.896	79%	0.791	S	S	*	*			cis	-140.1	-147.4	20.7	45.1	-24.7	0	0	0	114.7
124	S	27.4	Very low	30.5	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	78%	0.784	S	S	*	*			trans	-123.1	-179.3	-171.9	57.6	0	0	0	0	114.7
125	A	30	Very low	30.5	Very low	94 Å²	94	136.1 Å²	136.1	78%	0.777	78%	0.783	S	S	*	*			trans	78.4	160	170.4	0	0	0	0	0	116.2
126	S	29.9	Very low	30.6	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	78%	0.783	S	S	*	*			cis	-158.3	138.1	0.1	6.4	0	0	0	0	109.3
127	R	26.6	Very low	30.7	Very low	229 Å²	229	130.4 Å²	130.4	86%	0.864	78%	0.778	S	S	*	*				81.9	153.2	83.9	-160.5	-163.8	-96	-155.8	-4.5	114.2
128	I	28.2	Very low	30.8	Very low	156 Å²	156	124.2 Å²	124.2	80%	0.8	77%	0.766	S	S	*	*			trans	88.6	138.5	170.6	-53.5	168.8	0	0	0	112.5
129	S	30.8	Very low	30.4	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	77%	0.774	S	S	*	*			cis	-144.1	160.1	8.1	26.6	0	0	0	0	113.8
130	S	33.5	Very low	30.3	Very low	115 Å²	115	127.9 Å²	127.9	80%	0.804	77%	0.774	S	S	*	*			trans	-91	153.9	158.1	-37.1	0	0	0	0	110.9
131	P	34.9	Very low	30.9	Very low	132 Å²	132	125.1 Å²	125.1	86%	0.857	77%	0.766	S	S	*	*				-140.7	179.4	99.4	35.8	-20.3	0	0	0	111.8
132	G	26.7	Very low	30.8	Very low	63 Å²	63	119 Å²	119	65%	0.649	76%	0.76	S	S	*	*			cis	141.9	170.9	1	0	0	0	0	0	110.8
133	Q	31.9	Very low	31	Very low	197 Å²	197	120.5 Å²	120.5	92%	0.921	76%	0.759	S	S	*	*			trans	74.9	148.1	-177.6	-55	-170.1	35.5	0	0	115.7
134	S	31.4	Very low	30.5	Very low	99 Å²	99	120.7 Å²	120.7	69%	0.692	75%	0.753	S	S	*	*			cis	-168.7	176.1	-15.1	49.6	0	0	0	0	111.4
135	A	32.2	Very low	30.6	Very low	83 Å²	83	120.6 Å²	120.6	69%	0.686	75%	0.752	S	S	*	*			trans	65.4	115.8	160.1	0	0	0	0	0	117.7
136	S	32.2	Very low	31	Very low	109 Å²	109	121.7 Å²	121.7	76%	0.762	75%	0.752	S	S	*	*				78.8	151.3	68.4	88.5	0	0	0	0	113.6
137	S	32.6	Very low	31.6	Very low	95 Å²	95	121.9 Å²	121.9	66%	0.664	75%	0.75	S	S	*	*			cis	-158.3	153.8	10	-5.3	0	0	0	0	112.8
138	S	27.7	Very low	31.5	Very low	85 Å²	85	117.5 Å²	117.5	59%	0.594	75%	0.748	S	S	*	*			trans	-5.4	148.5	144.2	52.6	0	0	0	0	119.2
139	F	29.1	Very low	31.5	Very low	196 Å²	196	114.2 Å²	114.2	86%	0.86	75%	0.745	S	S	*	*				-154.6	154.6	60.4	-103.3	-81.7	0	0	0	118.2
140	S	27.8	Very low	31.2	Very low	103 Å²	103	117 Å²	117	72%	0.72	75%	0.748	S	S	*	*			trans	-90.8	-153.9	171	-38.3	0	0	0	0	110.1
141	P	39.7	Very low	30.9	Very low	105 Å²	105	119.7 Å²	119.7	68%	0.682	75%	0.747	S	S	*	*			cis	-143.4	170.4	-5	39.4	-19.4	0	0	0	118.6
142	S	28.4	Very low	31	Very low	110 Å²	110	118.2 Å²	118.2	77%	0.769	74%	0.738	S	S	*	*			trans	64.2	146.7	142.8	70.3	0	0	0	0	120.3
143	S	30.2	Very low	30.9	Very low	99 Å²	99	119.9 Å²	119.9	69%	0.692	74%	0.74	S	S	*	*			cis	-170.4	163.9	40.4	55.4	0	0	0	0	115.2
144	N	30.1	Very low	30.6	Very low	142 Å²	142	114.6 Å²	114.6	76%	0.759	73%	0.725	S	S	*	*			trans	64.6	98.2	142.1	-66.4	6.2	0	0	0	125.2
145	S	29.5	Very low	30.4	Very low	109 Å²	109	118.6 Å²	118.6	76%	0.762	73%	0.732	S	S	*	*				62.4	157.7	116.3	54.2	0	0	0	0	124.7
146	P	38.3	Very low	30.2	Very low	117 Å²	117	120.7 Å²	120.7	76%	0.76	73%	0.732	S	S	*	*			trans	-116.8	-148.4	-161.2	45.1	-29	0	0	0	112.5
147	P	41	Very low	30.2	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	74%	0.735	S	S	*	*			cis	-142.3	-167.3	-4.8	28.8	-1	0	0	0	117.6
148	V	26.5	Very low	29.9	Very low	136 Å²	136	122.8 Å²	122.8	82%	0.824	73%	0.728	S	S	*	*			trans	108.8	131.6	148.4	-177.2	0	0	0	0	121.3
149	A	27.1	Very low	30	Very low	88 Å²	88	130 Å²	130	73%	0.727	74%	0.743	S	S	*	*			trans	80.2	113.5	152.2	0	0	0	0	0	125.4
150	M	25.6	Very low	30	Very low	166 Å²	166	124.8 Å²	124.8	82%	0.818	73%	0.731	S	S	*	*				45.8	120.8	127.7	-68.7	-169.5	140.3	0	0	124.9
151	H	25.5	Very low	30.3	Very low	170 Å²	170	126.6 Å²	126.6	79%	0.787	74%	0.738	S	S	*	*			trans	61.1	169.7	141	-78.8	-68.4	0	0	0	119.4
152	P	37.5	Very low	30.1	Very low	102 Å²	102	127.3 Å²	127.3	66%	0.662	74%	0.743	S	S	*	*			cis	-132.3	-173.5	-28.6	30.9	-9.1	0	0	0	114
153	S	24.5	Very low	30	Very low	98 Å²	98	134.5 Å²	134.5	69%	0.685	75%	0.753	S	S	*	*			trans	61.8	151.7	140.8	59.6	0	0	0	0	124.5
154	S	25.6	Very low	29.8	Very low	86 Å²	86	133.5 Å²	133.5	60%	0.601	76%	0.758	S	S	*	*			trans	67.1	123.3	144	64.5	0	0	0	0	121.3
155	E	27.7	Very low	29.8	Very low	182 Å²	182	131.4 Å²	131.4	85%	0.85	76%	0.755	S	S	*	*				67.7	155.7	119.9	-70.2	171.3	-150.8	0	0	120.9
156	D	26.9	Very low	29.8	Very low	128 Å²	128	135.7 Å²	135.7	68%	0.684	76%	0.76	S	S	*	*			cis	-164	138.3	-33.3	-140.9	2.6	0	0	0	109.5
157	I	32	Very low	29.5	Very low	159 Å²	159	134.4 Å²	134.4	82%	0.815	76%	0.759	S	S	*	*			trans	-149.8	87.1	166.6	-58.8	-176.2	0	0	0	106.4
158	V	26.6	Very low	29.1	Very low	88 Å²	88	135.9 Å²	135.9	53%	0.533	76%	0.761	S	S	.	*				52.6	117.5	77.9	-168.4	0	0	0	0	110.6
159	W	29.5	Very low	29.4	Very low	236 Å²	236	136.6 Å²	136.6	89%	0.894	76%	0.76	S	S	*	*				-149.6	163.7	58.4	-72.7	74.9	0	0	0	110.4
160	S	29.9	Very low	29.6	Very low	87 Å²	87	135.3 Å²	135.3	61%	0.608	76%	0.755	S	S	*	*			cis	-172.9	154.2	-22.5	59.8	0	0	0	0	109.4
161	T	34	Very low	29.9	Very low	141 Å²	141	135.9 Å²	135.9	87%	0.865	76%	0.756	S	S	*	*			trans	-132.1	127.3	162.7	52.2	0	0	0	0	110.3
162	P	35.3	Very low	30.1	Very low	121 Å²	121	137.3 Å²	137.3	79%	0.786	76%	0.76	S	S	*	*			trans	-103.1	120.4	-179.5	34.8	-29.6	0	0	0	113.9
163	R	26.7	Very low	29.7	Very low	261 Å²	261	136.3 Å²	136.3	99%	0.985	76%	0.76	S	S	*	*			trans	-131.2	126.2	137.4	-94.4	-166.9	172.7	-153.9	-1.5	107.9
164	G	26.7	Very low	30	Very low	78 Å²	78	140.1 Å²	140.1	80%	0.804	77%	0.767	S	S	*	*			trans	-163.7	148.9	176.8	0	0	0	0	0	108.6
165	S	29	Very low	30.2	Very low	98 Å²	98	143.3 Å²	143.3	69%	0.685	78%	0.777	S	S	*	*			trans	-153.5	169.9	-170.3	56.4	0	0	0	0	112.1
166	F	30.6	Very low	30.3	Very low	199 Å²	199	142.9 Å²	142.9	87%	0.873	78%	0.775	S	S	*	*			trans	92.3	131.2	170.9	-59.6	-72.5	0	0	0	118.8
167	A	32.2	Very low	30.7	Very low	89 Å²	89	141.5 Å²	141.5	74%	0.736	77%	0.773	S	S	*	*			trans	-138.8	132.7	135.4	0	0	0	0	0	107.8
168	N	32.3	Very low	30.7	Very low	140 Å²	140	141.9 Å²	141.9	75%	0.749	77%	0.771	S	S	*	*			trans	12.2	151.5	147.6	-67	49	0	0	0	120.7
169	D	33.3	Very low	31	Very low	151 Å²	151	143.3 Å²	143.3	81%	0.807	78%	0.782	S	S	*	*			cis	-161.2	166	7.7	-120.8	-36.7	0	0	0	111.6
170	G	29.4	Very low	30.9	Very low	61 Å²	61	136.7 Å²	136.7	63%	0.629	77%	0.772	S	S	*	*			trans	129.6	89.6	155.6	0	0	0	0	0	120.9
171	H	33.7	Very low	30.7	Very low	179 Å²	179	140.3 Å²	140.3	83%	0.829	78%	0.784	S	S	*	*			trans	45.1	124	146.6	-63	-60.4	0	0	0	125
172	K	29.5	Very low	30.3	Very low	200 Å²	200	140.7 Å²	140.7	87%	0.87	78%	0.78	S	S	*	*				36.8	149.4	126.9	-63.6	-172.5	175.1	-170.2	0	122
173	A	28.6	Very low	29.8	Very low	80 Å²	80	141.4 Å²	141.4	66%	0.661	78%	0.782	S	S	*	*			cis	-175.6	172.9	-16.2	0	0	0	0	0	110
174	E	31.4	Very low	30	Very low	179 Å²	179	134.8 Å²	134.8	84%	0.836	77%	0.77	S	S	*	*			trans	77.3	113.2	161.8	-67.7	167.1	-153.2	0	0	121
175	D	29.8	Very low	30	Very low	152 Å²	152	142 Å²	142	81%	0.813	78%	0.775	S	S	*	*				62.7	141.7	129.2	-61.7	6.4	0	0	0	127.1
176	E	28.4	Very low	30.3	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	78%	0.778	S	S	*	*			trans	76.8	162.6	153.1	-76.8	-61.2	97.2	0	0	120.3
177	P	35.3	Very low	30.2	Very low	99 Å²	99	140.8 Å²	140.8	64%	0.643	78%	0.776	S	S	*	*				-118.6	-174.6	-123.9	45.8	-40.7	0	0	0	118.1
178	E	33.2	Very low	30.1	Very low	167 Å²	167	139.5 Å²	139.5	78%	0.78	77%	0.771	S	S	*	*			trans	11	124.4	158.8	-85.8	-85.3	172.1	0	0	118
179	P	32.4	Very low	30.3	Very low	117 Å²	117	143 Å²	143	76%	0.76	78%	0.776	S	S	*	*				-148.8	168.9	92.5	39.6	-24.3	0	0	0	117.5
180	S	27	Very low	30.5	Very low	98 Å²	98	145.5 Å²	145.5	69%	0.685	77%	0.774	S	S	*	*			trans	-55.6	147.7	171.1	62.2	0	0	0	0	116.7
181	L	26.5	Very low	30.9	Very low	163 Å²	163	148.8 Å²	148.8	85%	0.853	78%	0.777	S	S	*	*			trans	-165.8	171.2	134.7	-110.3	169	0	0	0	114
182	L	24.1	Very low	31.3	Very low	149 Å²	149	144.4 Å²	144.4	78%	0.78	76%	0.763	S	S	*	*			trans	-58.4	154.7	-176.7	-83.2	67.4	0	0	0	114.6
183	T	25.4	Very low	32	Very low	136 Å²	136	141.4 Å²	141.4	83%	0.834	75%	0.752	S	S	*	*				-163.1	141.1	129.2	11.8	0	0	0	0	114.8
184	V	30.3	Very low	33.3	Very low	121 Å²	121	141.8 Å²	141.8	73%	0.733	74%	0.742	S	S	*	*			trans	47.5	114	149.6	-176.3	0	0	0	0	120.5
185	Y	28	Very low	34	Very low	229 Å²	229	142.8 Å²	142.8	90%	0.898	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-80.4	133.3	148	-76.4	-91.6	0	0	0	110.3
186	P	35.8	Very low	34.9	Very low	115 Å²	115	143 Å²	143	75%	0.747	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-91.8	117.2	162.6	31.1	-25.2	0	0	0	110.9	G188	P186-G188 PolarHBondContact O-N 3.04Å
187	D	28	Very low	36.1	Very low	157 Å²	157	140.7 Å²	140.7	84%	0.84	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-65.3	121.4	167.8	-98.8	-53.4	0	0	0	110
188	G	30.7	Very low	37.1	Very low	62 Å²	62	140.9 Å²	140.9	64%	0.639	72%	0.719	S	S	*	*			trans	-172.5	11.4	-175.4	0	0	0	0	0	118.2	P186	P186-G188 PolarHBondContact O-N 3.04Å
189	Y	35.9	Very low	38.3	Very low	214 Å²	214	134.5 Å²	134.5	84%	0.839	70%	0.698	S	S	*	*			trans	-138.4	37.7	-173.3	-89.2	-80.9	0	0	0	114.7
190	R	36.2	Very low	39.5	Very low	203 Å²	203	131.3 Å²	131.3	77%	0.766	68%	0.682	S	S	*	*	S	Bend	trans	-102.2	-19.5	175	-86.8	-178	167.1	163.6	-1.7	115.9
191	D	38.5	Very low	41.1	Very low	130 Å²	130	129.3 Å²	129.3	70%	0.695	67%	0.671	S	S	*	*	S	Bend	trans	-86.9	-15.9	-170.7	-71.3	-44.4	0	0	0	115.8
192	T	43.1	Very low	42.8	Very low	87 Å²	87	127.8 Å²	127.8	53%	0.534	66%	0.659	S	S	.	*	H	α-helix	trans	-71	-48.7	-176.7	47.3	0	0	0	0	112.5	I194 R195	T192-I194 PolarHBondContact O-N 3.15Å; T192-R195 PolarHBondContact O-N 3.14Å
193	Q	44	Very low	44.7	Very low	138 Å²	138	124 Å²	124	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-65.6	-23.1	-179.4	-68.1	-177.7	-10.1	0	0	113.3
194	I	55.5	Low	46.4	Very low	87 Å²	87	123.1 Å²	123.1	45%	0.446	63%	0.634	S	S	.	*	H	α-helix	trans	-72	-36.4	177.2	-62	176.5	0	0	0	110.9	T192 Q198	T192-I194 PolarHBondContact O-N 3.15Å; I194-Q198 HydrophobicContact CG2-CG 4.46Å; I194-Q198 WeakPolarHBondContact O-CB 3.49Å; I194-Q198 WeakPolarHBondContact O-CG 3.31Å; I194-Q198 PolarHBondContact O-N 2.77Å
195	R	46.4	Very low	47.9	Very low	200 Å²	200	122 Å²	122	76%	0.755	62%	0.621	S	S	*	*	H	α-helix	trans	-68.7	-38.6	-179.1	-80.8	-174.5	171.7	173.4	-0.3	113.5	T192 Q198 G199	T192-R195 PolarHBondContact O-N 3.14Å; R195-Q198 PolarHBondContact O-N 3.44Å; R195-G199 PolarHBondContact O-N 2.88Å
196	E	48.5	Very low	49.6	Very low	156 Å²	156	113.8 Å²	113.8	73%	0.729	60%	0.601	S	S	*	*	H	α-helix	trans	-67.9	-41.5	178.5	-64.8	-173.8	159.3	0	0	111.6	Q198 G199 A200	E196-Q198 VanDerWaalsContact C-N 3.32Å; E196-Q198 PolarHBondContact O-N 3.11Å; E196-G199 PolarHBondContact O-N 2.74Å; E196-G199 VanDerWaalsContact O-N 3.17Å; E196-A200 PolarHBondContact O-N 3.33Å
197	L	53.6	Low	50.3	Low	126 Å²	126	113.4 Å²	113.4	66%	0.66	59%	0.592	S	S	*	*	H	α-helix	trans	-64	-35.8	172.5	-70.6	172.3	0	0	0	112.3	A201	L197-A201 WeakPolarHBondContact O-CB 3.49Å; L197-A201 PolarHBondContact O-N 3.46Å
198	Q	55.9	Low	51.5	Low	104 Å²	104	108.7 Å²	108.7	49%	0.486	57%	0.572	S	S	.	*	H	α-helix	trans	-65.2	-40.3	170.8	-77.1	177.4	-7.6	0	0	112.4	I194 R195 E196 A201 Q202	I194-Q198 HydrophobicContact CG2-CG 4.46Å; I194-Q198 WeakPolarHBondContact O-CB 3.49Å; I194-Q198 WeakPolarHBondContact O-CG 3.31Å; I194-Q198 PolarHBondContact O-N 2.77Å; R195-Q198 PolarHBondContact O-N 3.44Å; E196-Q198 VanDerWaalsContact C-N 3.32Å; E196-Q198 PolarHBondContact O-N 3.11Å; Q198-A201 PolarHBondContact O-N 3.45Å; Q198-Q202 WeakPolarHBondContact O-CB 3.27Å; Q198-Q202 VanDerWaalsContact O-CG 3.29Å; Q198-Q202 WeakPolarHBondContact O-CG 3.3Å; Q198-Q202 PolarHBondContact O-N 2.96Å
199	G	59.3	Low	52.6	Low	32 Å²	32	112.8 Å²	112.8	33%	0.33	57%	0.568	S	S	.	*	H	α-helix	trans	-62.3	-42.5	175.4	0	0	0	0	0	112.9	R195 E196 S203	R195-G199 PolarHBondContact O-N 2.88Å; E196-G199 PolarHBondContact O-N 2.74Å; E196-G199 VanDerWaalsContact O-N 3.17Å; G199-S203 WeakPolarHBondContact O-CB 3.44Å; G199-S203 PolarHBondContact O-N 3.46Å; G199-S203 PolarHBondContact O-OG 2.91Å
200	A	57.7	Low	53.1	Low	51 Å²	51	110.9 Å²	110.9	42%	0.421	56%	0.559	S	S	.	*	H	α-helix	trans	-63.5	-46.1	173.1	0	0	0	0	0	111.9	E196 Q202 S203 I204	E196-A200 PolarHBondContact O-N 3.33Å; A200-Q202 PolarHBondContact O-N 2.89Å; A200-S203 WeakPolarHBondContact O-CB 3.47Å; A200-S203 PolarHBondContact O-N 2.76Å; A200-I204 WeakPolarHBondContact O-CG1 3.41Å; A200-I204 PolarHBondContact O-N 2.97Å
201	A	60.1	Low	53.5	Low	56 Å²	56	105.9 Å²	105.9	46%	0.463	55%	0.548	S	S	.	.	H	α-helix	trans	-62.7	-42.5	177.7	0	0	0	0	0	112.6	L197 Q198 S203 I204 E205	L197-A201 WeakPolarHBondContact O-CB 3.49Å; L197-A201 PolarHBondContact O-N 3.46Å; Q198-A201 PolarHBondContact O-N 3.45Å; A201-S203 VanDerWaalsContact C-N 3.32Å; A201-S203 PolarHBondContact O-N 3.09Å; A201-I204 PolarHBondContact O-N 2.83Å; A201-E205 PolarHBondContact O-N 2.89Å
202	Q	62.8	Low	53.8	Low	130 Å²	130	108.7 Å²	108.7	61%	0.607	55%	0.549	S	S	*	.	H	α-helix	trans	-65	-35	175.4	-74.5	178.9	11.4	0	0	112.2	Q198 A200 E205 A206	Q198-Q202 WeakPolarHBondContact O-CB 3.27Å; Q198-Q202 VanDerWaalsContact O-CG 3.29Å; Q198-Q202 WeakPolarHBondContact O-CG 3.3Å; Q198-Q202 PolarHBondContact O-N 2.96Å; A200-Q202 PolarHBondContact O-N 2.89Å; Q202-E205 PolarHBondContact O-N 2.84Å; Q202-A206 WeakPolarHBondContact O-CB 3.46Å; Q202-A206 PolarHBondContact O-N 3.12Å
203	S	63.2	Low	53.8	Low	71 Å²	71	113.4 Å²	113.4	50%	0.497	56%	0.557	S	S	.	*	H	α-helix	trans	-66.3	-40.4	174.8	-59.6	0	0	0	0	112	G199 A200 A201 A206 L207	G199-S203 WeakPolarHBondContact O-CB 3.44Å; G199-S203 PolarHBondContact O-N 3.46Å; G199-S203 PolarHBondContact O-OG 2.91Å; A200-S203 WeakPolarHBondContact O-CB 3.47Å; A200-S203 PolarHBondContact O-N 2.76Å; A201-S203 VanDerWaalsContact C-N 3.32Å; A201-S203 PolarHBondContact O-N 3.09Å; S203-A206 PolarHBondContact O-N 3.44Å; S203-L207 PolarHBondContact O-N 3.23Å
204	I	61.5	Low	53.5	Low	116 Å²	116	115.6 Å²	115.6	60%	0.595	56%	0.559	S	S	*	*	H	α-helix	trans	-67.1	-40.8	174	-66.4	166.3	0	0	0	110.8	A200 A201 L207 S208	A200-I204 WeakPolarHBondContact O-CG1 3.41Å; A200-I204 PolarHBondContact O-N 2.97Å; A201-I204 PolarHBondContact O-N 2.83Å; I204-L207 PolarHBondContact O-N 3.27Å; I204-S208 WeakPolarHBondContact O-CB 3.42Å; I204-S208 PolarHBondContact O-N 3.49Å
205	E	61.6	Low	52.6	Low	97 Å²	97	117.9 Å²	117.9	45%	0.453	57%	0.571	S	S	.	*	H	α-helix	trans	-61.5	-42.8	171.6	-104.2	-131.1	89.8	0	0	112.2	A201 Q202 S208 R209	A201-E205 PolarHBondContact O-N 2.89Å; Q202-E205 PolarHBondContact O-N 2.84Å; E205-S208 PolarHBondContact O-N 2.95Å; E205-R209 WeakPolarHBondContact O-CB 3.43Å; E205-R209 WeakPolarHBondContact O-CG 3.34Å; E205-R209 PolarHBondContact O-N 2.9Å; E205-R209 IonicContact OE1-CZ 2.75Å; E205-R209 IonicContact OE1-NE 3.25Å; E205-R209 PolarHBondContact OE1-NE 2.85Å; E205-R209 IonicContact OE1-NH2 2.67Å; E205-R209 PolarHBondContact OE1-NH2 2.77Å; E205-R209 IonicContact OE2-CZ 3.8Å; E205-R209 IonicContact OE2-NE 3.76Å; E205-R209 IonicContact OE2-NH2 3.91Å; E205-R209 PolarHBondContact OE2-NH2 2.83Å
206	A	63.2	Low	52.1	Low	58 Å²	58	111.3 Å²	111.3	48%	0.479	56%	0.556	S	S	.	*	H	α-helix	trans	-63	-42.8	178	0	0	0	0	0	111.7	Q202 S203 R209 R210	Q202-A206 WeakPolarHBondContact O-CB 3.46Å; Q202-A206 PolarHBondContact O-N 3.12Å; S203-A206 PolarHBondContact O-N 3.44Å; A206-R209 PolarHBondContact O-N 3.36Å; A206-R210 WeakPolarHBondContact O-CB 3.23Å; A206-R210 PolarHBondContact O-N 3.11Å
207	L	50.3	Low	51.4	Low	106 Å²	106	109.6 Å²	109.6	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-61.7	-44.7	171.4	-80.7	162.6	0	0	0	111.8	S203 I204 R209 R210 N211	S203-L207 PolarHBondContact O-N 3.23Å; I204-L207 PolarHBondContact O-N 3.27Å; L207-R209 VanDerWaalsContact C-N 3.34Å; L207-R209 PolarHBondContact O-N 3.19Å; L207-R210 PolarHBondContact O-N 3.38Å; L207-N211 PolarHBondContact O-N 3.25Å
208	S	52.6	Low	50.6	Low	59 Å²	59	112.8 Å²	112.8	41%	0.413	56%	0.561	S	S	.	*	H	α-helix	trans	-63	-38.8	176.5	-173.3	0	0	0	0	112.4	I204 E205 R212	I204-S208 WeakPolarHBondContact O-CB 3.42Å; I204-S208 PolarHBondContact O-N 3.49Å; E205-S208 PolarHBondContact O-N 2.95Å; S208-R212 WeakPolarHBondContact O-CG 3.06Å; S208-R212 PolarHBondContact O-N 2.99Å
209	R	54.9	Low	49.4	Very low	148 Å²	148	113.6 Å²	113.6	56%	0.558	57%	0.573	S	S	*	*	H	α-helix	trans	-69.1	-37.6	175.5	-69.8	168.4	-173.5	-158.6	6.9	111.4	E205 A206 L207 R212 R213	E205-R209 WeakPolarHBondContact O-CB 3.43Å; E205-R209 WeakPolarHBondContact O-CG 3.34Å; E205-R209 PolarHBondContact O-N 2.9Å; E205-R209 IonicContact OE1-CZ 2.75Å; E205-R209 IonicContact OE1-NE 3.25Å; E205-R209 PolarHBondContact OE1-NE 2.85Å; E205-R209 IonicContact OE1-NH2 2.67Å; E205-R209 PolarHBondContact OE1-NH2 2.77Å; E205-R209 IonicContact OE2-CZ 3.8Å; E205-R209 IonicContact OE2-NE 3.76Å; E205-R209 IonicContact OE2-NH2 3.91Å; E205-R209 PolarHBondContact OE2-NH2 2.83Å; A206-R209 PolarHBondContact O-N 3.36Å; L207-R209 VanDerWaalsContact C-N 3.34Å; L207-R209 PolarHBondContact O-N 3.19Å; R209-R212 PolarHBondContact O-N 2.7Å; R209-R213 PolarHBondContact O-N 3.1Å; R209-R213 VanDerWaalsContact O-N 3.12Å
210	R	46.9	Very low	47.9	Very low	173 Å²	173	116.5 Å²	116.5	65%	0.653	59%	0.594	S	S	*	*	H	α-helix	trans	-66	-42.1	175.2	-164.7	174.2	-169.5	170.8	2.8	112	A206 L207 R213 R214	A206-R210 WeakPolarHBondContact O-CB 3.23Å; A206-R210 PolarHBondContact O-N 3.11Å; L207-R210 PolarHBondContact O-N 3.38Å; R210-R213 PolarHBondContact O-N 2.95Å; R210-R214 PolarHBondContact O-N 2.65Å; R210-R214 VanDerWaalsContact O-N 3.11Å
211	N	43.6	Very low	46.6	Very low	99 Å²	99	117.4 Å²	117.4	53%	0.529	61%	0.608	S	S	.	*	H	α-helix	trans	-70.7	-34.7	175.8	-75.3	-4.6	0	0	0	112.6	L207 R213 R214 L215	L207-N211 PolarHBondContact O-N 3.25Å; N211-R213 VanDerWaalsContact C-N 3.34Å; N211-R213 PolarHBondContact O-N 3.42Å; N211-R214 PolarHBondContact O-N 3.35Å; N211-L215 PolarHBondContact O-N 3.4Å; N211-L215 VanDerWaalsContact O-N 3.09Å
212	R	45.3	Very low	45.1	Very low	189 Å²	189	123.9 Å²	123.9	71%	0.713	63%	0.631	S	S	*	*	H	α-helix	trans	-62.3	-37.7	170.8	-78.6	-175.5	-176	-173.2	4.3	112.9	S208 R209 L215 S216	S208-R212 WeakPolarHBondContact O-CG 3.06Å; S208-R212 PolarHBondContact O-N 2.99Å; R209-R212 PolarHBondContact O-N 2.7Å; R212-L215 PolarHBondContact O-N 3.24Å; R212-S216 PolarHBondContact O-N 3.18Å
213	R	42.8	Very low	43.6	Very low	186 Å²	186	129 Å²	129	70%	0.702	65%	0.645	S	S	*	*	H	α-helix	trans	-66.2	-45.6	174.1	-72.4	-175.9	178.9	-171.9	-0.9	112.1	R209 R210 N211 L215 S216 D217	R209-R213 PolarHBondContact O-N 3.1Å; R209-R213 VanDerWaalsContact O-N 3.12Å; R210-R213 PolarHBondContact O-N 2.95Å; N211-R213 VanDerWaalsContact C-N 3.34Å; N211-R213 PolarHBondContact O-N 3.42Å; R213-L215 PolarHBondContact O-N 2.79Å; R213-L215 VanDerWaalsContact O-N 3.11Å; R213-S216 WeakPolarHBondContact CA-OG 3.42Å; R213-S216 PolarHBondContact O-N 2.9Å; R213-S216 PolarHBondContact O-OG 3.2Å; R213-D217 PolarHBondContact O-N 3.33Å; R213-D217 VanDerWaalsContact O-N 3.11Å
214	R	38.4	Very low	42.1	Very low	184 Å²	184	132.2 Å²	132.2	69%	0.694	66%	0.655	S	S	*	*	H	α-helix	trans	-59.8	-23.8	173.4	-80.1	-172.9	164.8	-174.1	-6	114.3	R210 N211	R210-R214 PolarHBondContact O-N 2.65Å; R210-R214 VanDerWaalsContact O-N 3.11Å; N211-R214 PolarHBondContact O-N 3.35Å
215	L	36.2	Very low	40.8	Very low	135 Å²	135	133.5 Å²	133.5	71%	0.707	67%	0.669	S	S	*	*	H	α-helix	trans	-84.7	-30.4	172.5	-121.8	71.8	0	0	0	113.9	N211 R212 R213 T219	N211-L215 PolarHBondContact O-N 3.4Å; N211-L215 VanDerWaalsContact O-N 3.09Å; R212-L215 PolarHBondContact O-N 3.24Å; R213-L215 PolarHBondContact O-N 2.79Å; R213-L215 VanDerWaalsContact O-N 3.11Å; L215-T219 PolarHBondContact O-OG1 2.86Å; L215-T219 VanDerWaalsContact O-OG1 3.07Å
216	S	36.7	Very low	39.4	Very low	62 Å²	62	136.2 Å²	136.2	43%	0.434	69%	0.686	S	S	.	*	H	α-helix	trans	-67.9	-39.5	173.9	53.7	0	0	0	0	111.9	R212 R213 F218 T219	R212-S216 PolarHBondContact O-N 3.18Å; R213-S216 WeakPolarHBondContact CA-OG 3.42Å; R213-S216 PolarHBondContact O-N 2.9Å; R213-S216 PolarHBondContact O-OG 3.2Å; S216-F218 PolarHBondContact O-N 2.87Å; S216-T219 PolarHBondContact O-N 3.24Å
217	D	33.6	Very low	37.9	Very low	120 Å²	120	136.9 Å²	136.9	64%	0.642	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-72.4	-20.1	-171.2	-54.8	-12.1	0	0	0	112	R213 T219	R213-D217 PolarHBondContact O-N 3.33Å; R213-D217 VanDerWaalsContact O-N 3.11Å; D217-T219 VanDerWaalsContact C-N 3.35Å
218	F	34.9	Very low	37.1	Very low	193 Å²	193	140 Å²	140	85%	0.846	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-84.6	-2.5	173.5	-137.1	-93.2	0	0	0	114.1	S216	S216-F218 PolarHBondContact O-N 2.87Å
219	T	31.6	Very low	36.2	Very low	121 Å²	121	140.6 Å²	140.6	74%	0.742	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-115.6	9.2	-176.2	-33	0	0	0	0	113.2	L215 S216 D217	L215-T219 PolarHBondContact O-OG1 2.86Å; L215-T219 VanDerWaalsContact O-OG1 3.07Å; S216-T219 PolarHBondContact O-N 3.24Å; D217-T219 VanDerWaalsContact C-N 3.35Å
220	A	29	Very low	35.6	Very low	93 Å²	93	139.2 Å²	139.2	77%	0.769	74%	0.741	S	S	*	*	S	Bend	trans	-120.4	33	-175.2	0	0	0	0	0	113.3
221	G	29.8	Very low	34.9	Very low	70 Å²	70	138.9 Å²	138.9	72%	0.722	75%	0.747	S	S	*	*	S	Bend	trans	-128.5	2.1	-165.2	0	0	0	0	0	118.5
222	M	28.3	Very low	34.3	Very low	191 Å²	191	141.6 Å²	141.6	94%	0.941	76%	0.759	S	S	*	*			trans	-142	112.2	178.6	-91.1	166.8	67.1	0	0	112.7
223	R	31.9	Very low	33.6	Very low	238 Å²	238	138.8 Å²	138.8	90%	0.898	76%	0.757	S	S	*	*			trans	-134.2	110.2	162.6	-83.5	-169	177.3	-171.4	0.8	110.4
224	I	31.5	Very low	33	Very low	138 Å²	138	134.4 Å²	134.4	71%	0.708	76%	0.756	S	S	*	*			trans	38.1	107.7	140.6	-46.6	172.4	0	0	0	117.2
225	T	34.5	Very low	32.6	Very low	144 Å²	144	131.2 Å²	131.2	88%	0.883	76%	0.757	S	S	*	*			trans	-134.3	130.5	136.7	44.5	0	0	0	0	108.9
226	D	30.8	Very low	32.6	Very low	154 Å²	154	129.3 Å²	129.3	82%	0.824	76%	0.76	S	S	*	*			trans	-89.2	156.8	-176.4	-58.9	-76	0	0	0	112.6
227	G	32.5	Very low	32.4	Very low	71 Å²	71	133 Å²	133	73%	0.732	77%	0.774	S	S	*	*			trans	-174.6	35.7	-172.6	0	0	0	0	0	121.7
228	N	33.8	Very low	32.2	Very low	173 Å²	173	136.2 Å²	136.2	93%	0.925	78%	0.777	S	S	*	*			trans	60.5	142.1	160.5	-61.4	-25.8	0	0	0	121.2
229	G	32.2	Very low	32	Very low	71 Å²	71	139 Å²	139	73%	0.732	78%	0.782	S	S	*	*			trans	-101.1	-137.9	174.8	0	0	0	0	0	113.5
230	P	43.1	Very low	32	Very low	118 Å²	118	142.7 Å²	142.7	77%	0.766	78%	0.783	S	S	*	*			cis	-144.7	-161.5	8.6	43.6	-22.5	0	0	0	116.7
231	Q	32.9	Very low	31.9	Very low	166 Å²	166	143.5 Å²	143.5	78%	0.776	78%	0.783	S	S	*	*			trans	77.3	120.6	165.9	-72.9	-177.5	-46.3	0	0	118
232	M	30.2	Very low	32	Very low	157 Å²	157	143.7 Å²	143.7	77%	0.773	79%	0.785	S	S	*	*				83.4	138.6	67.4	-79.1	173.3	155.6	0	0	112.7
233	D	31	Very low	32.2	Very low	129 Å²	129	142.6 Å²	142.6	69%	0.69	78%	0.781	S	S	*	*			cis	-136.7	156.8	10.7	-100.1	-59	0	0	0	110.1
234	S	30.9	Very low	32	Very low	95 Å²	95	137.1 Å²	137.1	66%	0.664	77%	0.774	S	S	*	*				66.7	139	61.9	106.8	0	0	0	0	114.4
235	T	30.1	Very low	32	Very low	117 Å²	117	136 Å²	136	72%	0.718	77%	0.774	S	S	*	*			cis	-151	154.9	7.2	54	0	0	0	0	113.5
236	A	35.9	Very low	32	Very low	94 Å²	94	139.7 Å²	139.7	78%	0.777	77%	0.772	S	S	*	*			trans	-177.3	102.9	140.8	0	0	0	0	0	110.2
237	L	31.4	Very low	31.9	Very low	140 Å²	140	140.3 Å²	140.3	73%	0.733	77%	0.774	S	S	*	*				56	134.1	82.2	-84.2	86.3	0	0	0	116.3
238	R	30.1	Very low	31.6	Very low	187 Å²	187	141.1 Å²	141.1	71%	0.706	78%	0.782	S	S	*	*			cis	-172.8	125.6	-14.7	-151.7	-173	-158.9	-176.4	10	111.1
239	R	30.6	Very low	31.4	Very low	252 Å²	252	136.6 Å²	136.6	95%	0.951	78%	0.776	S	S	*	*			trans	-143.4	134.8	144.6	-78.9	-158.9	173.3	-174.9	-1.7	110.2
240	R	32	Very low	31.3	Very low	198 Å²	198	140.3 Å²	140.3	75%	0.747	77%	0.774	S	S	*	*			trans	-81.9	146.2	179.2	-76.2	176.7	162.1	172.4	-9.1	109.6
241	S	27.4	Very low	30.8	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	78%	0.78	S	S	*	*			cis	95.5	118.9	23.6	83.6	0	0	0	0	115.5
242	G	31.8	Very low	30.6	Very low	74 Å²	74	144 Å²	144	76%	0.763	78%	0.784	S	S	*	*			trans	134.5	128.2	179.2	0	0	0	0	0	109.3
243	I	30.9	Very low	30.6	Very low	167 Å²	167	140 Å²	140	86%	0.856	78%	0.782	S	S	*	*			cis	-131.4	150.2	14.3	-71.2	169.2	0	0	0	110.8
244	T	29.4	Very low	30.4	Very low	123 Å²	123	141.6 Å²	141.6	76%	0.755	79%	0.789	S	S	*	*			trans	-119.2	156.1	162.9	69.5	0	0	0	0	107
245	T	30.7	Very low	30.4	Very low	114 Å²	114	144.3 Å²	144.3	70%	0.699	80%	0.795	S	S	*	*			cis	-158.6	164.4	26.4	37.3	0	0	0	0	109.2
246	R	34.1	Very low	30.4	Very low	223 Å²	223	147.5 Å²	147.5	84%	0.842	80%	0.801	S	S	*	*				169.4	128.2	115	-92	173.9	-174.2	-154.5	0.7	114.1
247	L	28.8	Very low	30.1	Very low	167 Å²	167	152.4 Å²	152.4	87%	0.874	81%	0.805	S	S	*	*			trans	46.7	111.3	139.7	-62.1	166.2	0	0	0	120.6
248	G	25.9	Very low	30.1	Very low	88 Å²	88	153.3 Å²	153.3	91%	0.907	81%	0.81	S	S	*	*			trans	105.1	110	136.1	0	0	0	0	0	117.5
249	G	29.5	Very low	30.3	Very low	77 Å²	77	150.1 Å²	150.1	79%	0.794	81%	0.814	S	S	*	*			trans	-173	113.9	168.5	0	0	0	0	0	111.8
250	Q	29.9	Very low	30.3	Very low	149 Å²	149	144.1 Å²	144.1	70%	0.696	81%	0.81	S	S	*	*			trans	-85.1	143.1	168	-67.3	180	-39.5	0	0	109.5	R252	Q250-R252 VanDerWaalsContact C-N 3.33Å; Q250-R252 HydrophobicContact CB-CG 4.49Å; Q250-R252 PolarHBondContact O-N 3.4Å
251	P	33.8	Very low	30.5	Very low	136 Å²	136	141.2 Å²	141.2	88%	0.883	81%	0.814	S	S	*	*			trans	-70.4	89.4	165	29.9	-33	0	0	0	109.9	G253	P251-G253 PolarHBondContact O-N 2.9Å
252	R	29.3	Very low	30.6	Very low	227 Å²	227	145.4 Å²	145.4	86%	0.857	82%	0.818	S	S	*	*			trans	-87.7	99.1	168.5	-76	-171.2	173.9	-156.8	-0.3	109.3	Q250	Q250-R252 VanDerWaalsContact C-N 3.33Å; Q250-R252 HydrophobicContact CB-CG 4.49Å; Q250-R252 PolarHBondContact O-N 3.4Å
253	G	28.3	Very low	30.3	Very low	71 Å²	71	154 Å²	154	73%	0.732	83%	0.828	S	S	*	*			trans	-137.2	16.8	-176.4	0	0	0	0	0	115.8	P251	P251-G253 PolarHBondContact O-N 2.9Å
254	I	28	Very low	30.4	Very low	163 Å²	163	150.6 Å²	150.6	84%	0.836	82%	0.819	S	S	*	*			trans	-137.3	149	-178.1	-42.7	-179.2	0	0	0	110.2
255	I	29.9	Very low	30.5	Very low	153 Å²	153	152.1 Å²	152.1	79%	0.785	82%	0.822	S	S	*	*			trans	74.1	89.1	175.6	-41.7	179.7	0	0	0	115.5
256	Q	30.5	Very low	30.3	Very low	184 Å²	184	155.6 Å²	155.6	86%	0.86	83%	0.833	S	S	*	*			trans	-153.8	83.4	140.5	-147	171.5	13.7	0	0	113.5
257	F	30.4	Very low	30.2	Very low	197 Å²	197	150 Å²	150	86%	0.864	83%	0.828	S	S	*	*			trans	-136.1	90.8	160.2	-87	-69.6	0	0	0	110
258	L	30.7	Very low	30.3	Very low	158 Å²	158	153.7 Å²	153.7	83%	0.827	83%	0.83	S	S	*	*			trans	-131.4	135.1	161.2	-73.8	174.3	0	0	0	106.8
259	P	34.7	Very low	30.7	Very low	121 Å²	121	154.1 Å²	154.1	79%	0.786	82%	0.819	S	S	*	*			trans	-66.8	137.6	-178.8	27.6	-33.9	0	0	0	110.8	V261	P259-V261 PolarHBondContact O-N 3.21Å; P259-V261 VanDerWaalsContact O-N 3.14Å
260	S	31.3	Very low	30.6	Very low	125 Å²	125	157.1 Å²	157.1	87%	0.874	82%	0.816	S	S	*	*			trans	-73.7	105.3	-176	-66.9	0	0	0	0	111.5
261	V	34.4	Very low	30.7	Very low	137 Å²	137	158.8 Å²	158.8	83%	0.83	82%	0.824	S	S	*	*			trans	-66.2	133.9	164.1	179.5	0	0	0	0	108.6	P259	P259-V261 PolarHBondContact O-N 3.21Å; P259-V261 VanDerWaalsContact O-N 3.14Å
262	K	29.9	Very low	30.5	Very low	199 Å²	199	158.5 Å²	158.5	87%	0.865	81%	0.811	S	S	*	*			trans	-60.9	140.6	-177.3	-65.2	-177.7	179.1	-178.7	0	111.2
263	R	26.8	Very low	30.5	Very low	255 Å²	255	151.5 Å²	151.5	96%	0.962	80%	0.796	S	S	*	*			trans	-95.8	113.9	165.9	-75.2	-178	173.4	175.8	-2.2	110
264	S	31.5	Very low	30.5	Very low	96 Å²	96	159.4 Å²	159.4	67%	0.671	81%	0.806	S	S	*	*			trans	-130.3	157.6	151.1	60.8	0	0	0	0	108.2
265	D	31.2	Very low	30.6	Very low	154 Å²	154	157.7 Å²	157.7	82%	0.824	80%	0.797	S	S	*	*			trans	65.8	106.4	170.1	-45.9	-45.9	0	0	0	116.9
266	M	26.4	Very low	30.5	Very low	187 Å²	187	154.8 Å²	154.8	92%	0.921	80%	0.796	S	S	*	*			trans	-144.1	94	177.1	-171.3	-171.8	73	0	0	112.4
267	S	32.3	Very low	30.4	Very low	105 Å²	105	152.4 Å²	152.4	73%	0.734	79%	0.789	S	S	*	*			trans	-142.6	126.4	164.6	42.3	0	0	0	0	107.8
268	R	32.6	Very low	30.2	Very low	245 Å²	245	150.2 Å²	150.2	93%	0.925	78%	0.779	S	S	*	*				61	131.1	78.1	-70.8	-176.9	177.8	-178.7	0	111.9
269	S	33.6	Very low	30.1	Very low	97 Å²	97	150.5 Å²	150.5	68%	0.678	78%	0.78	S	S	*	*			cis	-170.5	145.1	10.9	158.4	0	0	0	0	114.3
270	L	26.9	Very low	29.8	Very low	140 Å²	140	153.8 Å²	153.8	73%	0.733	78%	0.777	S	S	*	*			trans	42	114.6	147.1	-59	169.3	0	0	0	122.8
271	H	31.7	Very low	29.7	Very low	184 Å²	184	157.6 Å²	157.6	85%	0.852	77%	0.772	S	S	*	*				-156.7	112.2	119.5	-135.8	75.7	0	0	0	108.2
272	Q	30.5	Very low	29.3	Very low	131 Å²	131	157.3 Å²	157.3	61%	0.612	76%	0.762	S	S	*	*				86.5	89.1	53.1	-163.7	86.2	32.2	0	0	113.2
273	S	28.1	Very low	29.3	Very low	79 Å²	79	156.9 Å²	156.9	55%	0.552	75%	0.754	S	S	*	*			trans	46.1	119.3	150.9	65.4	0	0	0	0	122.5
274	Y	28	Very low	29.3	Very low	237 Å²	237	150.1 Å²	150.1	93%	0.929	74%	0.737	S	S	*	*			trans	-120.1	77.1	140.1	-151.6	-81.8	0	0	0	107
275	I	31.6	Very low	29.2	Very low	127 Å²	127	155.5 Å²	155.5	65%	0.651	74%	0.744	S	S	*	*				51.6	92.6	98.4	-54.9	-173	0	0	0	113.4
276	A	26.6	Very low	29.2	Very low	93 Å²	93	152.2 Å²	152.2	77%	0.769	73%	0.733	S	S	*	*			trans	32.8	102	141.8	0	0	0	0	0	121
277	D	28.3	Very low	29.4	Very low	134 Å²	134	149.8 Å²	149.8	72%	0.717	72%	0.724	S	S	*	*				-135.1	134.7	124.9	-151.6	38.7	0	0	0	106.2
278	K	27.8	Very low	29.5	Very low	150 Å²	150	153.1 Å²	153.1	65%	0.652	73%	0.728	S	S	*	*			cis	-150.7	120.9	1.8	-162.8	174.6	-125.5	99.7	0	111.5
279	I	27.3	Very low	29.4	Very low	164 Å²	164	145.6 Å²	145.6	84%	0.841	71%	0.712	S	S	*	*			trans	-93.7	99.6	160	-62.7	178.5	0	0	0	108.5
280	R	28.2	Very low	29.2	Very low	191 Å²	191	147.8 Å²	147.8	72%	0.721	72%	0.717	S	S	*	*			trans	-176.3	119.2	156.6	-101.7	167.1	-167.1	94.6	-10.1	106.6
281	R	29.2	Very low	29.6	Very low	205 Å²	205	146.2 Å²	146.2	77%	0.774	72%	0.715	S	S	*	*				68.4	116.5	96.4	-76	-172.2	-178.7	149.4	4.1	112.4
282	E	26.9	Very low	29.5	Very low	131 Å²	131	144.6 Å²	144.6	61%	0.612	71%	0.708	S	S	*	*				56.6	113.7	79.6	-79.8	-166.8	143.6	0	0	110.1
283	R	29	Very low	29.4	Very low	189 Å²	189	147.8 Å²	147.8	71%	0.713	71%	0.714	S	S	*	*				172.4	177.6	60.3	-89.3	138.6	-166.2	-100.6	-7.1	105.1
284	L	27.6	Very low	29.3	Very low	113 Å²	113	148.6 Å²	148.6	59%	0.592	72%	0.72	S	S	*	*			cis	-160.9	146.6	-19.8	-105.5	163.9	0	0	0	104.4
285	Y	30.3	Very low	29.4	Very low	210 Å²	210	146.5 Å²	146.5	82%	0.824	72%	0.715	S	S	*	*				152.7	151.6	108.1	-84.1	-71.2	0	0	0	104.8
286	S	31.2	Very low	29.2	Very low	85 Å²	85	144.9 Å²	144.9	59%	0.594	72%	0.721	S	S	*	*			cis	-158.2	154.8	1.7	45.6	0	0	0	0	109.6
287	D	29.8	Very low	29.3	Very low	136 Å²	136	146 Å²	146	73%	0.727	72%	0.718	S	S	*	*			trans	60.6	155.1	159.8	-46	-37.6	0	0	0	118
288	H	33.5	Very low	29.3	Very low	175 Å²	175	148.5 Å²	148.5	81%	0.81	72%	0.723	S	S	*	*			cis	-130.9	178.4	10.3	-92.9	-73.8	0	0	0	113.3
289	S	30.3	Very low	29.5	Very low	87 Å²	87	152.7 Å²	152.7	61%	0.608	73%	0.734	S	S	*	*			trans	-68.1	175.6	171	50.5	0	0	0	0	113
290	D	30.6	Very low	29.5	Very low	143 Å²	143	152.1 Å²	152.1	77%	0.765	73%	0.733	S	S	*	*			cis	-162.2	170.1	44.8	-98	-62.6	0	0	0	115.6
291	P	35.7	Very low	30.4	Very low	107 Å²	107	148.6 Å²	148.6	70%	0.695	74%	0.735	S	S	*	*			trans	-110.6	-173.3	173.5	42.8	-32.6	0	0	0	114.4
292	E	28.3	Very low	30.5	Very low	150 Å²	150	147.8 Å²	147.8	70%	0.701	74%	0.737	S	S	*	*			trans	51.6	118.8	153.8	-93.9	-161.2	-137.6	0	0	122.7
293	R	29.5	Very low	30.8	Very low	197 Å²	197	146 Å²	146	74%	0.743	74%	0.738	S	S	*	*				74.1	96.2	115.7	-164.1	178	-179	-178.4	3	121.2
294	S	26.8	Very low	31	Very low	97 Å²	97	145.7 Å²	145.7	68%	0.678	75%	0.745	S	S	*	*				87.4	159.8	125.6	84.5	0	0	0	0	121.6
295	K	29.4	Very low	31.2	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.835	75%	0.746	S	S	*	*			trans	77.9	81.2	162.4	-67.9	-178.2	178.5	179.5	0	120.1
296	A	27.1	Very low	31.3	Very low	93 Å²	93	140.5 Å²	140.5	77%	0.769	74%	0.741	S	S	*	*				85.5	165.2	108.9	0	0	0	0	0	121.4
297	V	29.4	Very low	31.4	Very low	118 Å²	118	143.6 Å²	143.6	72%	0.715	74%	0.744	S	S	*	*			trans	85.9	102.6	161.2	-177.1	0	0	0	0	118.3
298	K	27.1	Very low	31.3	Very low	185 Å²	185	143.5 Å²	143.5	80%	0.804	75%	0.749	S	S	*	*			trans	63.2	112.6	145.7	-62.2	171.1	-175	176.2	0	120.1
299	R	32	Very low	31.2	Very low	239 Å²	239	138.5 Å²	138.5	90%	0.902	74%	0.744	S	S	*	*				178.3	124.3	98	-97.6	159.9	179.7	153.8	-2.1	112.8
300	D	28.9	Very low	31	Very low	152 Å²	152	144.1 Å²	144.1	81%	0.813	76%	0.758	S	S	*	*			trans	-87.8	154.5	157.5	-47.3	-76.7	0	0	0	110.4
301	P	47.1	Very low	30.9	Very low	116 Å²	116	143 Å²	143	75%	0.753	76%	0.756	S	S	*	*			trans	-107	127.6	133.9	-8.9	28.3	0	0	0	109.3
302	F	30.3	Very low	30.5	Very low	188 Å²	188	146.2 Å²	146.2	83%	0.825	76%	0.762	S	S	*	*				59.7	134.2	85.5	-86	-111.2	0	0	0	114.1
303	C	32.2	Very low	30.9	Very low	95 Å²	95	144.1 Å²	144.1	64%	0.642	76%	0.761	S	S	*	*			cis	-176	168.8	-12.3	-123.2	0	0	0	0	107.8
304	E	33.4	Very low	30.9	Very low	182 Å²	182	141.2 Å²	141.2	85%	0.85	77%	0.765	S	S	*	*			cis	-129.4	-169.7	-0.8	-55.3	-170.6	135.8	0	0	108.1
305	G	32.6	Very low	30.9	Very low	60 Å²	60	142.7 Å²	142.7	62%	0.619	76%	0.762	S	S	*	*			cis	-174.7	146.1	-2.1	0	0	0	0	0	112.7
306	E	33	Very low	31.1	Very low	153 Å²	153	138.3 Å²	138.3	72%	0.715	75%	0.752	S	S	*	*				52.5	142.9	124.9	-53.6	-151.3	142.8	0	0	121.8
307	K	32.5	Very low	31	Very low	150 Å²	150	143 Å²	143	65%	0.652	75%	0.75	S	S	*	*			cis	-157.7	119.7	-1.9	-115.7	165.7	-176.6	145.4	0	111.8
308	T	28.7	Very low	30.9	Very low	135 Å²	135	142.3 Å²	142.3	83%	0.828	75%	0.751	S	S	*	*				31.8	133.4	125.4	64.1	0	0	0	0	123.8
309	G	29.8	Very low	30.8	Very low	70 Å²	70	144 Å²	144	72%	0.722	75%	0.754	S	S	*	*			trans	123.3	158.9	139.4	0	0	0	0	0	116.7
310	F	26.2	Very low	30.4	Very low	205 Å²	205	137 Å²	137	90%	0.899	75%	0.747	S	S	*	*			cis	-169.5	173.6	-22.6	-143.8	-89.1	0	0	0	108.3
311	V	30.1	Very low	30.3	Very low	118 Å²	118	134.4 Å²	134.4	72%	0.715	75%	0.746	S	S	*	*			trans	75.5	109.2	166.9	-151.9	0	0	0	0	119
312	E	25.7	Very low	29.2	Very low	175 Å²	175	138.6 Å²	138.6	82%	0.818	75%	0.748	S	S	*	*				0.7	175.1	124.1	-68.6	-173.5	135.2	0	0	121.9
313	P	36.7	Very low	29.1	Very low	106 Å²	106	141 Å²	141	69%	0.688	75%	0.752	S	S	*	*			cis	-134.7	-165.8	-39.7	36.3	-18	0	0	0	111.5
314	V	30.8	Very low	28.7	Very low	137 Å²	137	143.9 Å²	143.9	83%	0.83	75%	0.754	S	S	*	*			trans	152.8	132	136.5	162.4	0	0	0	0	112.9
315	E	25.3	Very low	28.3	Very low	128 Å²	128	141.5 Å²	141.5	60%	0.598	74%	0.744	S	S	*	*			trans	-71.9	-174.5	173.1	-108.9	-159.9	136	0	0	113.3	R317	E315-R317 IonicContact OE1-CZ 2.94Å; E315-R317 IonicContact OE1-NE 2.66Å; E315-R317 PolarHBondContact OE1-NE 2.77Å; E315-R317 IonicContact OE1-NH2 2.71Å; E315-R317 PolarHBondContact OE1-NH2 3.11Å; E315-R317 IonicContact OE2-NH2 3.99Å; E315-R317 PolarHBondContact OE2-NH2 2.85Å
316	P	34.6	Very low	28.1	Very low	99 Å²	99	144.6 Å²	144.6	64%	0.643	75%	0.746	S	S	*	*			cis	-137.5	179.2	-7.5	22.7	3.6	0	0	0	115.9
317	R	25.3	Very low	27.6	Very low	193 Å²	193	141.3 Å²	141.3	73%	0.728	75%	0.745	S	S	*	*				13.7	146.8	127.2	-37.6	164.5	-155.3	177.7	6.2	117.4	E315	E315-R317 IonicContact OE1-CZ 2.94Å; E315-R317 IonicContact OE1-NE 2.66Å; E315-R317 PolarHBondContact OE1-NE 2.77Å; E315-R317 IonicContact OE1-NH2 2.71Å; E315-R317 PolarHBondContact OE1-NH2 3.11Å; E315-R317 IonicContact OE2-NH2 3.99Å; E315-R317 PolarHBondContact OE2-NH2 2.85Å
318	S	26.9	Very low	27.4	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	75%	0.749	S	S	*	*				-177	153.9	63.4	-59.7	0	0	0	0	116.4
319	Y	24.4	Very low	27.4	Very low	221 Å²	221	138.6 Å²	138.6	87%	0.867	75%	0.745	S	S	*	*			trans	-0.4	125.6	142.2	-76.3	-101.8	0	0	0	122.3
320	A	23.3	Very low	27.1	Very low	92 Å²	92	143.8 Å²	143.8	76%	0.76	75%	0.748	S	S	*	*				38.6	124.5	117.2	0	0	0	0	0	123.8
321	A	27.9	Very low	27.2	Very low	96 Å²	96	138.9 Å²	138.9	79%	0.793	74%	0.735	S	S	*	*				-162.2	137.1	126.9	0	0	0	0	0	108.9
322	Y	22.9	Very low	27.1	Very low	205 Å²	205	142.1 Å²	142.1	80%	0.804	74%	0.739	S	S	*	*			cis	76.1	90.5	45.8	-104.3	-68.1	0	0	0	117.2
323	R	28.1	Very low	27	Very low	239 Å²	239	142.7 Å²	142.7	90%	0.902	74%	0.744	S	S	*	*			trans	-171.3	136.7	145.1	-105.3	169.2	-162.2	-161.2	4.1	108.4
324	K	24.4	Very low	26.4	Very low	155 Å²	155	142 Å²	142	67%	0.674	75%	0.748	S	S	*	*			cis	62.4	136.1	26.9	-70	-171.4	150	-158.6	0	113.7
325	M	25.6	Very low	26.6	Very low	132 Å²	132	140.8 Å²	140.8	65%	0.65	74%	0.743	S	S	*	*			cis	-162.1	165.8	1.6	-102.8	156.9	71.7	0	0	106
326	D	27.7	Very low	26.6	Very low	125 Å²	125	141.3 Å²	141.3	67%	0.668	75%	0.745	S	S	*	*			cis	-157.8	152.4	3.8	-126	-6.2	0	0	0	108.9
327	A	23.6	Very low	26.2	Very low	83 Å²	83	146 Å²	146	69%	0.686	75%	0.75	S	S	*	*				76	164.5	106.3	0	0	0	0	0	118
328	A	26.5	Very low	26.2	Very low	90 Å²	90	145.9 Å²	145.9	74%	0.744	76%	0.758	S	S	*	*			trans	70.2	146.2	-176.5	0	0	0	0	0	115.5
329	D	28.8	Very low	26.2	Very low	138 Å²	138	146 Å²	146	74%	0.738	75%	0.754	S	S	*	*			cis	-155.2	160.5	-7.2	-127.1	-12.5	0	0	0	115.3
330	F	25.4	Very low	26.6	Very low	179 Å²	179	143.2 Å²	143.2	79%	0.785	75%	0.749	S	S	*	*			trans	36.5	132.6	147.7	-90.1	-134.8	0	0	0	124.7
331	V	26.6	Very low	26.9	Very low	103 Å²	103	145.7 Å²	145.7	62%	0.624	74%	0.744	S	S	*	*				97.2	134.6	126.6	158.1	0	0	0	0	123.1
332	K	29	Very low	26.8	Very low	185 Å²	185	152.4 Å²	152.4	80%	0.804	75%	0.749	S	S	*	*			trans	64.3	137.2	169.8	-74.2	152.5	-166.3	174	0	116
333	M	23.6	Very low	27.2	Very low	187 Å²	187	148.5 Å²	148.5	92%	0.921	75%	0.752	S	S	*	*			cis	73.1	139.4	44.6	-73.6	-167.8	162	0	0	115.2
334	A	24	Very low	27.2	Very low	92 Å²	92	148.5 Å²	148.5	76%	0.76	75%	0.752	S	S	*	*			trans	-59.3	167.1	174.9	0	0	0	0	0	112.1
335	P	35.6	Very low	27.3	Very low	112 Å²	112	146.7 Å²	146.7	73%	0.727	76%	0.758	S	S	*	*				-153.5	172.4	52.5	44.2	-23	0	0	0	119.8
336	E	24	Very low	27.4	Very low	138 Å²	138	145.2 Å²	145.2	65%	0.645	77%	0.767	S	S	*	*			trans	31.3	130.7	136.5	-61.4	-167	116.5	0	0	125
337	R	26.4	Very low	27.3	Very low	197 Å²	197	147.2 Å²	147.2	74%	0.743	77%	0.772	S	S	*	*				52.9	124.6	122.1	-57.5	170.7	161.3	159.2	-11.9	121.6	V339	R337-V339 HydrophobicContact CB-CG2 4.12Å
338	E	26.3	Very low	27.6	Very low	192 Å²	192	152.9 Å²	152.9	90%	0.897	78%	0.776	S	S	*	*				-95.9	138.2	127.6	-59.2	-177.9	133.1	0	0	107.5
339	V	25.9	Very low	27.6	Very low	105 Å²	105	158.7 Å²	158.7	64%	0.636	78%	0.779	S	S	*	*			cis	81.2	104	12.3	-168.9	0	0	0	0	116.1	R337	R337-V339 HydrophobicContact CB-CG2 4.12Å
340	H	32	Very low	27.6	Very low	163 Å²	163	159.5 Å²	159.5	76%	0.755	78%	0.78	S	S	*	*			trans	-138.2	114.8	134.6	-104.8	53.7	0	0	0	111.4
341	Q	30.9	Very low	27.6	Very low	144 Å²	144	157.2 Å²	157.2	67%	0.673	78%	0.781	S	S	*	*			trans	49	113.5	131	-49.2	-173.4	28.2	0	0	119.3
342	R	26.3	Very low	27.8	Very low	237 Å²	237	159.1 Å²	159.1	89%	0.894	79%	0.788	S	S	*	*				62.6	131.1	76.5	-68.9	-172.2	177.5	-178	3	113.4
343	S	29.8	Very low	27.8	Very low	122 Å²	122	154.3 Å²	154.3	85%	0.853	78%	0.783	S	S	*	*				-152	-169	56.4	-68.4	0	0	0	0	114.9
344	R	27.8	Very low	28.2	Very low	239 Å²	239	151.9 Å²	151.9	90%	0.902	78%	0.778	S	S	*	*			trans	-107.2	151.3	-166.5	-72.1	-179.9	166.4	178	-5.2	115.7
345	S	26.5	Very low	28.6	Very low	117 Å²	117	154.6 Å²	154.6	82%	0.818	78%	0.779	S	S	*	*			trans	60.1	111.4	139.7	61.3	0	0	0	0	121.9
346	A	29.6	Very low	28.1	Very low	101 Å²	101	160.2 Å²	160.2	84%	0.835	79%	0.786	S	S	*	*			trans	-153.9	146.4	139.9	0	0	0	0	0	112.6
347	Q	25.5	Very low	28.3	Very low	167 Å²	167	161 Å²	161	78%	0.78	80%	0.795	S	S	*	*			trans	-5.3	150.1	163	-111.7	70.5	-15.9	0	0	123.4
348	R	28.1	Very low	28.4	Very low	203 Å²	203	159.1 Å²	159.1	77%	0.766	80%	0.8	S	S	*	*			trans	85.3	124.2	144	-72.9	170.1	177.2	-172.2	0.9	120.8
349	R	26.7	Very low	28.3	Very low	212 Å²	212	157.1 Å²	157.1	80%	0.8	79%	0.794	S	S	*	*				64.9	136.6	127.7	-70	-177.1	-178.1	-179.5	-1	118.7
350	M	28.9	Very low	28.2	Very low	155 Å²	155	161.7 Å²	161.7	76%	0.764	81%	0.809	S	S	*	*			cis	-139.4	162.3	-2.3	-59.7	-170.7	62.9	0	0	110.5
351	T	26.2	Very low	27.8	Very low	131 Å²	131	157.4 Å²	157.4	80%	0.804	80%	0.802	S	S	*	*			trans	-120.9	128	161.6	43.7	0	0	0	0	109
352	N	30.5	Very low	27.5	Very low	143 Å²	143	161.5 Å²	161.5	77%	0.765	81%	0.812	S	S	*	*			trans	-102.8	124.3	158.4	-63.8	-5.4	0	0	0	105.3
353	A	28.2	Very low	27.3	Very low	84 Å²	84	159.1 Å²	159.1	69%	0.694	81%	0.811	S	S	*	*			cis	83.7	69.5	34.1	0	0	0	0	0	113.7
354	V	33	Very low	27.1	Very low	136 Å²	136	162.5 Å²	162.5	82%	0.824	81%	0.813	S	S	*	*			trans	-152.1	126.2	153	175.1	0	0	0	0	105.4
355	D	31.5	Very low	27.1	Very low	148 Å²	148	160.5 Å²	160.5	79%	0.791	81%	0.813	S	S	*	*			cis	-149.6	160.1	-22.9	-104.4	-33.9	0	0	0	108.9
356	R	25.3	Very low	27	Very low	230 Å²	230	166 Å²	166	87%	0.868	82%	0.816	S	S	*	*			trans	-156	70.6	-178	-157.2	-170.7	-162.7	-166.7	7	115.9
357	D	28.8	Very low	26.7	Very low	154 Å²	154	168.9 Å²	168.9	82%	0.824	81%	0.814	S	S	*	*			trans	-96.8	171.1	166.5	-96.8	-46.3	0	0	0	113.5
358	N	27.4	Very low	26.8	Very low	159 Å²	159	167.6 Å²	167.6	85%	0.85	81%	0.813	S	S	*	*			trans	68.5	73.7	-178.4	-66	-45.9	0	0	0	116.6
359	L	25.1	Very low	26.6	Very low	149 Å²	149	165.1 Å²	165.1	78%	0.78	81%	0.814	S	S	*	*			trans	-141.4	59.3	157.3	-135	166.3	0	0	0	112.2
360	Q	23.7	Very low	26.5	Very low	202 Å²	202	163.9 Å²	163.9	94%	0.944	82%	0.817	S	S	*	*			trans	-126.8	73.2	170.5	-74.7	-164	-2.4	0	0	112.3
361	A	24.7	Very low	26.5	Very low	73 Å²	73	160.9 Å²	160.9	60%	0.603	81%	0.811	S	S	*	*			trans	-150.8	157.4	158.3	0	0	0	0	0	109
362	Y	23.7	Very low	26.5	Very low	230 Å²	230	159.7 Å²	159.7	90%	0.902	80%	0.8	S	S	*	*			trans	64.2	59.2	176.4	-61.2	-77.7	0	0	0	117.5
363	H	22.9	Very low	26.4	Very low	187 Å²	187	163.7 Å²	163.7	87%	0.866	80%	0.804	S	S	*	*			trans	-127.9	85.3	151.6	-108.5	-64.1	0	0	0	110.1
364	H	25.2	Very low	26.6	Very low	192 Å²	192	165.5 Å²	165.5	89%	0.889	80%	0.802	S	S	*	*			trans	-171.5	84.3	153.7	-109.7	64.6	0	0	0	112.7
365	H	27.9	Very low	26.5	Very low	197 Å²	197	163.9 Å²	163.9	91%	0.912	79%	0.789	S	S	*	*				-160.7	121.9	129.5	-116.8	-77.4	0	0	0	109.1
366	R	23.6	Very low	26.7	Very low	232 Å²	232	162.1 Å²	162.1	88%	0.875	78%	0.779	S	S	*	*			trans	-131.7	97.6	-171.7	177.2	-171.4	-179.2	-179.7	1.8	109.2
367	M	24.7	Very low	27.2	Very low	163 Å²	163	153.5 Å²	153.5	80%	0.803	76%	0.757	S	S	*	*			trans	-148.4	160	167.7	-79.7	-69.6	100.6	0	0	109.1
368	D	26	Very low	27.7	Very low	139 Å²	139	148.7 Å²	148.7	74%	0.743	73%	0.731	S	S	*	*			trans	60.4	48.8	166.4	-56.5	-5.2	0	0	0	118.3	E370	D368-E370 PolarHBondContact O-N 2.95Å
369	L	24.3	Very low	28.3	Very low	152 Å²	152	144.4 Å²	144.4	80%	0.796	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	40.2	172.1	-158.8	80.4	0	0	0	114.2	L372	L369-L372 HydrophobicContact CD1-CD1 4.17Å
370	E	25.5	Very low	28.8	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	-10.4	175	-70.2	-161.2	130	0	0	114.1	D368 L372	D368-E370 PolarHBondContact O-N 2.95Å; E370-L372 PolarHBondContact O-N 2.82Å
371	S	27.8	Very low	29.5	Very low	92 Å²	92	132.8 Å²	132.8	64%	0.643	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-78.6	-11.1	-175.9	55.7	0	0	0	0	115.4
372	L	27	Very low	30.3	Very low	107 Å²	107	133.3 Å²	133.3	56%	0.56	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-84.1	-15.7	-165.8	-90.8	155.9	0	0	0	116.2	L369 E370 N374 L375	L369-L372 HydrophobicContact CD1-CD1 4.17Å; E370-L372 PolarHBondContact O-N 2.82Å; L372-N374 PolarHBondContact O-N 2.86Å; L372-N374 VanDerWaalsContact O-N 3.12Å; L372-L375 HydrophobicContact CD2-CD1 3.89Å
373	R	27.6	Very low	31.2	Very low	226 Å²	226	129.7 Å²	129.7	85%	0.853	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-72	-0.8	-176.5	-74.6	-170.5	175.1	-165.6	-0.9	115.8
374	N	32.3	Very low	32	Very low	123 Å²	123	123.8 Å²	123.8	66%	0.658	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-100.8	10.8	-177.2	-70.8	-31.5	0	0	0	114.2	L372	L372-N374 PolarHBondContact O-N 2.86Å; L372-N374 VanDerWaalsContact O-N 3.12Å
375	L	32.5	Very low	32.8	Very low	102 Å²	102	116.5 Å²	116.5	53%	0.534	58%	0.578	S	S	.	*	S	Bend	trans	-95.8	-24.5	-177.4	-87.5	150.6	0	0	0	114.6	L372 A377 L378	L372-L375 HydrophobicContact CD2-CD1 3.89Å; L375-A377 PolarHBondContact O-N 3Å; L375-A377 VanDerWaalsContact O-N 3.12Å; L375-L378 PolarHBondContact O-N 3.15Å
376	D	35.9	Very low	33.4	Very low	111 Å²	111	110.4 Å²	110.4	59%	0.594	56%	0.558	S	S	*	*	H	α-helix	trans	-62.5	-22.7	-177	-62.5	-53.9	0	0	0	113.8	L378 D379 S380	D376-L378 PolarHBondContact O-N 2.97Å; D376-D379 PolarHBondContact O-N 2.76Å; D376-S380 WeakPolarHBondContact O-CB 2.88Å; D376-S380 PolarHBondContact O-N 3.26Å; D376-S380 PolarHBondContact O-OG 2.75Å
377	A	35.5	Very low	34.1	Very low	49 Å²	49	104.3 Å²	104.3	41%	0.405	54%	0.542	S	S	.	.	H	α-helix	trans	-70.3	-11.9	179.8	0	0	0	0	0	114.7	L375 Q617	L375-A377 PolarHBondContact O-N 3Å; L375-A377 VanDerWaalsContact O-N 3.12Å; A377-Q617 PolarHBondContact O-NE2 3.38Å
378	L	38.5	Very low	34.7	Very low	52 Å²	52	98 Å²	98	27%	0.272	51%	0.511	S	S	.	.	H	α-helix	trans	-102.4	-37.9	172.4	-171.6	64.6	0	0	0	111.4	L375 D376 S380 V381 N382 W574	L375-L378 PolarHBondContact O-N 3.15Å; D376-L378 PolarHBondContact O-N 2.97Å; L378-S380 VanDerWaalsContact C-N 3.3Å; L378-S380 PolarHBondContact O-N 3.34Å; L378-V381 WeakPolarHBondContact O-CB 3.49Å; L378-V381 PolarHBondContact O-N 3.01Å; L378-V381 VanDerWaalsContact O-N 3.07Å; L378-N382 PolarHBondContact O-N 3.46Å; L378-W574 HydrophobicContact CD1-CH2 4.4Å
379	D	39.9	Very low	35.4	Very low	70 Å²	70	96.2 Å²	96.2	37%	0.374	50%	0.497	S	S	.	.	H	α-helix	trans	-67.4	-34.4	179.4	-147	62.9	0	0	0	111.7	D376 V381 N382 R383	D376-D379 PolarHBondContact O-N 2.76Å; D379-V381 VanDerWaalsContact C-N 3.32Å; D379-V381 PolarHBondContact O-N 2.75Å; D379-N382 PolarHBondContact O-N 2.99Å; D379-R383 WeakPolarHBondContact O-CB 3.11Å; D379-R383 VanDerWaalsContact O-CG 3.22Å; D379-R383 WeakPolarHBondContact O-CG 3.1Å; D379-R383 PolarHBondContact O-N 3.49Å; D379-R383 IonicContact OD2-CZ 3.18Å; D379-R383 IonicContact OD2-NE 2.68Å; D379-R383 PolarHBondContact OD2-NE 2.88Å; D379-R383 IonicContact OD2-NH2 2.89Å; D379-R383 PolarHBondContact OD2-NH2 3Å
380	S	35.9	Very low	36.2	Very low	65 Å²	65	92.9 Å²	92.9	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-33.4	169.2	47.6	0	0	0	0	113.8	D376 L378 F384	D376-S380 WeakPolarHBondContact O-CB 2.88Å; D376-S380 PolarHBondContact O-N 3.26Å; D376-S380 PolarHBondContact O-OG 2.75Å; L378-S380 VanDerWaalsContact C-N 3.3Å; L378-S380 PolarHBondContact O-N 3.34Å; S380-F384 WeakPolarHBondContact O-CB 3.46Å; S380-F384 PolarHBondContact O-N 3.33Å; S380-F384 VanDerWaalsContact O-N 3.13Å
381	V	38.8	Very low	36.6	Very low	41 Å²	41	90 Å²	90	25%	0.248	48%	0.476	C	S	.	.	H	α-helix	trans	-72.3	-43.5	174.2	176.5	0	0	0	0	110.6	L378 D379 F384 T385 Q617	L378-V381 WeakPolarHBondContact O-CB 3.49Å; L378-V381 PolarHBondContact O-N 3.01Å; L378-V381 VanDerWaalsContact O-N 3.07Å; D379-V381 VanDerWaalsContact C-N 3.32Å; D379-V381 PolarHBondContact O-N 2.75Å; V381-F384 WeakPolarHBondContact O-CA 3.17Å; V381-F384 WeakPolarHBondContact O-CB 3.44Å; V381-F384 PolarHBondContact O-N 2.94Å; V381-F384 VanDerWaalsContact O-N 3.08Å; V381-T385 PolarHBondContact O-N 2.67Å; V381-T385 PolarHBondContact O-OG1 3.32Å; V381-Q617 HydrophobicContact CG2-CG 4.07Å
382	N	41	Very low	37.2	Very low	85 Å²	85	91.5 Å²	91.5	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-39.9	178	-69.3	-18.2	0	0	0	112.4	L378 D379 F384 T385 S386	L378-N382 PolarHBondContact O-N 3.46Å; D379-N382 PolarHBondContact O-N 2.99Å; N382-F384 VanDerWaalsContact C-N 3.25Å; N382-F384 PolarHBondContact O-N 2.79Å; N382-T385 PolarHBondContact O-N 3.38Å; N382-T385 PolarHBondContact O-OG1 2.89Å; N382-S386 PolarHBondContact O-N 2.88Å; N382-S386 PolarHBondContact O-OG 3.32Å
383	R	42.2	Very low	37.4	Very low	154 Å²	154	90.8 Å²	90.8	58%	0.581	47%	0.471	S	S	*	.	H	α-helix	trans	-65.6	-28.8	172	-67.9	172.8	-159.1	-167.9	8.4	112.2	D379 S386 L387	D379-R383 WeakPolarHBondContact O-CB 3.11Å; D379-R383 VanDerWaalsContact O-CG 3.22Å; D379-R383 WeakPolarHBondContact O-CG 3.1Å; D379-R383 PolarHBondContact O-N 3.49Å; D379-R383 IonicContact OD2-CZ 3.18Å; D379-R383 IonicContact OD2-NE 2.68Å; D379-R383 PolarHBondContact OD2-NE 2.88Å; D379-R383 IonicContact OD2-NH2 2.89Å; D379-R383 PolarHBondContact OD2-NH2 3Å; R383-S386 WeakPolarHBondContact CA-OG 3.45Å; R383-S386 PolarHBondContact O-OG 2.91Å; R383-L387 WeakPolarHBondContact O-CB 3.36Å; R383-L387 WeakPolarHBondContact O-CG 3.4Å; R383-L387 PolarHBondContact O-N 2.91Å
384	F	39.7	Very low	37.5	Very low	63 Å²	63	84 Å²	84	28%	0.276	46%	0.458	S	S	.	.	H	α-helix	trans	-76.3	-40.5	175.9	-177.9	-100.2	0	0	0	112.4	S380 V381 N382 L387 L388 P620 L624	S380-F384 WeakPolarHBondContact O-CB 3.46Å; S380-F384 PolarHBondContact O-N 3.33Å; S380-F384 VanDerWaalsContact O-N 3.13Å; V381-F384 WeakPolarHBondContact O-CA 3.17Å; V381-F384 WeakPolarHBondContact O-CB 3.44Å; V381-F384 PolarHBondContact O-N 2.94Å; V381-F384 VanDerWaalsContact O-N 3.08Å; N382-F384 VanDerWaalsContact C-N 3.25Å; N382-F384 PolarHBondContact O-N 2.79Å; F384-L387 PolarHBondContact O-N 2.79Å; F384-L388 HydrophobicContact CD1-CD1 3.96Å; F384-L388 HydrophobicContact CE1-CD1 3.4Å; F384-L388 VanDerWaalsContact CE1-CD1 3.4Å; F384-L388 HydrophobicContact CE1-CG 4.12Å; F384-L388 HydrophobicContact CZ-CD1 3.86Å; F384-L388 HydrophobicContact CZ-CG 4.22Å; F384-L388 PolarHBondContact O-N 2.78Å; F384-P620 HydrophobicContact CE1-CB 3.98Å; F384-L624 HydrophobicContact CE2-CD1 4.06Å; F384-L624 HydrophobicContact CE2-CD2 4.25Å; F384-L624 HydrophobicContact CZ-CD1 3.89Å; F384-L624 HydrophobicContact CZ-CD2 4.04Å; F384-L624 HydrophobicContact CZ-CG 4.13Å
385	T	42.3	Very low	37.4	Very low	39 Å²	39	85.3 Å²	85.3	24%	0.239	47%	0.465	C	S	.	.	H	α-helix	trans	-68.5	-32.4	170.8	38.5	0	0	0	0	112.5	V381 N382 L388 K389	V381-T385 PolarHBondContact O-N 2.67Å; V381-T385 PolarHBondContact O-OG1 3.32Å; N382-T385 PolarHBondContact O-N 3.38Å; N382-T385 PolarHBondContact O-OG1 2.89Å; T385-L388 PolarHBondContact O-N 3.08Å; T385-K389 WeakPolarHBondContact O-CB 3.12Å; T385-K389 WeakPolarHBondContact O-CG 3.37Å; T385-K389 PolarHBondContact O-N 3.07Å
386	S	41.3	Very low	37.3	Very low	69 Å²	69	83.6 Å²	83.6	48%	0.483	47%	0.473	S	S	.	.	H	α-helix	trans	-68	-38.8	170.9	70.4	0	0	0	0	112.4	N382 R383 K389 S390	N382-S386 PolarHBondContact O-N 2.88Å; N382-S386 PolarHBondContact O-OG 3.32Å; R383-S386 WeakPolarHBondContact CA-OG 3.45Å; R383-S386 PolarHBondContact O-OG 2.91Å; S386-K389 PolarHBondContact O-N 3.42Å; S386-S390 WeakPolarHBondContact O-CB 3.36Å; S386-S390 PolarHBondContact O-N 3.32Å
387	L	37.8	Very low	36.7	Very low	104 Å²	104	89.8 Å²	89.8	55%	0.545	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-43.4	171.4	-84.6	164.5	0	0	0	112	R383 F384 K389 S390 L391	R383-L387 WeakPolarHBondContact O-CB 3.36Å; R383-L387 WeakPolarHBondContact O-CG 3.4Å; R383-L387 PolarHBondContact O-N 2.91Å; F384-L387 PolarHBondContact O-N 2.79Å; L387-K389 VanDerWaalsContact C-N 3.33Å; L387-K389 PolarHBondContact O-N 3.21Å; L387-S390 CarbonylContact O-C 3.55Å; L387-S390 PolarHBondContact O-N 3.2Å; L387-L391 WeakPolarHBondContact O-CG 3.45Å; L387-L391 PolarHBondContact O-N 3.37Å
388	L	37.8	Very low	36.4	Very low	30 Å²	30	93.5 Å²	93.5	16%	0.157	51%	0.506	C	S	.	.	H	α-helix	trans	-66.3	-31.1	175.6	-77.7	176.7	0	0	0	113.2	F384 T385 R392	F384-L388 HydrophobicContact CD1-CD1 3.96Å; F384-L388 HydrophobicContact CE1-CD1 3.4Å; F384-L388 VanDerWaalsContact CE1-CD1 3.4Å; F384-L388 HydrophobicContact CE1-CG 4.12Å; F384-L388 HydrophobicContact CZ-CD1 3.86Å; F384-L388 HydrophobicContact CZ-CG 4.22Å; F384-L388 PolarHBondContact O-N 2.78Å; T385-L388 PolarHBondContact O-N 3.08Å; L388-R392 WeakPolarHBondContact O-CG 3.13Å
389	K	41	Very low	35.8	Very low	102 Å²	102	96.3 Å²	96.3	44%	0.443	53%	0.53	S	S	.	.	H	α-helix	trans	-71.6	-41.3	171.6	-74.1	173.5	-177.8	171.5	0	111	T385 S386 L387 L391 R392 D658	T385-K389 WeakPolarHBondContact O-CB 3.12Å; T385-K389 WeakPolarHBondContact O-CG 3.37Å; T385-K389 PolarHBondContact O-N 3.07Å; S386-K389 PolarHBondContact O-N 3.42Å; L387-K389 VanDerWaalsContact C-N 3.33Å; L387-K389 PolarHBondContact O-N 3.21Å; K389-L391 PolarHBondContact O-N 3.3Å; K389-R392 PolarHBondContact O-N 3.33Å; K389-R392 VanDerWaalsContact O-N 3.12Å; K389-D658 WeakPolarHBondContact CE-OD2 3.3Å; K389-D658 IonicContact NZ-OD1 3.17Å; K389-D658 IonicContact NZ-OD2 2.82Å; K389-D658 PolarHBondContact NZ-OD2 3.46Å
390	S	40.5	Very low	35.3	Very low	81 Å²	81	100.2 Å²	100.2	57%	0.566	55%	0.551	S	S	*	*	H	α-helix	trans	-64.7	-16.6	172.9	-172.4	0	0	0	0	114.6	S386 L387 S393	S386-S390 WeakPolarHBondContact O-CB 3.36Å; S386-S390 PolarHBondContact O-N 3.32Å; L387-S390 CarbonylContact O-C 3.55Å; L387-S390 PolarHBondContact O-N 3.2Å; S390-S393 PolarHBondContact O-OG 3.45Å
391	L	34.1	Very low	34.8	Very low	125 Å²	125	106.9 Å²	106.9	65%	0.654	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-2.7	175.7	-74.3	168.2	0	0	0	113.6	L387 K389	L387-L391 WeakPolarHBondContact O-CG 3.45Å; L387-L391 PolarHBondContact O-N 3.37Å; K389-L391 PolarHBondContact O-N 3.3Å
392	R	39.4	Very low	34.3	Very low	124 Å²	124	109.7 Å²	109.7	47%	0.468	60%	0.602	S	S	.	*	S	Bend	trans	-97.1	-8.4	172.5	-67.6	-177.8	-154.7	-150.3	6.8	113.3	L388 K389 S394 H651 N655	L388-R392 WeakPolarHBondContact O-CG 3.13Å; K389-R392 PolarHBondContact O-N 3.33Å; K389-R392 VanDerWaalsContact O-N 3.12Å; R392-S394 PolarHBondContact O-N 3.04Å; R392-H651 PolarHBondContact NH1-NE2 3.11Å; R392-H651 PolarHBondContact NH2-CE1 2.97Å; R392-H651 VanDerWaalsContact NH2-CE1 3.3Å; R392-N655 PolarHBondContact NH1-ND2 3.3Å; R392-N655 PolarHBondContact NH1-OD1 3.42Å; R392-N655 PolarHBondContact NH2-OD1 3.42Å
393	S	32.3	Very low	33.8	Very low	91 Å²	91	113.4 Å²	113.4	64%	0.636	62%	0.622	S	S	*	*	S	Bend	trans	-94	24.1	-176.1	58.9	0	0	0	0	114.4	S390	S390-S393 PolarHBondContact O-OG 3.45Å
394	S	28.9	Very low	33.2	Very low	83 Å²	83	114 Å²	114	58%	0.58	63%	0.631	S	S	*	*	S	Bend	trans	-95.3	-34.7	174	51.5	0	0	0	0	113.5	R392	R392-S394 PolarHBondContact O-N 3.04Å
395	D	30.1	Very low	32.8	Very low	151 Å²	151	117.6 Å²	117.6	81%	0.807	65%	0.652	S	S	*	*	S	Bend	trans	-106.3	92.7	-175	-58.9	-54.9	0	0	0	109.9
396	G	30.1	Very low	32.2	Very low	67 Å²	67	119 Å²	119	69%	0.691	66%	0.658	S	S	*	*			trans	145.9	47.3	-176.3	0	0	0	0	0	114.8	T398	G396-T398 VanDerWaalsContact C-N 3.32Å; G396-T398 PolarHBondContact O-N 2.85Å
397	R	24.7	Very low	31.5	Very low	241 Å²	241	118.6 Å²	118.6	91%	0.909	67%	0.665	S	S	*	*			trans	-88.6	67.2	168	-81.4	-170.6	171.7	-173.1	-2.6	111.6
398	T	27.7	Very low	31.1	Very low	127 Å²	127	118.9 Å²	118.9	78%	0.779	66%	0.662	S	S	*	*			trans	-86.3	112.1	148.6	46.8	0	0	0	0	106.8	G396	G396-T398 VanDerWaalsContact C-N 3.32Å; G396-T398 PolarHBondContact O-N 2.85Å
399	S	26.2	Very low	30.7	Very low	111 Å²	111	123.9 Å²	123.9	78%	0.776	69%	0.689	S	S	*	*			trans	-88.2	112.4	-176	51.3	0	0	0	0	111.3
400	D	28.9	Very low	30.1	Very low	152 Å²	152	123 Å²	123	81%	0.813	70%	0.695	S	S	*	*			trans	-144.7	96.2	166.1	-81.4	-51.7	0	0	0	110.6
401	Q	26	Very low	29.5	Very low	205 Å²	205	126.6 Å²	126.6	96%	0.958	70%	0.703	S	S	*	*			trans	-170.9	78.1	156.5	-116.9	176.8	42.6	0	0	111
402	A	28.8	Very low	29.3	Very low	100 Å²	100	127.8 Å²	127.8	83%	0.826	71%	0.705	S	S	*	*			trans	-167.2	84.3	164.4	0	0	0	0	0	110.1
403	D	30.3	Very low	28.7	Very low	162 Å²	162	129 Å²	129	87%	0.866	72%	0.721	S	S	*	*			trans	-82.9	151.8	163.8	-82.6	-53.4	0	0	0	110.5
404	E	29	Very low	28.6	Very low	168 Å²	168	132.7 Å²	132.7	79%	0.785	73%	0.734	S	S	*	*			trans	64.7	126.7	-179.2	-54.8	176.2	-174.8	0	0	113.5
405	I	31.3	Very low	28.5	Very low	137 Å²	137	132.5 Å²	132.5	70%	0.703	74%	0.737	S	S	*	*			cis	-143.8	109.5	36	-63.2	163.4	0	0	0	112.1
406	N	29.2	Very low	28.5	Very low	70 Å²	70	134.5 Å²	134.5	37%	0.374	74%	0.741	S	S	.	*				46.9	129.6	128.2	-51.6	12.5	0	0	0	122.3	E805 R808	N406-E805 VanDerWaalsContact CB-OE1 3.28Å; N406-E805 WeakPolarHBondContact CB-OE1 3.47Å; N406-E805 WeakPolarHBondContact CB-OE2 3.41Å; N406-E805 PolarHBondContact ND2-OE1 3.1Å; N406-R808 PolarHBondContact O-NH1 2.9Å; N406-R808 PolarHBondContact O-NH2 3.41Å
407	G	28.3	Very low	28.3	Very low	60 Å²	60	138.8 Å²	138.8	62%	0.619	75%	0.747	S	S	*	*			trans	-152.8	-7.6	-166.7	0	0	0	0	0	125.4
408	F	28.3	Very low	28.6	Very low	110 Å²	110	132.9 Å²	132.9	48%	0.482	74%	0.743	S	S	.	*			trans	77.5	134.1	164.3	-118.3	-40.2	0	0	0	122.5	V809	F408-V809 HydrophobicContact CD2-CG2 4.05Å; F408-V809 HydrophobicContact CE1-CG1 4.42Å; F408-V809 HydrophobicContact CE2-CB 3.91Å; F408-V809 HydrophobicContact CE2-CG1 3.58Å; F408-V809 HydrophobicContact CE2-CG2 3.63Å; F408-V809 HydrophobicContact CZ-CB 4.16Å; F408-V809 HydrophobicContact CZ-CG1 3.39Å; F408-V809 HydrophobicContact CZ-CG2 3.92Å
409	N	28.7	Very low	28.6	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	75%	0.745	S	S	*	*			trans	69.6	142.7	156.3	-77.7	-5.9	0	0	0	121.1
410	S	29.9	Very low	29.3	Very low	82 Å²	82	132.5 Å²	132.5	57%	0.573	74%	0.743	S	S	*	*			cis	-177.2	137.1	-15	48.4	0	0	0	0	112.2
411	Q	27.2	Very low	29.2	Very low	158 Å²	158	132.3 Å²	132.3	74%	0.738	74%	0.742	S	S	*	*			trans	53.9	155.8	150.6	-75	157.1	-97.6	0	0	119.9
412	E	29.6	Very low	29.4	Very low	149 Å²	149	128.1 Å²	128.1	70%	0.696	73%	0.73	S	S	*	*			cis	-136.8	140.4	-6.4	-100.6	129.5	-152.2	0	0	105.6
413	D	27.5	Very low	29.3	Very low	151 Å²	151	128.1 Å²	128.1	81%	0.807	72%	0.724	S	S	*	*				67.5	106.4	61	-77.2	-37.6	0	0	0	115.7
414	D	29.7	Very low	29	Very low	168 Å²	168	129.6 Å²	129.6	90%	0.898	73%	0.725	S	S	*	*				-161.9	158.4	126.8	-135.7	-25.3	0	0	0	111.5
415	A	27.7	Very low	29	Very low	79 Å²	79	127.7 Å²	127.7	65%	0.653	73%	0.731	S	S	*	*			trans	-136.9	164.3	-171.8	0	0	0	0	0	113.4
416	H	30.1	Very low	28.7	Very low	193 Å²	193	126.3 Å²	126.3	89%	0.894	73%	0.733	S	S	*	*			trans	-170.2	157.4	145.1	-105.8	-68.2	0	0	0	113.3
417	L	26.2	Very low	28.7	Very low	157 Å²	157	129 Å²	129	82%	0.822	75%	0.753	S	S	*	*			trans	-105.4	157.9	-178.2	-55.5	105.7	0	0	0	112.9
418	S	29.3	Very low	28.8	Very low	116 Å²	116	132.7 Å²	132.7	81%	0.811	76%	0.763	S	S	*	*			trans	-168.8	105.3	146.1	-84.1	0	0	0	0	114.9
419	S	29.3	Very low	28.6	Very low	118 Å²	118	132.7 Å²	132.7	83%	0.825	78%	0.777	S	S	*	*				50.9	162.4	129.2	-58	0	0	0	0	124.6
420	P	41	Very low	28.5	Very low	113 Å²	113	130.5 Å²	130.5	73%	0.734	78%	0.777	S	S	*	*			trans	-125.6	-146.8	-158.1	45.3	-28.8	0	0	0	115.3
421	D	25.4	Very low	28.3	Very low	147 Å²	147	135.1 Å²	135.1	79%	0.786	79%	0.79	S	S	*	*			trans	79.9	155.5	173.3	-71.2	-11.1	0	0	0	118.7
422	V	30.6	Very low	28.4	Very low	118 Å²	118	137.3 Å²	137.3	72%	0.715	80%	0.798	S	S	*	*			cis	-167.5	160	-41.5	120.1	0	0	0	0	109.3
423	S	26.2	Very low	28.2	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	80%	0.796	S	S	*	*			trans	67.3	118	167.3	67.3	0	0	0	0	118.4
424	E	24	Very low	28.3	Very low	192 Å²	192	135.4 Å²	135.4	90%	0.897	79%	0.794	S	S	*	*				74.5	114.3	90.6	-66.9	-162.3	152.1	0	0	117.4
425	S	29.3	Very low	28.3	Very low	128 Å²	128	135 Å²	135	90%	0.895	79%	0.787	S	S	*	*			trans	-155.6	157.8	134.7	50.4	0	0	0	0	109.9
426	S	24.9	Very low	28.4	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	79%	0.788	S	S	*	*			trans	-130.6	-166.2	-171.1	63.8	0	0	0	0	111.6
427	T	29.4	Very low	28.3	Very low	128 Å²	128	134.1 Å²	134.1	79%	0.785	78%	0.777	S	S	*	*			trans	87.2	142.8	-172.7	75.7	0	0	0	0	114.8
428	T	30.6	Very low	28.4	Very low	137 Å²	137	134 Å²	134	84%	0.84	78%	0.777	S	S	*	*			cis	-148.3	162.8	-5.1	-5.7	0	0	0	0	111.8
429	S	23.2	Very low	28.5	Very low	109 Å²	109	140.2 Å²	140.2	76%	0.762	78%	0.783	S	S	*	*			trans	-94.7	145.6	175.4	54.8	0	0	0	0	113.6
430	A	27.5	Very low	28.4	Very low	89 Å²	89	144.3 Å²	144.3	74%	0.736	79%	0.789	S	S	*	*				165	142.6	126.1	0	0	0	0	0	113.7
431	E	25	Very low	27.8	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	79%	0.787	S	S	*	*			trans	29.6	128	139.9	-57	172.9	-174.2	0	0	119.4
432	F	29.2	Very low	28.1	Very low	205 Å²	205	144 Å²	144	90%	0.899	78%	0.784	S	S	*	*				-150.2	-168.8	64	-148.3	-106.7	0	0	0	113.9
433	S	26.2	Very low	28.2	Very low	96 Å²	96	147 Å²	147	67%	0.671	80%	0.795	S	S	*	*			trans	-119.4	167.9	-160.3	-162.3	0	0	0	0	116.8
434	Q	30	Very low	28.5	Very low	163 Å²	163	147.5 Å²	147.5	76%	0.762	79%	0.789	S	S	*	*			trans	89	136.4	162.7	-57.7	-174.4	-10	0	0	120.6
435	H	28.2	Very low	29.4	Very low	160 Å²	160	141.2 Å²	141.2	74%	0.741	77%	0.766	S	S	*	*			trans	61	126	169.3	-71.6	-73.8	0	0	0	117.6
436	N	31.3	Very low	30.3	Very low	126 Å²	126	141.4 Å²	141.4	67%	0.674	76%	0.757	S	S	*	*			cis	-159.4	152.6	26.9	-105.5	-33.5	0	0	0	115
437	N	28.1	Very low	31.7	Very low	127 Å²	127	139.3 Å²	139.3	68%	0.679	74%	0.742	S	S	*	*			trans	40.7	128.2	142	-67.5	-25.1	0	0	0	124.1
438	L	27.3	Very low	33	Very low	155 Å²	155	137.1 Å²	137.1	81%	0.812	73%	0.726	S	S	*	*			trans	48.6	100.5	143.9	-73.4	86.7	0	0	0	119.4
439	R	31.2	Very low	34.5	Very low	247 Å²	247	134.2 Å²	134.2	93%	0.932	71%	0.711	S	S	*	*				-171.2	125.6	116.9	-103.4	166.7	-172.8	-143.1	0.5	110.8
440	Q	27.6	Very low	36.6	Very low	204 Å²	204	136.6 Å²	136.6	95%	0.953	71%	0.708	S	S	*	*			trans	-147.6	82.6	168.2	-159.4	172.1	27.4	0	0	110.9
441	S	28.2	Very low	38.7	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	69%	0.693	S	S	*	*			trans	-163.4	143.3	172	69.1	0	0	0	0	105.2
442	E	32.1	Very low	40.8	Very low	151 Å²	151	133.8 Å²	133.8	71%	0.706	68%	0.682	S	S	*	*			cis	-140.8	146.1	13.1	-67.1	171.3	141.7	0	0	110.7	I444	E442-I444 HydrophobicContact CB-CD1 4.18Å; E442-I444 HydrophobicContact CB-CG1 4.18Å; E442-I444 HydrophobicContact CG-CD1 4.19Å
443	L	32.6	Very low	42.6	Very low	183 Å²	183	126.4 Å²	126.4	96%	0.958	66%	0.659	S	S	*	*			trans	-132.7	78.7	155.6	-91.9	173.5	0	0	0	106.5
444	I	33.2	Very low	44.9	Very low	109 Å²	109	124.5 Å²	124.5	56%	0.559	64%	0.641	S	S	*	*			trans	-75.6	126.3	-178.3	-71	164	0	0	0	108.7	E442 D448	E442-I444 HydrophobicContact CB-CD1 4.18Å; E442-I444 HydrophobicContact CB-CG1 4.18Å; E442-I444 HydrophobicContact CG-CD1 4.19Å; I444-D448 HydrophobicContact CG2-CB 4.11Å
445	S	42.1	Very low	47.1	Very low	61 Å²	61	119 Å²	119	43%	0.427	62%	0.616	S	S	.	*			trans	-79.2	146.2	170	175.7	0	0	0	0	109.6	S447 D448	S445-S447 WeakPolarHBondContact CB-OG 3.28Å; S445-S447 PolarHBondContact O-N 2.94Å; S445-S447 PolarHBondContact OG-N 3.22Å; S445-S447 PolarHBondContact OG-OG 2.82Å; S445-D448 PolarHBondContact O-N 3.14Å
446	D	48.3	Very low	49.3	Very low	131 Å²	131	116 Å²	116	70%	0.701	61%	0.605	S	S	*	*	H	α-helix	trans	-50.9	-29.3	172.4	-63.6	-62.7	0	0	0	112.9	D448 S449 F450	D446-D448 VanDerWaalsContact C-N 3.31Å; D446-D448 PolarHBondContact O-N 3.04Å; D446-S449 WeakPolarHBondContact O-CB 3.38Å; D446-S449 PolarHBondContact O-N 2.78Å; D446-S449 VanDerWaalsContact O-N 3.15Å; D446-F450 WeakPolarHBondContact O-CD2 3.34Å; D446-F450 PolarHBondContact O-N 2.86Å
447	S	53.8	Low	51.5	Low	64 Å²	64	114.8 Å²	114.8	45%	0.448	60%	0.598	S	S	.	*	H	α-helix	trans	-59.3	-36.2	176.2	60.2	0	0	0	0	113.8	S445 L451	S445-S447 WeakPolarHBondContact CB-OG 3.28Å; S445-S447 PolarHBondContact O-N 2.94Å; S445-S447 PolarHBondContact OG-N 3.22Å; S445-S447 PolarHBondContact OG-OG 2.82Å; S447-L451 VanDerWaalsContact O-CD1 3.24Å; S447-L451 WeakPolarHBondContact O-CD1 3.39Å; S447-L451 PolarHBondContact O-N 2.89Å; S447-L451 VanDerWaalsContact O-N 3.12Å
448	D	56.7	Low	54.2	Low	82 Å²	82	109.9 Å²	109.9	44%	0.439	57%	0.57	S	S	.	*	H	α-helix	trans	-68.9	-35	176.1	-70	-51.7	0	0	0	111.8	I444 S445 D446 L451 Q452	I444-D448 HydrophobicContact CG2-CB 4.11Å; S445-D448 PolarHBondContact O-N 3.14Å; D446-D448 VanDerWaalsContact C-N 3.31Å; D446-D448 PolarHBondContact O-N 3.04Å; D448-L451 PolarHBondContact O-N 3.29Å; D448-Q452 VanDerWaalsContact O-CB 3.28Å; D448-Q452 WeakPolarHBondContact O-CB 3.48Å; D448-Q452 PolarHBondContact O-N 3.06Å
449	S	63.6	Low	56.8	Low	77 Å²	77	110.4 Å²	110.4	54%	0.538	56%	0.561	S	S	.	*	H	α-helix	trans	-61.3	-45.5	177.4	-172	0	0	0	0	111.4	D446 Q452 A453	D446-S449 WeakPolarHBondContact O-CB 3.38Å; D446-S449 PolarHBondContact O-N 2.78Å; D446-S449 VanDerWaalsContact O-N 3.15Å; S449-Q452 PolarHBondContact O-N 3.18Å; S449-A453 WeakPolarHBondContact O-CB 3.37Å; S449-A453 PolarHBondContact O-N 2.87Å
450	F	67.5	Low	59.2	Low	158 Å²	158	109 Å²	109	69%	0.693	56%	0.556	S	S	*	*	H	α-helix	trans	-66.1	-42.4	174.7	-74.7	-76.1	0	0	0	112.7	D446 Q452 A453 D454	D446-F450 WeakPolarHBondContact O-CD2 3.34Å; D446-F450 PolarHBondContact O-N 2.86Å; F450-Q452 VanDerWaalsContact C-N 3.29Å; F450-Q452 PolarHBondContact O-N 2.7Å; F450-A453 PolarHBondContact O-N 3.5Å; F450-D454 PolarHBondContact O-N 2.82Å
451	L	69.6	Low	61.9	Low	81 Å²	81	103.5 Å²	103.5	42%	0.424	53%	0.526	S	S	.	.	H	α-helix	trans	-58.5	-42.5	173.6	-98.7	79.9	0	0	0	111.5	S447 D448 D454 M455 V635	S447-L451 VanDerWaalsContact O-CD1 3.24Å; S447-L451 WeakPolarHBondContact O-CD1 3.39Å; S447-L451 PolarHBondContact O-N 2.89Å; S447-L451 VanDerWaalsContact O-N 3.12Å; D448-L451 PolarHBondContact O-N 3.29Å; L451-D454 PolarHBondContact O-N 3.35Å; L451-M455 WeakPolarHBondContact O-CB 3.46Å; L451-M455 VanDerWaalsContact O-CG 3.3Å; L451-M455 WeakPolarHBondContact O-CG 3.5Å; L451-M455 PolarHBondContact O-N 2.84Å; L451-V635 HydrophobicContact CB-CG1 4.4Å; L451-V635 HydrophobicContact CD2-CG1 3.75Å; L451-V635 HydrophobicContact CG-CG1 3.82Å
452	Q	69.1	Low	64.6	Low	129 Å²	129	102.4 Å²	102.4	60%	0.603	52%	0.519	S	S	*	.	H	α-helix	trans	-71.5	-37.7	-177.3	-162	136.9	110.3	0	0	112.3	D448 S449 F450 L456	D448-Q452 VanDerWaalsContact O-CB 3.28Å; D448-Q452 WeakPolarHBondContact O-CB 3.48Å; D448-Q452 PolarHBondContact O-N 3.06Å; S449-Q452 PolarHBondContact O-N 3.18Å; F450-Q452 VanDerWaalsContact C-N 3.29Å; F450-Q452 PolarHBondContact O-N 2.7Å; Q452-L456 WeakPolarHBondContact O-CG 3.45Å; Q452-L456 PolarHBondContact O-N 2.94Å
453	A	68.7	Low	67	Low	49 Å²	49	104.2 Å²	104.2	41%	0.405	52%	0.524	S	S	.	.	H	α-helix	trans	-60.2	-45.6	170.2	0	0	0	0	0	111.6	S449 F450 L456 L457	S449-A453 WeakPolarHBondContact O-CB 3.37Å; S449-A453 PolarHBondContact O-N 2.87Å; F450-A453 PolarHBondContact O-N 3.5Å; A453-L456 WeakPolarHBondContact O-CB 3.49Å; A453-L456 PolarHBondContact O-N 2.84Å; A453-L457 WeakPolarHBondContact O-CG 3.36Å; A453-L457 PolarHBondContact O-N 2.92Å
454	D	73.5	Confident	69.5	Low	57 Å²	57	97.8 Å²	97.8	31%	0.305	50%	0.502	S	S	.	.	H	α-helix	trans	-72	-35.9	-179	-152	42.4	0	0	0	111.9	F450 L451 L456 L457 W458 V635	F450-D454 PolarHBondContact O-N 2.82Å; L451-D454 PolarHBondContact O-N 3.35Å; D454-L456 VanDerWaalsContact C-N 3.31Å; D454-L456 PolarHBondContact O-N 3.13Å; D454-L457 PolarHBondContact O-N 2.85Å; D454-W458 PolarHBondContact O-N 2.9Å; D454-V635 HydrophobicContact CB-CG2 3.99Å
455	M	77.4	Confident	72.2	Confident	48 Å²	48	94.2 Å²	94.2	24%	0.236	49%	0.487	C	S	.	.	H	α-helix	trans	-55.7	-44	167.2	-76.7	176.5	67.6	0	0	112.1	L451 W458 R459 V635 E636	L451-M455 WeakPolarHBondContact O-CB 3.46Å; L451-M455 VanDerWaalsContact O-CG 3.3Å; L451-M455 WeakPolarHBondContact O-CG 3.5Å; L451-M455 PolarHBondContact O-N 2.84Å; M455-W458 PolarHBondContact O-N 3.34Å; M455-R459 WeakPolarHBondContact O-CB 3.2Å; M455-R459 WeakPolarHBondContact O-CG 3.43Å; M455-R459 PolarHBondContact O-N 3.15Å; M455-V635 HydrophobicContact CG-CB 3.91Å; M455-V635 HydrophobicContact CG-CG1 4.17Å; M455-V635 HydrophobicContact CG-CG2 4.45Å; M455-E636 HydrophobicContact CE-CG 4.03Å; M455-E636 WeakPolarHBondContact CE-OE1 3.5Å; M455-E636 HydrophobicContact CG-CG 4.31Å
456	L	74.5	Confident	74.4	Confident	97 Å²	97	94 Å²	94	51%	0.508	48%	0.48	S	S	.	.	H	α-helix	trans	-66.9	-38.8	176.7	-72.7	169.7	0	0	0	112.2	Q452 A453 D454 R459 R460	Q452-L456 WeakPolarHBondContact O-CG 3.45Å; Q452-L456 PolarHBondContact O-N 2.94Å; A453-L456 WeakPolarHBondContact O-CB 3.49Å; A453-L456 PolarHBondContact O-N 2.84Å; D454-L456 VanDerWaalsContact C-N 3.31Å; D454-L456 PolarHBondContact O-N 3.13Å; L456-R459 PolarHBondContact O-N 2.63Å; L456-R460 WeakPolarHBondContact O-CB 3.27Å; L456-R460 VanDerWaalsContact O-CG 3.31Å; L456-R460 WeakPolarHBondContact O-CG 3.33Å; L456-R460 PolarHBondContact O-N 2.87Å
457	L	77.1	Confident	76.3	Confident	100 Å²	100	96.5 Å²	96.5	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-47.5	173.1	-71.5	172.7	0	0	0	111.2	A453 D454 R460 R461	A453-L457 WeakPolarHBondContact O-CG 3.36Å; A453-L457 PolarHBondContact O-N 2.92Å; D454-L457 PolarHBondContact O-N 2.85Å; L457-R460 PolarHBondContact O-N 2.87Å; L457-R461 WeakPolarHBondContact O-CG 3.41Å; L457-R461 PolarHBondContact O-N 2.9Å
458	W	83.3	Confident	78.1	Confident	24 Å²	24	100.4 Å²	100.4	9%	0.091	49%	0.489	C	S	.	.	H	α-helix	trans	-62.6	-42.4	177	-82.7	101	0	0	0	112.9	D454 M455 R460 R461 H469 K631 S634	D454-W458 PolarHBondContact O-N 2.9Å; M455-W458 PolarHBondContact O-N 3.34Å; W458-R460 VanDerWaalsContact C-N 3.3Å; W458-R460 PolarHBondContact O-N 3.31Å; W458-R461 PolarHBondContact O-N 2.97Å; W458-H469 HydrophobicContact CH2-CB 3.82Å; W458-H469 AromaticContact CH2-CG 3.57Å; W458-H469 AromaticContact CH2-ND1 3.6Å; W458-H469 HydrophobicContact CZ3-CB 3.82Å; W458-H469 AromaticContact CZ3-CD2 3.89Å; W458-H469 AromaticContact CZ3-CG 3.73Å; W458-K631 WeakPolarHBondContact CZ2-O 3.4Å; W458-S634 VanDerWaalsContact CD2-CB 3.44Å
459	R	82.4	Confident	79.8	Confident	165 Å²	165	97.8 Å²	97.8	62%	0.623	47%	0.474	S	S	*	.	H	α-helix	trans	-66.9	-26.3	175.2	-73.1	179.2	-179.8	-166.9	3.5	113.5	M455 L456 E636	M455-R459 WeakPolarHBondContact O-CB 3.2Å; M455-R459 WeakPolarHBondContact O-CG 3.43Å; M455-R459 PolarHBondContact O-N 3.15Å; L456-R459 PolarHBondContact O-N 2.63Å; R459-E636 IonicContact CZ-OE1 2.69Å; R459-E636 IonicContact NE-OE1 2.65Å; R459-E636 PolarHBondContact NE-OE1 3.1Å; R459-E636 IonicContact NH2-OE1 2.81Å; R459-E636 PolarHBondContact NH2-OE1 2.7Å
460	R	81.6	Confident	81.2	Confident	218 Å²	218	97.4 Å²	97.4	82%	0.823	46%	0.464	S	S	*	.	H	α-helix	trans	-84	-9.1	176	-76.8	178.6	170.4	-170.8	-2.4	114.3	L456 L457 W458	L456-R460 WeakPolarHBondContact O-CB 3.27Å; L456-R460 VanDerWaalsContact O-CG 3.31Å; L456-R460 WeakPolarHBondContact O-CG 3.33Å; L456-R460 PolarHBondContact O-N 2.87Å; L457-R460 PolarHBondContact O-N 2.87Å; W458-R460 VanDerWaalsContact C-N 3.3Å; W458-R460 PolarHBondContact O-N 3.31Å
461	R	84.4	Confident	82.4	Confident	88 Å²	88	94.1 Å²	94.1	33%	0.332	45%	0.453	S	S	.	.	S	Bend	trans	-67.1	140.2	176.8	-71.9	179.1	-171.1	-76.2	-2.9	111.3	L457 W458 I466 H469	L457-R461 WeakPolarHBondContact O-CG 3.41Å; L457-R461 PolarHBondContact O-N 2.9Å; W458-R461 PolarHBondContact O-N 2.97Å; R461-I466 HydrophobicContact CB-CD1 4.26Å; R461-I466 HydrophobicContact CB-CG1 3.79Å; R461-I466 WeakPolarHBondContact O-CD1 3.27Å; R461-H469 PolarHBondContact NH1-NE2 3.04Å
462	S	85.5	Confident	83.6	Confident	79 Å²	79	92.3 Å²	92.3	55%	0.552	45%	0.446	S	S	*	.			trans	-64.9	154.1	174.5	72.9	0	0	0	0	111.6	G464 S465 I466	S462-G464 PolarHBondContact O-N 2.99Å; S462-G464 VanDerWaalsContact O-N 3.11Å; S462-S465 WeakPolarHBondContact O-CA 3.41Å; S462-S465 WeakPolarHBondContact O-CB 3.4Å; S462-S465 PolarHBondContact O-N 2.92Å; S462-S465 PolarHBondContact OG-N 3.37Å; S462-I466 PolarHBondContact O-N 2.66Å
463	K	82.2	Confident	84.9	Confident	188 Å²	188	86.4 Å²	86.4	82%	0.817	42%	0.418	S	S	*	.	H	α-helix	trans	-54	-33.4	176.6	-67.7	-179.1	178.8	176.6	0	112.8	R467	K463-R467 PolarHBondContact O-N 3.48Å; K463-R467 VanDerWaalsContact O-N 3.07Å
464	G	85.7	Confident	86.1	Confident	49 Å²	49	85.1 Å²	85.1	51%	0.505	41%	0.405	S	S	.	.	H	α-helix	trans	-69.8	-41.5	173.8	0	0	0	0	0	113.5	S462 R467 K468	S462-G464 PolarHBondContact O-N 2.99Å; S462-G464 VanDerWaalsContact O-N 3.11Å; G464-R467 PolarHBondContact O-N 3.31Å; G464-K468 PolarHBondContact O-N 2.93Å
465	S	89.1	Confident	87.2	Confident	33 Å²	33	88.2 Å²	88.2	23%	0.231	42%	0.417	C	S	.	.	H	α-helix	trans	-63.2	-43.5	172.9	174.4	0	0	0	0	111.4	S462 R467 K468 H469	S462-S465 WeakPolarHBondContact O-CA 3.41Å; S462-S465 WeakPolarHBondContact O-CB 3.4Å; S462-S465 PolarHBondContact O-N 2.92Å; S462-S465 PolarHBondContact OG-N 3.37Å; S465-R467 PolarHBondContact O-N 3.04Å; S465-K468 PolarHBondContact O-N 3.37Å; S465-H469 PolarHBondContact O-CD2 2.74Å; S465-H469 PolarHBondContact O-N 3.05Å
466	I	87.4	Confident	88.1	Confident	56 Å²	56	86.5 Å²	86.5	29%	0.287	41%	0.409	S	S	.	.	H	α-helix	trans	-61.6	-43.4	178.3	-67.3	168.1	0	0	0	111.2	R461 S462 H469 Q470	R461-I466 HydrophobicContact CB-CD1 4.26Å; R461-I466 HydrophobicContact CB-CG1 3.79Å; R461-I466 WeakPolarHBondContact O-CD1 3.27Å; S462-I466 PolarHBondContact O-N 2.66Å; I466-H469 PolarHBondContact O-N 2.89Å; I466-Q470 WeakPolarHBondContact O-CG 3.38Å; I466-Q470 PolarHBondContact O-N 3.24Å
467	R	89	Confident	89.1	Confident	184 Å²	184	82 Å²	82	69%	0.694	39%	0.385	S	S	*	.	H	α-helix	trans	-57.4	-53	171.3	-83	-172.9	168.6	-164.2	-4	111.6	K463 G464 S465 H469 Q470 D471	K463-R467 PolarHBondContact O-N 3.48Å; K463-R467 VanDerWaalsContact O-N 3.07Å; G464-R467 PolarHBondContact O-N 3.31Å; S465-R467 PolarHBondContact O-N 3.04Å; R467-H469 PolarHBondContact O-N 3.44Å; R467-H469 VanDerWaalsContact O-N 3.16Å; R467-Q470 CarbonylContact O-C 3.44Å; R467-Q470 WeakPolarHBondContact O-CA 3.41Å; R467-Q470 WeakPolarHBondContact O-CB 3.22Å; R467-Q470 PolarHBondContact O-N 3.5Å; R467-D471 PolarHBondContact O-N 2.96Å; R467-D471 VanDerWaalsContact O-OD2 3.06Å
468	K	91.3	Very high	90	Very high	147 Å²	147	81.4 Å²	81.4	64%	0.639	38%	0.379	S	S	*	.	H	α-helix	trans	-54.1	-39	177.6	-174.2	175.7	179.4	178.5	0	112.4	G464 S465 T472	G464-K468 PolarHBondContact O-N 2.93Å; S465-K468 PolarHBondContact O-N 3.37Å; K468-T472 WeakPolarHBondContact O-CB 3.5Å; K468-T472 PolarHBondContact O-N 3.34Å; K468-T472 PolarHBondContact O-OG1 3.04Å; K468-T472 VanDerWaalsContact O-OG1 3.07Å
469	H	93	Very high	90.7	Very high	26 Å²	26	85 Å²	85	12%	0.12	40%	0.396	C	S	.	.	H	α-helix	trans	-65.8	-41.6	174.7	-78	-76.3	0	0	0	113.1	W458 R461 S465 I466 R467 T472 R473 H632	W458-H469 HydrophobicContact CH2-CB 3.82Å; W458-H469 AromaticContact CH2-CG 3.57Å; W458-H469 AromaticContact CH2-ND1 3.6Å; W458-H469 HydrophobicContact CZ3-CB 3.82Å; W458-H469 AromaticContact CZ3-CD2 3.89Å; W458-H469 AromaticContact CZ3-CG 3.73Å; R461-H469 PolarHBondContact NH1-NE2 3.04Å; S465-H469 PolarHBondContact O-CD2 2.74Å; S465-H469 PolarHBondContact O-N 3.05Å; I466-H469 PolarHBondContact O-N 2.89Å; R467-H469 PolarHBondContact O-N 3.44Å; R467-H469 VanDerWaalsContact O-N 3.16Å; H469-T472 PolarHBondContact O-N 3.07Å; H469-R473 WeakPolarHBondContact O-CB 3.47Å; H469-R473 PolarHBondContact O-N 3.04Å; H469-H632 AromaticContact CE1-ND1 3.97Å; H469-H632 AromaticContact CG-ND1 3.81Å; H469-H632 AromaticContact ND1-CE1 3.47Å; H469-H632 PolarHBondContact ND1-CE1 3.48Å; H469-H632 AromaticContact ND1-CG 3.83Å; H469-H632 AromaticContact ND1-ND1 3.03Å; H469-H632 PolarHBondContact ND1-ND1 3.14Å
470	Q	92.2	Very high	91.3	Very high	70 Å²	70	77.5 Å²	77.5	33%	0.327	37%	0.369	S	S	.	.	H	α-helix	trans	-66.7	-38.9	175.9	-69.4	174.4	-3.7	0	0	112.4	I466 R467 T474 N546	I466-Q470 WeakPolarHBondContact O-CG 3.38Å; I466-Q470 PolarHBondContact O-N 3.24Å; R467-Q470 CarbonylContact O-C 3.44Å; R467-Q470 WeakPolarHBondContact O-CA 3.41Å; R467-Q470 WeakPolarHBondContact O-CB 3.22Å; R467-Q470 PolarHBondContact O-N 3.5Å; Q470-T474 WeakPolarHBondContact O-CB 3.38Å; Q470-T474 PolarHBondContact O-N 3.43Å; Q470-T474 PolarHBondContact O-OG1 2.81Å; Q470-N546 HydrophobicContact CG-CB 4.3Å; Q470-N546 PolarHBondContact OE1-ND2 3.41Å
471	D	93.3	Very high	92	Very high	88 Å²	88	67.7 Å²	67.7	47%	0.471	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-49.4	174.5	-60.8	-39.2	0	0	0	110	R467 T474 H475	R467-D471 PolarHBondContact O-N 2.96Å; R467-D471 VanDerWaalsContact O-OD2 3.06Å; D471-T474 WeakPolarHBondContact O-CB 3.29Å; D471-T474 PolarHBondContact O-N 3.38Å; D471-H475 PolarHBondContact O-N 3.22Å; D471-H475 PolarHBondContact O-ND1 2.9Å
472	T	94.8	Very high	92.7	Very high	43 Å²	43	69.8 Å²	69.8	26%	0.264	35%	0.347	S	S	.	.	H	α-helix	trans	-65.4	-41	177.2	-58.5	0	0	0	0	112.5	K468 H469 T474 H475 I476 H632	K468-T472 WeakPolarHBondContact O-CB 3.5Å; K468-T472 PolarHBondContact O-N 3.34Å; K468-T472 PolarHBondContact O-OG1 3.04Å; K468-T472 VanDerWaalsContact O-OG1 3.07Å; H469-T472 PolarHBondContact O-N 3.07Å; T472-T474 VanDerWaalsContact C-N 3.25Å; T472-T474 PolarHBondContact O-N 2.8Å; T472-H475 PolarHBondContact O-N 3.39Å; T472-H475 VanDerWaalsContact O-N 3.09Å; T472-I476 HydrophobicContact CG2-CD1 3.85Å; T472-I476 HydrophobicContact CG2-CG1 4.33Å; T472-I476 WeakPolarHBondContact O-CG1 3.38Å; T472-I476 PolarHBondContact O-N 2.83Å; T472-H632 WeakPolarHBondContact CB-ND1 3.35Å; T472-H632 VanDerWaalsContact CG2-CE1 3.45Å; T472-H632 WeakPolarHBondContact CG2-CE1 3.29Å
473	R	95.4	Very high	93.2	Very high	6 Å²	6	68 Å²	68	2%	0.023	33%	0.333	C	S	.	.	H	α-helix	trans	-54.6	-43.3	171.2	166.2	163.2	175.7	97.2	8.3	111.2	H469 I476 V477 W544 Q548 L629 H632 T633 H637 D639	H469-R473 WeakPolarHBondContact O-CB 3.47Å; H469-R473 PolarHBondContact O-N 3.04Å; R473-I476 PolarHBondContact O-N 3.47Å; R473-V477 WeakPolarHBondContact O-CG2 3.26Å; R473-V477 PolarHBondContact O-N 3.17Å; R473-V477 VanDerWaalsContact O-N 3.12Å; R473-W544 HydrophobicContact CG-CZ2 4.42Å; R473-Q548 PolarHBondContact NH2-O 3.4Å; R473-L629 HydrophobicContact CB-CD1 4.33Å; R473-L629 HydrophobicContact CG-CD1 3.74Å; R473-H632 HydrophobicContact CB-CB 4.14Å; R473-T633 PolarHBondContact NH1-OG1 3.31Å; R473-H637 VanDerWaalsContact CZ-CE1 3.44Å; R473-H637 PolarHBondContact NH2-CE1 3.45Å; R473-D639 IonicContact CZ-OD2 3.56Å; R473-D639 IonicContact NH1-OD2 2.7Å; R473-D639 PolarHBondContact NH1-OD2 3.1Å; R473-D639 VanDerWaalsContact NH1-OD2 3.16Å; R473-D639 IonicContact NH2-OD2 2.77Å; R473-D639 PolarHBondContact NH2-OD2 3Å
474	T	95.1	Very high	93.9	Very high	22 Å²	22	59.1 Å²	59.1	14%	0.135	29%	0.294	C	S	.	.	H	α-helix	trans	-65.7	-37.5	176.8	-61.6	0	0	0	0	112.5	Q470 D471 T472 K478 W544	Q470-T474 WeakPolarHBondContact O-CB 3.38Å; Q470-T474 PolarHBondContact O-N 3.43Å; Q470-T474 PolarHBondContact O-OG1 2.81Å; D471-T474 WeakPolarHBondContact O-CB 3.29Å; D471-T474 PolarHBondContact O-N 3.38Å; T472-T474 VanDerWaalsContact C-N 3.25Å; T472-T474 PolarHBondContact O-N 2.8Å; T474-K478 HydrophobicContact CG2-CD 4.43Å; T474-K478 WeakPolarHBondContact O-CG 3.24Å; T474-K478 PolarHBondContact O-N 3.35Å; T474-W544 PolarHBondContact OG1-NE1 3.31Å
475	H	95.7	Very high	94.5	Very high	122 Å²	122	59.4 Å²	59.4	57%	0.565	28%	0.284	S	S	*	.	H	α-helix	trans	-67.8	-43.3	175.5	-74.1	81	0	0	0	112.4	D471 T472 V477 K478 E479	D471-H475 PolarHBondContact O-N 3.22Å; D471-H475 PolarHBondContact O-ND1 2.9Å; T472-H475 PolarHBondContact O-N 3.39Å; T472-H475 VanDerWaalsContact O-N 3.09Å; H475-V477 VanDerWaalsContact C-N 3.31Å; H475-V477 PolarHBondContact O-N 2.9Å; H475-K478 WeakPolarHBondContact O-CB 3.28Å; H475-K478 PolarHBondContact O-N 3.46Å; H475-E479 PolarHBondContact O-N 2.99Å
476	I	96.3	Very high	94.8	Very high	12 Å²	12	60.8 Å²	60.8	6%	0.062	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-38.5	177.9	-62.9	159.6	0	0	0	111.1	T472 R473 E479 L480 L625 E628 L629 H632	T472-I476 HydrophobicContact CG2-CD1 3.85Å; T472-I476 HydrophobicContact CG2-CG1 4.33Å; T472-I476 WeakPolarHBondContact O-CG1 3.38Å; T472-I476 PolarHBondContact O-N 2.83Å; R473-I476 PolarHBondContact O-N 3.47Å; I476-E479 PolarHBondContact O-N 2.98Å; I476-L480 PolarHBondContact O-N 3.19Å; I476-L625 HydrophobicContact CG2-CD2 4.18Å; I476-E628 HydrophobicContact CD1-CB 4.03Å; I476-E628 HydrophobicContact CD1-CG 3.82Å; I476-E628 HydrophobicContact CG1-CG 4.49Å; I476-L629 HydrophobicContact CB-CD1 4.4Å; I476-L629 HydrophobicContact CG2-CB 3.99Å; I476-L629 HydrophobicContact CG2-CD1 4.29Å; I476-H632 HydrophobicContact CD1-CB 4.45Å
477	V	96	Very high	95.2	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-70.7	-37	176.4	174.9	0	0	0	0	111.6	R473 H475 L480 V481 I541 W544 I550 L629	R473-V477 WeakPolarHBondContact O-CG2 3.26Å; R473-V477 PolarHBondContact O-N 3.17Å; R473-V477 VanDerWaalsContact O-N 3.12Å; H475-V477 VanDerWaalsContact C-N 3.31Å; H475-V477 PolarHBondContact O-N 2.9Å; V477-L480 WeakPolarHBondContact O-CB 3.45Å; V477-L480 PolarHBondContact O-N 3.24Å; V477-V481 WeakPolarHBondContact O-CG2 3.21Å; V477-V481 PolarHBondContact O-N 3.13Å; V477-V481 VanDerWaalsContact O-N 3.14Å; V477-I541 HydrophobicContact CG1-CD1 4.42Å; V477-W544 HydrophobicContact CB-CH2 4.07Å; V477-W544 HydrophobicContact CB-CZ2 4.26Å; V477-W544 HydrophobicContact CG1-CE3 4.28Å; V477-W544 HydrophobicContact CG1-CH2 3.9Å; V477-W544 HydrophobicContact CG1-CZ2 4.4Å; V477-W544 HydrophobicContact CG1-CZ3 3.83Å; V477-W544 HydrophobicContact CG2-CH2 3.76Å; V477-W544 HydrophobicContact CG2-CZ2 4.18Å; V477-W544 HydrophobicContact CG2-CZ3 4.46Å; V477-I550 HydrophobicContact CG1-CD1 3.83Å; V477-I550 HydrophobicContact CG1-CG1 4.02Å; V477-I550 HydrophobicContact CG2-CG1 4.01Å; V477-L629 HydrophobicContact CG2-CD1 3.8Å; V477-L629 HydrophobicContact CG2-CD2 4.14Å
478	K	96	Very high	95.6	Very high	88 Å²	88	49.6 Å²	49.6	38%	0.383	25%	0.248	S	C	.	.	H	α-helix	trans	-61.1	-47.2	170.1	-75.1	174.6	178.7	-176.5	0	111.8	T474 H475 L480 V481 E482 I541	T474-K478 HydrophobicContact CG2-CD 4.43Å; T474-K478 WeakPolarHBondContact O-CG 3.24Å; T474-K478 PolarHBondContact O-N 3.35Å; H475-K478 WeakPolarHBondContact O-CB 3.28Å; H475-K478 PolarHBondContact O-N 3.46Å; K478-L480 VanDerWaalsContact C-N 3.3Å; K478-L480 PolarHBondContact O-N 3.29Å; K478-V481 PolarHBondContact O-N 2.7Å; K478-V481 VanDerWaalsContact O-N 3.08Å; K478-E482 WeakPolarHBondContact O-CB 3.48Å; K478-E482 WeakPolarHBondContact O-CG 3.25Å; K478-E482 PolarHBondContact O-N 2.93Å; K478-I541 HydrophobicContact CG-CD1 3.8Å
479	E	97.2	Very high	95.8	Very high	99 Å²	99	46.7 Å²	46.7	46%	0.463	24%	0.237	S	C	.	.	H	α-helix	trans	-57.7	-41.1	176	-171.6	-171.3	161.7	0	0	111.8	H475 I476 V481 E482 T483 L625	H475-E479 PolarHBondContact O-N 2.99Å; I476-E479 PolarHBondContact O-N 2.98Å; E479-V481 PolarHBondContact O-N 2.7Å; E479-E482 PolarHBondContact O-N 3.43Å; E479-T483 HydrophobicContact CG-CG2 4Å; E479-T483 VanDerWaalsContact O-CB 3.27Å; E479-T483 WeakPolarHBondContact O-CB 3.42Å; E479-T483 VanDerWaalsContact O-CG2 3.23Å; E479-T483 WeakPolarHBondContact O-CG2 3.23Å; E479-T483 PolarHBondContact O-N 3.16Å; E479-T483 PolarHBondContact O-OG1 3.47Å; E479-L625 HydrophobicContact CG-CD2 4.28Å
480	L	96.5	Very high	95.9	Very high	8 Å²	8	46 Å²	46	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-57.7	-48.1	173.8	177.4	63.9	0	0	0	111.5	I476 V477 K478 T483 E484 L537 I550 Y622 L625	I476-L480 PolarHBondContact O-N 3.19Å; V477-L480 WeakPolarHBondContact O-CB 3.45Å; V477-L480 PolarHBondContact O-N 3.24Å; K478-L480 VanDerWaalsContact C-N 3.3Å; K478-L480 PolarHBondContact O-N 3.29Å; L480-T483 PolarHBondContact O-OG1 3.4Å; L480-E484 WeakPolarHBondContact O-CB 3.43Å; L480-E484 PolarHBondContact O-N 2.98Å; L480-L537 HydrophobicContact CD2-CD2 4.17Å; L480-L537 HydrophobicContact CG-CD1 4.25Å; L480-I550 HydrophobicContact CD2-CG2 3.85Å; L480-Y622 HydrophobicContact CD1-CD1 3.84Å; L480-Y622 HydrophobicContact CD1-CE1 3.91Å; L480-L625 HydrophobicContact CB-CD1 4.37Å; L480-L625 HydrophobicContact CD1-CD1 3.87Å
481	V	96.9	Very high	96	Very high	13 Å²	13	42.7 Å²	42.7	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-69.2	-41.5	179.8	-177.6	0	0	0	0	112.4	V477 K478 E479 E484 N485 L534 L537 K538 I541	V477-V481 WeakPolarHBondContact O-CG2 3.21Å; V477-V481 PolarHBondContact O-N 3.13Å; V477-V481 VanDerWaalsContact O-N 3.14Å; K478-V481 PolarHBondContact O-N 2.7Å; K478-V481 VanDerWaalsContact O-N 3.08Å; E479-V481 PolarHBondContact O-N 2.7Å; V481-E484 PolarHBondContact O-N 2.81Å; V481-N485 WeakPolarHBondContact O-CB 3.38Å; V481-N485 PolarHBondContact O-N 3.35Å; V481-L534 HydrophobicContact CG1-CD1 4.34Å; V481-L537 HydrophobicContact CG2-CB 4.02Å; V481-K538 HydrophobicContact CG1-CG 3.99Å; V481-I541 HydrophobicContact CG2-CD1 4.06Å
482	E	97.2	Very high	96.1	Very high	132 Å²	132	41.1 Å²	41.1	62%	0.617	21%	0.207	S	C	*	.	H	α-helix	trans	-68.6	-45.7	-179.5	-72.3	170.4	-156.8	0	0	111.6	K478 E479 E484 N485 S486	K478-E482 WeakPolarHBondContact O-CB 3.48Å; K478-E482 WeakPolarHBondContact O-CG 3.25Å; K478-E482 PolarHBondContact O-N 2.93Å; E479-E482 PolarHBondContact O-N 3.43Å; E482-E484 VanDerWaalsContact C-N 3.29Å; E482-E484 PolarHBondContact O-N 3.06Å; E482-N485 PolarHBondContact O-N 3.49Å; E482-S486 PolarHBondContact O-N 2.93Å
483	T	97	Very high	96	Very high	42 Å²	42	40.8 Å²	40.8	26%	0.258	20%	0.203	S	C	.	.	H	α-helix	trans	-67.2	-30.7	174.5	61.7	0	0	0	0	112.1	E479 L480 Y487 R618	E479-T483 HydrophobicContact CG-CG2 4Å; E479-T483 VanDerWaalsContact O-CB 3.27Å; E479-T483 WeakPolarHBondContact O-CB 3.42Å; E479-T483 VanDerWaalsContact O-CG2 3.23Å; E479-T483 WeakPolarHBondContact O-CG2 3.23Å; E479-T483 PolarHBondContact O-N 3.16Å; E479-T483 PolarHBondContact O-OG1 3.47Å; L480-T483 PolarHBondContact O-OG1 3.4Å; T483-Y487 WeakPolarHBondContact O-CB 3.25Å; T483-Y487 PolarHBondContact O-N 3.2Å; T483-R618 PolarHBondContact OG1-NH1 2.78Å; T483-R618 PolarHBondContact OG1-NH2 2.78Å; T483-R618 VanDerWaalsContact OG1-NH2 3.14Å
484	E	97.5	Very high	96	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-73.8	-38.7	174.9	-169.6	61.3	-173	0	0	112.3	L480 V481 E482 S486 Y487 V488 H530 F533 L534 L537 R618 Y622	L480-E484 WeakPolarHBondContact O-CB 3.43Å; L480-E484 PolarHBondContact O-N 2.98Å; V481-E484 PolarHBondContact O-N 2.81Å; E482-E484 VanDerWaalsContact C-N 3.29Å; E482-E484 PolarHBondContact O-N 3.06Å; E484-S486 VanDerWaalsContact C-N 3.31Å; E484-S486 PolarHBondContact O-N 3.2Å; E484-Y487 PolarHBondContact O-N 2.95Å; E484-V488 HydrophobicContact CG-CG2 4.47Å; E484-V488 WeakPolarHBondContact O-CB 3.46Å; E484-V488 WeakPolarHBondContact O-CG2 3.38Å; E484-V488 PolarHBondContact O-N 2.85Å; E484-H530 IonicContact OE1-CE1 2.79Å; E484-H530 IonicContact OE1-CG 2.8Å; E484-H530 IonicContact OE1-ND1 3.37Å; E484-H530 PolarHBondContact OE1-ND1 2.75Å; E484-F533 HydrophobicContact CG-CD1 4.04Å; E484-F533 HydrophobicContact CG-CE1 4.28Å; E484-F533 WeakPolarHBondContact OE1-CD1 3.33Å; E484-L534 HydrophobicContact CB-CD1 4.04Å; E484-L534 HydrophobicContact CG-CB 4.14Å; E484-L534 HydrophobicContact CG-CD1 4.01Å; E484-L537 HydrophobicContact CB-CD1 4.32Å; E484-L537 HydrophobicContact CG-CD1 4.26Å; E484-R618 VanDerWaalsContact CA-NH2 3.27Å; E484-R618 VanDerWaalsContact N-NH2 3.14Å; E484-R618 IonicContact OE2-CZ 2.67Å; E484-R618 IonicContact OE2-NE 3.26Å; E484-R618 PolarHBondContact OE2-NE 2.93Å; E484-R618 IonicContact OE2-NH2 3.75Å; E484-R618 PolarHBondContact OE2-NH2 2.84Å; E484-Y622 PolarHBondContact OE1-OH 2.93Å; E484-Y622 PolarHBondContact OE2-OH 2.72Å
485	N	97.4	Very high	96	Very high	55 Å²	55	39.7 Å²	39.7	29%	0.294	20%	0.198	S	C	.	.	H	α-helix	trans	-58.5	-46.8	171.3	-169.7	94.9	0	0	0	110.6	V481 E482 Y487 V488 E489 L534 K538	V481-N485 WeakPolarHBondContact O-CB 3.38Å; V481-N485 PolarHBondContact O-N 3.35Å; E482-N485 PolarHBondContact O-N 3.49Å; N485-Y487 PolarHBondContact O-N 3.44Å; N485-V488 PolarHBondContact O-N 2.86Å; N485-E489 WeakPolarHBondContact O-CG 3.45Å; N485-E489 PolarHBondContact O-N 3.47Å; N485-L534 HydrophobicContact CB-CD1 4.11Å; N485-L534 HydrophobicContact CB-CD2 4.27Å; N485-K538 WeakPolarHBondContact OD1-CE 3.3Å; N485-K538 PolarHBondContact OD1-NZ 2.75Å
486	S	95.2	Very high	95.9	Very high	62 Å²	62	38.2 Å²	38.2	43%	0.434	19%	0.191	S	C	.	.	H	α-helix	trans	-60.2	-44.3	175.1	-171.9	0	0	0	0	112.2	E482 E484 E489 N490	E482-S486 PolarHBondContact O-N 2.93Å; E484-S486 VanDerWaalsContact C-N 3.31Å; E484-S486 PolarHBondContact O-N 3.2Å; S486-E489 PolarHBondContact O-N 2.95Å; S486-N490 PolarHBondContact O-N 3.13Å; S486-N490 VanDerWaalsContact O-N 3.15Å; S486-N490 PolarHBondContact O-ND2 2.89Å
487	Y	96.4	Very high	95.6	Very high	5 Å²	5	40 Å²	40	2%	0.02	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-46.7	178	178.6	-126	0	0	0	112.5	T483 E484 N485 E489 N490 L491 M526 H530 M614 P615 R618	T483-Y487 WeakPolarHBondContact O-CB 3.25Å; T483-Y487 PolarHBondContact O-N 3.2Å; E484-Y487 PolarHBondContact O-N 2.95Å; N485-Y487 PolarHBondContact O-N 3.44Å; Y487-E489 PolarHBondContact O-N 2.93Å; Y487-N490 PolarHBondContact O-N 3.22Å; Y487-N490 VanDerWaalsContact O-N 3.17Å; Y487-L491 HydrophobicContact CD1-CD1 4.36Å; Y487-L491 HydrophobicContact CD2-CG 4.44Å; Y487-L491 HydrophobicContact CE1-CD1 3.78Å; Y487-L491 HydrophobicContact CE1-CG 4.41Å; Y487-L491 HydrophobicContact CE2-CD1 4.22Å; Y487-L491 HydrophobicContact CE2-CD2 4.07Å; Y487-L491 HydrophobicContact CE2-CG 4Å; Y487-L491 PolarHBondContact O-N 2.88Å; Y487-M526 WeakPolarHBondContact OH-CE 3.17Å; Y487-H530 AromaticContact CD1-ND1 3.96Å; Y487-H530 HydrophobicContact CE1-CB 4.47Å; Y487-H530 AromaticContact CE1-CE1 3.8Å; Y487-H530 AromaticContact CE1-CG 3.76Å; Y487-H530 AromaticContact CE1-ND1 3.61Å; Y487-M614 HydrophobicContact CD2-CB 4.2Å; Y487-M614 HydrophobicContact CD2-CE 4.31Å; Y487-M614 HydrophobicContact CE2-CB 3.93Å; Y487-P615 WeakPolarHBondContact OH-CA 3.47Å; Y487-R618 HydrophobicContact CD1-CG 3.79Å; Y487-R618 HydrophobicContact CE1-CB 4.18Å; Y487-R618 HydrophobicContact CE1-CG 3.78Å; Y487-R618 HydrophobicContact CE2-CB 4.35Å; Y487-R618 HydrophobicContact CG-CG 4.21Å
488	V	97.2	Very high	95.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-41.7	177.1	167.4	0	0	0	0	112.1	E484 N485 N490 L491 K492 L527 H530 E531 L534	E484-V488 HydrophobicContact CG-CG2 4.47Å; E484-V488 WeakPolarHBondContact O-CB 3.46Å; E484-V488 WeakPolarHBondContact O-CG2 3.38Å; E484-V488 PolarHBondContact O-N 2.85Å; N485-V488 PolarHBondContact O-N 2.86Å; V488-N490 VanDerWaalsContact C-N 3.3Å; V488-N490 PolarHBondContact O-N 2.86Å; V488-L491 PolarHBondContact O-N 2.85Å; V488-K492 HydrophobicContact CG1-CD 4.25Å; V488-K492 HydrophobicContact CG1-CG 4.44Å; V488-K492 WeakPolarHBondContact O-CG 3.34Å; V488-K492 PolarHBondContact O-N 2.84Å; V488-L527 HydrophobicContact CG1-CD1 4.29Å; V488-H530 HydrophobicContact CG2-CB 3.83Å; V488-E531 HydrophobicContact CG1-CG 3.77Å; V488-L534 HydrophobicContact CB-CD2 3.86Å; V488-L534 HydrophobicContact CG1-CD2 3.99Å; V488-L534 HydrophobicContact CG2-CB 4.13Å; V488-L534 HydrophobicContact CG2-CD2 3.93Å
489	E	95.2	Very high	95.4	Very high	86 Å²	86	36.3 Å²	36.3	40%	0.402	18%	0.182	S	C	.	.	H	α-helix	trans	-65.1	-32.8	175.8	-65.8	-50.2	132.5	0	0	112.6	N485 S486 Y487 K492 L493	N485-E489 WeakPolarHBondContact O-CG 3.45Å; N485-E489 PolarHBondContact O-N 3.47Å; S486-E489 PolarHBondContact O-N 2.95Å; Y487-E489 PolarHBondContact O-N 2.93Å; E489-K492 PolarHBondContact O-N 2.7Å; E489-K492 IonicContact OE1-NZ 2.67Å; E489-K492 PolarHBondContact OE1-NZ 2.92Å; E489-K492 WeakPolarHBondContact OE2-CD 3.41Å; E489-K492 IonicContact OE2-NZ 3.58Å; E489-L493 WeakPolarHBondContact O-CB 3.41Å; E489-L493 PolarHBondContact O-N 2.84Å
490	N	94.7	Very high	95.1	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.053	19%	0.186	C	C	.	.	H	α-helix	trans	-70.2	-36.8	172.5	-76.4	-84.2	0	0	0	112.4	S486 Y487 V488 L493 L494 H602 L611 M614	S486-N490 PolarHBondContact O-N 3.13Å; S486-N490 VanDerWaalsContact O-N 3.15Å; S486-N490 PolarHBondContact O-ND2 2.89Å; Y487-N490 PolarHBondContact O-N 3.22Å; Y487-N490 VanDerWaalsContact O-N 3.17Å; V488-N490 VanDerWaalsContact C-N 3.3Å; V488-N490 PolarHBondContact O-N 2.86Å; N490-L493 WeakPolarHBondContact O-CB 3.2Å; N490-L493 PolarHBondContact O-N 3.12Å; N490-L494 PolarHBondContact O-N 2.87Å; N490-L494 VanDerWaalsContact O-N 3.15Å; N490-H602 PolarHBondContact OD1-CE1 2.88Å; N490-L611 HydrophobicContact CB-CD2 4.13Å; N490-L611 WeakPolarHBondContact OD1-CD2 3.45Å; N490-M614 HydrophobicContact CB-CE 4.07Å; N490-M614 HydrophobicContact CB-SD 3.75Å
491	L	95.5	Very high	94.9	Very high	2 Å²	2	39 Å²	39	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-65.6	-41.8	170.9	-69.2	-177.6	0	0	0	111.9	Y487 V488 L493 L494 V495 L527 H530 P615	Y487-L491 HydrophobicContact CD1-CD1 4.36Å; Y487-L491 HydrophobicContact CD2-CG 4.44Å; Y487-L491 HydrophobicContact CE1-CD1 3.78Å; Y487-L491 HydrophobicContact CE1-CG 4.41Å; Y487-L491 HydrophobicContact CE2-CD1 4.22Å; Y487-L491 HydrophobicContact CE2-CD2 4.07Å; Y487-L491 HydrophobicContact CE2-CG 4Å; Y487-L491 PolarHBondContact O-N 2.88Å; V488-L491 PolarHBondContact O-N 2.85Å; L491-L493 VanDerWaalsContact C-N 3.29Å; L491-L493 PolarHBondContact O-N 3.27Å; L491-L494 HydrophobicContact CD2-CD1 4.26Å; L491-L494 WeakPolarHBondContact O-CB 3.49Å; L491-L494 PolarHBondContact O-N 2.84Å; L491-V495 PolarHBondContact O-N 2.92Å; L491-V495 VanDerWaalsContact O-N 3.15Å; L491-L527 HydrophobicContact CB-CB 4.23Å; L491-L527 HydrophobicContact CB-CD1 3.72Å; L491-L527 HydrophobicContact CB-CG 4.49Å; L491-H530 HydrophobicContact CD1-CB 4.11Å; L491-P615 HydrophobicContact CD2-CG 4.39Å
492	K	95.7	Very high	94.7	Very high	55 Å²	55	38.3 Å²	38.3	24%	0.239	19%	0.187	C	C	.	.	H	α-helix	trans	-59	-42.2	173	-74.7	172.4	179.7	170	0	111	V488 E489 V495 H496 L527 E531	V488-K492 HydrophobicContact CG1-CD 4.25Å; V488-K492 HydrophobicContact CG1-CG 4.44Å; V488-K492 WeakPolarHBondContact O-CG 3.34Å; V488-K492 PolarHBondContact O-N 2.84Å; E489-K492 PolarHBondContact O-N 2.7Å; E489-K492 IonicContact OE1-NZ 2.67Å; E489-K492 PolarHBondContact OE1-NZ 2.92Å; E489-K492 WeakPolarHBondContact OE2-CD 3.41Å; E489-K492 IonicContact OE2-NZ 3.58Å; K492-V495 PolarHBondContact O-N 3.06Å; K492-H496 VanDerWaalsContact O-CB 3.26Å; K492-H496 WeakPolarHBondContact O-CB 3.38Å; K492-H496 PolarHBondContact O-N 3.16Å; K492-H496 PolarHBondContact O-ND1 2.9Å; K492-L527 HydrophobicContact CG-CD1 3.69Å; K492-L527 HydrophobicContact CG-CD2 4.18Å; K492-E531 WeakPolarHBondContact CE-OE1 3.44Å; K492-E531 IonicContact NZ-OE1 2.84Å
493	L	92.7	Very high	94.3	Very high	35 Å²	35	36.8 Å²	36.8	18%	0.183	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-47.1	177.5	-171.9	73.6	0	0	0	111.6	E489 N490 L491 V495 K497 Y498 L611	E489-L493 WeakPolarHBondContact O-CB 3.41Å; E489-L493 PolarHBondContact O-N 2.84Å; N490-L493 WeakPolarHBondContact O-CB 3.2Å; N490-L493 PolarHBondContact O-N 3.12Å; L491-L493 VanDerWaalsContact C-N 3.29Å; L491-L493 PolarHBondContact O-N 3.27Å; L493-V495 PolarHBondContact O-N 2.88Å; L493-K497 HydrophobicContact CD1-CB 3.9Å; L493-K497 HydrophobicContact CD1-CD 3.69Å; L493-K497 HydrophobicContact CD1-CG 4.42Å; L493-K497 HydrophobicContact CG-CB 4.37Å; L493-K497 WeakPolarHBondContact O-CA 3.34Å; L493-K497 VanDerWaalsContact O-CB 3.27Å; L493-K497 WeakPolarHBondContact O-CB 3.36Å; L493-K497 PolarHBondContact O-N 3.12Å; L493-Y498 HydrophobicContact CD2-CE2 4.47Å; L493-Y498 HydrophobicContact CG-CE2 4.24Å; L493-L611 HydrophobicContact CD2-CD1 3.96Å; L493-L611 HydrophobicContact CD2-CD2 4.4Å
494	L	94.5	Very high	93.9	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	19%	0.189	C	C	.	.	I	π-helix	trans	-54.9	-49.1	174.9	-72.2	167.1	0	0	0	111.5	N490 L491 Y498 L499 F520 V523 L608 L611 L612	N490-L494 PolarHBondContact O-N 2.87Å; N490-L494 VanDerWaalsContact O-N 3.15Å; L491-L494 HydrophobicContact CD2-CD1 4.26Å; L491-L494 WeakPolarHBondContact O-CB 3.49Å; L491-L494 PolarHBondContact O-N 2.84Å; L494-Y498 WeakPolarHBondContact O-CB 3.29Å; L494-Y498 PolarHBondContact O-N 3.08Å; L494-L499 PolarHBondContact O-N 3.42Å; L494-F520 HydrophobicContact CB-CE1 4.32Å; L494-F520 HydrophobicContact CD2-CE1 3.9Å; L494-V523 HydrophobicContact CB-CG1 4.02Å; L494-V523 HydrophobicContact CD1-CG1 4.11Å; L494-L608 HydrophobicContact CD2-CD1 3.44Å; L494-L608 VanDerWaalsContact CD2-CD1 3.44Å; L494-L611 HydrophobicContact CD1-CB 4.28Å; L494-L611 HydrophobicContact CD2-CB 3.76Å; L494-L611 HydrophobicContact CD2-CD1 4.18Å; L494-L611 HydrophobicContact CG-CB 4.15Å; L494-L612 HydrophobicContact CD1-CD2 4.12Å; L494-L612 HydrophobicContact CD2-CD2 4.02Å; L494-L612 HydrophobicContact CD2-CG 4.18Å
495	V	95.3	Very high	93.2	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.024	22%	0.224	C	C	.	.	I	π-helix	trans	-71.5	-46	-178.2	176	0	0	0	0	112.7	L491 K492 L493 R500 V523 P524 L527	L491-V495 PolarHBondContact O-N 2.92Å; L491-V495 VanDerWaalsContact O-N 3.15Å; K492-V495 PolarHBondContact O-N 3.06Å; L493-V495 PolarHBondContact O-N 2.88Å; V495-R500 HydrophobicContact CG1-CG 4.4Å; V495-R500 WeakPolarHBondContact O-CB 3.49Å; V495-R500 WeakPolarHBondContact O-CG 3.44Å; V495-R500 PolarHBondContact O-N 3.4Å; V495-V523 HydrophobicContact CG2-CG1 4.17Å; V495-P524 HydrophobicContact CG2-CG 4.48Å; V495-L527 HydrophobicContact CB-CD2 3.98Å; V495-L527 HydrophobicContact CG1-CD2 4.38Å; V495-L527 HydrophobicContact CG2-CB 4.48Å; V495-L527 HydrophobicContact CG2-CD2 3.74Å
496	H	93.5	Very high	92.6	Very high	90 Å²	90	50.4 Å²	50.4	42%	0.417	24%	0.241	S	C	.	.	I	π-helix	trans	-88.6	-29.2	-169.1	-66.2	79	0	0	0	114	K492 R500 P501	K492-H496 VanDerWaalsContact O-CB 3.26Å; K492-H496 WeakPolarHBondContact O-CB 3.38Å; K492-H496 PolarHBondContact O-N 3.16Å; K492-H496 PolarHBondContact O-ND1 2.9Å; H496-R500 PolarHBondContact CD2-NH1 2.61Å; H496-R500 PolarHBondContact NE2-NH1 3.41Å; H496-P501 VanDerWaalsContact O-CD 3.22Å; H496-P501 WeakPolarHBondContact O-CD 3.35Å; H496-P501 WeakPolarHBondContact O-CG 3.48Å
497	K	90.9	Very high	92.1	Very high	49 Å²	49	49.6 Å²	49.6	21%	0.213	23%	0.231	C	C	.	.	I	π-helix	trans	-103.9	-28.2	-177.3	-164.6	173.7	-174.3	177.4	0	113.9	L493 P501 Y594 E601	L493-K497 HydrophobicContact CD1-CB 3.9Å; L493-K497 HydrophobicContact CD1-CD 3.69Å; L493-K497 HydrophobicContact CD1-CG 4.42Å; L493-K497 HydrophobicContact CG-CB 4.37Å; L493-K497 WeakPolarHBondContact O-CA 3.34Å; L493-K497 VanDerWaalsContact O-CB 3.27Å; L493-K497 WeakPolarHBondContact O-CB 3.36Å; L493-K497 PolarHBondContact O-N 3.12Å; K497-P501 WeakPolarHBondContact O-CG 3.26Å; K497-Y594 PolarHBondContact O-OH 2.98Å; K497-E601 VanDerWaalsContact CE-OE2 3.23Å; K497-E601 WeakPolarHBondContact CE-OE2 3.39Å; K497-E601 IonicContact NZ-OE2 2.68Å; K497-E601 PolarHBondContact NZ-OE2 3.34Å
498	Y	92.9	Very high	91.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.251	C	S	.	.	I	π-helix	trans	-103.4	-68.4	176.3	-58.6	-99.4	0	0	0	111.5	L493 L494 P501 L502 F520 L595 C598 L608 L611	L493-Y498 HydrophobicContact CD2-CE2 4.47Å; L493-Y498 HydrophobicContact CG-CE2 4.24Å; L494-Y498 WeakPolarHBondContact O-CB 3.29Å; L494-Y498 PolarHBondContact O-N 3.08Å; Y498-P501 WeakPolarHBondContact O-CD 3.38Å; Y498-L502 WeakPolarHBondContact O-CB 3.41Å; Y498-L502 WeakPolarHBondContact O-CD1 3.33Å; Y498-L502 WeakPolarHBondContact O-CG 3.35Å; Y498-L502 PolarHBondContact O-N 3.39Å; Y498-L502 VanDerWaalsContact O-N 3.07Å; Y498-F520 VanDerWaalsContact CB-CZ 3.44Å; Y498-F520 HydrophobicContact CG-CZ 4.29Å; Y498-L595 HydrophobicContact CD1-CD2 3.69Å; Y498-L595 HydrophobicContact CE1-CD2 3.77Å; Y498-C598 HydrophobicContact CD1-CB 4.28Å; Y498-C598 HydrophobicContact CE1-CB 3.47Å; Y498-C598 VanDerWaalsContact CE1-CB 3.47Å; Y498-C598 HydrophobicContact CE2-CB 4.45Å; Y498-L608 HydrophobicContact CD1-CD1 4.13Å; Y498-L608 HydrophobicContact CD1-CD2 4.48Å; Y498-L608 HydrophobicContact CE1-CB 4.39Å; Y498-L608 HydrophobicContact CE1-CD1 4.31Å; Y498-L608 HydrophobicContact CG-CD1 4.27Å; Y498-L611 HydrophobicContact CE2-CD1 3.93Å
499	L	93.2	Very high	90.8	Very high	13 Å²	13	56.2 Å²	56.2	7%	0.068	28%	0.278	C	S	.	.	I	π-helix	trans	-61	-55.3	-169.7	177.9	59.6	0	0	0	114	L494 L502 K503 L516 F520 P524	L494-L499 PolarHBondContact O-N 3.42Å; L499-L502 PolarHBondContact O-N 2.89Å; L499-K503 HydrophobicContact CD1-CD 4.18Å; L499-K503 HydrophobicContact CD1-CG 4.45Å; L499-K503 PolarHBondContact O-N 3.43Å; L499-L516 HydrophobicContact CD1-CD1 4.41Å; L499-L516 HydrophobicContact CD1-CD2 4.39Å; L499-L516 HydrophobicContact CD1-CG 4.06Å; L499-F520 HydrophobicContact CB-CB 4.47Å; L499-F520 HydrophobicContact CB-CD1 4.23Å; L499-F520 HydrophobicContact CB-CD2 4.27Å; L499-F520 HydrophobicContact CB-CG 4.07Å; L499-F520 HydrophobicContact CD1-CB 3.9Å; L499-F520 HydrophobicContact CD1-CD2 3.96Å; L499-F520 HydrophobicContact CD1-CG 4.06Å; L499-F520 HydrophobicContact CD2-CB 4.02Å; L499-F520 HydrophobicContact CG-CB 4.35Å; L499-F520 HydrophobicContact CG-CG 4.43Å; L499-P524 HydrophobicContact CD2-CG 3.73Å
500	R	92.6	Very high	90.5	Very high	140 Å²	140	53.5 Å²	53.5	53%	0.528	27%	0.266	S	S	.	.	H	α-helix	trans	-64.6	-43.7	-177	-72.7	-178	-170	157.8	10	113	V495 H496 K503	V495-R500 HydrophobicContact CG1-CG 4.4Å; V495-R500 WeakPolarHBondContact O-CB 3.49Å; V495-R500 WeakPolarHBondContact O-CG 3.44Å; V495-R500 PolarHBondContact O-N 3.4Å; H496-R500 PolarHBondContact CD2-NH1 2.61Å; H496-R500 PolarHBondContact NE2-NH1 3.41Å; R500-K503 PolarHBondContact O-N 3.31Å
501	P	91.8	Very high	90.2	Very high	22 Å²	22	53.2 Å²	53.2	14%	0.143	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-43.4	174.5	-28.8	39.4	0	0	0	113.3	H496 K497 Y498 K503 R504 L507 Y594	H496-P501 VanDerWaalsContact O-CD 3.22Å; H496-P501 WeakPolarHBondContact O-CD 3.35Å; H496-P501 WeakPolarHBondContact O-CG 3.48Å; K497-P501 WeakPolarHBondContact O-CG 3.26Å; Y498-P501 WeakPolarHBondContact O-CD 3.38Å; P501-K503 PolarHBondContact O-N 3.05Å; P501-R504 VanDerWaalsContact O-CB 3.32Å; P501-R504 WeakPolarHBondContact O-CB 3.43Å; P501-R504 PolarHBondContact O-N 3.27Å; P501-L507 HydrophobicContact CB-CD1 4.03Å; P501-Y594 WeakPolarHBondContact CB-OH 3.43Å
502	L	92.1	Very high	89.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-18	179	-69.6	167.2	0	0	0	113.6	Y498 L499 C508 L510 V511 L516 F591 Y594	Y498-L502 WeakPolarHBondContact O-CB 3.41Å; Y498-L502 WeakPolarHBondContact O-CD1 3.33Å; Y498-L502 WeakPolarHBondContact O-CG 3.35Å; Y498-L502 PolarHBondContact O-N 3.39Å; Y498-L502 VanDerWaalsContact O-N 3.07Å; L499-L502 PolarHBondContact O-N 2.89Å; L502-C508 WeakPolarHBondContact O-CA 3.21Å; L502-L510 HydrophobicContact CD2-CB 4.38Å; L502-L510 HydrophobicContact CD2-CD1 4.19Å; L502-V511 HydrophobicContact CD2-CG1 4.42Å; L502-L516 HydrophobicContact CB-CD1 3.77Å; L502-L516 HydrophobicContact CB-CD2 3.68Å; L502-L516 HydrophobicContact CB-CG 4.42Å; L502-L516 HydrophobicContact CD1-CD1 3.74Å; L502-L516 HydrophobicContact CG-CD1 4.4Å; L502-F591 HydrophobicContact CD1-CE2 3.86Å; L502-F591 HydrophobicContact CD2-CD2 4.31Å; L502-F591 HydrophobicContact CD2-CE2 4.18Å; L502-Y594 HydrophobicContact CD1-CE1 4.12Å; L502-Y594 HydrophobicContact CD2-CD1 3.97Å; L502-Y594 HydrophobicContact CD2-CE1 3.83Å; L502-Y594 HydrophobicContact CG-CD1 4.49Å; L502-Y594 HydrophobicContact CG-CE1 3.93Å
503	K	89.4	Confident	89.6	Confident	99 Å²	99	61.7 Å²	61.7	43%	0.43	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.7	169.7	-72.9	-170.2	172.3	-178.2	0	114.6	L499 R500 P501 L513 L516 N517	L499-K503 HydrophobicContact CD1-CD 4.18Å; L499-K503 HydrophobicContact CD1-CG 4.45Å; L499-K503 PolarHBondContact O-N 3.43Å; R500-K503 PolarHBondContact O-N 3.31Å; P501-K503 PolarHBondContact O-N 3.05Å; K503-L513 HydrophobicContact CD-CD1 4.37Å; K503-L513 HydrophobicContact CG-CD1 4.07Å; K503-L516 HydrophobicContact CG-CD2 3.53Å; K503-N517 WeakPolarHBondContact CE-OD1 3.42Å; K503-N517 PolarHBondContact NZ-OD1 2.82Å
504	R	88.6	Confident	89.4	Confident	133 Å²	133	62.3 Å²	62.3	50%	0.502	32%	0.323	S	S	.	.	S	Bend	trans	-74.1	147.9	175.4	-67.2	-177.8	121.5	97.9	1.2	111.4	P501 E506 L507 C508	P501-R504 VanDerWaalsContact O-CB 3.32Å; P501-R504 WeakPolarHBondContact O-CB 3.43Å; P501-R504 PolarHBondContact O-N 3.27Å; R504-E506 WeakPolarHBondContact CD-OE2 3.39Å; R504-E506 IonicContact NE-OE1 2.71Å; R504-E506 IonicContact NE-OE2 2.69Å; R504-E506 PolarHBondContact O-N 3.09Å; R504-E506 VanDerWaalsContact O-N 3.09Å; R504-L507 PolarHBondContact O-N 3.37Å; R504-C508 WeakPolarHBondContact O-CB 3.37Å; R504-C508 PolarHBondContact O-N 3.11Å
505	P	82.7	Confident	89.3	Confident	113 Å²	113	63.8 Å²	63.8	73%	0.734	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-30.5	175.4	-26.8	35.5	0	0	0	114.3	L507	P505-L507 VanDerWaalsContact C-N 3.29Å; P505-L507 PolarHBondContact O-N 3.11Å
506	E	83.9	Confident	89.1	Confident	137 Å²	137	63.7 Å²	63.7	64%	0.64	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.5	176.9	-58.4	126.2	-130.2	0	0	113.7	R504	R504-E506 WeakPolarHBondContact CD-OE2 3.39Å; R504-E506 IonicContact NE-OE1 2.71Å; R504-E506 IonicContact NE-OE2 2.69Å; R504-E506 PolarHBondContact O-N 3.09Å; R504-E506 VanDerWaalsContact O-N 3.09Å
507	L	84.8	Confident	89.1	Confident	45 Å²	45	62.8 Å²	62.8	24%	0.236	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-12.2	-166.9	-62.9	175.7	0	0	0	114.1	P501 R504 P505 S509 L510 Y594	P501-L507 HydrophobicContact CB-CD1 4.03Å; R504-L507 PolarHBondContact O-N 3.37Å; P505-L507 VanDerWaalsContact C-N 3.29Å; P505-L507 PolarHBondContact O-N 3.11Å; L507-S509 PolarHBondContact O-N 2.82Å; L507-L510 HydrophobicContact CB-CD1 4.31Å; L507-L510 HydrophobicContact CD2-CD1 3.81Å; L507-L510 VanDerWaalsContact O-CB 3.26Å; L507-L510 WeakPolarHBondContact O-CB 3.17Å; L507-L510 WeakPolarHBondContact O-CG 3.4Å; L507-L510 PolarHBondContact O-N 3.11Å; L507-Y594 HydrophobicContact CD1-CE2 4.06Å
508	C	82.2	Confident	89.1	Confident	63 Å²	63	63.8 Å²	63.8	43%	0.426	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-6.4	178.6	69.5	0	0	0	0	114.1	L502 R504 V511	L502-C508 WeakPolarHBondContact O-CA 3.21Å; R504-C508 WeakPolarHBondContact O-CB 3.37Å; R504-C508 PolarHBondContact O-N 3.11Å; C508-V511 VanDerWaalsContact O-O 3.06Å
509	S	84.7	Confident	89.2	Confident	82 Å²	82	63.9 Å²	63.9	57%	0.573	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.8	167.8	59.3	0	0	0	0	112.8	L507 K588	L507-S509 PolarHBondContact O-N 2.82Å; S509-K588 PolarHBondContact O-NZ 2.62Å
510	L	88.3	Confident	89.3	Confident	29 Å²	29	63.5 Å²	63.5	15%	0.152	33%	0.333	C	S	.	.	S	Bend	trans	-68.5	-35.1	-176	-64.5	-179.4	0	0	0	113.2	L502 L507 K588 A590 F591 Y594	L502-L510 HydrophobicContact CD2-CB 4.38Å; L502-L510 HydrophobicContact CD2-CD1 4.19Å; L507-L510 HydrophobicContact CB-CD1 4.31Å; L507-L510 HydrophobicContact CD2-CD1 3.81Å; L507-L510 VanDerWaalsContact O-CB 3.26Å; L507-L510 WeakPolarHBondContact O-CB 3.17Å; L507-L510 WeakPolarHBondContact O-CG 3.4Å; L507-L510 PolarHBondContact O-N 3.11Å; L510-K588 WeakPolarHBondContact O-CD 3.48Å; L510-A590 HydrophobicContact CD2-CB 3.6Å; L510-F591 HydrophobicContact CB-CB 4.46Å; L510-F591 HydrophobicContact CB-CD2 4.36Å; L510-F591 WeakPolarHBondContact O-CB 3.38Å; L510-Y594 HydrophobicContact CD1-CD2 3.99Å; L510-Y594 HydrophobicContact CD1-CG 4.08Å
511	V	89.8	Confident	89.4	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.024	33%	0.327	C	S	.	.	S	Bend	trans	-147.9	145	176.7	67.3	0	0	0	0	109.2	L502 C508 T515 L516 A584 F591	L502-V511 HydrophobicContact CD2-CG1 4.42Å; C508-V511 VanDerWaalsContact O-O 3.06Å; V511-T515 HydrophobicContact CG2-CG2 4.17Å; V511-L516 HydrophobicContact CG1-CB 4.16Å; V511-L516 HydrophobicContact CG1-CD1 3.94Å; V511-L516 HydrophobicContact CG1-CG 4.45Å; V511-A584 HydrophobicContact CG2-CB 3.88Å; V511-F591 HydrophobicContact CB-CD2 3.88Å; V511-F591 HydrophobicContact CB-CE2 3.89Å; V511-F591 HydrophobicContact CB-CG 4.28Å; V511-F591 HydrophobicContact CB-CZ 4.29Å; V511-F591 HydrophobicContact CG1-CD2 4.09Å; V511-F591 HydrophobicContact CG1-CE2 3.75Å; V511-F591 HydrophobicContact CG1-CZ 4.33Å; V511-F591 HydrophobicContact CG2-CE1 4.49Å; V511-F591 HydrophobicContact CG2-CE2 4.41Å; V511-F591 HydrophobicContact CG2-CZ 4.32Å
512	E	88.8	Confident	89.5	Confident	137 Å²	137	62.2 Å²	62.2	64%	0.64	33%	0.33	S	S	*	.			trans	-71.1	143.6	-175.9	-173.4	163.2	-163.6	0	0	111.6	G514 T515 L516	E512-G514 VanDerWaalsContact C-N 3.28Å; E512-G514 PolarHBondContact O-N 3.12Å; E512-T515 PolarHBondContact O-N 3.25Å; E512-T515 VanDerWaalsContact O-N 3.14Å; E512-L516 PolarHBondContact O-N 2.79Å
513	L	88.9	Confident	89.7	Confident	98 Å²	98	62.3 Å²	62.3	51%	0.513	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-33.9	-169.8	-170.2	66.7	0	0	0	112.8	K503 L516 N517	K503-L513 HydrophobicContact CD-CD1 4.37Å; K503-L513 HydrophobicContact CG-CD1 4.07Å; L513-L516 HydrophobicContact CD1-CD2 4.41Å; L513-L516 PolarHBondContact O-N 3.47Å; L513-N517 VanDerWaalsContact O-CG 3.25Å; L513-N517 PolarHBondContact O-N 3.35Å; L513-N517 PolarHBondContact O-ND2 3.07Å
514	G	89	Confident	90	Very high	49 Å²	49	59.7 Å²	59.7	51%	0.505	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-54.8	172.4	0	0	0	0	0	111.6	E512 L516 N517 E518	E512-G514 VanDerWaalsContact C-N 3.28Å; E512-G514 PolarHBondContact O-N 3.12Å; G514-L516 VanDerWaalsContact C-N 3.26Å; G514-L516 PolarHBondContact O-N 3Å; G514-N517 PolarHBondContact O-N 3.2Å; G514-N517 VanDerWaalsContact O-N 3.12Å; G514-E518 PolarHBondContact O-N 2.92Å
515	T	91	Very high	90.4	Very high	33 Å²	33	57.4 Å²	57.4	20%	0.202	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-32.5	176	-46	0	0	0	0	112.5	V511 E512 E518 I519 A580 A584	V511-T515 HydrophobicContact CG2-CG2 4.17Å; E512-T515 PolarHBondContact O-N 3.25Å; E512-T515 VanDerWaalsContact O-N 3.14Å; T515-E518 PolarHBondContact O-N 2.88Å; T515-I519 HydrophobicContact CG2-CD1 4.04Å; T515-I519 WeakPolarHBondContact O-CB 3.5Å; T515-I519 WeakPolarHBondContact O-CD1 3.2Å; T515-I519 WeakPolarHBondContact O-CG1 3.35Å; T515-I519 PolarHBondContact O-N 2.99Å; T515-A580 HydrophobicContact CG2-CB 3.92Å; T515-A584 HydrophobicContact CG2-CB 4.45Å
516	L	93.1	Very high	91	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-68.9	-40.4	174.8	-172.9	63.6	0	0	0	112.1	L499 L502 K503 V511 E512 L513 G514 I519 F520	L499-L516 HydrophobicContact CD1-CD1 4.41Å; L499-L516 HydrophobicContact CD1-CD2 4.39Å; L499-L516 HydrophobicContact CD1-CG 4.06Å; L502-L516 HydrophobicContact CB-CD1 3.77Å; L502-L516 HydrophobicContact CB-CD2 3.68Å; L502-L516 HydrophobicContact CB-CG 4.42Å; L502-L516 HydrophobicContact CD1-CD1 3.74Å; L502-L516 HydrophobicContact CG-CD1 4.4Å; K503-L516 HydrophobicContact CG-CD2 3.53Å; V511-L516 HydrophobicContact CG1-CB 4.16Å; V511-L516 HydrophobicContact CG1-CD1 3.94Å; V511-L516 HydrophobicContact CG1-CG 4.45Å; E512-L516 PolarHBondContact O-N 2.79Å; L513-L516 HydrophobicContact CD1-CD2 4.41Å; L513-L516 PolarHBondContact O-N 3.47Å; G514-L516 VanDerWaalsContact C-N 3.26Å; G514-L516 PolarHBondContact O-N 3Å; L516-I519 PolarHBondContact O-N 3.32Å; L516-F520 HydrophobicContact CD1-CD2 3.74Å; L516-F520 HydrophobicContact CD1-CE2 3.68Å; L516-F520 HydrophobicContact CG-CD2 4.47Å; L516-F520 WeakPolarHBondContact O-CD2 3.29Å; L516-F520 PolarHBondContact O-N 2.94Å
517	N	91.7	Very high	91.7	Very high	72 Å²	72	46 Å²	46	39%	0.385	26%	0.256	S	S	.	.	H	α-helix	trans	-68.1	-37	174.1	-68.3	-25.7	0	0	0	111.5	K503 L513 G514 F521	K503-N517 WeakPolarHBondContact CE-OD1 3.42Å; K503-N517 PolarHBondContact NZ-OD1 2.82Å; L513-N517 VanDerWaalsContact O-CG 3.25Å; L513-N517 PolarHBondContact O-N 3.35Å; L513-N517 PolarHBondContact O-ND2 3.07Å; G514-N517 PolarHBondContact O-N 3.2Å; G514-N517 VanDerWaalsContact O-N 3.12Å; N517-F521 WeakPolarHBondContact O-CA 3.23Å; N517-F521 WeakPolarHBondContact O-CB 3.48Å; N517-F521 PolarHBondContact O-N 3.19Å
518	E	92.3	Very high	92.2	Very high	70 Å²	70	46.5 Å²	46.5	33%	0.327	27%	0.266	S	S	.	.	H	α-helix	trans	-60.6	-46	172.7	-176.2	-172.2	-177.6	0	0	111.7	G514 T515 F520 N573 A580	G514-E518 PolarHBondContact O-N 2.92Å; T515-E518 PolarHBondContact O-N 2.88Å; E518-F520 PolarHBondContact O-N 2.75Å; E518-N573 PolarHBondContact O-ND2 3Å; E518-A580 HydrophobicContact CG-CB 4.24Å
519	I	94.1	Very high	92.9	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-33.2	-177.8	-69.5	166.5	0	0	0	112.9	T515 L516 A580 I581 F591 L608 L612	T515-I519 HydrophobicContact CG2-CD1 4.04Å; T515-I519 WeakPolarHBondContact O-CB 3.5Å; T515-I519 WeakPolarHBondContact O-CD1 3.2Å; T515-I519 WeakPolarHBondContact O-CG1 3.35Å; T515-I519 PolarHBondContact O-N 2.99Å; L516-I519 PolarHBondContact O-N 3.32Å; I519-A580 HydrophobicContact CD1-CB 4.18Å; I519-A580 HydrophobicContact CG1-CB 3.71Å; I519-I581 HydrophobicContact CD1-CG1 3.81Å; I519-I581 HydrophobicContact CG1-CG1 3.95Å; I519-I581 HydrophobicContact CG2-CD1 4.01Å; I519-I581 HydrophobicContact CG2-CG1 3.86Å; I519-F591 HydrophobicContact CD1-CZ 4.48Å; I519-L608 HydrophobicContact CG2-CD2 4.14Å; I519-L612 HydrophobicContact CG2-CD1 4.1Å
520	F	95.3	Very high	93.5	Very high	5 Å²	5	43 Å²	43	2%	0.022	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	18.8	-174.9	-64.6	-82.3	0	0	0	114.1	L494 Y498 L499 L516 E518 Q522 V523 L608	L494-F520 HydrophobicContact CB-CE1 4.32Å; L494-F520 HydrophobicContact CD2-CE1 3.9Å; Y498-F520 VanDerWaalsContact CB-CZ 3.44Å; Y498-F520 HydrophobicContact CG-CZ 4.29Å; L499-F520 HydrophobicContact CB-CB 4.47Å; L499-F520 HydrophobicContact CB-CD1 4.23Å; L499-F520 HydrophobicContact CB-CD2 4.27Å; L499-F520 HydrophobicContact CB-CG 4.07Å; L499-F520 HydrophobicContact CD1-CB 3.9Å; L499-F520 HydrophobicContact CD1-CD2 3.96Å; L499-F520 HydrophobicContact CD1-CG 4.06Å; L499-F520 HydrophobicContact CD2-CB 4.02Å; L499-F520 HydrophobicContact CG-CB 4.35Å; L499-F520 HydrophobicContact CG-CG 4.43Å; L516-F520 HydrophobicContact CD1-CD2 3.74Å; L516-F520 HydrophobicContact CD1-CE2 3.68Å; L516-F520 HydrophobicContact CG-CD2 4.47Å; L516-F520 WeakPolarHBondContact O-CD2 3.29Å; L516-F520 PolarHBondContact O-N 2.94Å; E518-F520 PolarHBondContact O-N 2.75Å; F520-Q522 PolarHBondContact O-N 2.67Å; F520-V523 WeakPolarHBondContact O-CB 3.49Å; F520-V523 PolarHBondContact O-N 3.3Å; F520-L608 HydrophobicContact CE1-CD1 3.86Å; F520-L608 HydrophobicContact CZ-CD1 3.79Å; F520-L608 HydrophobicContact CZ-CD2 4.01Å
521	F	94.2	Very high	94	Very high	92 Å²	92	45.4 Å²	45.4	40%	0.404	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	131.5	178.4	-173	-117.4	0	0	0	111.3	N517 V523 A569 F570 N573	N517-F521 WeakPolarHBondContact O-CA 3.23Å; N517-F521 WeakPolarHBondContact O-CB 3.48Å; N517-F521 PolarHBondContact O-N 3.19Å; F521-V523 PolarHBondContact O-N 3.23Å; F521-A569 HydrophobicContact CE1-CB 4.02Å; F521-F570 WeakPolarHBondContact O-CD2 3.25Å; F521-N573 WeakPolarHBondContact CB-ND2 3.33Å; F521-N573 HydrophobicContact CD1-CB 3.77Å; F521-N573 HydrophobicContact CE1-CB 4.43Å
522	Q	95	Very high	94.3	Very high	44 Å²	44	47.7 Å²	47.7	21%	0.206	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	-1.3	-178.6	-58.6	-67.4	-1.6	0	0	117	F520 E525 M526 T566 A569 F570	F520-Q522 PolarHBondContact O-N 2.67Å; Q522-E525 VanDerWaalsContact C-OE2 3.28Å; Q522-E525 WeakPolarHBondContact CA-OE2 3.37Å; Q522-E525 PolarHBondContact O-N 2.8Å; Q522-M526 WeakPolarHBondContact O-CB 3.27Å; Q522-M526 WeakPolarHBondContact O-CG 3.4Å; Q522-M526 PolarHBondContact O-N 2.99Å; Q522-T566 HydrophobicContact CB-CG2 4Å; Q522-T566 HydrophobicContact CG-CG2 4.49Å; Q522-A569 HydrophobicContact CG-CB 3.91Å; Q522-F570 HydrophobicContact CB-CB 4.13Å
523	V	96.4	Very high	94.7	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.012	23%	0.232	C	C	.	.	H	α-helix	trans	-66.5	-41.7	179.9	180	0	0	0	0	113.1	L494 V495 F520 F521 E525 L527 F570 L612	L494-V523 HydrophobicContact CB-CG1 4.02Å; L494-V523 HydrophobicContact CD1-CG1 4.11Å; V495-V523 HydrophobicContact CG2-CG1 4.17Å; F520-V523 WeakPolarHBondContact O-CB 3.49Å; F520-V523 PolarHBondContact O-N 3.3Å; F521-V523 PolarHBondContact O-N 3.23Å; V523-E525 VanDerWaalsContact C-N 3.35Å; V523-L527 PolarHBondContact O-N 3.42Å; V523-F570 HydrophobicContact CG2-CD2 4.05Å; V523-F570 HydrophobicContact CG2-CE2 3.59Å; V523-L612 HydrophobicContact CG2-CD2 4.15Å
524	P	96	Very high	95.1	Very high	44 Å²	44	37 Å²	37	29%	0.286	21%	0.21	S	C	.	.	H	α-helix	trans	-60.9	-40	173.8	-24.5	34.7	0	0	0	113.9	V495 L499 L527 A528	V495-P524 HydrophobicContact CG2-CG 4.48Å; L499-P524 HydrophobicContact CD2-CG 3.73Å; P524-L527 WeakPolarHBondContact O-CB 3.33Å; P524-L527 PolarHBondContact O-N 3.07Å; P524-A528 PolarHBondContact O-N 2.67Å; P524-A528 VanDerWaalsContact O-N 3.12Å
525	E	96.8	Very high	95.5	Very high	84 Å²	84	42 Å²	42	39%	0.393	22%	0.218	S	C	.	.	H	α-helix	trans	-68.2	-46.9	-179.1	-65.7	70.5	-157.8	0	0	110	Q522 V523 L527 A528 Y529 T566	Q522-E525 VanDerWaalsContact C-OE2 3.28Å; Q522-E525 WeakPolarHBondContact CA-OE2 3.37Å; Q522-E525 PolarHBondContact O-N 2.8Å; V523-E525 VanDerWaalsContact C-N 3.35Å; E525-L527 VanDerWaalsContact C-N 3.33Å; E525-L527 PolarHBondContact O-N 3.26Å; E525-A528 PolarHBondContact O-N 2.76Å; E525-Y529 HydrophobicContact CB-CE2 4.43Å; E525-Y529 WeakPolarHBondContact O-CD2 3.35Å; E525-Y529 PolarHBondContact O-N 3.04Å; E525-T566 HydrophobicContact CB-CG2 3.86Å
526	M	95.3	Very high	95.8	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-54.4	-46.2	169.7	-77.5	-153.2	70.3	0	0	112.6	Y487 Q522 A528 Y529 H530 T566 Y567 F570 P615	Y487-M526 WeakPolarHBondContact OH-CE 3.17Å; Q522-M526 WeakPolarHBondContact O-CB 3.27Å; Q522-M526 WeakPolarHBondContact O-CG 3.4Å; Q522-M526 PolarHBondContact O-N 2.99Å; M526-A528 VanDerWaalsContact C-N 3.32Å; M526-A528 PolarHBondContact O-N 2.67Å; M526-Y529 PolarHBondContact O-N 3.26Å; M526-H530 PolarHBondContact O-CD2 2.79Å; M526-H530 VanDerWaalsContact O-CD2 3.26Å; M526-H530 PolarHBondContact O-N 2.86Å; M526-H530 VanDerWaalsContact O-N 3.09Å; M526-T566 HydrophobicContact CG-CG2 3.76Å; M526-Y567 HydrophobicContact CE-CD1 4.06Å; M526-Y567 HydrophobicContact CE-CD2 4.04Å; M526-Y567 HydrophobicContact CE-CE1 3.52Å; M526-Y567 HydrophobicContact CE-CE2 3.51Å; M526-Y567 HydrophobicContact CE-CG 4.31Å; M526-F570 HydrophobicContact SD-CB 4.26Å; M526-F570 HydrophobicContact SD-CD1 4.39Å; M526-F570 HydrophobicContact SD-CD2 4.47Å; M526-F570 HydrophobicContact SD-CG 4.09Å; M526-P615 HydrophobicContact CE-CB 3.88Å; M526-P615 HydrophobicContact CE-CG 4.49Å; M526-P615 HydrophobicContact SD-CB 3.82Å; M526-P615 HydrophobicContact SD-CG 4.19Å
527	L	97.4	Very high	95.9	Very high	8 Å²	8	42.2 Å²	42.2	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-45.2	177.9	172.6	61	0	0	0	111.6	V488 L491 K492 V495 V523 P524 E525 Y529 H530 E531	V488-L527 HydrophobicContact CG1-CD1 4.29Å; L491-L527 HydrophobicContact CB-CB 4.23Å; L491-L527 HydrophobicContact CB-CD1 3.72Å; L491-L527 HydrophobicContact CB-CG 4.49Å; K492-L527 HydrophobicContact CG-CD1 3.69Å; K492-L527 HydrophobicContact CG-CD2 4.18Å; V495-L527 HydrophobicContact CB-CD2 3.98Å; V495-L527 HydrophobicContact CG1-CD2 4.38Å; V495-L527 HydrophobicContact CG2-CB 4.48Å; V495-L527 HydrophobicContact CG2-CD2 3.74Å; V523-L527 PolarHBondContact O-N 3.42Å; P524-L527 WeakPolarHBondContact O-CB 3.33Å; P524-L527 PolarHBondContact O-N 3.07Å; E525-L527 VanDerWaalsContact C-N 3.33Å; E525-L527 PolarHBondContact O-N 3.26Å; L527-Y529 PolarHBondContact O-N 2.77Å; L527-H530 PolarHBondContact O-N 2.95Å; L527-E531 HydrophobicContact CD1-CG 3.72Å; L527-E531 HydrophobicContact CG-CG 4.28Å; L527-E531 WeakPolarHBondContact O-CB 3.29Å; L527-E531 WeakPolarHBondContact O-CG 3.5Å; L527-E531 PolarHBondContact O-N 2.89Å
528	A	97	Very high	96.2	Very high	56 Å²	56	42.6 Å²	42.6	46%	0.463	22%	0.221	S	C	.	.	H	α-helix	trans	-61.4	-42.4	-179.3	0	0	0	0	0	112.8	P524 E525 M526 A532	P524-A528 PolarHBondContact O-N 2.67Å; P524-A528 VanDerWaalsContact O-N 3.12Å; E525-A528 PolarHBondContact O-N 2.76Å; M526-A528 VanDerWaalsContact C-N 3.32Å; M526-A528 PolarHBondContact O-N 2.67Å; A528-A532 PolarHBondContact O-N 3.04Å
529	Y	96.4	Very high	96.3	Very high	69 Å²	69	42.6 Å²	42.6	27%	0.271	23%	0.229	S	C	.	.	H	α-helix	trans	-65.7	-41.5	176.6	-59.1	-52.6	0	0	0	112.4	E525 M526 L527 A532 F533 V563 T566	E525-Y529 HydrophobicContact CB-CE2 4.43Å; E525-Y529 WeakPolarHBondContact O-CD2 3.35Å; E525-Y529 PolarHBondContact O-N 3.04Å; M526-Y529 PolarHBondContact O-N 3.26Å; L527-Y529 PolarHBondContact O-N 2.77Å; Y529-A532 PolarHBondContact O-N 3Å; Y529-F533 WeakPolarHBondContact O-CB 3.36Å; Y529-F533 PolarHBondContact O-N 3.32Å; Y529-V563 HydrophobicContact CD1-CG2 3.75Å; Y529-V563 HydrophobicContact CD2-CG2 4.1Å; Y529-V563 HydrophobicContact CE1-CG2 3.92Å; Y529-V563 HydrophobicContact CE2-CG2 4.27Å; Y529-V563 HydrophobicContact CG-CG2 3.84Å; Y529-T566 HydrophobicContact CD2-CG2 4.45Å; Y529-T566 HydrophobicContact CE2-CG2 3.98Å; Y529-T566 WeakPolarHBondContact CE2-OG1 3.49Å
530	H	97.6	Very high	96.3	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.019	24%	0.239	C	C	.	.	H	α-helix	trans	-75.7	-30.5	-179.1	-77	-82.5	0	0	0	113.2	E484 Y487 V488 L491 M526 L527 F533 L534 F558 Y567 Y622	E484-H530 IonicContact OE1-CE1 2.79Å; E484-H530 IonicContact OE1-CG 2.8Å; E484-H530 IonicContact OE1-ND1 3.37Å; E484-H530 PolarHBondContact OE1-ND1 2.75Å; Y487-H530 AromaticContact CD1-ND1 3.96Å; Y487-H530 HydrophobicContact CE1-CB 4.47Å; Y487-H530 AromaticContact CE1-CE1 3.8Å; Y487-H530 AromaticContact CE1-CG 3.76Å; Y487-H530 AromaticContact CE1-ND1 3.61Å; V488-H530 HydrophobicContact CG2-CB 3.83Å; L491-H530 HydrophobicContact CD1-CB 4.11Å; M526-H530 PolarHBondContact O-CD2 2.79Å; M526-H530 VanDerWaalsContact O-CD2 3.26Å; M526-H530 PolarHBondContact O-N 2.86Å; M526-H530 VanDerWaalsContact O-N 3.09Å; L527-H530 PolarHBondContact O-N 2.95Å; H530-F533 PolarHBondContact O-N 2.81Å; H530-L534 VanDerWaalsContact O-CB 3.31Å; H530-L534 WeakPolarHBondContact O-CB 3.43Å; H530-L534 PolarHBondContact O-N 2.87Å; H530-F558 AromaticContact CE1-CZ 4Å; H530-Y567 AromaticContact NE2-CE2 3.64Å; H530-Y567 AromaticContact NE2-CZ 3.84Å; H530-Y567 PolarHBondContact NE2-OH 3.02Å; H530-Y622 PolarHBondContact CE1-OH 3.1Å
531	E	97.7	Very high	96.2	Very high	78 Å²	78	47.1 Å²	47.1	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-62.6	-42.2	167.6	-77.1	-175.6	152.1	0	0	111.9	V488 K492 L527 K535	V488-E531 HydrophobicContact CG1-CG 3.77Å; K492-E531 WeakPolarHBondContact CE-OE1 3.44Å; K492-E531 IonicContact NZ-OE1 2.84Å; L527-E531 HydrophobicContact CD1-CG 3.72Å; L527-E531 HydrophobicContact CG-CG 4.28Å; L527-E531 WeakPolarHBondContact O-CB 3.29Å; L527-E531 WeakPolarHBondContact O-CG 3.5Å; L527-E531 PolarHBondContact O-N 2.89Å; E531-K535 WeakPolarHBondContact O-CB 3.38Å; E531-K535 PolarHBondContact O-N 2.84Å
532	A	96.7	Very high	96.1	Very high	53 Å²	53	48.8 Å²	48.8	44%	0.438	26%	0.262	S	S	.	.	H	α-helix	trans	-65.3	-41.2	174.9	0	0	0	0	0	112.2	A528 Y529 K535 A536	A528-A532 PolarHBondContact O-N 3.04Å; Y529-A532 PolarHBondContact O-N 3Å; A532-K535 PolarHBondContact O-N 3.43Å; A532-A536 PolarHBondContact O-N 3.04Å; A532-A536 VanDerWaalsContact O-N 3.13Å
533	F	97	Very high	95.9	Very high	2 Å²	2	53 Å²	53	1%	0.009	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-50.7	175.5	-176.8	-136.8	0	0	0	112.2	E484 Y529 H530 K535 A536 L537 I553 L554 N557 F558 Y622	E484-F533 HydrophobicContact CG-CD1 4.04Å; E484-F533 HydrophobicContact CG-CE1 4.28Å; E484-F533 WeakPolarHBondContact OE1-CD1 3.33Å; Y529-F533 WeakPolarHBondContact O-CB 3.36Å; Y529-F533 PolarHBondContact O-N 3.32Å; H530-F533 PolarHBondContact O-N 2.81Å; F533-K535 VanDerWaalsContact C-N 3.29Å; F533-K535 PolarHBondContact O-N 2.69Å; F533-A536 PolarHBondContact O-N 3.36Å; F533-A536 VanDerWaalsContact O-N 3.15Å; F533-L537 HydrophobicContact CD1-CD1 4.21Å; F533-L537 HydrophobicContact CD2-CD1 4.32Å; F533-L537 HydrophobicContact CD2-CG 4.19Å; F533-L537 HydrophobicContact CE1-CD1 3.81Å; F533-L537 HydrophobicContact CE2-CD1 3.94Å; F533-L537 HydrophobicContact CE2-CD2 4.09Å; F533-L537 HydrophobicContact CE2-CG 3.9Å; F533-L537 HydrophobicContact CG-CD1 4.44Å; F533-L537 HydrophobicContact CZ-CD1 3.66Å; F533-L537 HydrophobicContact CZ-CD2 4.31Å; F533-L537 HydrophobicContact CZ-CG 4.13Å; F533-L537 WeakPolarHBondContact O-CG 3.43Å; F533-L537 PolarHBondContact O-N 3.36Å; F533-I553 HydrophobicContact CD2-CG2 3.88Å; F533-I553 HydrophobicContact CE2-CG2 3.87Å; F533-L554 HydrophobicContact CE2-CD2 4.05Å; F533-L554 HydrophobicContact CE2-CG 4.47Å; F533-L554 HydrophobicContact CZ-CD2 3.59Å; F533-L554 HydrophobicContact CZ-CG 4.41Å; F533-N557 WeakPolarHBondContact CA-ND2 3.47Å; F533-N557 VanDerWaalsContact CB-ND2 3.31Å; F533-N557 WeakPolarHBondContact CB-ND2 3.49Å; F533-F558 HydrophobicContact CD1-CE2 4.44Å; F533-F558 HydrophobicContact CE1-CE2 4.06Å; F533-F558 HydrophobicContact CE1-CZ 4.36Å; F533-F558 HydrophobicContact CE2-CE2 4.41Å; F533-F558 HydrophobicContact CZ-CE2 4.04Å; F533-Y622 AromaticContact CE1-CE1 3.92Å; F533-Y622 HydrophobicContact CE1-CE1 3.92Å; F533-Y622 AromaticContact CE1-CZ 3.91Å
534	L	97.5	Very high	95.7	Very high	9 Å²	9	55.3 Å²	55.3	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-59.9	-38.7	177.7	-179.4	62.6	0	0	0	112.2	V481 E484 N485 V488 H530 L537 K538	V481-L534 HydrophobicContact CG1-CD1 4.34Å; E484-L534 HydrophobicContact CB-CD1 4.04Å; E484-L534 HydrophobicContact CG-CB 4.14Å; E484-L534 HydrophobicContact CG-CD1 4.01Å; N485-L534 HydrophobicContact CB-CD1 4.11Å; N485-L534 HydrophobicContact CB-CD2 4.27Å; V488-L534 HydrophobicContact CB-CD2 3.86Å; V488-L534 HydrophobicContact CG1-CD2 3.99Å; V488-L534 HydrophobicContact CG2-CB 4.13Å; V488-L534 HydrophobicContact CG2-CD2 3.93Å; H530-L534 VanDerWaalsContact O-CB 3.31Å; H530-L534 WeakPolarHBondContact O-CB 3.43Å; H530-L534 PolarHBondContact O-N 2.87Å; L534-L537 PolarHBondContact O-N 3.47Å; L534-K538 HydrophobicContact CD1-CD 4.43Å; L534-K538 HydrophobicContact CD1-CG 4.34Å; L534-K538 HydrophobicContact CG-CD 4.34Å; L534-K538 WeakPolarHBondContact O-CB 3.4Å; L534-K538 WeakPolarHBondContact O-CG 3.35Å; L534-K538 PolarHBondContact O-N 3.15Å
535	K	97.2	Very high	95.5	Very high	153 Å²	153	56.9 Å²	56.9	67%	0.665	30%	0.3	S	S	*	.	H	α-helix	trans	-62.3	-43.8	175.6	-175.2	-179.9	178.4	-176.5	0	111.7	E531 A532 F533 S539	E531-K535 WeakPolarHBondContact O-CB 3.38Å; E531-K535 PolarHBondContact O-N 2.84Å; A532-K535 PolarHBondContact O-N 3.43Å; F533-K535 VanDerWaalsContact C-N 3.29Å; F533-K535 PolarHBondContact O-N 2.69Å; K535-S539 WeakPolarHBondContact O-CB 3.24Å; K535-S539 PolarHBondContact O-N 2.89Å; K535-S539 PolarHBondContact O-OG 3.41Å
536	A	96.4	Very high	94.9	Very high	38 Å²	38	55.9 Å²	55.9	31%	0.314	30%	0.297	S	S	.	.	H	α-helix	trans	-65.8	-42.8	177.2	0	0	0	0	0	111.9	A532 F533 S539 R540 I553	A532-A536 PolarHBondContact O-N 3.04Å; A532-A536 VanDerWaalsContact O-N 3.13Å; F533-A536 PolarHBondContact O-N 3.36Å; F533-A536 VanDerWaalsContact O-N 3.15Å; A536-S539 PolarHBondContact O-N 2.94Å; A536-R540 PolarHBondContact O-N 3.23Å; A536-R540 VanDerWaalsContact O-N 3.12Å; A536-I553 HydrophobicContact CB-CG2 3.66Å
537	L	96.6	Very high	94.7	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-44.8	175	-74.7	179.3	0	0	0	112.8	L480 V481 E484 F533 L534 R540 I541 I550 I553	L480-L537 HydrophobicContact CD2-CD2 4.17Å; L480-L537 HydrophobicContact CG-CD1 4.25Å; V481-L537 HydrophobicContact CG2-CB 4.02Å; E484-L537 HydrophobicContact CB-CD1 4.32Å; E484-L537 HydrophobicContact CG-CD1 4.26Å; F533-L537 HydrophobicContact CD1-CD1 4.21Å; F533-L537 HydrophobicContact CD2-CD1 4.32Å; F533-L537 HydrophobicContact CD2-CG 4.19Å; F533-L537 HydrophobicContact CE1-CD1 3.81Å; F533-L537 HydrophobicContact CE2-CD1 3.94Å; F533-L537 HydrophobicContact CE2-CD2 4.09Å; F533-L537 HydrophobicContact CE2-CG 3.9Å; F533-L537 HydrophobicContact CG-CD1 4.44Å; F533-L537 HydrophobicContact CZ-CD1 3.66Å; F533-L537 HydrophobicContact CZ-CD2 4.31Å; F533-L537 HydrophobicContact CZ-CG 4.13Å; F533-L537 WeakPolarHBondContact O-CG 3.43Å; F533-L537 PolarHBondContact O-N 3.36Å; L534-L537 PolarHBondContact O-N 3.47Å; L537-R540 WeakPolarHBondContact O-CB 3.43Å; L537-R540 PolarHBondContact O-N 2.89Å; L537-I541 PolarHBondContact O-N 2.86Å; L537-I550 HydrophobicContact CD2-CD1 4.3Å; L537-I550 HydrophobicContact CD2-CG2 4.44Å; L537-I553 HydrophobicContact CD2-CD1 4.33Å; L537-I553 HydrophobicContact CD2-CG2 4.3Å
538	K	96.5	Very high	94.5	Very high	80 Å²	80	64.3 Å²	64.3	35%	0.348	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-48.3	176.1	-74.4	-178.3	178.8	-177.4	0	111.9	V481 N485 L534 R540 I541 D542	V481-K538 HydrophobicContact CG1-CG 3.99Å; N485-K538 WeakPolarHBondContact OD1-CE 3.3Å; N485-K538 PolarHBondContact OD1-NZ 2.75Å; L534-K538 HydrophobicContact CD1-CD 4.43Å; L534-K538 HydrophobicContact CD1-CG 4.34Å; L534-K538 HydrophobicContact CG-CD 4.34Å; L534-K538 WeakPolarHBondContact O-CB 3.4Å; L534-K538 WeakPolarHBondContact O-CG 3.35Å; L534-K538 PolarHBondContact O-N 3.15Å; K538-R540 PolarHBondContact O-N 3.3Å; K538-I541 PolarHBondContact O-N 3.49Å; K538-D542 PolarHBondContact O-N 3.11Å
539	S	95.1	Very high	94.4	Very high	70 Å²	70	65.7 Å²	65.7	49%	0.49	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-20.7	177.8	-50.9	0	0	0	0	113.5	K535 A536	K535-S539 WeakPolarHBondContact O-CB 3.24Å; K535-S539 PolarHBondContact O-N 2.89Å; K535-S539 PolarHBondContact O-OG 3.41Å; A536-S539 PolarHBondContact O-N 2.94Å
540	R	94.2	Very high	94.4	Very high	59 Å²	59	62.5 Å²	62.5	22%	0.223	32%	0.316	C	S	.	.	H	α-helix	trans	-81.3	-49.6	171.9	-171.5	58.9	59.4	85.9	-5.5	111	A536 L537 K538 D542 L543 Q548 K549 I550 D552 I553	A536-R540 PolarHBondContact O-N 3.23Å; A536-R540 VanDerWaalsContact O-N 3.12Å; L537-R540 WeakPolarHBondContact O-CB 3.43Å; L537-R540 PolarHBondContact O-N 2.89Å; K538-R540 PolarHBondContact O-N 3.3Å; R540-D542 VanDerWaalsContact C-N 3.31Å; R540-D542 PolarHBondContact O-N 2.88Å; R540-L543 PolarHBondContact O-N 3.2Å; R540-Q548 VanDerWaalsContact CG-OE1 3.23Å; R540-Q548 PolarHBondContact O-NE2 3.28Å; R540-Q548 PolarHBondContact O-OE1 2.97Å; R540-K549 PolarHBondContact NH1-O 2.82Å; R540-I550 HydrophobicContact CG-CD1 3.93Å; R540-D552 IonicContact CZ-OD1 2.7Å; R540-D552 IonicContact CZ-OD2 3.78Å; R540-D552 VanDerWaalsContact CZ-OD2 3.3Å; R540-D552 VanDerWaalsContact NH1-CG 3.28Å; R540-D552 IonicContact NH1-OD1 2.73Å; R540-D552 PolarHBondContact NH1-OD1 2.88Å; R540-D552 IonicContact NH1-OD2 3.44Å; R540-D552 PolarHBondContact NH1-OD2 3.31Å; R540-D552 IonicContact NH2-OD1 3.57Å; R540-D552 IonicContact NH2-OD2 3.5Å; R540-D552 PolarHBondContact NH2-OD2 2.63Å; R540-I553 HydrophobicContact CB-CD1 3.73Å; R540-I553 HydrophobicContact CG-CD1 3.89Å
541	I	93.2	Very high	94.2	Very high	42 Å²	42	62.3 Å²	62.3	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-69.5	-25.1	-176.6	-146.2	171.1	0	0	0	113.8	V477 K478 V481 L537 K538 L543 W544	V477-I541 HydrophobicContact CG1-CD1 4.42Å; K478-I541 HydrophobicContact CG-CD1 3.8Å; V481-I541 HydrophobicContact CG2-CD1 4.06Å; L537-I541 PolarHBondContact O-N 2.86Å; K538-I541 PolarHBondContact O-N 3.49Å; I541-L543 PolarHBondContact O-N 2.87Å; I541-L543 VanDerWaalsContact O-N 3.11Å; I541-W544 HydrophobicContact CG1-CB 4.12Å; I541-W544 HydrophobicContact CG1-CG 4.39Å; I541-W544 WeakPolarHBondContact O-CB 3.48Å; I541-W544 PolarHBondContact O-N 3.21Å; I541-W544 VanDerWaalsContact O-N 3.13Å
542	D	91.3	Very high	94.2	Very high	126 Å²	126	60.9 Å²	60.9	67%	0.674	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.4	172.6	-67.1	-30.8	0	0	0	113	K538 R540	K538-D542 PolarHBondContact O-N 3.11Å; R540-D542 VanDerWaalsContact C-N 3.31Å; R540-D542 PolarHBondContact O-N 2.88Å
543	L	91.4	Very high	94.1	Very high	133 Å²	133	58.9 Å²	58.9	70%	0.696	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	21.1	178.4	-63.6	174.6	0	0	0	112.6	R540 I541 Q548	R540-L543 PolarHBondContact O-N 3.2Å; I541-L543 PolarHBondContact O-N 2.87Å; I541-L543 VanDerWaalsContact O-N 3.11Å; L543-Q548 VanDerWaalsContact C-NE2 3.28Å; L543-Q548 PolarHBondContact O-NE2 3.3Å
544	W	91.9	Very high	94.1	Very high	51 Å²	51	59 Å²	59	19%	0.193	29%	0.293	C	S	.	.			trans	-54.4	133.5	-165.6	-175.4	-108.2	0	0	0	115.2	R473 T474 V477 I541 Q548 I550	R473-W544 HydrophobicContact CG-CZ2 4.42Å; T474-W544 PolarHBondContact OG1-NE1 3.31Å; V477-W544 HydrophobicContact CB-CH2 4.07Å; V477-W544 HydrophobicContact CB-CZ2 4.26Å; V477-W544 HydrophobicContact CG1-CE3 4.28Å; V477-W544 HydrophobicContact CG1-CH2 3.9Å; V477-W544 HydrophobicContact CG1-CZ2 4.4Å; V477-W544 HydrophobicContact CG1-CZ3 3.83Å; V477-W544 HydrophobicContact CG2-CH2 3.76Å; V477-W544 HydrophobicContact CG2-CZ2 4.18Å; V477-W544 HydrophobicContact CG2-CZ3 4.46Å; I541-W544 HydrophobicContact CG1-CB 4.12Å; I541-W544 HydrophobicContact CG1-CG 4.39Å; I541-W544 WeakPolarHBondContact O-CB 3.48Å; I541-W544 PolarHBondContact O-N 3.21Å; I541-W544 VanDerWaalsContact O-N 3.13Å; W544-Q548 HydrophobicContact CE3-CB 3.94Å; W544-Q548 HydrophobicContact CE3-CG 4.49Å; W544-Q548 VanDerWaalsContact CE3-OE1 3.25Å; W544-Q548 HydrophobicContact CH2-CB 4.37Å; W544-Q548 HydrophobicContact CZ3-CB 3.72Å; W544-I550 HydrophobicContact CH2-CG1 4.31Å; W544-I550 HydrophobicContact CZ3-CD1 4.08Å; W544-I550 HydrophobicContact CZ3-CG1 4.07Å
545	D	91.3	Very high	94	Very high	77 Å²	77	59.6 Å²	59.6	41%	0.412	30%	0.296	S	S	.	.			trans	-143.7	164.9	170.5	78.6	55.7	0	0	0	112.1	K547 Q548	D545-K547 PolarHBondContact O-N 3.03Å; D545-K547 VanDerWaalsContact O-N 3.08Å; D545-K547 VanDerWaalsContact OD1-CA 3.26Å; D545-K547 WeakPolarHBondContact OD1-CA 3.44Å; D545-K547 WeakPolarHBondContact OD1-CB 3.42Å; D545-K547 PolarHBondContact OD1-N 3.19Å; D545-Q548 HydrophobicContact CB-CG 4.46Å; D545-Q548 WeakPolarHBondContact O-CB 3.26Å; D545-Q548 PolarHBondContact O-N 3.48Å; D545-Q548 VanDerWaalsContact O-N 3.11Å; D545-Q548 PolarHBondContact OD1-N 3.3Å
546	N	85	Confident	93.8	Very high	63 Å²	63	55 Å²	55	34%	0.337	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-0	-173.8	-65.2	-7.6	0	0	0	114.8	Q470 H637	Q470-N546 HydrophobicContact CG-CB 4.3Å; Q470-N546 PolarHBondContact OE1-ND2 3.41Å; N546-H637 PolarHBondContact O-CD2 2.67Å; N546-H637 PolarHBondContact O-NE2 3.26Å
547	K	90.5	Very high	93.6	Very high	159 Å²	159	54 Å²	54	69%	0.691	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-8.8	172.6	-66.6	-173.5	176.6	-175.4	0	113.3	D545 H637 P638	D545-K547 PolarHBondContact O-N 3.03Å; D545-K547 VanDerWaalsContact O-N 3.08Å; D545-K547 VanDerWaalsContact OD1-CA 3.26Å; D545-K547 WeakPolarHBondContact OD1-CA 3.44Å; D545-K547 WeakPolarHBondContact OD1-CB 3.42Å; D545-K547 PolarHBondContact OD1-N 3.19Å; K547-H637 VanDerWaalsContact C-CE1 3.4Å; K547-H637 WeakPolarHBondContact CA-NE2 3.19Å; K547-H637 PolarHBondContact N-NE2 3.2Å; K547-H637 VanDerWaalsContact N-NE2 3.12Å; K547-H637 PolarHBondContact O-CE1 2.64Å; K547-P638 WeakPolarHBondContact O-CG 3.44Å
548	Q	93.9	Very high	93.5	Very high	28 Å²	28	54.2 Å²	54.2	13%	0.131	28%	0.277	C	S	.	.			trans	-59.1	150.5	178.4	-79.4	-154.8	-8.4	0	0	113.1	R473 R540 L543 W544 D545 H637	R473-Q548 PolarHBondContact NH2-O 3.4Å; R540-Q548 VanDerWaalsContact CG-OE1 3.23Å; R540-Q548 PolarHBondContact O-NE2 3.28Å; R540-Q548 PolarHBondContact O-OE1 2.97Å; L543-Q548 VanDerWaalsContact C-NE2 3.28Å; L543-Q548 PolarHBondContact O-NE2 3.3Å; W544-Q548 HydrophobicContact CE3-CB 3.94Å; W544-Q548 HydrophobicContact CE3-CG 4.49Å; W544-Q548 VanDerWaalsContact CE3-OE1 3.25Å; W544-Q548 HydrophobicContact CH2-CB 4.37Å; W544-Q548 HydrophobicContact CZ3-CB 3.72Å; D545-Q548 HydrophobicContact CB-CG 4.46Å; D545-Q548 WeakPolarHBondContact O-CB 3.26Å; D545-Q548 PolarHBondContact O-N 3.48Å; D545-Q548 VanDerWaalsContact O-N 3.11Å; D545-Q548 PolarHBondContact OD1-N 3.3Å; Q548-H637 PolarHBondContact O-CE1 3.1Å
549	K	94.6	Very high	93.2	Very high	84 Å²	84	54 Å²	54	37%	0.365	28%	0.283	S	S	.	.			trans	-94.7	156.2	180	-60.9	169.1	-179.9	-170.5	0	111.5	R540 D552 P638 D639 L642	R540-K549 PolarHBondContact NH1-O 2.82Å; K549-D552 VanDerWaalsContact CB-OD1 3.27Å; K549-D552 WeakPolarHBondContact CB-OD1 3.34Å; K549-P638 VanDerWaalsContact CE-O 3.22Å; K549-P638 WeakPolarHBondContact CE-O 3.36Å; K549-D639 VanDerWaalsContact CA-CG 3.49Å; K549-D639 WeakPolarHBondContact CA-OD1 3.32Å; K549-D639 HydrophobicContact CB-CB 4.3Å; K549-D639 WeakPolarHBondContact CB-OD1 3.28Å; K549-D639 HydrophobicContact CG-CB 4.11Å; K549-L642 HydrophobicContact CB-CD1 4.46Å; K549-L642 HydrophobicContact CD-CD1 3.73Å; K549-L642 HydrophobicContact CG-CD1 4.22Å
550	I	95.9	Very high	93.1	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.01	28%	0.279	C	S	.	.	S	Bend	trans	-135.9	-27	169.8	-66.1	-67.2	0	0	0	110.8	V477 L480 L537 R540 W544 D552 I553 L554 D639	V477-I550 HydrophobicContact CG1-CD1 3.83Å; V477-I550 HydrophobicContact CG1-CG1 4.02Å; V477-I550 HydrophobicContact CG2-CG1 4.01Å; L480-I550 HydrophobicContact CD2-CG2 3.85Å; L537-I550 HydrophobicContact CD2-CD1 4.3Å; L537-I550 HydrophobicContact CD2-CG2 4.44Å; R540-I550 HydrophobicContact CG-CD1 3.93Å; W544-I550 HydrophobicContact CH2-CG1 4.31Å; W544-I550 HydrophobicContact CZ3-CD1 4.08Å; W544-I550 HydrophobicContact CZ3-CG1 4.07Å; I550-D552 PolarHBondContact N-OD1 3Å; I550-D552 PolarHBondContact O-N 2.89Å; I550-I553 PolarHBondContact O-N 2.9Å; I550-I553 VanDerWaalsContact O-N 3.15Å; I550-L554 HydrophobicContact CG2-CD1 3.91Å; I550-L554 HydrophobicContact CG2-CG 4.38Å; I550-L554 PolarHBondContact O-N 2.83Å; I550-L554 VanDerWaalsContact O-N 3.17Å; I550-D639 VanDerWaalsContact N-CG 3.3Å; I550-D639 PolarHBondContact N-OD1 2.94Å; I550-D639 PolarHBondContact N-OD2 3.38Å; I550-D639 VanDerWaalsContact N-OD2 3.17Å
551	G	95.4	Very high	92.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-28.1	177.6	0	0	0	0	0	113.6	L555 D639	G551-L555 WeakPolarHBondContact O-CB 3.34Å; G551-L555 WeakPolarHBondContact O-CD1 3.31Å; G551-L555 WeakPolarHBondContact O-CG 3.37Å; G551-L555 PolarHBondContact O-N 2.84Å; G551-D639 PolarHBondContact N-OD1 2.92Å
552	D	95.8	Very high	92.7	Very high	48 Å²	48	58.3 Å²	58.3	26%	0.257	30%	0.301	S	S	.	.	H	α-helix	trans	-63.8	-43.4	173.2	62.5	-43	0	0	0	112.4	R540 K549 I550 A556 L642	R540-D552 IonicContact CZ-OD1 2.7Å; R540-D552 IonicContact CZ-OD2 3.78Å; R540-D552 VanDerWaalsContact CZ-OD2 3.3Å; R540-D552 VanDerWaalsContact NH1-CG 3.28Å; R540-D552 IonicContact NH1-OD1 2.73Å; R540-D552 PolarHBondContact NH1-OD1 2.88Å; R540-D552 IonicContact NH1-OD2 3.44Å; R540-D552 PolarHBondContact NH1-OD2 3.31Å; R540-D552 IonicContact NH2-OD1 3.57Å; R540-D552 IonicContact NH2-OD2 3.5Å; R540-D552 PolarHBondContact NH2-OD2 2.63Å; K549-D552 VanDerWaalsContact CB-OD1 3.27Å; K549-D552 WeakPolarHBondContact CB-OD1 3.34Å; I550-D552 PolarHBondContact N-OD1 3Å; I550-D552 PolarHBondContact O-N 2.89Å; D552-A556 VanDerWaalsContact O-CB 3.22Å; D552-A556 WeakPolarHBondContact O-CB 3.34Å; D552-A556 PolarHBondContact O-N 2.89Å; D552-L642 HydrophobicContact CB-CD1 4.23Å
553	I	96.4	Very high	92.7	Very high	11 Å²	11	52.4 Å²	52.4	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-69.6	-40.5	179.4	-53.8	176.9	0	0	0	110.7	F533 A536 L537 R540 I550 A556 N557	F533-I553 HydrophobicContact CD2-CG2 3.88Å; F533-I553 HydrophobicContact CE2-CG2 3.87Å; A536-I553 HydrophobicContact CB-CG2 3.66Å; L537-I553 HydrophobicContact CD2-CD1 4.33Å; L537-I553 HydrophobicContact CD2-CG2 4.3Å; R540-I553 HydrophobicContact CB-CD1 3.73Å; R540-I553 HydrophobicContact CG-CD1 3.89Å; I550-I553 PolarHBondContact O-N 2.9Å; I550-I553 VanDerWaalsContact O-N 3.15Å; I553-A556 PolarHBondContact O-N 3.32Å; I553-N557 PolarHBondContact O-N 2.97Å
554	L	95.4	Very high	92.6	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-50.3	176.6	-74.3	161.4	0	0	0	111.4	F533 I550 A556 N557 F558 L626 L643 A646 L650	F533-L554 HydrophobicContact CE2-CD2 4.05Å; F533-L554 HydrophobicContact CE2-CG 4.47Å; F533-L554 HydrophobicContact CZ-CD2 3.59Å; F533-L554 HydrophobicContact CZ-CG 4.41Å; I550-L554 HydrophobicContact CG2-CD1 3.91Å; I550-L554 HydrophobicContact CG2-CG 4.38Å; I550-L554 PolarHBondContact O-N 2.83Å; I550-L554 VanDerWaalsContact O-N 3.17Å; L554-A556 PolarHBondContact O-N 3.16Å; L554-N557 PolarHBondContact O-N 3.02Å; L554-F558 HydrophobicContact CD2-CD2 4.24Å; L554-F558 HydrophobicContact CD2-CE2 4.1Å; L554-F558 WeakPolarHBondContact O-CD2 3.46Å; L554-F558 PolarHBondContact O-N 3.46Å; L554-L626 HydrophobicContact CD1-CD1 4.12Å; L554-L626 HydrophobicContact CD1-CD2 3.87Å; L554-L626 HydrophobicContact CD1-CG 4.16Å; L554-L643 HydrophobicContact CD1-CD2 4.49Å; L554-A646 HydrophobicContact CB-CB 3.88Å; L554-A646 HydrophobicContact CD1-CB 4.24Å; L554-L650 HydrophobicContact CD2-CD1 4.19Å
555	L	95.2	Very high	92.4	Very high	22 Å²	22	48.8 Å²	48.8	12%	0.115	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-48.5	176.5	-72.6	166.6	0	0	0	111.1	G551 N557 F558 T559 L642 R645 A646 V649	G551-L555 WeakPolarHBondContact O-CB 3.34Å; G551-L555 WeakPolarHBondContact O-CD1 3.31Å; G551-L555 WeakPolarHBondContact O-CG 3.37Å; G551-L555 PolarHBondContact O-N 2.84Å; L555-N557 PolarHBondContact O-N 2.88Å; L555-F558 PolarHBondContact O-N 3.34Å; L555-T559 HydrophobicContact CD2-CG2 3.96Å; L555-T559 PolarHBondContact O-N 3.03Å; L555-T559 VanDerWaalsContact O-N 3.15Å; L555-T559 PolarHBondContact O-OG1 2.85Å; L555-L642 HydrophobicContact CD1-CD2 4.19Å; L555-R645 HydrophobicContact CD1-CB 4.25Å; L555-R645 HydrophobicContact CD1-CG 4.35Å; L555-R645 HydrophobicContact CD2-CB 4.32Å; L555-R645 HydrophobicContact CD2-CG 3.96Å; L555-A646 HydrophobicContact CD2-CB 4.37Å; L555-A646 HydrophobicContact CG-CB 4.15Å; L555-V649 HydrophobicContact CD2-CG2 4Å
556	A	94	Very high	92.4	Very high	56 Å²	56	45.5 Å²	45.5	46%	0.463	24%	0.238	S	C	.	.	H	α-helix	trans	-61.6	-8.3	-177.2	0	0	0	0	0	115.2	D552 I553 L554 K560	D552-A556 VanDerWaalsContact O-CB 3.22Å; D552-A556 WeakPolarHBondContact O-CB 3.34Å; D552-A556 PolarHBondContact O-N 2.89Å; I553-A556 PolarHBondContact O-N 3.32Å; L554-A556 PolarHBondContact O-N 3.16Å; A556-K560 WeakPolarHBondContact O-CE 3.26Å; A556-K560 PolarHBondContact O-NZ 2.98Å
557	N	92.7	Very high	92.7	Very high	18 Å²	18	42.6 Å²	42.6	10%	0.096	22%	0.222	C	C	.	.	H	α-helix	trans	-114.5	-46.5	169	-81.4	-22.6	0	0	0	113.7	F533 I553 L554 L555 T559 K560	F533-N557 WeakPolarHBondContact CA-ND2 3.47Å; F533-N557 VanDerWaalsContact CB-ND2 3.31Å; F533-N557 WeakPolarHBondContact CB-ND2 3.49Å; I553-N557 PolarHBondContact O-N 2.97Å; L554-N557 PolarHBondContact O-N 3.02Å; L555-N557 PolarHBondContact O-N 2.88Å; N557-T559 PolarHBondContact O-N 2.82Å; N557-K560 WeakPolarHBondContact O-CB 3.28Å; N557-K560 PolarHBondContact O-N 3.25Å; N557-K560 PolarHBondContact OD1-NZ 3.5Å
558	F	93	Very high	92.6	Very high	4 Å²	4	36 Å²	36	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-81.9	-7.8	-171.4	-65.8	-71.3	0	0	0	114.9	H530 F533 L554 L555 V563 Y567 I619 Y622 V649 L650 L653	H530-F558 AromaticContact CE1-CZ 4Å; F533-F558 HydrophobicContact CD1-CE2 4.44Å; F533-F558 HydrophobicContact CE1-CE2 4.06Å; F533-F558 HydrophobicContact CE1-CZ 4.36Å; F533-F558 HydrophobicContact CE2-CE2 4.41Å; F533-F558 HydrophobicContact CZ-CE2 4.04Å; L554-F558 HydrophobicContact CD2-CD2 4.24Å; L554-F558 HydrophobicContact CD2-CE2 4.1Å; L554-F558 WeakPolarHBondContact O-CD2 3.46Å; L554-F558 PolarHBondContact O-N 3.46Å; L555-F558 PolarHBondContact O-N 3.34Å; F558-V563 HydrophobicContact CD1-CG1 4.45Å; F558-Y567 HydrophobicContact CE1-CE2 4.3Å; F558-I619 HydrophobicContact CD1-CD1 4.29Å; F558-I619 HydrophobicContact CE1-CD1 3.87Å; F558-Y622 HydrophobicContact CE1-CE2 4.1Å; F558-Y622 HydrophobicContact CE2-CD2 4.38Å; F558-Y622 HydrophobicContact CE2-CE2 4.07Å; F558-Y622 HydrophobicContact CZ-CD2 4.06Å; F558-Y622 AromaticContact CZ-CE2 3.44Å; F558-Y622 HydrophobicContact CZ-CE2 3.44Å; F558-Y622 VanDerWaalsContact CZ-CE2 3.44Å; F558-Y622 AromaticContact CZ-CZ 3.97Å; F558-V649 HydrophobicContact CB-CG1 4.3Å; F558-L650 HydrophobicContact CB-CD2 4.21Å; F558-L650 HydrophobicContact CB-CG 4.4Å; F558-L650 HydrophobicContact CD1-CD2 3.99Å; F558-L650 HydrophobicContact CD2-CD1 4.34Å; F558-L650 HydrophobicContact CD2-CD2 4.06Å; F558-L650 HydrophobicContact CD2-CG 4.47Å; F558-L650 HydrophobicContact CE1-CD2 4.42Å; F558-L650 HydrophobicContact CE2-CD2 4.49Å; F558-L650 HydrophobicContact CG-CD2 3.81Å; F558-L650 HydrophobicContact CG-CG 4.37Å; F558-L653 HydrophobicContact CD1-CD2 4.32Å
559	T	92	Very high	92.3	Very high	77 Å²	77	35.9 Å²	35.9	47%	0.472	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.1	167.1	65.7	0	0	0	0	113.9	L555 N557 Q561 V649	L555-T559 HydrophobicContact CD2-CG2 3.96Å; L555-T559 PolarHBondContact O-N 3.03Å; L555-T559 VanDerWaalsContact O-N 3.15Å; L555-T559 PolarHBondContact O-OG1 2.85Å; N557-T559 PolarHBondContact O-N 2.82Å; T559-Q561 PolarHBondContact O-N 3.38Å; T559-V649 HydrophobicContact CG2-CG1 3.92Å; T559-V649 HydrophobicContact CG2-CG2 3.89Å
560	K	91.8	Very high	92.2	Very high	93 Å²	93	32.1 Å²	32.1	40%	0.404	18%	0.181	S	C	.	.			trans	-74.7	119.4	179.5	-71.2	172.3	175.8	146.9	0	110.1	A556 N557 C562 V563 I564	A556-K560 WeakPolarHBondContact O-CE 3.26Å; A556-K560 PolarHBondContact O-NZ 2.98Å; N557-K560 WeakPolarHBondContact O-CB 3.28Å; N557-K560 PolarHBondContact O-N 3.25Å; N557-K560 PolarHBondContact OD1-NZ 3.5Å; K560-C562 VanDerWaalsContact C-N 3.29Å; K560-C562 PolarHBondContact O-N 3.07Å; K560-V563 HydrophobicContact CB-CB 4.3Å; K560-V563 HydrophobicContact CB-CG2 3.82Å; K560-V563 HydrophobicContact CD-CG2 4.3Å; K560-V563 WeakPolarHBondContact O-CB 3.23Å; K560-V563 PolarHBondContact O-N 3.21Å; K560-I564 PolarHBondContact O-N 3.04Å
561	Q	87.8	Confident	91.7	Very high	106 Å²	106	32.2 Å²	32.2	50%	0.495	18%	0.182	S	C	.	.	H	α-helix	trans	-54.2	-43.4	-177.5	-169.1	54.4	47.4	0	0	112.6	T559 V563 I564 D565	T559-Q561 PolarHBondContact O-N 3.38Å; Q561-V563 VanDerWaalsContact C-N 3.27Å; Q561-V563 PolarHBondContact O-N 3.11Å; Q561-I564 WeakPolarHBondContact O-CA 3.42Å; Q561-I564 WeakPolarHBondContact O-CB 3.19Å; Q561-I564 PolarHBondContact O-N 3.32Å; Q561-D565 WeakPolarHBondContact CG-OD2 3.16Å; Q561-D565 PolarHBondContact NE2-OD1 3.16Å; Q561-D565 PolarHBondContact O-N 3.32Å; Q561-D565 VanDerWaalsContact O-OD2 3.11Å
562	C	91.6	Very high	91.1	Very high	61 Å²	61	35.5 Å²	35.5	41%	0.412	20%	0.199	S	C	.	.	H	α-helix	trans	-58.7	-31.2	175.9	54.4	0	0	0	0	114.6	K560 T566	K560-C562 VanDerWaalsContact C-N 3.29Å; K560-C562 PolarHBondContact O-N 3.07Å; C562-T566 WeakPolarHBondContact O-CB 3.38Å; C562-T566 PolarHBondContact O-N 3.47Å; C562-T566 VanDerWaalsContact O-N 3.09Å; C562-T566 PolarHBondContact O-OG1 3.27Å
563	V	91.2	Very high	90.7	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-72.9	-41.6	175.1	179.1	0	0	0	0	110.1	Y529 F558 K560 Q561 Y567	Y529-V563 HydrophobicContact CD1-CG2 3.75Å; Y529-V563 HydrophobicContact CD2-CG2 4.1Å; Y529-V563 HydrophobicContact CE1-CG2 3.92Å; Y529-V563 HydrophobicContact CE2-CG2 4.27Å; Y529-V563 HydrophobicContact CG-CG2 3.84Å; F558-V563 HydrophobicContact CD1-CG1 4.45Å; K560-V563 HydrophobicContact CB-CB 4.3Å; K560-V563 HydrophobicContact CB-CG2 3.82Å; K560-V563 HydrophobicContact CD-CG2 4.3Å; K560-V563 WeakPolarHBondContact O-CB 3.23Å; K560-V563 PolarHBondContact O-N 3.21Å; Q561-V563 VanDerWaalsContact C-N 3.27Å; Q561-V563 PolarHBondContact O-N 3.11Å; V563-Y567 HydrophobicContact CG1-CD2 4.23Å; V563-Y567 PolarHBondContact O-N 3.33Å; V563-Y567 VanDerWaalsContact O-N 3.07Å
564	I	88.6	Confident	90.3	Very high	27 Å²	27	35 Å²	35	14%	0.138	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-51.8	174.9	-62	171	0	0	0	109.7	K560 Q561 T566 Y567 M568 L653	K560-I564 PolarHBondContact O-N 3.04Å; Q561-I564 WeakPolarHBondContact O-CA 3.42Å; Q561-I564 WeakPolarHBondContact O-CB 3.19Å; Q561-I564 PolarHBondContact O-N 3.32Å; I564-T566 VanDerWaalsContact C-N 3.33Å; I564-T566 PolarHBondContact O-N 3.48Å; I564-Y567 WeakPolarHBondContact O-CB 3.5Å; I564-Y567 PolarHBondContact O-N 2.85Å; I564-Y567 VanDerWaalsContact O-N 3.12Å; I564-M568 HydrophobicContact CG2-CG 4.3Å; I564-M568 WeakPolarHBondContact O-CG 3.01Å; I564-M568 PolarHBondContact O-N 3.49Å; I564-L653 HydrophobicContact CG1-CD1 4.37Å; I564-L653 HydrophobicContact CG2-CD1 4.05Å
565	D	88.5	Confident	89.7	Confident	81 Å²	81	37.3 Å²	37.3	43%	0.433	21%	0.205	S	C	.	.	H	α-helix	trans	-61.3	-41.4	-177.9	-59.1	-31.5	0	0	0	111.9	Q561 Y567 M568 A569	Q561-D565 WeakPolarHBondContact CG-OD2 3.16Å; Q561-D565 PolarHBondContact NE2-OD1 3.16Å; Q561-D565 PolarHBondContact O-N 3.32Å; Q561-D565 VanDerWaalsContact O-OD2 3.11Å; D565-Y567 PolarHBondContact O-N 3.26Å; D565-M568 PolarHBondContact O-N 2.88Å; D565-A569 WeakPolarHBondContact O-CB 3.46Å; D565-A569 PolarHBondContact O-N 3.19Å
566	T	92.1	Very high	89.2	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.055	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-45.1	174.4	-58.5	0	0	0	0	111.3	Q522 E525 M526 Y529 C562 I564 F570	Q522-T566 HydrophobicContact CB-CG2 4Å; Q522-T566 HydrophobicContact CG-CG2 4.49Å; E525-T566 HydrophobicContact CB-CG2 3.86Å; M526-T566 HydrophobicContact CG-CG2 3.76Å; Y529-T566 HydrophobicContact CD2-CG2 4.45Å; Y529-T566 HydrophobicContact CE2-CG2 3.98Å; Y529-T566 WeakPolarHBondContact CE2-OG1 3.49Å; C562-T566 WeakPolarHBondContact O-CB 3.38Å; C562-T566 PolarHBondContact O-N 3.47Å; C562-T566 VanDerWaalsContact O-N 3.09Å; C562-T566 PolarHBondContact O-OG1 3.27Å; I564-T566 VanDerWaalsContact C-N 3.33Å; I564-T566 PolarHBondContact O-N 3.48Å; T566-F570 WeakPolarHBondContact O-CB 3.33Å; T566-F570 PolarHBondContact O-N 2.75Å
567	Y	90.9	Very high	89.1	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-46.7	176.7	-105.8	-78	0	0	0	112.2	M526 H530 F558 V563 I564 D565 F570 I571 I619	M526-Y567 HydrophobicContact CE-CD1 4.06Å; M526-Y567 HydrophobicContact CE-CD2 4.04Å; M526-Y567 HydrophobicContact CE-CE1 3.52Å; M526-Y567 HydrophobicContact CE-CE2 3.51Å; M526-Y567 HydrophobicContact CE-CG 4.31Å; H530-Y567 AromaticContact NE2-CE2 3.64Å; H530-Y567 AromaticContact NE2-CZ 3.84Å; H530-Y567 PolarHBondContact NE2-OH 3.02Å; F558-Y567 HydrophobicContact CE1-CE2 4.3Å; V563-Y567 HydrophobicContact CG1-CD2 4.23Å; V563-Y567 PolarHBondContact O-N 3.33Å; V563-Y567 VanDerWaalsContact O-N 3.07Å; I564-Y567 WeakPolarHBondContact O-CB 3.5Å; I564-Y567 PolarHBondContact O-N 2.85Å; I564-Y567 VanDerWaalsContact O-N 3.12Å; D565-Y567 PolarHBondContact O-N 3.26Å; Y567-F570 PolarHBondContact O-N 3.48Å; Y567-I571 HydrophobicContact CD1-CD1 4.12Å; Y567-I571 WeakPolarHBondContact O-CB 3.49Å; Y567-I571 WeakPolarHBondContact O-CD1 3.42Å; Y567-I571 VanDerWaalsContact O-CG1 3.23Å; Y567-I571 WeakPolarHBondContact O-CG1 3.49Å; Y567-I571 PolarHBondContact O-N 2.89Å; Y567-I619 HydrophobicContact CD1-CG1 4.09Å; Y567-I619 HydrophobicContact CE1-CD1 3.9Å; Y567-I619 HydrophobicContact CE1-CG1 3.47Å; Y567-I619 VanDerWaalsContact CE1-CG1 3.47Å; Y567-I619 HydrophobicContact CE2-CD1 3.91Å; Y567-I619 HydrophobicContact CE2-CG1 4.4Å; Y567-I619 VanDerWaalsContact CZ-CD1 3.49Å; Y567-I619 WeakPolarHBondContact OH-CD1 3.34Å
568	M	87.1	Confident	88.8	Confident	20 Å²	20	39.7 Å²	39.7	10%	0.099	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-43.6	179	-60.8	-59	-68.8	0	0	111.2	I564 D565 I571 N572 K656 I657 T660	I564-M568 HydrophobicContact CG2-CG 4.3Å; I564-M568 WeakPolarHBondContact O-CG 3.01Å; I564-M568 PolarHBondContact O-N 3.49Å; D565-M568 PolarHBondContact O-N 2.88Å; M568-I571 PolarHBondContact O-N 2.94Å; M568-N572 WeakPolarHBondContact O-CB 3.47Å; M568-N572 VanDerWaalsContact O-CG 3.26Å; M568-N572 PolarHBondContact O-N 3.11Å; M568-K656 HydrophobicContact CE-CB 4.39Å; M568-K656 HydrophobicContact CE-CD 4.2Å; M568-K656 HydrophobicContact CE-CG 3.8Å; M568-K656 HydrophobicContact SD-CB 4.36Å; M568-K656 HydrophobicContact SD-CD 4.23Å; M568-K656 HydrophobicContact SD-CG 4.18Å; M568-I657 HydrophobicContact SD-CG1 4.09Å; M568-T660 HydrophobicContact CE-CG2 3.98Å; M568-T660 VanDerWaalsContact CE-OG1 3.25Å; M568-T660 WeakPolarHBondContact CE-OG1 3.39Å
569	A	88.6	Confident	88.5	Confident	25 Å²	25	44.5 Å²	44.5	21%	0.207	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-39.9	177.5	0	0	0	0	0	112.7	F521 Q522 D565 N573	F521-A569 HydrophobicContact CE1-CB 4.02Å; Q522-A569 HydrophobicContact CG-CB 3.91Å; D565-A569 WeakPolarHBondContact O-CB 3.46Å; D565-A569 PolarHBondContact O-N 3.19Å; A569-N573 PolarHBondContact O-N 3.38Å
570	F	91.7	Very high	88.5	Confident	5 Å²	5	41 Å²	41	2%	0.022	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-48.4	171.1	178.7	-95.3	0	0	0	111.5	F521 Q522 V523 M526 T566 Y567 N573 W574 L612 P615 V616	F521-F570 WeakPolarHBondContact O-CD2 3.25Å; Q522-F570 HydrophobicContact CB-CB 4.13Å; V523-F570 HydrophobicContact CG2-CD2 4.05Å; V523-F570 HydrophobicContact CG2-CE2 3.59Å; M526-F570 HydrophobicContact SD-CB 4.26Å; M526-F570 HydrophobicContact SD-CD1 4.39Å; M526-F570 HydrophobicContact SD-CD2 4.47Å; M526-F570 HydrophobicContact SD-CG 4.09Å; T566-F570 WeakPolarHBondContact O-CB 3.33Å; T566-F570 PolarHBondContact O-N 2.75Å; Y567-F570 PolarHBondContact O-N 3.48Å; F570-N573 PolarHBondContact O-N 2.74Å; F570-W574 HydrophobicContact CE1-CB 4.2Å; F570-W574 AromaticContact CE1-CD1 3.96Å; F570-W574 HydrophobicContact CE1-CG 4.35Å; F570-W574 AromaticContact CZ-CD1 3.91Å; F570-W574 WeakPolarHBondContact O-CB 3.39Å; F570-W574 PolarHBondContact O-N 3.46Å; F570-L612 HydrophobicContact CE2-CD2 4.48Å; F570-L612 WeakPolarHBondContact CZ-O 3.29Å; F570-P615 HydrophobicContact CD1-CB 3.95Å; F570-P615 HydrophobicContact CD1-CG 4.35Å; F570-P615 HydrophobicContact CE1-CB 3.66Å; F570-P615 HydrophobicContact CE1-CG 3.72Å; F570-P615 HydrophobicContact CZ-CB 4.3Å; F570-P615 HydrophobicContact CZ-CG 3.84Å; F570-V616 HydrophobicContact CE1-CG2 4.28Å
571	I	86.6	Confident	88.5	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-68.8	-38.7	-172.7	-72.5	168.1	0	0	0	112	Y567 M568 N573 W574 V616 I657 Q661	Y567-I571 HydrophobicContact CD1-CD1 4.12Å; Y567-I571 WeakPolarHBondContact O-CB 3.49Å; Y567-I571 WeakPolarHBondContact O-CD1 3.42Å; Y567-I571 VanDerWaalsContact O-CG1 3.23Å; Y567-I571 WeakPolarHBondContact O-CG1 3.49Å; Y567-I571 PolarHBondContact O-N 2.89Å; M568-I571 PolarHBondContact O-N 2.94Å; I571-N573 VanDerWaalsContact C-N 3.3Å; I571-N573 PolarHBondContact O-N 3.46Å; I571-W574 PolarHBondContact O-N 2.91Å; I571-V616 HydrophobicContact CG1-CG2 4.33Å; I571-I657 HydrophobicContact CD1-CB 4.28Å; I571-I657 HydrophobicContact CD1-CD1 3.56Å; I571-I657 HydrophobicContact CD1-CG1 3.55Å; I571-I657 HydrophobicContact CD1-CG2 3.81Å; I571-I657 HydrophobicContact CG2-CG2 4.47Å; I571-Q661 HydrophobicContact CG2-CG 3.77Å
572	N	82.3	Confident	88.7	Confident	68 Å²	68	38.5 Å²	38.5	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-58	-43.3	172.6	-73.7	-10.3	0	0	0	111.8	M568 T660	M568-N572 WeakPolarHBondContact O-CB 3.47Å; M568-N572 VanDerWaalsContact O-CG 3.26Å; M568-N572 PolarHBondContact O-N 3.11Å; N572-T660 WeakPolarHBondContact OD1-CG2 3.4Å
573	N	87.7	Confident	88.6	Confident	26 Å²	26	43.1 Å²	43.1	14%	0.139	21%	0.206	C	C	.	.	H	α-helix	trans	-83.8	-19.8	-177.7	-177.4	70	0	0	0	114	E518 F521 A569 F570 I571 K575 N576 A577	E518-N573 PolarHBondContact O-ND2 3Å; F521-N573 WeakPolarHBondContact CB-ND2 3.33Å; F521-N573 HydrophobicContact CD1-CB 3.77Å; F521-N573 HydrophobicContact CE1-CB 4.43Å; A569-N573 PolarHBondContact O-N 3.38Å; F570-N573 PolarHBondContact O-N 2.74Å; I571-N573 VanDerWaalsContact C-N 3.3Å; I571-N573 PolarHBondContact O-N 3.46Å; N573-K575 VanDerWaalsContact C-N 3.27Å; N573-K575 PolarHBondContact O-N 3Å; N573-K575 VanDerWaalsContact O-N 3.15Å; N573-N576 WeakPolarHBondContact O-CA 3.27Å; N573-N576 WeakPolarHBondContact O-CB 3.48Å; N573-N576 PolarHBondContact O-N 3.44Å; N573-A577 PolarHBondContact O-N 3.19Å
574	W	87.9	Confident	88.6	Confident	24 Å²	24	43.6 Å²	43.6	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-55	-38.1	-174.4	173.8	81.6	0	0	0	113.8	L378 F570 I571 N576 R578 L612 I613 V616	L378-W574 HydrophobicContact CD1-CH2 4.4Å; F570-W574 HydrophobicContact CE1-CB 4.2Å; F570-W574 AromaticContact CE1-CD1 3.96Å; F570-W574 HydrophobicContact CE1-CG 4.35Å; F570-W574 AromaticContact CZ-CD1 3.91Å; F570-W574 WeakPolarHBondContact O-CB 3.39Å; F570-W574 PolarHBondContact O-N 3.46Å; I571-W574 PolarHBondContact O-N 2.91Å; W574-N576 VanDerWaalsContact C-N 3.34Å; W574-N576 PolarHBondContact O-N 2.91Å; W574-R578 PolarHBondContact O-N 2.98Å; W574-R578 VanDerWaalsContact O-N 3.16Å; W574-L612 PolarHBondContact NE1-O 2.98Å; W574-I613 HydrophobicContact CH2-CD1 3.9Å; W574-I613 HydrophobicContact CZ2-CB 4.11Å; W574-I613 HydrophobicContact CZ2-CD1 3.53Å; W574-I613 HydrophobicContact CZ2-CG1 4.24Å; W574-V616 HydrophobicContact CG-CG2 4.43Å
575	K	82.3	Confident	88.7	Confident	53 Å²	53	43.8 Å²	43.8	23%	0.23	21%	0.214	C	C	.	.	H	α-helix	trans	-59.2	-45.1	173.6	-67.8	173.2	177.3	172.6	0	111.5	N573 R578 L579 Q661 T664 G665 D668	N573-K575 VanDerWaalsContact C-N 3.27Å; N573-K575 PolarHBondContact O-N 3Å; N573-K575 VanDerWaalsContact O-N 3.15Å; K575-R578 PolarHBondContact O-N 2.89Å; K575-L579 PolarHBondContact O-N 2.85Å; K575-Q661 PolarHBondContact NZ-O 3.16Å; K575-T664 PolarHBondContact NZ-OG1 3.48Å; K575-G665 VanDerWaalsContact NZ-N 3.1Å; K575-D668 IonicContact NZ-OD2 3.68Å; K575-D668 PolarHBondContact NZ-OD2 3.2Å
576	N	85.8	Confident	88.8	Confident	69 Å²	69	44.5 Å²	44.5	37%	0.369	23%	0.225	S	C	.	.	H	α-helix	trans	-70.2	-46	-178.7	-62.1	-18.8	0	0	0	111.2	N573 W574 R578 L579 A580	N573-N576 WeakPolarHBondContact O-CA 3.27Å; N573-N576 WeakPolarHBondContact O-CB 3.48Å; N573-N576 PolarHBondContact O-N 3.44Å; W574-N576 VanDerWaalsContact C-N 3.34Å; W574-N576 PolarHBondContact O-N 2.91Å; N576-R578 PolarHBondContact O-N 2.96Å; N576-R578 VanDerWaalsContact O-N 3.13Å; N576-L579 CarbonylContact O-C 3.46Å; N576-L579 WeakPolarHBondContact O-CA 3.45Å; N576-L579 WeakPolarHBondContact O-CB 3.06Å; N576-L579 PolarHBondContact O-N 2.78Å; N576-A580 WeakPolarHBondContact O-CB 3.29Å; N576-A580 PolarHBondContact O-N 2.78Å
577	A	90.6	Very high	88.7	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.033	25%	0.252	C	S	.	.	H	α-helix	trans	-50.5	-40	171.9	0	0	0	0	0	112.2	N573 A580 I581	N573-A577 PolarHBondContact O-N 3.19Å; A577-A580 PolarHBondContact O-N 3.02Å; A577-I581 VanDerWaalsContact O-CG1 3.32Å; A577-I581 WeakPolarHBondContact O-CG1 3.24Å; A577-I581 PolarHBondContact O-N 2.81Å
578	R	87.6	Confident	88.7	Confident	72 Å²	72	51.5 Å²	51.5	27%	0.272	27%	0.269	S	S	.	.	H	α-helix	trans	-71.3	-28.7	177.2	-147.4	177	68.8	157.1	-1.7	113.9	W574 K575 N576 R582 D609	W574-R578 PolarHBondContact O-N 2.98Å; W574-R578 VanDerWaalsContact O-N 3.16Å; K575-R578 PolarHBondContact O-N 2.89Å; N576-R578 PolarHBondContact O-N 2.96Å; N576-R578 VanDerWaalsContact O-N 3.13Å; R578-R582 WeakPolarHBondContact O-CG 3.2Å; R578-D609 WeakPolarHBondContact CG-OD1 3.24Å
579	L	86.5	Confident	89	Confident	105 Å²	105	54.9 Å²	54.9	55%	0.55	29%	0.292	S	S	.	.	H	α-helix	trans	-76.5	-40.8	170.8	-66.9	172.4	0	0	0	111.4	K575 N576 R582 K583	K575-L579 PolarHBondContact O-N 2.85Å; N576-L579 CarbonylContact O-C 3.46Å; N576-L579 WeakPolarHBondContact O-CA 3.45Å; N576-L579 WeakPolarHBondContact O-CB 3.06Å; N576-L579 PolarHBondContact O-N 2.78Å; L579-R582 PolarHBondContact O-N 2.69Å; L579-K583 WeakPolarHBondContact O-CB 3.38Å; L579-K583 PolarHBondContact O-N 2.98Å
580	A	90.9	Very high	89.1	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.033	30%	0.304	C	S	.	.	H	α-helix	trans	-59.1	-44.8	176.2	0	0	0	0	0	112.1	T515 E518 I519 N576 A577 R582 K583 A584	T515-A580 HydrophobicContact CG2-CB 3.92Å; E518-A580 HydrophobicContact CG-CB 4.24Å; I519-A580 HydrophobicContact CD1-CB 4.18Å; I519-A580 HydrophobicContact CG1-CB 3.71Å; N576-A580 WeakPolarHBondContact O-CB 3.29Å; N576-A580 PolarHBondContact O-N 2.78Å; A577-A580 PolarHBondContact O-N 3.02Å; A580-R582 PolarHBondContact O-N 3.43Å; A580-K583 PolarHBondContact O-N 3.06Å; A580-A584 VanDerWaalsContact O-CB 3.25Å; A580-A584 WeakPolarHBondContact O-CB 3.09Å; A580-A584 PolarHBondContact O-N 3.48Å
581	I	92.3	Very high	89.2	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.036	30%	0.303	C	S	.	.	H	α-helix	trans	-55.5	-51	172.5	-71.3	165.1	0	0	0	110.8	I519 A577 K583 A584 C585 L595 L608 L612	I519-I581 HydrophobicContact CD1-CG1 3.81Å; I519-I581 HydrophobicContact CG1-CG1 3.95Å; I519-I581 HydrophobicContact CG2-CD1 4.01Å; I519-I581 HydrophobicContact CG2-CG1 3.86Å; A577-I581 VanDerWaalsContact O-CG1 3.32Å; A577-I581 WeakPolarHBondContact O-CG1 3.24Å; A577-I581 PolarHBondContact O-N 2.81Å; I581-K583 PolarHBondContact O-N 2.93Å; I581-A584 PolarHBondContact O-N 3.02Å; I581-C585 WeakPolarHBondContact O-CB 3.49Å; I581-C585 PolarHBondContact O-N 2.97Å; I581-C585 PolarHBondContact O-SG 3.32Å; I581-L595 HydrophobicContact CG2-CD1 4.22Å; I581-L608 HydrophobicContact CD1-CB 4.47Å; I581-L608 HydrophobicContact CD1-CD2 3.71Å; I581-L608 HydrophobicContact CD1-CG 3.8Å; I581-L608 HydrophobicContact CG1-CD2 4Å; I581-L612 HydrophobicContact CD1-CD1 3.66Å
582	R	90.9	Very high	89.5	Confident	139 Å²	139	57.5 Å²	57.5	53%	0.525	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-46	-179.2	-67.7	172.3	-176.1	-161.3	-1.9	111.8	R578 L579 A580 C585 S586	R578-R582 WeakPolarHBondContact O-CG 3.2Å; L579-R582 PolarHBondContact O-N 2.69Å; A580-R582 PolarHBondContact O-N 3.43Å; R582-C585 PolarHBondContact O-N 2.83Å; R582-S586 PolarHBondContact O-N 3.02Å; R582-S586 PolarHBondContact O-OG 3.21Å
583	K	89.5	Confident	90	Very high	159 Å²	159	61.5 Å²	61.5	69%	0.691	33%	0.329	S	S	*	.	H	α-helix	trans	-65.2	-40	179.4	-172	-179	177.9	-173.2	0	112.1	L579 A580 I581 S586 A587	L579-K583 WeakPolarHBondContact O-CB 3.38Å; L579-K583 PolarHBondContact O-N 2.98Å; A580-K583 PolarHBondContact O-N 3.06Å; I581-K583 PolarHBondContact O-N 2.93Å; K583-S586 PolarHBondContact O-OG 2.82Å; K583-A587 WeakPolarHBondContact O-CB 3.33Å; K583-A587 PolarHBondContact O-N 2.9Å
584	A	91.7	Very high	90.2	Very high	11 Å²	11	62.2 Å²	62.2	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-42.8	175.3	0	0	0	0	0	112	V511 T515 A580 I581 A587 K588 F591	V511-A584 HydrophobicContact CG2-CB 3.88Å; T515-A584 HydrophobicContact CG2-CB 4.45Å; A580-A584 VanDerWaalsContact O-CB 3.25Å; A580-A584 WeakPolarHBondContact O-CB 3.09Å; A580-A584 PolarHBondContact O-N 3.48Å; I581-A584 PolarHBondContact O-N 3.02Å; A584-A587 PolarHBondContact O-N 2.79Å; A584-K588 PolarHBondContact O-N 3Å; A584-F591 HydrophobicContact CB-CD1 3.69Å; A584-F591 HydrophobicContact CB-CE1 3.62Å
585	C	91.8	Very high	90.4	Very high	32 Å²	32	61.9 Å²	61.9	22%	0.216	33%	0.331	C	S	.	.	H	α-helix	trans	-64.2	-40.3	177.6	-75.4	0	0	0	0	113.1	I581 R582 A592	I581-C585 WeakPolarHBondContact O-CB 3.49Å; I581-C585 PolarHBondContact O-N 2.97Å; I581-C585 PolarHBondContact O-SG 3.32Å; R582-C585 PolarHBondContact O-N 2.83Å; C585-A592 HydrophobicContact CB-CB 4.06Å
586	S	89.9	Confident	90.8	Very high	95 Å²	95	64 Å²	64	66%	0.664	34%	0.341	S	S	*	.	H	α-helix	trans	-73.9	-35.4	176.5	61.8	0	0	0	0	112.8	R582 K583	R582-S586 PolarHBondContact O-N 3.02Å; R582-S586 PolarHBondContact O-OG 3.21Å; K583-S586 PolarHBondContact O-OG 2.82Å
587	A	90.3	Very high	91.1	Very high	75 Å²	75	68.4 Å²	68.4	62%	0.62	35%	0.353	S	S	*	.	H	α-helix	trans	-74.2	-33.7	177.2	0	0	0	0	0	113.6	K583 A584	K583-A587 WeakPolarHBondContact O-CB 3.33Å; K583-A587 PolarHBondContact O-N 2.9Å; A584-A587 PolarHBondContact O-N 2.79Å
588	K	91.2	Very high	91.1	Very high	84 Å²	84	68.5 Å²	68.5	37%	0.365	35%	0.353	S	S	.	.			trans	-133.3	91.4	-175.6	-69.1	-176.5	176.9	-177.5	0	111.4	S509 L510 A584 A590 F591 A592	S509-K588 PolarHBondContact O-NZ 2.62Å; L510-K588 WeakPolarHBondContact O-CD 3.48Å; A584-K588 PolarHBondContact O-N 3Å; K588-A590 PolarHBondContact O-N 3.44Å; K588-F591 HydrophobicContact CB-CB 4.26Å; K588-F591 WeakPolarHBondContact O-CB 3.42Å; K588-F591 PolarHBondContact O-N 2.73Å; K588-A592 PolarHBondContact O-N 2.71Å
589	P	92	Very high	91.1	Very high	90 Å²	90	66.1 Å²	66.1	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-57.5	-23	179.7	-28.4	36.2	0	0	0	115.4	F591 A592 K593	P589-F591 VanDerWaalsContact C-N 3.35Å; P589-A592 PolarHBondContact O-N 3.39Å; P589-K593 PolarHBondContact O-N 2.66Å; P589-K593 VanDerWaalsContact O-N 3.11Å
590	A	91.3	Very high	91.1	Very high	57 Å²	57	69.7 Å²	69.7	47%	0.471	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-34.3	172.9	0	0	0	0	0	112.6	L510 K588 Y594	L510-A590 HydrophobicContact CD2-CB 3.6Å; K588-A590 PolarHBondContact O-N 3.44Å; A590-Y594 PolarHBondContact O-N 3.41Å
591	F	93.7	Very high	90.7	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-69.4	-42.7	173.7	-178.8	-115.1	0	0	0	111.4	L502 L510 V511 I519 A584 K588 P589 K593 Y594 L595	L502-F591 HydrophobicContact CD1-CE2 3.86Å; L502-F591 HydrophobicContact CD2-CD2 4.31Å; L502-F591 HydrophobicContact CD2-CE2 4.18Å; L510-F591 HydrophobicContact CB-CB 4.46Å; L510-F591 HydrophobicContact CB-CD2 4.36Å; L510-F591 WeakPolarHBondContact O-CB 3.38Å; V511-F591 HydrophobicContact CB-CD2 3.88Å; V511-F591 HydrophobicContact CB-CE2 3.89Å; V511-F591 HydrophobicContact CB-CG 4.28Å; V511-F591 HydrophobicContact CB-CZ 4.29Å; V511-F591 HydrophobicContact CG1-CD2 4.09Å; V511-F591 HydrophobicContact CG1-CE2 3.75Å; V511-F591 HydrophobicContact CG1-CZ 4.33Å; V511-F591 HydrophobicContact CG2-CE1 4.49Å; V511-F591 HydrophobicContact CG2-CE2 4.41Å; V511-F591 HydrophobicContact CG2-CZ 4.32Å; I519-F591 HydrophobicContact CD1-CZ 4.48Å; A584-F591 HydrophobicContact CB-CD1 3.69Å; A584-F591 HydrophobicContact CB-CE1 3.62Å; K588-F591 HydrophobicContact CB-CB 4.26Å; K588-F591 WeakPolarHBondContact O-CB 3.42Å; K588-F591 PolarHBondContact O-N 2.73Å; P589-F591 VanDerWaalsContact C-N 3.35Å; F591-K593 VanDerWaalsContact C-N 3.33Å; F591-K593 PolarHBondContact O-N 3.44Å; F591-Y594 WeakPolarHBondContact O-CB 3.47Å; F591-Y594 PolarHBondContact O-N 2.86Å; F591-Y594 VanDerWaalsContact O-N 3.09Å; F591-L595 HydrophobicContact CD1-CD1 4.24Å; F591-L595 HydrophobicContact CE1-CD1 3.68Å; F591-L595 HydrophobicContact CE1-CG 4.24Å; F591-L595 HydrophobicContact CE2-CD2 4.18Å; F591-L595 HydrophobicContact CE2-CG 4.29Å; F591-L595 HydrophobicContact CZ-CD1 3.84Å; F591-L595 HydrophobicContact CZ-CD2 4.12Å; F591-L595 HydrophobicContact CZ-CG 4.1Å; F591-L595 PolarHBondContact O-N 2.9Å
592	A	92.3	Very high	90.2	Very high	34 Å²	34	74.8 Å²	74.8	28%	0.281	38%	0.376	S	S	.	.	H	α-helix	trans	-56.6	-45.7	174.1	0	0	0	0	0	111.9	C585 K588 P589 Y594 L595 E596	C585-A592 HydrophobicContact CB-CB 4.06Å; K588-A592 PolarHBondContact O-N 2.71Å; P589-A592 PolarHBondContact O-N 3.39Å; A592-Y594 PolarHBondContact O-N 2.9Å; A592-L595 PolarHBondContact O-N 2.86Å; A592-E596 PolarHBondContact O-N 3.44Å
593	K	93.1	Very high	89.5	Confident	151 Å²	151	76.5 Å²	76.5	66%	0.657	39%	0.392	S	S	*	.	H	α-helix	trans	-64.6	-35.2	174.5	-72.6	-177	176.6	-175.5	0	113.5	P589 F591 R597	P589-K593 PolarHBondContact O-N 2.66Å; P589-K593 VanDerWaalsContact O-N 3.11Å; F591-K593 VanDerWaalsContact C-N 3.33Å; F591-K593 PolarHBondContact O-N 3.44Å; K593-R597 WeakPolarHBondContact O-CB 3.34Å; K593-R597 PolarHBondContact O-N 3.45Å
594	Y	93.4	Very high	89	Confident	42 Å²	42	74.2 Å²	74.2	17%	0.165	39%	0.388	C	S	.	.	H	α-helix	trans	-63.6	-44.5	173.7	-179.6	-88.8	0	0	0	111.5	K497 P501 L502 L507 L510 A590 F591 A592 R597 C598	K497-Y594 PolarHBondContact O-OH 2.98Å; P501-Y594 WeakPolarHBondContact CB-OH 3.43Å; L502-Y594 HydrophobicContact CD1-CE1 4.12Å; L502-Y594 HydrophobicContact CD2-CD1 3.97Å; L502-Y594 HydrophobicContact CD2-CE1 3.83Å; L502-Y594 HydrophobicContact CG-CD1 4.49Å; L502-Y594 HydrophobicContact CG-CE1 3.93Å; L507-Y594 HydrophobicContact CD1-CE2 4.06Å; L510-Y594 HydrophobicContact CD1-CD2 3.99Å; L510-Y594 HydrophobicContact CD1-CG 4.08Å; A590-Y594 PolarHBondContact O-N 3.41Å; F591-Y594 WeakPolarHBondContact O-CB 3.47Å; F591-Y594 PolarHBondContact O-N 2.86Å; F591-Y594 VanDerWaalsContact O-N 3.09Å; A592-Y594 PolarHBondContact O-N 2.9Å; Y594-R597 PolarHBondContact O-N 3Å; Y594-C598 VanDerWaalsContact CE1-SG 3.53Å; Y594-C598 PolarHBondContact O-N 3.12Å; Y594-C598 PolarHBondContact O-SG 2.78Å
595	L	92.3	Very high	88.7	Confident	17 Å²	17	81.2 Å²	81.2	9%	0.089	42%	0.416	C	S	.	.	H	α-helix	trans	-66.6	-42.3	176.5	-64.4	-172.4	0	0	0	112.5	Y498 I581 F591 A592 R597 C598 S599 L608	Y498-L595 HydrophobicContact CD1-CD2 3.69Å; Y498-L595 HydrophobicContact CE1-CD2 3.77Å; I581-L595 HydrophobicContact CG2-CD1 4.22Å; F591-L595 HydrophobicContact CD1-CD1 4.24Å; F591-L595 HydrophobicContact CE1-CD1 3.68Å; F591-L595 HydrophobicContact CE1-CG 4.24Å; F591-L595 HydrophobicContact CE2-CD2 4.18Å; F591-L595 HydrophobicContact CE2-CG 4.29Å; F591-L595 HydrophobicContact CZ-CD1 3.84Å; F591-L595 HydrophobicContact CZ-CD2 4.12Å; F591-L595 HydrophobicContact CZ-CG 4.1Å; F591-L595 PolarHBondContact O-N 2.9Å; A592-L595 PolarHBondContact O-N 2.86Å; L595-R597 VanDerWaalsContact C-N 3.35Å; L595-R597 PolarHBondContact O-N 2.84Å; L595-C598 PolarHBondContact O-N 2.79Å; L595-S599 WeakPolarHBondContact O-CB 3.47Å; L595-S599 PolarHBondContact O-N 2.95Å; L595-L608 HydrophobicContact CD1-CD2 4.04Å; L595-L608 HydrophobicContact CD2-CB 4.48Å; L595-L608 HydrophobicContact CD2-CD2 3.8Å
596	E	90.8	Very high	88.5	Confident	96 Å²	96	82 Å²	82	45%	0.449	42%	0.418	S	S	.	.	H	α-helix	trans	-58.1	-47.2	175.1	-167.6	-145.5	137.4	0	0	110.9	A592 C598 S599 R600	A592-E596 PolarHBondContact O-N 3.44Å; E596-C598 PolarHBondContact O-N 2.75Å; E596-S599 PolarHBondContact O-N 2.78Å; E596-R600 WeakPolarHBondContact O-CB 3.43Å; E596-R600 WeakPolarHBondContact O-CG 3.18Å; E596-R600 PolarHBondContact O-N 2.95Å; E596-R600 WeakPolarHBondContact OE1-CD 3.32Å; E596-R600 IonicContact OE1-CZ 3.84Å; E596-R600 IonicContact OE1-NE 3.72Å; E596-R600 IonicContact OE1-NH1 2.7Å; E596-R600 PolarHBondContact OE1-NH1 3.12Å
597	R	91.9	Very high	88.5	Confident	163 Å²	163	79 Å²	79	62%	0.615	40%	0.397	S	S	*	.	H	α-helix	trans	-58.8	-48.8	175.3	179.5	178.3	172.6	167.9	2	111.8	K593 Y594 L595 S599 R600 E601	K593-R597 WeakPolarHBondContact O-CB 3.34Å; K593-R597 PolarHBondContact O-N 3.45Å; Y594-R597 PolarHBondContact O-N 3Å; L595-R597 VanDerWaalsContact C-N 3.35Å; L595-R597 PolarHBondContact O-N 2.84Å; R597-S599 VanDerWaalsContact C-N 3.3Å; R597-S599 PolarHBondContact O-N 2.94Å; R597-R600 PolarHBondContact O-N 3.09Å; R597-E601 HydrophobicContact CG-CG 4.48Å; R597-E601 IonicContact CZ-OE1 3.59Å; R597-E601 VanDerWaalsContact CZ-OE1 3.28Å; R597-E601 IonicContact NE-OE1 3.17Å; R597-E601 PolarHBondContact NE-OE1 2.95Å; R597-E601 IonicContact NH2-OE1 2.72Å; R597-E601 PolarHBondContact NH2-OE1 2.7Å; R597-E601 WeakPolarHBondContact O-CB 3.24Å; R597-E601 WeakPolarHBondContact O-CG 3.42Å; R597-E601 PolarHBondContact O-N 3.47Å
598	C	89.8	Confident	88.6	Confident	5 Å²	5	75.6 Å²	75.6	3%	0.034	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-37.1	-178.7	-68.8	0	0	0	0	112.5	Y498 Y594 L595 E596 H602	Y498-C598 HydrophobicContact CD1-CB 4.28Å; Y498-C598 HydrophobicContact CE1-CB 3.47Å; Y498-C598 VanDerWaalsContact CE1-CB 3.47Å; Y498-C598 HydrophobicContact CE2-CB 4.45Å; Y594-C598 VanDerWaalsContact CE1-SG 3.53Å; Y594-C598 PolarHBondContact O-N 3.12Å; Y594-C598 PolarHBondContact O-SG 2.78Å; L595-C598 PolarHBondContact O-N 2.79Å; E596-C598 PolarHBondContact O-N 2.75Å; C598-H602 PolarHBondContact O-N 3.46Å
599	S	88.1	Confident	88.4	Confident	22 Å²	22	73.8 Å²	73.8	15%	0.154	36%	0.363	C	S	.	.	H	α-helix	trans	-65	-47.8	173	169.9	0	0	0	0	112.2	L595 E596 R597 E601 H602 K605 L606	L595-S599 WeakPolarHBondContact O-CB 3.47Å; L595-S599 PolarHBondContact O-N 2.95Å; E596-S599 PolarHBondContact O-N 2.78Å; R597-S599 VanDerWaalsContact C-N 3.3Å; R597-S599 PolarHBondContact O-N 2.94Å; S599-E601 VanDerWaalsContact C-N 3.26Å; S599-E601 PolarHBondContact O-N 3.15Å; S599-H602 WeakPolarHBondContact O-CB 3.28Å; S599-H602 PolarHBondContact O-N 2.86Å; S599-K605 WeakPolarHBondContact O-CA 3.34Å; S599-K605 PolarHBondContact OG-O 3.09Å; S599-L606 WeakPolarHBondContact CA-O 3.44Å; S599-L606 VanDerWaalsContact CB-O 3.25Å; S599-L606 WeakPolarHBondContact CB-O 3.1Å; S599-L606 PolarHBondContact OG-O 2.82Å
600	R	85.4	Confident	88.3	Confident	181 Å²	181	71 Å²	71	68%	0.683	35%	0.347	S	S	*	.	H	α-helix	trans	-64.6	-28	178.6	-71.3	172.8	68.2	156.8	5.7	113.7	E596 R597 H602	E596-R600 WeakPolarHBondContact O-CB 3.43Å; E596-R600 WeakPolarHBondContact O-CG 3.18Å; E596-R600 PolarHBondContact O-N 2.95Å; E596-R600 WeakPolarHBondContact OE1-CD 3.32Å; E596-R600 IonicContact OE1-CZ 3.84Å; E596-R600 IonicContact OE1-NE 3.72Å; E596-R600 IonicContact OE1-NH1 2.7Å; E596-R600 PolarHBondContact OE1-NH1 3.12Å; R597-R600 PolarHBondContact O-N 3.09Å; R600-H602 VanDerWaalsContact C-N 3.33Å
601	E	83.2	Confident	88.4	Confident	90 Å²	90	68.3 Å²	68.3	42%	0.421	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	3.1	172.4	-68.5	177.2	-177.7	0	0	113.6	K497 R597 S599	K497-E601 VanDerWaalsContact CE-OE2 3.23Å; K497-E601 WeakPolarHBondContact CE-OE2 3.39Å; K497-E601 IonicContact NZ-OE2 2.68Å; K497-E601 PolarHBondContact NZ-OE2 3.34Å; R597-E601 HydrophobicContact CG-CG 4.48Å; R597-E601 IonicContact CZ-OE1 3.59Å; R597-E601 VanDerWaalsContact CZ-OE1 3.28Å; R597-E601 IonicContact NE-OE1 3.17Å; R597-E601 PolarHBondContact NE-OE1 2.95Å; R597-E601 IonicContact NH2-OE1 2.72Å; R597-E601 PolarHBondContact NH2-OE1 2.7Å; R597-E601 WeakPolarHBondContact O-CB 3.24Å; R597-E601 WeakPolarHBondContact O-CG 3.42Å; R597-E601 PolarHBondContact O-N 3.47Å; S599-E601 VanDerWaalsContact C-N 3.26Å; S599-E601 PolarHBondContact O-N 3.15Å
602	H	80.8	Confident	88.4	Confident	28 Å²	28	68.5 Å²	68.5	13%	0.13	33%	0.325	C	S	.	.	S	Bend	trans	-91.2	137.4	171.5	-174.8	-138.1	0	0	0	110.5	N490 C598 S599 R600 N604 K605	N490-H602 PolarHBondContact OD1-CE1 2.88Å; C598-H602 PolarHBondContact O-N 3.46Å; S599-H602 WeakPolarHBondContact O-CB 3.28Å; S599-H602 PolarHBondContact O-N 2.86Å; R600-H602 VanDerWaalsContact C-N 3.33Å; H602-N604 PolarHBondContact O-N 2.94Å; H602-K605 WeakPolarHBondContact O-CA 3.49Å; H602-K605 PolarHBondContact O-N 2.94Å
603	M	76.6	Confident	88.3	Confident	174 Å²	174	67.7 Å²	67.7	86%	0.857	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-42.6	-177.7	-64.4	-60.6	176.6	0	0	112.6
604	N	79.6	Confident	88.2	Confident	111 Å²	111	62.3 Å²	62.3	59%	0.594	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	10	-179.7	-62.5	-5.7	0	0	0	113.2	H602 L606	H602-N604 PolarHBondContact O-N 2.94Å; N604-L606 HydrophobicContact CB-CD1 4.39Å; N604-L606 HydrophobicContact CB-CD2 4.48Å; N604-L606 HydrophobicContact CB-CG 3.99Å; N604-L606 PolarHBondContact O-N 3.41Å
605	K	85.5	Confident	88.1	Confident	158 Å²	158	60.4 Å²	60.4	69%	0.687	29%	0.287	S	S	*	.			trans	50.8	29.2	179.2	-60	176.4	-175.6	171.1	0	115.2	S599 H602	S599-K605 WeakPolarHBondContact O-CA 3.34Å; S599-K605 PolarHBondContact OG-O 3.09Å; H602-K605 WeakPolarHBondContact O-CA 3.49Å; H602-K605 PolarHBondContact O-N 2.94Å
606	L	87.4	Confident	87.9	Confident	49 Å²	49	60.3 Å²	60.3	26%	0.257	29%	0.287	S	S	.	.			trans	-70.2	140.7	-178	-60.2	-178.4	0	0	0	111.6	S599 N604 A610 L611	S599-L606 WeakPolarHBondContact CA-O 3.44Å; S599-L606 VanDerWaalsContact CB-O 3.25Å; S599-L606 WeakPolarHBondContact CB-O 3.1Å; S599-L606 PolarHBondContact OG-O 2.82Å; N604-L606 HydrophobicContact CB-CD1 4.39Å; N604-L606 HydrophobicContact CB-CD2 4.48Å; N604-L606 HydrophobicContact CB-CG 3.99Å; N604-L606 PolarHBondContact O-N 3.41Å; L606-A610 HydrophobicContact CB-CB 4.22Å; L606-A610 HydrophobicContact CD2-CB 4.31Å; L606-L611 HydrophobicContact CB-CD2 4.17Å; L606-L611 HydrophobicContact CB-CG 4.13Å; L606-L611 HydrophobicContact CD1-CD2 3.84Å
607	S	90.3	Very high	87.9	Confident	31 Å²	31	57.2 Å²	57.2	22%	0.217	27%	0.272	C	S	.	.			trans	-75.2	166.2	168.1	63.5	0	0	0	0	111.3	D609 A610 L611	S607-D609 VanDerWaalsContact C-N 3.32Å; S607-D609 PolarHBondContact O-N 3.06Å; S607-A610 PolarHBondContact O-N 2.87Å; S607-A610 VanDerWaalsContact O-N 3.14Å; S607-A610 WeakPolarHBondContact OG-CB 3.46Å; S607-A610 PolarHBondContact OG-N 2.74Å; S607-L611 PolarHBondContact O-N 2.89Å; S607-L611 VanDerWaalsContact O-N 3.11Å
608	L	92.3	Very high	88	Confident	5 Å²	5	50 Å²	50	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-59.8	-42.6	175.6	-179.6	57.8	0	0	0	111.6	L494 Y498 I519 F520 I581 L595 A610 L611 L612	L494-L608 HydrophobicContact CD2-CD1 3.44Å; L494-L608 VanDerWaalsContact CD2-CD1 3.44Å; Y498-L608 HydrophobicContact CD1-CD1 4.13Å; Y498-L608 HydrophobicContact CD1-CD2 4.48Å; Y498-L608 HydrophobicContact CE1-CB 4.39Å; Y498-L608 HydrophobicContact CE1-CD1 4.31Å; Y498-L608 HydrophobicContact CG-CD1 4.27Å; I519-L608 HydrophobicContact CG2-CD2 4.14Å; F520-L608 HydrophobicContact CE1-CD1 3.86Å; F520-L608 HydrophobicContact CZ-CD1 3.79Å; F520-L608 HydrophobicContact CZ-CD2 4.01Å; I581-L608 HydrophobicContact CD1-CB 4.47Å; I581-L608 HydrophobicContact CD1-CD2 3.71Å; I581-L608 HydrophobicContact CD1-CG 3.8Å; I581-L608 HydrophobicContact CG1-CD2 4Å; L595-L608 HydrophobicContact CD1-CD2 4.04Å; L595-L608 HydrophobicContact CD2-CB 4.48Å; L595-L608 HydrophobicContact CD2-CD2 3.8Å; L608-A610 VanDerWaalsContact C-N 3.3Å; L608-A610 PolarHBondContact O-N 2.85Å; L608-L611 PolarHBondContact O-N 2.88Å; L608-L612 HydrophobicContact CD1-CD1 3.98Å; L608-L612 HydrophobicContact CD1-CG 4.12Å; L608-L612 HydrophobicContact CG-CD1 3.88Å; L608-L612 HydrophobicContact CG-CG 4.45Å; L608-L612 WeakPolarHBondContact O-CG 3.37Å; L608-L612 PolarHBondContact O-N 3.27Å
609	D	87.5	Confident	88.1	Confident	46 Å²	46	49.8 Å²	49.8	25%	0.246	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-40.5	173.5	-56.2	-116.3	0	0	0	112.7	R578 S607 L611 L612 I613	R578-D609 WeakPolarHBondContact CG-OD1 3.24Å; S607-D609 VanDerWaalsContact C-N 3.32Å; S607-D609 PolarHBondContact O-N 3.06Å; D609-L611 VanDerWaalsContact C-N 3.33Å; D609-L612 PolarHBondContact O-N 2.89Å; D609-I613 PolarHBondContact O-N 2.93Å
610	A	89.6	Confident	88.1	Confident	30 Å²	30	50.5 Å²	50.5	25%	0.248	25%	0.248	C	C	.	.	H	α-helix	trans	-73.2	-23.8	-179.5	0	0	0	0	0	113.2	L606 S607 L608 I613	L606-A610 HydrophobicContact CB-CB 4.22Å; L606-A610 HydrophobicContact CD2-CB 4.31Å; S607-A610 PolarHBondContact O-N 2.87Å; S607-A610 VanDerWaalsContact O-N 3.14Å; S607-A610 WeakPolarHBondContact OG-CB 3.46Å; S607-A610 PolarHBondContact OG-N 2.74Å; L608-A610 VanDerWaalsContact C-N 3.3Å; L608-A610 PolarHBondContact O-N 2.85Å; A610-I613 WeakPolarHBondContact O-CG2 3.35Å
611	L	92.9	Very high	88.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-79.6	-42.4	169.9	-66.7	168.3	0	0	0	111.3	N490 L493 L494 Y498 L606 S607 L608 D609 I613 M614	N490-L611 HydrophobicContact CB-CD2 4.13Å; N490-L611 WeakPolarHBondContact OD1-CD2 3.45Å; L493-L611 HydrophobicContact CD2-CD1 3.96Å; L493-L611 HydrophobicContact CD2-CD2 4.4Å; L494-L611 HydrophobicContact CD1-CB 4.28Å; L494-L611 HydrophobicContact CD2-CB 3.76Å; L494-L611 HydrophobicContact CD2-CD1 4.18Å; L494-L611 HydrophobicContact CG-CB 4.15Å; Y498-L611 HydrophobicContact CE2-CD1 3.93Å; L606-L611 HydrophobicContact CB-CD2 4.17Å; L606-L611 HydrophobicContact CB-CG 4.13Å; L606-L611 HydrophobicContact CD1-CD2 3.84Å; S607-L611 PolarHBondContact O-N 2.89Å; S607-L611 VanDerWaalsContact O-N 3.11Å; L608-L611 PolarHBondContact O-N 2.88Å; D609-L611 VanDerWaalsContact C-N 3.33Å; L611-I613 VanDerWaalsContact C-N 3.31Å; L611-I613 PolarHBondContact O-N 3.47Å; L611-M614 HydrophobicContact CD2-SD 4.17Å; L611-M614 WeakPolarHBondContact O-CB 3.45Å; L611-M614 WeakPolarHBondContact O-CG 3.33Å; L611-M614 PolarHBondContact O-N 2.76Å; L611-M614 VanDerWaalsContact O-N 3.15Å
612	L	93.2	Very high	89.1	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-71.1	-18.3	-176.9	-72.4	171.6	0	0	0	114.4	L494 I519 V523 F570 W574 I581 L608 D609 M614 P615	L494-L612 HydrophobicContact CD1-CD2 4.12Å; L494-L612 HydrophobicContact CD2-CD2 4.02Å; L494-L612 HydrophobicContact CD2-CG 4.18Å; I519-L612 HydrophobicContact CG2-CD1 4.1Å; V523-L612 HydrophobicContact CG2-CD2 4.15Å; F570-L612 HydrophobicContact CE2-CD2 4.48Å; F570-L612 WeakPolarHBondContact CZ-O 3.29Å; W574-L612 PolarHBondContact NE1-O 2.98Å; I581-L612 HydrophobicContact CD1-CD1 3.66Å; L608-L612 HydrophobicContact CD1-CD1 3.98Å; L608-L612 HydrophobicContact CD1-CG 4.12Å; L608-L612 HydrophobicContact CG-CD1 3.88Å; L608-L612 HydrophobicContact CG-CG 4.45Å; L608-L612 WeakPolarHBondContact O-CG 3.37Å; L608-L612 PolarHBondContact O-N 3.27Å; D609-L612 PolarHBondContact O-N 2.89Å; L612-M614 VanDerWaalsContact C-N 3.35Å; L612-P615 WeakPolarHBondContact O-CD 3.42Å
613	I	90.1	Very high	89.6	Confident	18 Å²	18	42.7 Å²	42.7	9%	0.092	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-18.7	171.2	-175.8	59.4	0	0	0	113	W574 D609 A610 L611 P615 V616 Q617	W574-I613 HydrophobicContact CH2-CD1 3.9Å; W574-I613 HydrophobicContact CZ2-CB 4.11Å; W574-I613 HydrophobicContact CZ2-CD1 3.53Å; W574-I613 HydrophobicContact CZ2-CG1 4.24Å; D609-I613 PolarHBondContact O-N 2.93Å; A610-I613 WeakPolarHBondContact O-CG2 3.35Å; L611-I613 VanDerWaalsContact C-N 3.31Å; L611-I613 PolarHBondContact O-N 3.47Å; I613-P615 VanDerWaalsContact C-CD 3.49Å; I613-V616 HydrophobicContact CD1-CB 3.9Å; I613-V616 HydrophobicContact CD1-CG1 4.43Å; I613-V616 HydrophobicContact CD1-CG2 4Å; I613-V616 PolarHBondContact O-N 3.14Å; I613-Q617 HydrophobicContact CG1-CG 4.07Å; I613-Q617 PolarHBondContact O-N 3.35Å
614	M	91.8	Very high	90.4	Very high	37 Å²	37	38.5 Å²	38.5	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-57.9	-39.3	-174.1	-62.7	-177.6	75.6	0	0	114.8	Y487 N490 L611 L612 V616 Q617 R618	Y487-M614 HydrophobicContact CD2-CB 4.2Å; Y487-M614 HydrophobicContact CD2-CE 4.31Å; Y487-M614 HydrophobicContact CE2-CB 3.93Å; N490-M614 HydrophobicContact CB-CE 4.07Å; N490-M614 HydrophobicContact CB-SD 3.75Å; L611-M614 HydrophobicContact CD2-SD 4.17Å; L611-M614 WeakPolarHBondContact O-CB 3.45Å; L611-M614 WeakPolarHBondContact O-CG 3.33Å; L611-M614 PolarHBondContact O-N 2.76Å; L611-M614 VanDerWaalsContact O-N 3.15Å; L612-M614 VanDerWaalsContact C-N 3.35Å; M614-V616 PolarHBondContact O-N 2.97Å; M614-Q617 CarbonylContact O-C 3.51Å; M614-Q617 PolarHBondContact O-N 2.81Å; M614-R618 PolarHBondContact O-N 3.05Å
615	P	91.4	Very high	91.1	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.013	17%	0.171	C	C	.	.	H	α-helix	trans	-56.5	-45.7	174.5	-26.9	36.5	0	0	0	113.9	Y487 L491 M526 F570 L612 I613 Q617 R618	Y487-P615 WeakPolarHBondContact OH-CA 3.47Å; L491-P615 HydrophobicContact CD2-CG 4.39Å; M526-P615 HydrophobicContact CE-CB 3.88Å; M526-P615 HydrophobicContact CE-CG 4.49Å; M526-P615 HydrophobicContact SD-CB 3.82Å; M526-P615 HydrophobicContact SD-CG 4.19Å; F570-P615 HydrophobicContact CD1-CB 3.95Å; F570-P615 HydrophobicContact CD1-CG 4.35Å; F570-P615 HydrophobicContact CE1-CB 3.66Å; F570-P615 HydrophobicContact CE1-CG 3.72Å; F570-P615 HydrophobicContact CZ-CB 4.3Å; F570-P615 HydrophobicContact CZ-CG 3.84Å; L612-P615 WeakPolarHBondContact O-CD 3.42Å; I613-P615 VanDerWaalsContact C-CD 3.49Å; P615-Q617 VanDerWaalsContact C-N 3.26Å; P615-Q617 PolarHBondContact O-N 2.91Å; P615-R618 PolarHBondContact O-N 3.47Å; P615-R618 VanDerWaalsContact O-N 3.12Å
616	V	88.7	Confident	91.6	Very high	15 Å²	15	27 Å²	27	9%	0.091	14%	0.14	C	C	.	.	H	α-helix	trans	-61.4	-38.4	178.4	-165.7	0	0	0	0	110.6	F570 I571 W574 I613 M614 P620 Q661	F570-V616 HydrophobicContact CE1-CG2 4.28Å; I571-V616 HydrophobicContact CG1-CG2 4.33Å; W574-V616 HydrophobicContact CG-CG2 4.43Å; I613-V616 HydrophobicContact CD1-CB 3.9Å; I613-V616 HydrophobicContact CD1-CG1 4.43Å; I613-V616 HydrophobicContact CD1-CG2 4Å; I613-V616 PolarHBondContact O-N 3.14Å; M614-V616 PolarHBondContact O-N 2.97Å; V616-P620 VanDerWaalsContact O-CD 3.3Å; V616-P620 WeakPolarHBondContact O-CD 3.45Å; V616-Q661 VanDerWaalsContact CG1-NE2 3.32Å
617	Q	90.1	Very high	91.8	Very high	32 Å²	32	29.1 Å²	29.1	15%	0.15	15%	0.147	C	C	.	.	H	α-helix	trans	-79	-14.8	178	-67	-178.1	-2.1	0	0	114.3	A377 V381 I613 M614 P615 R621	A377-Q617 PolarHBondContact O-NE2 3.38Å; V381-Q617 HydrophobicContact CG2-CG 4.07Å; I613-Q617 HydrophobicContact CG1-CG 4.07Å; I613-Q617 PolarHBondContact O-N 3.35Å; M614-Q617 CarbonylContact O-C 3.51Å; M614-Q617 PolarHBondContact O-N 2.81Å; P615-Q617 VanDerWaalsContact C-N 3.26Å; P615-Q617 PolarHBondContact O-N 2.91Å; Q617-R621 VanDerWaalsContact O-CG 3.31Å; Q617-R621 WeakPolarHBondContact O-CG 3.25Å; Q617-R621 VanDerWaalsContact OE1-NH2 3.09Å
618	R	93.8	Very high	92.1	Very high	10 Å²	10	31.1 Å²	31.1	4%	0.038	15%	0.153	C	C	.	.	H	α-helix	trans	-78.6	-41.3	-174.1	-169.4	66	178.7	150.3	-1.7	112.6	T483 E484 Y487 M614 P615 R621 Y622	T483-R618 PolarHBondContact OG1-NH1 2.78Å; T483-R618 PolarHBondContact OG1-NH2 2.78Å; T483-R618 VanDerWaalsContact OG1-NH2 3.14Å; E484-R618 VanDerWaalsContact CA-NH2 3.27Å; E484-R618 VanDerWaalsContact N-NH2 3.14Å; E484-R618 IonicContact OE2-CZ 2.67Å; E484-R618 IonicContact OE2-NE 3.26Å; E484-R618 PolarHBondContact OE2-NE 2.93Å; E484-R618 IonicContact OE2-NH2 3.75Å; E484-R618 PolarHBondContact OE2-NH2 2.84Å; Y487-R618 HydrophobicContact CD1-CG 3.79Å; Y487-R618 HydrophobicContact CE1-CB 4.18Å; Y487-R618 HydrophobicContact CE1-CG 3.78Å; Y487-R618 HydrophobicContact CE2-CB 4.35Å; Y487-R618 HydrophobicContact CG-CG 4.21Å; M614-R618 PolarHBondContact O-N 3.05Å; P615-R618 PolarHBondContact O-N 3.47Å; P615-R618 VanDerWaalsContact O-N 3.12Å; R618-R621 WeakPolarHBondContact O-CB 3.47Å; R618-R621 PolarHBondContact O-N 2.9Å; R618-R621 VanDerWaalsContact O-N 3.16Å; R618-Y622 HydrophobicContact CG-CE1 4.32Å; R618-Y622 HydrophobicContact CG-CE2 3.75Å; R618-Y622 WeakPolarHBondContact CG-OH 3.4Å; R618-Y622 PolarHBondContact NE-OH 3.04Å; R618-Y622 PolarHBondContact O-N 2.82Å
619	I	91.3	Very high	92.2	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-49.8	-179.8	-64.1	-59.2	0	0	0	112.4	F558 Y567 R621 Y622 E623 L650 L653 A654 I657	F558-I619 HydrophobicContact CD1-CD1 4.29Å; F558-I619 HydrophobicContact CE1-CD1 3.87Å; Y567-I619 HydrophobicContact CD1-CG1 4.09Å; Y567-I619 HydrophobicContact CE1-CD1 3.9Å; Y567-I619 HydrophobicContact CE1-CG1 3.47Å; Y567-I619 VanDerWaalsContact CE1-CG1 3.47Å; Y567-I619 HydrophobicContact CE2-CD1 3.91Å; Y567-I619 HydrophobicContact CE2-CG1 4.4Å; Y567-I619 VanDerWaalsContact CZ-CD1 3.49Å; Y567-I619 WeakPolarHBondContact OH-CD1 3.34Å; I619-R621 PolarHBondContact O-N 3.11Å; I619-Y622 HydrophobicContact CD1-CD2 4.01Å; I619-Y622 HydrophobicContact CD1-CE2 4.06Å; I619-Y622 PolarHBondContact O-N 2.66Å; I619-Y622 VanDerWaalsContact O-N 3.1Å; I619-E623 PolarHBondContact O-N 3.4Å; I619-L650 HydrophobicContact CD1-CD2 4.08Å; I619-L650 HydrophobicContact CG2-CD2 4.4Å; I619-L653 HydrophobicContact CD1-CD2 3.79Å; I619-L653 HydrophobicContact CG1-CD2 4.26Å; I619-L653 HydrophobicContact CG2-CD2 4.42Å; I619-L653 HydrophobicContact CG2-CG 4.34Å; I619-A654 HydrophobicContact CG2-CB 4.07Å; I619-I657 HydrophobicContact CB-CD1 4.33Å; I619-I657 HydrophobicContact CG1-CD1 4.14Å; I619-I657 HydrophobicContact CG2-CD1 4.31Å
620	P	89.3	Confident	92.5	Very high	37 Å²	37	30.4 Å²	30.4	24%	0.24	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-28.2	177	-24	35	0	0	0	114.2	F384 V616 E623 L624	F384-P620 HydrophobicContact CE1-CB 3.98Å; V616-P620 VanDerWaalsContact O-CD 3.3Å; V616-P620 WeakPolarHBondContact O-CD 3.45Å; P620-E623 PolarHBondContact O-N 3.09Å; P620-L624 PolarHBondContact O-N 3.25Å
621	R	93.4	Very high	92.7	Very high	123 Å²	123	34.6 Å²	34.6	46%	0.464	16%	0.162	S	C	.	.	H	α-helix	trans	-69.9	-32.2	176	-68.8	176.7	-165.2	-159	8.1	112.3	Q617 R618 I619 L624 L625	Q617-R621 VanDerWaalsContact O-CG 3.31Å; Q617-R621 WeakPolarHBondContact O-CG 3.25Å; Q617-R621 VanDerWaalsContact OE1-NH2 3.09Å; R618-R621 WeakPolarHBondContact O-CB 3.47Å; R618-R621 PolarHBondContact O-N 2.9Å; R618-R621 VanDerWaalsContact O-N 3.16Å; I619-R621 PolarHBondContact O-N 3.11Å; R621-L624 PolarHBondContact O-N 2.94Å; R621-L625 WeakPolarHBondContact O-CG 3.31Å; R621-L625 PolarHBondContact O-N 3.45Å
622	Y	95.4	Very high	92.7	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-65	-40.2	171.9	-61.9	-49.7	0	0	0	111.8	L480 E484 H530 F533 F558 R618 I619 L624 L625 L626 L650	L480-Y622 HydrophobicContact CD1-CD1 3.84Å; L480-Y622 HydrophobicContact CD1-CE1 3.91Å; E484-Y622 PolarHBondContact OE1-OH 2.93Å; E484-Y622 PolarHBondContact OE2-OH 2.72Å; H530-Y622 PolarHBondContact CE1-OH 3.1Å; F533-Y622 AromaticContact CE1-CE1 3.92Å; F533-Y622 HydrophobicContact CE1-CE1 3.92Å; F533-Y622 AromaticContact CE1-CZ 3.91Å; F558-Y622 HydrophobicContact CE1-CE2 4.1Å; F558-Y622 HydrophobicContact CE2-CD2 4.38Å; F558-Y622 HydrophobicContact CE2-CE2 4.07Å; F558-Y622 HydrophobicContact CZ-CD2 4.06Å; F558-Y622 AromaticContact CZ-CE2 3.44Å; F558-Y622 HydrophobicContact CZ-CE2 3.44Å; F558-Y622 VanDerWaalsContact CZ-CE2 3.44Å; F558-Y622 AromaticContact CZ-CZ 3.97Å; R618-Y622 HydrophobicContact CG-CE1 4.32Å; R618-Y622 HydrophobicContact CG-CE2 3.75Å; R618-Y622 WeakPolarHBondContact CG-OH 3.4Å; R618-Y622 PolarHBondContact NE-OH 3.04Å; R618-Y622 PolarHBondContact O-N 2.82Å; I619-Y622 HydrophobicContact CD1-CD2 4.01Å; I619-Y622 HydrophobicContact CD1-CE2 4.06Å; I619-Y622 PolarHBondContact O-N 2.66Å; I619-Y622 VanDerWaalsContact O-N 3.1Å; Y622-L624 VanDerWaalsContact C-N 3.31Å; Y622-L624 PolarHBondContact O-N 3.2Å; Y622-L625 PolarHBondContact O-N 3.16Å; Y622-L626 VanDerWaalsContact O-CB 3.3Å; Y622-L626 WeakPolarHBondContact O-CB 3.47Å; Y622-L626 PolarHBondContact O-N 3.35Å; Y622-L650 HydrophobicContact CD2-CD2 4.02Å
623	E	91.3	Very high	92.7	Very high	11 Å²	11	36 Å²	36	5%	0.051	17%	0.168	C	C	.	.	H	α-helix	trans	-61.3	-40.4	177.5	-168.2	-173.7	171.1	0	0	111.6	I619 P620 K627 H651	I619-E623 PolarHBondContact O-N 3.4Å; P620-E623 PolarHBondContact O-N 3.09Å; E623-K627 HydrophobicContact CG-CD 4.34Å; E623-K627 WeakPolarHBondContact O-CB 3.37Å; E623-K627 VanDerWaalsContact O-CG 3.29Å; E623-K627 WeakPolarHBondContact O-CG 3.24Å; E623-K627 PolarHBondContact O-N 2.9Å; E623-K627 VanDerWaalsContact OE1-CE 3.26Å; E623-K627 WeakPolarHBondContact OE1-CE 3.21Å; E623-K627 IonicContact OE1-NZ 2.75Å; E623-K627 PolarHBondContact OE1-NZ 3.49Å; E623-H651 IonicContact OE1-CE1 3.69Å; E623-H651 IonicContact OE1-CG 3.68Å; E623-H651 IonicContact OE1-ND1 3.88Å; E623-H651 PolarHBondContact OE1-ND1 2.66Å; E623-H651 IonicContact OE2-ND1 2.66Å
624	L	92.7	Very high	92.7	Very high	85 Å²	85	36.5 Å²	36.5	45%	0.445	17%	0.173	S	C	.	.	H	α-helix	trans	-64.7	-49.8	174.3	-67.3	175.2	0	0	0	112.2	F384 P620 R621 Y622 L626 K627 E628	F384-L624 HydrophobicContact CE2-CD1 4.06Å; F384-L624 HydrophobicContact CE2-CD2 4.25Å; F384-L624 HydrophobicContact CZ-CD1 3.89Å; F384-L624 HydrophobicContact CZ-CD2 4.04Å; F384-L624 HydrophobicContact CZ-CG 4.13Å; P620-L624 PolarHBondContact O-N 3.25Å; R621-L624 PolarHBondContact O-N 2.94Å; Y622-L624 VanDerWaalsContact C-N 3.31Å; Y622-L624 PolarHBondContact O-N 3.2Å; L624-L626 VanDerWaalsContact C-N 3.3Å; L624-L626 PolarHBondContact O-N 3.19Å; L624-K627 PolarHBondContact O-N 2.85Å; L624-E628 PolarHBondContact O-N 2.76Å
625	L	95.5	Very high	92.6	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-38.6	178.2	-72.1	168.3	0	0	0	111.8	I476 E479 L480 R621 Y622 L629	I476-L625 HydrophobicContact CG2-CD2 4.18Å; E479-L625 HydrophobicContact CG-CD2 4.28Å; L480-L625 HydrophobicContact CB-CD1 4.37Å; L480-L625 HydrophobicContact CD1-CD1 3.87Å; R621-L625 WeakPolarHBondContact O-CG 3.31Å; R621-L625 PolarHBondContact O-N 3.45Å; Y622-L625 PolarHBondContact O-N 3.16Å; L625-L629 WeakPolarHBondContact O-CB 3.41Å; L625-L629 PolarHBondContact O-N 2.85Å
626	L	95.2	Very high	92.4	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-65.8	-43.5	175.2	-90.3	156.9	0	0	0	112.9	L554 Y622 L624 E628 L629 L630 L643 A646 L650	L554-L626 HydrophobicContact CD1-CD1 4.12Å; L554-L626 HydrophobicContact CD1-CD2 3.87Å; L554-L626 HydrophobicContact CD1-CG 4.16Å; Y622-L626 VanDerWaalsContact O-CB 3.3Å; Y622-L626 WeakPolarHBondContact O-CB 3.47Å; Y622-L626 PolarHBondContact O-N 3.35Å; L624-L626 VanDerWaalsContact C-N 3.3Å; L624-L626 PolarHBondContact O-N 3.19Å; L626-E628 VanDerWaalsContact C-N 3.35Å; L626-L629 PolarHBondContact O-N 3.43Å; L626-L630 WeakPolarHBondContact O-CB 3.24Å; L626-L630 WeakPolarHBondContact O-CG 3.4Å; L626-L630 PolarHBondContact O-N 2.92Å; L626-L643 HydrophobicContact CD2-CB 4.07Å; L626-L643 HydrophobicContact CD2-CD2 3.62Å; L626-L643 HydrophobicContact CD2-CG 4.41Å; L626-A646 HydrophobicContact CD1-CB 4.4Å; L626-A646 HydrophobicContact CD2-CB 4.25Å; L626-L650 HydrophobicContact CD1-CD1 3.42Å; L626-L650 VanDerWaalsContact CD1-CD1 3.42Å
627	K	93	Very high	92.7	Very high	95 Å²	95	40.9 Å²	40.9	41%	0.413	19%	0.194	S	C	.	.	H	α-helix	trans	-62.7	-41.2	176.6	-76.3	172.4	-176.7	174.4	0	111.6	E623 L624 K631	E623-K627 HydrophobicContact CG-CD 4.34Å; E623-K627 WeakPolarHBondContact O-CB 3.37Å; E623-K627 VanDerWaalsContact O-CG 3.29Å; E623-K627 WeakPolarHBondContact O-CG 3.24Å; E623-K627 PolarHBondContact O-N 2.9Å; E623-K627 VanDerWaalsContact OE1-CE 3.26Å; E623-K627 WeakPolarHBondContact OE1-CE 3.21Å; E623-K627 IonicContact OE1-NZ 2.75Å; E623-K627 PolarHBondContact OE1-NZ 3.49Å; L624-K627 PolarHBondContact O-N 2.85Å; K627-K631 WeakPolarHBondContact O-CG 3.44Å; K627-K631 PolarHBondContact O-N 3.23Å
628	E	94.7	Very high	92.9	Very high	72 Å²	72	42.7 Å²	42.7	34%	0.336	21%	0.208	S	C	.	.	H	α-helix	trans	-70.2	-41.9	175.8	-149.9	62.4	-142.9	0	0	111.9	I476 L624 L626 L630 K631 H632	I476-E628 HydrophobicContact CD1-CB 4.03Å; I476-E628 HydrophobicContact CD1-CG 3.82Å; I476-E628 HydrophobicContact CG1-CG 4.49Å; L624-E628 PolarHBondContact O-N 2.76Å; L626-E628 VanDerWaalsContact C-N 3.35Å; E628-L630 VanDerWaalsContact C-N 3.3Å; E628-L630 PolarHBondContact O-N 2.92Å; E628-K631 VanDerWaalsContact CD-NZ 3.29Å; E628-K631 WeakPolarHBondContact O-CB 3.15Å; E628-K631 PolarHBondContact O-N 2.71Å; E628-K631 VanDerWaalsContact OE1-CD 3.27Å; E628-K631 WeakPolarHBondContact OE1-CD 3.49Å; E628-K631 IonicContact OE1-NZ 3.78Å; E628-K631 PolarHBondContact OE1-NZ 2.97Å; E628-K631 VanDerWaalsContact OE1-NZ 3.13Å; E628-K631 IonicContact OE2-NZ 2.8Å; E628-K631 PolarHBondContact OE2-NZ 2.67Å; E628-H632 PolarHBondContact O-CD2 3.07Å; E628-H632 PolarHBondContact O-N 3.34Å
629	L	95.7	Very high	93	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-39.7	177.3	-173.8	58	0	0	0	111.8	R473 I476 V477 L625 L626 H632 T633 L643	R473-L629 HydrophobicContact CB-CD1 4.33Å; R473-L629 HydrophobicContact CG-CD1 3.74Å; I476-L629 HydrophobicContact CB-CD1 4.4Å; I476-L629 HydrophobicContact CG2-CB 3.99Å; I476-L629 HydrophobicContact CG2-CD1 4.29Å; V477-L629 HydrophobicContact CG2-CD1 3.8Å; V477-L629 HydrophobicContact CG2-CD2 4.14Å; L625-L629 WeakPolarHBondContact O-CB 3.41Å; L625-L629 PolarHBondContact O-N 2.85Å; L626-L629 PolarHBondContact O-N 3.43Å; L629-H632 CarbonylContact O-C 3.57Å; L629-H632 PolarHBondContact O-N 2.92Å; L629-T633 WeakPolarHBondContact O-CB 3.18Å; L629-T633 PolarHBondContact O-N 3.01Å; L629-T633 PolarHBondContact O-OG1 3.36Å; L629-L643 HydrophobicContact CD2-CD1 3.91Å; L629-L643 HydrophobicContact CD2-CD2 3.75Å; L629-L643 HydrophobicContact CG-CD1 3.8Å
630	L	94	Very high	93.1	Very high	31 Å²	31	43.3 Å²	43.3	16%	0.162	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-44.5	175.6	-83.6	165.3	0	0	0	112.8	L626 E628 H632 T633 L643 L644	L626-L630 WeakPolarHBondContact O-CB 3.24Å; L626-L630 WeakPolarHBondContact O-CG 3.4Å; L626-L630 PolarHBondContact O-N 2.92Å; E628-L630 VanDerWaalsContact C-N 3.3Å; E628-L630 PolarHBondContact O-N 2.92Å; L630-H632 PolarHBondContact O-N 2.94Å; L630-T633 PolarHBondContact O-N 3.44Å; L630-L643 HydrophobicContact CD1-CB 4.46Å; L630-L643 HydrophobicContact CD2-CB 3.67Å; L630-L643 HydrophobicContact CD2-CD1 4.33Å; L630-L643 HydrophobicContact CG-CB 3.94Å; L630-L644 HydrophobicContact CD1-CD2 4.04Å; L630-L644 HydrophobicContact CD2-CD2 4.22Å; L630-L644 HydrophobicContact CD2-CG 4.02Å
631	K	93.1	Very high	93.3	Very high	118 Å²	118	44.8 Å²	44.8	51%	0.513	23%	0.227	S	C	.	.	H	α-helix	trans	-56.5	-25.6	174.2	-65.5	168.8	-174.9	172.3	0	113.3	W458 K627 E628	W458-K631 WeakPolarHBondContact CZ2-O 3.4Å; K627-K631 WeakPolarHBondContact O-CG 3.44Å; K627-K631 PolarHBondContact O-N 3.23Å; E628-K631 VanDerWaalsContact CD-NZ 3.29Å; E628-K631 WeakPolarHBondContact O-CB 3.15Å; E628-K631 PolarHBondContact O-N 2.71Å; E628-K631 VanDerWaalsContact OE1-CD 3.27Å; E628-K631 WeakPolarHBondContact OE1-CD 3.49Å; E628-K631 IonicContact OE1-NZ 3.78Å; E628-K631 PolarHBondContact OE1-NZ 2.97Å; E628-K631 VanDerWaalsContact OE1-NZ 3.13Å; E628-K631 IonicContact OE2-NZ 2.8Å; E628-K631 PolarHBondContact OE2-NZ 2.67Å
632	H	93.9	Very high	93.5	Very high	33 Å²	33	40.7 Å²	40.7	15%	0.153	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	13.7	-179.8	-72.7	-86.5	0	0	0	113.6	H469 T472 R473 I476 E628 L629 L630	H469-H632 AromaticContact CE1-ND1 3.97Å; H469-H632 AromaticContact CG-ND1 3.81Å; H469-H632 AromaticContact ND1-CE1 3.47Å; H469-H632 PolarHBondContact ND1-CE1 3.48Å; H469-H632 AromaticContact ND1-CG 3.83Å; H469-H632 AromaticContact ND1-ND1 3.03Å; H469-H632 PolarHBondContact ND1-ND1 3.14Å; T472-H632 WeakPolarHBondContact CB-ND1 3.35Å; T472-H632 VanDerWaalsContact CG2-CE1 3.45Å; T472-H632 WeakPolarHBondContact CG2-CE1 3.29Å; R473-H632 HydrophobicContact CB-CB 4.14Å; I476-H632 HydrophobicContact CD1-CB 4.45Å; E628-H632 PolarHBondContact O-CD2 3.07Å; E628-H632 PolarHBondContact O-N 3.34Å; L629-H632 CarbonylContact O-C 3.57Å; L629-H632 PolarHBondContact O-N 2.92Å; L630-H632 PolarHBondContact O-N 2.94Å
633	T	93.3	Very high	93.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.213	C	C	.	.	S	Bend	trans	-128.9	109.9	-177.5	-57	0	0	0	0	110.6	R473 L629 L630 H637 H640 L643	R473-T633 PolarHBondContact NH1-OG1 3.31Å; L629-T633 WeakPolarHBondContact O-CB 3.18Å; L629-T633 PolarHBondContact O-N 3.01Å; L629-T633 PolarHBondContact O-OG1 3.36Å; L630-T633 PolarHBondContact O-N 3.44Å; T633-H637 HydrophobicContact CG2-CB 3.64Å; T633-H640 HydrophobicContact CG2-CB 4.1Å; T633-H640 PolarHBondContact O-ND1 3.01Å; T633-L643 HydrophobicContact CG2-CD1 4.19Å
634	S	90.1	Very high	93.7	Very high	29 Å²	29	44.4 Å²	44.4	20%	0.203	23%	0.234	C	C	.	.			trans	-61.3	153.3	-179.7	60.9	0	0	0	0	113.1	W458 E636 H637 H640	W458-S634 VanDerWaalsContact CD2-CB 3.44Å; S634-E636 PolarHBondContact O-N 3.33Å; S634-H637 WeakPolarHBondContact O-CB 3.4Å; S634-H637 PolarHBondContact O-N 3.48Å; S634-H640 WeakPolarHBondContact O-CB 3.3Å; S634-H640 PolarHBondContact O-ND1 3.19Å
635	V	88.8	Confident	93.7	Very high	25 Å²	25	48 Å²	48	15%	0.152	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-34.8	177.4	-171.9	0	0	0	0	112	L451 D454 M455 H637	L451-V635 HydrophobicContact CB-CG1 4.4Å; L451-V635 HydrophobicContact CD2-CG1 3.75Å; L451-V635 HydrophobicContact CG-CG1 3.82Å; D454-V635 HydrophobicContact CB-CG2 3.99Å; M455-V635 HydrophobicContact CG-CB 3.91Å; M455-V635 HydrophobicContact CG-CG1 4.17Å; M455-V635 HydrophobicContact CG-CG2 4.45Å; V635-H637 PolarHBondContact O-N 3.16Å
636	E	87.8	Confident	93.7	Very high	100 Å²	100	47.1 Å²	47.1	47%	0.467	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-5.5	175.3	-60.2	-179.1	156.2	0	0	114	M455 R459 S634	M455-E636 HydrophobicContact CE-CG 4.03Å; M455-E636 WeakPolarHBondContact CE-OE1 3.5Å; M455-E636 HydrophobicContact CG-CG 4.31Å; R459-E636 IonicContact CZ-OE1 2.69Å; R459-E636 IonicContact NE-OE1 2.65Å; R459-E636 PolarHBondContact NE-OE1 3.1Å; R459-E636 IonicContact NH2-OE1 2.81Å; R459-E636 PolarHBondContact NH2-OE1 2.7Å; S634-E636 PolarHBondContact O-N 3.33Å
637	H	93.3	Very high	93.6	Very high	22 Å²	22	47.6 Å²	47.6	10%	0.102	24%	0.244	C	C	.	.	S	Bend	trans	-79.6	132.8	-179.6	-171.2	-75.3	0	0	0	110.8	R473 N546 K547 Q548 T633 S634 V635 D639 H640	R473-H637 VanDerWaalsContact CZ-CE1 3.44Å; R473-H637 PolarHBondContact NH2-CE1 3.45Å; N546-H637 PolarHBondContact O-CD2 2.67Å; N546-H637 PolarHBondContact O-NE2 3.26Å; K547-H637 VanDerWaalsContact C-CE1 3.4Å; K547-H637 WeakPolarHBondContact CA-NE2 3.19Å; K547-H637 PolarHBondContact N-NE2 3.2Å; K547-H637 VanDerWaalsContact N-NE2 3.12Å; K547-H637 PolarHBondContact O-CE1 2.64Å; Q548-H637 PolarHBondContact O-CE1 3.1Å; T633-H637 HydrophobicContact CG2-CB 3.64Å; S634-H637 WeakPolarHBondContact O-CB 3.4Å; S634-H637 PolarHBondContact O-N 3.48Å; V635-H637 PolarHBondContact O-N 3.16Å; H637-D639 WeakPolarHBondContact CE1-CB 3.23Å; H637-D639 WeakPolarHBondContact ND1-CB 3.31Å; H637-D639 PolarHBondContact ND1-N 2.9Å; H637-D639 VanDerWaalsContact ND1-N 3.1Å; H637-D639 PolarHBondContact O-N 3.36Å; H637-H640 WeakPolarHBondContact O-CB 3.24Å; H637-H640 PolarHBondContact O-N 2.94Å
638	P	94.4	Very high	93.5	Very high	69 Å²	69	49.7 Å²	49.7	45%	0.448	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-0.4	-171.8	31.1	-39.5	0	0	0	115.1	K547 K549	K547-P638 WeakPolarHBondContact O-CG 3.44Å; K549-P638 VanDerWaalsContact CE-O 3.22Å; K549-P638 WeakPolarHBondContact CE-O 3.36Å
639	D	96.2	Very high	93.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-19.3	173.2	-162.6	36.1	0	0	0	112.8	R473 K549 I550 G551 H637 A641 L642 L643	R473-D639 IonicContact CZ-OD2 3.56Å; R473-D639 IonicContact NH1-OD2 2.7Å; R473-D639 PolarHBondContact NH1-OD2 3.1Å; R473-D639 VanDerWaalsContact NH1-OD2 3.16Å; R473-D639 IonicContact NH2-OD2 2.77Å; R473-D639 PolarHBondContact NH2-OD2 3Å; K549-D639 VanDerWaalsContact CA-CG 3.49Å; K549-D639 WeakPolarHBondContact CA-OD1 3.32Å; K549-D639 HydrophobicContact CB-CB 4.3Å; K549-D639 WeakPolarHBondContact CB-OD1 3.28Å; K549-D639 HydrophobicContact CG-CB 4.11Å; I550-D639 VanDerWaalsContact N-CG 3.3Å; I550-D639 PolarHBondContact N-OD1 2.94Å; I550-D639 PolarHBondContact N-OD2 3.38Å; I550-D639 VanDerWaalsContact N-OD2 3.17Å; G551-D639 PolarHBondContact N-OD1 2.92Å; H637-D639 WeakPolarHBondContact CE1-CB 3.23Å; H637-D639 WeakPolarHBondContact ND1-CB 3.31Å; H637-D639 PolarHBondContact ND1-N 2.9Å; H637-D639 VanDerWaalsContact ND1-N 3.1Å; H637-D639 PolarHBondContact O-N 3.36Å; D639-A641 PolarHBondContact O-N 3.2Å; D639-L642 CarbonylContact O-C 3.57Å; D639-L642 WeakPolarHBondContact O-CA 3.29Å; D639-L642 WeakPolarHBondContact O-CB 3.32Å; D639-L642 PolarHBondContact O-N 2.64Å; D639-L643 HydrophobicContact CB-CD1 4.47Å; D639-L643 HydrophobicContact CB-CG 4.47Å; D639-L643 WeakPolarHBondContact O-CG 3.4Å; D639-L643 PolarHBondContact O-N 2.83Å; D639-L643 WeakPolarHBondContact OD2-CD1 3.17Å; D639-L643 WeakPolarHBondContact OD2-CG 3.28Å
640	H	94.5	Very high	93.2	Very high	25 Å²	25	47.3 Å²	47.3	12%	0.116	24%	0.243	C	C	.	.	H	α-helix	trans	-56.7	-50.3	-169.1	-173.8	99.4	0	0	0	112.7	T633 S634 H637 L642 L643 L644	T633-H640 HydrophobicContact CG2-CB 4.1Å; T633-H640 PolarHBondContact O-ND1 3.01Å; S634-H640 WeakPolarHBondContact O-CB 3.3Å; S634-H640 PolarHBondContact O-ND1 3.19Å; H637-H640 WeakPolarHBondContact O-CB 3.24Å; H637-H640 PolarHBondContact O-N 2.94Å; H640-L642 VanDerWaalsContact C-N 3.27Å; H640-L642 PolarHBondContact O-N 3.19Å; H640-L643 PolarHBondContact O-N 3.28Å; H640-L644 PolarHBondContact O-N 3.42Å
641	A	93.6	Very high	93.1	Very high	67 Å²	67	48.3 Å²	48.3	55%	0.554	25%	0.247	S	C	*	.	H	α-helix	trans	-65.8	-26.1	176.2	0	0	0	0	0	113.8	D639 R645	D639-A641 PolarHBondContact O-N 3.2Å; A641-R645 WeakPolarHBondContact O-CB 3.36Å; A641-R645 PolarHBondContact O-N 2.75Å
642	L	96.7	Very high	92.9	Very high	37 Å²	37	47.4 Å²	47.4	19%	0.194	25%	0.245	C	C	.	.	H	α-helix	trans	-77.7	-39	176	-61.2	173.3	0	0	0	111.2	K549 D552 L555 D639 H640 R645 A646	K549-L642 HydrophobicContact CB-CD1 4.46Å; K549-L642 HydrophobicContact CD-CD1 3.73Å; K549-L642 HydrophobicContact CG-CD1 4.22Å; D552-L642 HydrophobicContact CB-CD1 4.23Å; L555-L642 HydrophobicContact CD1-CD2 4.19Å; D639-L642 CarbonylContact O-C 3.57Å; D639-L642 WeakPolarHBondContact O-CA 3.29Å; D639-L642 WeakPolarHBondContact O-CB 3.32Å; D639-L642 PolarHBondContact O-N 2.64Å; H640-L642 VanDerWaalsContact C-N 3.27Å; H640-L642 PolarHBondContact O-N 3.19Å; L642-R645 PolarHBondContact O-N 3.13Å; L642-A646 VanDerWaalsContact O-CB 3.3Å; L642-A646 WeakPolarHBondContact O-CB 3.18Å; L642-A646 PolarHBondContact O-N 3.22Å
643	L	96.2	Very high	92.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.1	-40.2	174.5	-65.5	177.2	0	0	0	112	L554 L626 L629 L630 T633 D639 H640 R645 A646 G647	L554-L643 HydrophobicContact CD1-CD2 4.49Å; L626-L643 HydrophobicContact CD2-CB 4.07Å; L626-L643 HydrophobicContact CD2-CD2 3.62Å; L626-L643 HydrophobicContact CD2-CG 4.41Å; L629-L643 HydrophobicContact CD2-CD1 3.91Å; L629-L643 HydrophobicContact CD2-CD2 3.75Å; L629-L643 HydrophobicContact CG-CD1 3.8Å; L630-L643 HydrophobicContact CD1-CB 4.46Å; L630-L643 HydrophobicContact CD2-CB 3.67Å; L630-L643 HydrophobicContact CD2-CD1 4.33Å; L630-L643 HydrophobicContact CG-CB 3.94Å; T633-L643 HydrophobicContact CG2-CD1 4.19Å; D639-L643 HydrophobicContact CB-CD1 4.47Å; D639-L643 HydrophobicContact CB-CG 4.47Å; D639-L643 WeakPolarHBondContact O-CG 3.4Å; D639-L643 PolarHBondContact O-N 2.83Å; D639-L643 WeakPolarHBondContact OD2-CD1 3.17Å; D639-L643 WeakPolarHBondContact OD2-CG 3.28Å; H640-L643 PolarHBondContact O-N 3.28Å; L643-R645 VanDerWaalsContact C-N 3.34Å; L643-R645 PolarHBondContact O-N 2.89Å; L643-A646 PolarHBondContact O-N 3Å; L643-G647 PolarHBondContact O-N 3.05Å
644	L	94.1	Very high	92.3	Very high	92 Å²	92	47 Å²	47	48%	0.482	25%	0.246	S	C	.	.	H	α-helix	trans	-57.8	-47	171.5	-76.8	171.5	0	0	0	111.3	L630 H640 G647 K648	L630-L644 HydrophobicContact CD1-CD2 4.04Å; L630-L644 HydrophobicContact CD2-CD2 4.22Å; L630-L644 HydrophobicContact CD2-CG 4.02Å; H640-L644 PolarHBondContact O-N 3.42Å; L644-G647 PolarHBondContact O-N 3.4Å; L644-K648 PolarHBondContact O-N 3.45Å
645	R	93.8	Very high	92	Very high	160 Å²	160	47.4 Å²	47.4	60%	0.604	25%	0.246	S	C	*	.	H	α-helix	trans	-66.7	-41.8	178.6	-164.6	-176.2	-62.7	-177.4	-1.2	112.3	L555 A641 L642 L643 K648 V649	L555-R645 HydrophobicContact CD1-CB 4.25Å; L555-R645 HydrophobicContact CD1-CG 4.35Å; L555-R645 HydrophobicContact CD2-CB 4.32Å; L555-R645 HydrophobicContact CD2-CG 3.96Å; A641-R645 WeakPolarHBondContact O-CB 3.36Å; A641-R645 PolarHBondContact O-N 2.75Å; L642-R645 PolarHBondContact O-N 3.13Å; L643-R645 VanDerWaalsContact C-N 3.34Å; L643-R645 PolarHBondContact O-N 2.89Å; R645-K648 PolarHBondContact O-N 3.06Å; R645-V649 WeakPolarHBondContact O-CG2 3.02Å; R645-V649 PolarHBondContact O-N 2.86Å; R645-V649 VanDerWaalsContact O-N 3.09Å
646	A	95.1	Very high	91.6	Very high	2 Å²	2	50.6 Å²	50.6	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-40.8	175.1	0	0	0	0	0	111.9	L554 L555 L626 L642 L643 V649 L650	L554-A646 HydrophobicContact CB-CB 3.88Å; L554-A646 HydrophobicContact CD1-CB 4.24Å; L555-A646 HydrophobicContact CD2-CB 4.37Å; L555-A646 HydrophobicContact CG-CB 4.15Å; L626-A646 HydrophobicContact CD1-CB 4.4Å; L626-A646 HydrophobicContact CD2-CB 4.25Å; L642-A646 VanDerWaalsContact O-CB 3.3Å; L642-A646 WeakPolarHBondContact O-CB 3.18Å; L642-A646 PolarHBondContact O-N 3.22Å; L643-A646 PolarHBondContact O-N 3Å; A646-V649 PolarHBondContact O-N 2.7Å; A646-L650 WeakPolarHBondContact O-CB 3.33Å; A646-L650 PolarHBondContact O-N 2.89Å
647	G	92.5	Very high	91.2	Very high	17 Å²	17	46.5 Å²	46.5	18%	0.175	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-44.7	173.9	0	0	0	0	0	112.3	L643 L644 L650 H651	L643-G647 PolarHBondContact O-N 3.05Å; L644-G647 PolarHBondContact O-N 3.4Å; G647-L650 PolarHBondContact O-N 3.25Å; G647-H651 WeakPolarHBondContact O-CB 3.35Å; G647-H651 PolarHBondContact O-N 3.39Å
648	K	92.4	Very high	90.4	Very high	138 Å²	138	47.3 Å²	47.3	60%	0.6	24%	0.244	S	C	*	.	H	α-helix	trans	-60.6	-50.2	175	-178.9	167.7	174.8	172.3	0	112.1	L644 R645 L650 H651 E652	L644-K648 PolarHBondContact O-N 3.45Å; R645-K648 PolarHBondContact O-N 3.06Å; K648-L650 PolarHBondContact O-N 2.99Å; K648-H651 PolarHBondContact O-N 2.77Å; K648-E652 WeakPolarHBondContact CE-OE1 3.42Å; K648-E652 HydrophobicContact CG-CG 4.44Å; K648-E652 WeakPolarHBondContact CG-OE1 3.32Å; K648-E652 IonicContact NZ-OE1 2.74Å; K648-E652 WeakPolarHBondContact O-CB 3.48Å; K648-E652 WeakPolarHBondContact O-CG 3.47Å; K648-E652 PolarHBondContact O-N 3.07Å
649	V	91.9	Very high	89.5	Confident	26 Å²	26	49.2 Å²	49.2	16%	0.158	25%	0.247	C	C	.	.	H	α-helix	trans	-59.1	-43.7	179.1	170.8	0	0	0	0	112.1	L555 F558 T559 R645 A646 E652 L653	L555-V649 HydrophobicContact CD2-CG2 4Å; F558-V649 HydrophobicContact CB-CG1 4.3Å; T559-V649 HydrophobicContact CG2-CG1 3.92Å; T559-V649 HydrophobicContact CG2-CG2 3.89Å; R645-V649 WeakPolarHBondContact O-CG2 3.02Å; R645-V649 PolarHBondContact O-N 2.86Å; R645-V649 VanDerWaalsContact O-N 3.09Å; A646-V649 PolarHBondContact O-N 2.7Å; V649-E652 PolarHBondContact O-N 3.24Å; V649-L653 WeakPolarHBondContact O-CB 3.34Å; V649-L653 PolarHBondContact O-N 3.02Å
650	L	91.8	Very high	88.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-72.4	-31.9	179	-80.7	159.3	0	0	0	112.9	L554 F558 I619 Y622 L626 A646 G647 K648 A654	L554-L650 HydrophobicContact CD2-CD1 4.19Å; F558-L650 HydrophobicContact CB-CD2 4.21Å; F558-L650 HydrophobicContact CB-CG 4.4Å; F558-L650 HydrophobicContact CD1-CD2 3.99Å; F558-L650 HydrophobicContact CD2-CD1 4.34Å; F558-L650 HydrophobicContact CD2-CD2 4.06Å; F558-L650 HydrophobicContact CD2-CG 4.47Å; F558-L650 HydrophobicContact CE1-CD2 4.42Å; F558-L650 HydrophobicContact CE2-CD2 4.49Å; F558-L650 HydrophobicContact CG-CD2 3.81Å; F558-L650 HydrophobicContact CG-CG 4.37Å; I619-L650 HydrophobicContact CD1-CD2 4.08Å; I619-L650 HydrophobicContact CG2-CD2 4.4Å; Y622-L650 HydrophobicContact CD2-CD2 4.02Å; L626-L650 HydrophobicContact CD1-CD1 3.42Å; L626-L650 VanDerWaalsContact CD1-CD1 3.42Å; A646-L650 WeakPolarHBondContact O-CB 3.33Å; A646-L650 PolarHBondContact O-N 2.89Å; G647-L650 PolarHBondContact O-N 3.25Å; K648-L650 PolarHBondContact O-N 2.99Å; L650-A654 WeakPolarHBondContact O-CB 3.5Å; L650-A654 PolarHBondContact O-N 3.32Å
651	H	91.3	Very high	87.3	Confident	53 Å²	53	51.8 Å²	51.8	25%	0.245	26%	0.26	C	S	.	.	H	α-helix	trans	-69.9	-39	172.6	-176.2	84.6	0	0	0	111.9	R392 E623 G647 K648 A654 N655	R392-H651 PolarHBondContact NH1-NE2 3.11Å; R392-H651 PolarHBondContact NH2-CE1 2.97Å; R392-H651 VanDerWaalsContact NH2-CE1 3.3Å; E623-H651 IonicContact OE1-CE1 3.69Å; E623-H651 IonicContact OE1-CG 3.68Å; E623-H651 IonicContact OE1-ND1 3.88Å; E623-H651 PolarHBondContact OE1-ND1 2.66Å; E623-H651 IonicContact OE2-ND1 2.66Å; G647-H651 WeakPolarHBondContact O-CB 3.35Å; G647-H651 PolarHBondContact O-N 3.39Å; K648-H651 PolarHBondContact O-N 2.77Å; H651-A654 PolarHBondContact O-N 3.09Å; H651-N655 PolarHBondContact CD2-ND2 3.3Å; H651-N655 PolarHBondContact NE2-ND2 3.1Å; H651-N655 WeakPolarHBondContact O-CB 3.49Å; H651-N655 PolarHBondContact O-N 2.89Å; H651-N655 PolarHBondContact O-ND2 2.95Å
652	E	89.5	Confident	86.2	Confident	98 Å²	98	53.4 Å²	53.4	46%	0.458	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-44.9	172.2	-74.4	168	172.7	0	0	111.2	K648 V649 N655 K656	K648-E652 WeakPolarHBondContact CE-OE1 3.42Å; K648-E652 HydrophobicContact CG-CG 4.44Å; K648-E652 WeakPolarHBondContact CG-OE1 3.32Å; K648-E652 IonicContact NZ-OE1 2.74Å; K648-E652 WeakPolarHBondContact O-CB 3.48Å; K648-E652 WeakPolarHBondContact O-CG 3.47Å; K648-E652 PolarHBondContact O-N 3.07Å; V649-E652 PolarHBondContact O-N 3.24Å; E652-N655 PolarHBondContact O-N 2.95Å; E652-K656 WeakPolarHBondContact O-CB 3.39Å; E652-K656 PolarHBondContact O-N 2.65Å
653	L	87.1	Confident	84.8	Confident	9 Å²	9	57 Å²	57	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-43.8	173.2	-178.4	58.4	0	0	0	112.1	F558 I564 I619 V649 N655 K656 I657	F558-L653 HydrophobicContact CD1-CD2 4.32Å; I564-L653 HydrophobicContact CG1-CD1 4.37Å; I564-L653 HydrophobicContact CG2-CD1 4.05Å; I619-L653 HydrophobicContact CD1-CD2 3.79Å; I619-L653 HydrophobicContact CG1-CD2 4.26Å; I619-L653 HydrophobicContact CG2-CD2 4.42Å; I619-L653 HydrophobicContact CG2-CG 4.34Å; V649-L653 WeakPolarHBondContact O-CB 3.34Å; V649-L653 PolarHBondContact O-N 3.02Å; L653-N655 PolarHBondContact O-N 3.11Å; L653-K656 PolarHBondContact O-N 3.39Å; L653-I657 HydrophobicContact CD1-CD1 4.27Å; L653-I657 HydrophobicContact CG-CD1 4.12Å; L653-I657 VanDerWaalsContact O-CG1 3.26Å; L653-I657 WeakPolarHBondContact O-CG1 3.19Å; L653-I657 PolarHBondContact O-N 3.12Å
654	A	86.9	Confident	83.4	Confident	16 Å²	16	58.5 Å²	58.5	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-62.9	-40.4	176.7	0	0	0	0	0	112.7	I619 L650 H651 I657 D658	I619-A654 HydrophobicContact CG2-CB 4.07Å; L650-A654 WeakPolarHBondContact O-CB 3.5Å; L650-A654 PolarHBondContact O-N 3.32Å; H651-A654 PolarHBondContact O-N 3.09Å; A654-I657 PolarHBondContact O-N 3.41Å; A654-D658 PolarHBondContact O-N 3.06Å
655	N	84.4	Confident	82.4	Confident	38 Å²	38	54.9 Å²	54.9	20%	0.203	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-43.2	175	-70.6	-24.7	0	0	0	111.5	R392 H651 E652 L653 I657 D658 Q659	R392-N655 PolarHBondContact NH1-ND2 3.3Å; R392-N655 PolarHBondContact NH1-OD1 3.42Å; R392-N655 PolarHBondContact NH2-OD1 3.42Å; H651-N655 PolarHBondContact CD2-ND2 3.3Å; H651-N655 PolarHBondContact NE2-ND2 3.1Å; H651-N655 WeakPolarHBondContact O-CB 3.49Å; H651-N655 PolarHBondContact O-N 2.89Å; H651-N655 PolarHBondContact O-ND2 2.95Å; E652-N655 PolarHBondContact O-N 2.95Å; L653-N655 PolarHBondContact O-N 3.11Å; N655-I657 VanDerWaalsContact C-N 3.27Å; N655-I657 PolarHBondContact O-N 3.18Å; N655-D658 PolarHBondContact O-N 2.87Å; N655-Q659 WeakPolarHBondContact O-CB 3.02Å; N655-Q659 WeakPolarHBondContact O-CG 3.23Å; N655-Q659 PolarHBondContact O-N 3.15Å
656	K	81.2	Confident	81.4	Confident	92 Å²	92	52.6 Å²	52.6	40%	0.4	26%	0.261	S	S	.	.	H	α-helix	trans	-60.7	-39	176.8	-152.3	-179.4	-173.9	-179.2	0	111.3	M568 E652 L653 T660	M568-K656 HydrophobicContact CE-CB 4.39Å; M568-K656 HydrophobicContact CE-CD 4.2Å; M568-K656 HydrophobicContact CE-CG 3.8Å; M568-K656 HydrophobicContact SD-CB 4.36Å; M568-K656 HydrophobicContact SD-CD 4.23Å; M568-K656 HydrophobicContact SD-CG 4.18Å; E652-K656 WeakPolarHBondContact O-CB 3.39Å; E652-K656 PolarHBondContact O-N 2.65Å; L653-K656 PolarHBondContact O-N 3.39Å; K656-T660 WeakPolarHBondContact O-CB 3.1Å; K656-T660 PolarHBondContact O-N 3.23Å; K656-T660 PolarHBondContact O-OG1 3.37Å
657	I	77.6	Confident	80.2	Confident	14 Å²	14	54.1 Å²	54.1	7%	0.072	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-46.5	173.6	-72.1	168.6	0	0	0	112	M568 I571 I619 L653 A654 N655 Q661	M568-I657 HydrophobicContact SD-CG1 4.09Å; I571-I657 HydrophobicContact CD1-CB 4.28Å; I571-I657 HydrophobicContact CD1-CD1 3.56Å; I571-I657 HydrophobicContact CD1-CG1 3.55Å; I571-I657 HydrophobicContact CD1-CG2 3.81Å; I571-I657 HydrophobicContact CG2-CG2 4.47Å; I619-I657 HydrophobicContact CB-CD1 4.33Å; I619-I657 HydrophobicContact CG1-CD1 4.14Å; I619-I657 HydrophobicContact CG2-CD1 4.31Å; L653-I657 HydrophobicContact CD1-CD1 4.27Å; L653-I657 HydrophobicContact CG-CD1 4.12Å; L653-I657 VanDerWaalsContact O-CG1 3.26Å; L653-I657 WeakPolarHBondContact O-CG1 3.19Å; L653-I657 PolarHBondContact O-N 3.12Å; A654-I657 PolarHBondContact O-N 3.41Å; N655-I657 VanDerWaalsContact C-N 3.27Å; N655-I657 PolarHBondContact O-N 3.18Å; I657-Q661 WeakPolarHBondContact O-CB 3.4Å; I657-Q661 WeakPolarHBondContact O-CG 3.34Å; I657-Q661 PolarHBondContact O-N 3.09Å
658	D	77.6	Confident	79.5	Confident	39 Å²	39	56.9 Å²	56.9	21%	0.209	28%	0.282	C	S	.	.	H	α-helix	trans	-66.6	-39.9	178.9	-171.6	37.2	0	0	0	111.8	K389 A654 N655 Q662	K389-D658 WeakPolarHBondContact CE-OD2 3.3Å; K389-D658 IonicContact NZ-OD1 3.17Å; K389-D658 IonicContact NZ-OD2 2.82Å; K389-D658 PolarHBondContact NZ-OD2 3.46Å; A654-D658 PolarHBondContact O-N 3.06Å; N655-D658 PolarHBondContact O-N 2.87Å; D658-Q662 VanDerWaalsContact O-CG 3.31Å; D658-Q662 WeakPolarHBondContact O-CG 3.38Å; D658-Q662 PolarHBondContact O-N 3.28Å; D658-Q662 VanDerWaalsContact O-N 3.15Å; D658-Q662 PolarHBondContact O-NE2 3.02Å; D658-Q662 VanDerWaalsContact O-NE2 3.09Å; D658-Q662 PolarHBondContact OD1-NE2 2.93Å; D658-Q662 PolarHBondContact OD2-NE2 3.29Å
659	Q	75.2	Confident	79	Confident	110 Å²	110	57 Å²	57	51%	0.514	29%	0.285	S	S	.	.	H	α-helix	trans	-58.6	-56.2	172.7	-76.1	173.9	-34.2	0	0	111	N655 Q661 Q662 E663	N655-Q659 WeakPolarHBondContact O-CB 3.02Å; N655-Q659 WeakPolarHBondContact O-CG 3.23Å; N655-Q659 PolarHBondContact O-N 3.15Å; Q659-Q661 VanDerWaalsContact C-N 3.31Å; Q659-Q661 PolarHBondContact O-N 3.25Å; Q659-Q662 CarbonylContact O-C 3.6Å; Q659-Q662 WeakPolarHBondContact O-CA 3.34Å; Q659-Q662 WeakPolarHBondContact O-CB 3.37Å; Q659-Q662 PolarHBondContact O-N 3.4Å; Q659-E663 WeakPolarHBondContact O-CG 3.19Å; Q659-E663 PolarHBondContact O-N 2.81Å
660	T	72.5	Confident	78.8	Confident	20 Å²	20	56.6 Å²	56.6	12%	0.123	28%	0.281	C	S	.	.	H	α-helix	trans	-69.7	-24.6	-176.1	-61.7	0	0	0	0	113.8	M568 N572 K656 E663 T664	M568-T660 HydrophobicContact CE-CG2 3.98Å; M568-T660 VanDerWaalsContact CE-OG1 3.25Å; M568-T660 WeakPolarHBondContact CE-OG1 3.39Å; N572-T660 WeakPolarHBondContact OD1-CG2 3.4Å; K656-T660 WeakPolarHBondContact O-CB 3.1Å; K656-T660 PolarHBondContact O-N 3.23Å; K656-T660 PolarHBondContact O-OG1 3.37Å; T660-E663 WeakPolarHBondContact CA-OE2 3.23Å; T660-E663 PolarHBondContact OG1-OE2 2.88Å; T660-T664 HydrophobicContact CG2-CG2 4.32Å; T660-T664 WeakPolarHBondContact O-CB 3.45Å; T660-T664 WeakPolarHBondContact O-CG2 3.4Å; T660-T664 PolarHBondContact O-N 2.8Å; T660-T664 PolarHBondContact O-OG1 3.24Å
661	Q	71.1	Confident	78.4	Confident	59 Å²	59	59.1 Å²	59.1	28%	0.276	29%	0.293	S	S	.	.	H	α-helix	trans	-68.2	-34.8	167.3	-76.5	-169.2	19.6	0	0	113.3	I571 K575 V616 I657 Q659 T664 G665	I571-Q661 HydrophobicContact CG2-CG 3.77Å; K575-Q661 PolarHBondContact NZ-O 3.16Å; V616-Q661 VanDerWaalsContact CG1-NE2 3.32Å; I657-Q661 WeakPolarHBondContact O-CB 3.4Å; I657-Q661 WeakPolarHBondContact O-CG 3.34Å; I657-Q661 PolarHBondContact O-N 3.09Å; Q659-Q661 VanDerWaalsContact C-N 3.31Å; Q659-Q661 PolarHBondContact O-N 3.25Å; Q661-T664 PolarHBondContact O-OG1 3.3Å; Q661-G665 PolarHBondContact O-N 3.26Å; Q661-G665 VanDerWaalsContact O-N 3.07Å
662	Q	70.9	Confident	78	Confident	100 Å²	100	60.3 Å²	60.3	47%	0.467	30%	0.299	S	S	.	.	H	α-helix	trans	-73	-45.2	174.1	-70.5	165	55.3	0	0	111.4	D658 Q659 G665 F666	D658-Q662 VanDerWaalsContact O-CG 3.31Å; D658-Q662 WeakPolarHBondContact O-CG 3.38Å; D658-Q662 PolarHBondContact O-N 3.28Å; D658-Q662 VanDerWaalsContact O-N 3.15Å; D658-Q662 PolarHBondContact O-NE2 3.02Å; D658-Q662 VanDerWaalsContact O-NE2 3.09Å; D658-Q662 PolarHBondContact OD1-NE2 2.93Å; D658-Q662 PolarHBondContact OD2-NE2 3.29Å; Q659-Q662 CarbonylContact O-C 3.6Å; Q659-Q662 WeakPolarHBondContact O-CA 3.34Å; Q659-Q662 WeakPolarHBondContact O-CB 3.37Å; Q659-Q662 PolarHBondContact O-N 3.4Å; Q662-G665 CarbonylContact O-C 3.58Å; Q662-G665 PolarHBondContact O-N 3.19Å; Q662-F666 WeakPolarHBondContact O-CB 3.42Å; Q662-F666 PolarHBondContact O-N 3.45Å
663	E	68.5	Low	77.9	Confident	112 Å²	112	60 Å²	60	52%	0.523	30%	0.296	S	S	.	.	H	α-helix	trans	-58	-52.1	176	-68.2	161.8	170.6	0	0	111.6	Q659 T660 G665 F666 S667	Q659-E663 WeakPolarHBondContact O-CG 3.19Å; Q659-E663 PolarHBondContact O-N 2.81Å; T660-E663 WeakPolarHBondContact CA-OE2 3.23Å; T660-E663 PolarHBondContact OG1-OE2 2.88Å; E663-G665 VanDerWaalsContact C-N 3.32Å; E663-G665 PolarHBondContact O-N 2.89Å; E663-F666 PolarHBondContact O-N 3.39Å; E663-S667 PolarHBondContact O-N 3.46Å
664	T	67.2	Low	78	Confident	33 Å²	33	59.6 Å²	59.6	20%	0.202	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-41.2	175.4	52.2	0	0	0	0	111.2	K575 T660 Q661 F666 S667 D668	K575-T664 PolarHBondContact NZ-OG1 3.48Å; T660-T664 HydrophobicContact CG2-CG2 4.32Å; T660-T664 WeakPolarHBondContact O-CB 3.45Å; T660-T664 WeakPolarHBondContact O-CG2 3.4Å; T660-T664 PolarHBondContact O-N 2.8Å; T660-T664 PolarHBondContact O-OG1 3.24Å; Q661-T664 PolarHBondContact O-OG1 3.3Å; T664-F666 VanDerWaalsContact C-N 3.3Å; T664-F666 PolarHBondContact O-N 3.48Å; T664-S667 PolarHBondContact O-N 3.1Å; T664-D668 WeakPolarHBondContact O-CB 3.44Å; T664-D668 PolarHBondContact O-N 3.06Å; T664-D668 VanDerWaalsContact O-OD2 3.06Å
665	G	71.2	Confident	78.1	Confident	15 Å²	15	63.7 Å²	63.7	16%	0.155	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-30.4	177.7	0	0	0	0	0	113.9	K575 Q661 Q662 E663 Q669	K575-G665 VanDerWaalsContact NZ-N 3.1Å; Q661-G665 PolarHBondContact O-N 3.26Å; Q661-G665 VanDerWaalsContact O-N 3.07Å; Q662-G665 CarbonylContact O-C 3.58Å; Q662-G665 PolarHBondContact O-N 3.19Å; E663-G665 VanDerWaalsContact C-N 3.32Å; E663-G665 PolarHBondContact O-N 2.89Å; G665-Q669 VanDerWaalsContact O-CG 3.32Å; G665-Q669 WeakPolarHBondContact O-CG 3.28Å; G665-Q669 PolarHBondContact O-N 2.99Å; G665-Q669 PolarHBondContact O-NE2 3.09Å
666	F	74	Confident	78.2	Confident	113 Å²	113	67.1 Å²	67.1	50%	0.496	32%	0.32	S	S	.	.	H	α-helix	trans	-75.4	-43.2	172.5	-179.2	-98.1	0	0	0	111.3	Q662 E663 T664 Q669 M670	Q662-F666 WeakPolarHBondContact O-CB 3.42Å; Q662-F666 PolarHBondContact O-N 3.45Å; E663-F666 PolarHBondContact O-N 3.39Å; T664-F666 VanDerWaalsContact C-N 3.3Å; T664-F666 PolarHBondContact O-N 3.48Å; F666-Q669 PolarHBondContact O-N 3.43Å; F666-M670 HydrophobicContact CE1-CE 3.82Å; F666-M670 HydrophobicContact CE2-CE 4.06Å; F666-M670 HydrophobicContact CZ-CE 3.41Å; F666-M670 VanDerWaalsContact CZ-CE 3.41Å; F666-M670 WeakPolarHBondContact O-CB 3.41Å; F666-M670 PolarHBondContact O-N 3.16Å
667	S	70.6	Confident	78.6	Confident	34 Å²	34	63 Å²	63	24%	0.238	30%	0.303	C	S	.	.	H	α-helix	trans	-62.6	-43.4	175.5	-168.5	0	0	0	0	112	E663 T664 Q669 M670 Q671	E663-S667 PolarHBondContact O-N 3.46Å; T664-S667 PolarHBondContact O-N 3.1Å; S667-Q669 VanDerWaalsContact C-N 3.33Å; S667-Q669 PolarHBondContact O-N 2.82Å; S667-M670 PolarHBondContact O-N 3.03Å; S667-Q671 WeakPolarHBondContact O-CG 3.49Å; S667-Q671 PolarHBondContact O-N 3.08Å
668	D	76.6	Confident	79.1	Confident	75 Å²	75	64.9 Å²	64.9	40%	0.401	31%	0.311	S	S	.	.	H	α-helix	trans	-52.9	-49.7	173.7	-70.3	-36.1	0	0	0	111.2	K575 T664 Q672	K575-D668 IonicContact NZ-OD2 3.68Å; K575-D668 PolarHBondContact NZ-OD2 3.2Å; T664-D668 WeakPolarHBondContact O-CB 3.44Å; T664-D668 PolarHBondContact O-N 3.06Å; T664-D668 VanDerWaalsContact O-OD2 3.06Å; D668-Q672 WeakPolarHBondContact O-CB 3.48Å; D668-Q672 PolarHBondContact O-N 3.35Å; D668-Q672 VanDerWaalsContact O-N 3.17Å
669	Q	81.8	Confident	79.5	Confident	141 Å²	141	67.3 Å²	67.3	66%	0.659	34%	0.337	S	S	*	.	H	α-helix	trans	-68.1	-39.2	178.4	-74.5	172.6	71.2	0	0	112.3	G665 F666 S667 Q672 K673	G665-Q669 VanDerWaalsContact O-CG 3.32Å; G665-Q669 WeakPolarHBondContact O-CG 3.28Å; G665-Q669 PolarHBondContact O-N 2.99Å; G665-Q669 PolarHBondContact O-NE2 3.09Å; F666-Q669 PolarHBondContact O-N 3.43Å; S667-Q669 VanDerWaalsContact C-N 3.33Å; S667-Q669 PolarHBondContact O-N 2.82Å; Q669-Q672 PolarHBondContact O-N 2.88Å; Q669-K673 WeakPolarHBondContact O-CB 3.43Å; Q669-K673 PolarHBondContact O-N 2.84Å
670	M	86.9	Confident	80	Confident	17 Å²	17	64.7 Å²	64.7	8%	0.084	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-50.5	179.4	-169.5	60.2	66.5	0	0	111	F666 S667 Q672 K673 L674 R692 I693 Y694	F666-M670 HydrophobicContact CE1-CE 3.82Å; F666-M670 HydrophobicContact CE2-CE 4.06Å; F666-M670 HydrophobicContact CZ-CE 3.41Å; F666-M670 VanDerWaalsContact CZ-CE 3.41Å; F666-M670 WeakPolarHBondContact O-CB 3.41Å; F666-M670 PolarHBondContact O-N 3.16Å; S667-M670 PolarHBondContact O-N 3.03Å; M670-Q672 PolarHBondContact O-N 2.87Å; M670-K673 CarbonylContact O-C 3.6Å; M670-K673 WeakPolarHBondContact O-CA 3.42Å; M670-K673 WeakPolarHBondContact O-CB 3.41Å; M670-K673 PolarHBondContact O-N 3.34Å; M670-L674 WeakPolarHBondContact O-CG 3.44Å; M670-L674 PolarHBondContact O-N 3.4Å; M670-R692 VanDerWaalsContact CG-O 3.23Å; M670-R692 WeakPolarHBondContact CG-O 3.11Å; M670-I693 HydrophobicContact CE-CB 4.45Å; M670-I693 HydrophobicContact CE-CG2 3.91Å; M670-Y694 PolarHBondContact SD-N 3.23Å
671	Q	84.2	Confident	80.8	Confident	53 Å²	53	64 Å²	64	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-58.5	-36.3	175.8	-69.7	-176.8	28.9	0	0	112.3	S667 L674 R675 V688	S667-Q671 WeakPolarHBondContact O-CG 3.49Å; S667-Q671 PolarHBondContact O-N 3.08Å; Q671-L674 PolarHBondContact O-N 2.95Å; Q671-R675 PolarHBondContact O-N 3.26Å; Q671-V688 HydrophobicContact CB-CG1 4.35Å; Q671-V688 HydrophobicContact CG-CG1 4.4Å
672	Q	83.9	Confident	81.5	Confident	78 Å²	78	66.1 Å²	66.1	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-67.3	-42.5	175.1	-178.1	52.7	30.2	0	0	112	D668 Q669 M670 L674 R675 E676	D668-Q672 WeakPolarHBondContact O-CB 3.48Å; D668-Q672 PolarHBondContact O-N 3.35Å; D668-Q672 VanDerWaalsContact O-N 3.17Å; Q669-Q672 PolarHBondContact O-N 2.88Å; M670-Q672 PolarHBondContact O-N 2.87Å; Q672-L674 VanDerWaalsContact C-N 3.32Å; Q672-L674 PolarHBondContact O-N 2.74Å; Q672-R675 PolarHBondContact O-N 2.97Å; Q672-R675 VanDerWaalsContact OE1-NH2 3.09Å; Q672-E676 WeakPolarHBondContact CG-OE1 3.49Å; Q672-E676 PolarHBondContact NE2-OE1 3.24Å; Q672-E676 WeakPolarHBondContact O-CG 3.49Å; Q672-E676 PolarHBondContact O-N 2.75Å
673	K	86	Confident	82	Confident	92 Å²	92	63.9 Å²	63.9	40%	0.4	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-36.2	173.5	-164.4	178	-170.4	-179.9	0	112.3	Q669 M670 E676 I677 Y694	Q669-K673 WeakPolarHBondContact O-CB 3.43Å; Q669-K673 PolarHBondContact O-N 2.84Å; M670-K673 CarbonylContact O-C 3.6Å; M670-K673 WeakPolarHBondContact O-CA 3.42Å; M670-K673 WeakPolarHBondContact O-CB 3.41Å; M670-K673 PolarHBondContact O-N 3.34Å; K673-E676 PolarHBondContact O-N 2.93Å; K673-I677 HydrophobicContact CG-CD1 4.46Å; K673-I677 VanDerWaalsContact O-CG1 3.31Å; K673-I677 WeakPolarHBondContact O-CG1 3.47Å; K673-I677 PolarHBondContact O-N 2.76Å; K673-Y694 HydrophobicContact CD-CD1 3.91Å; K673-Y694 HydrophobicContact CD-CE1 4.49Å
674	L	90.6	Very high	82.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.2	-48.1	171.9	-64.2	-179.9	0	0	0	111.2	M670 Q671 Q672 E676 I677 E678 L687 V688 R692 F734	M670-L674 WeakPolarHBondContact O-CG 3.44Å; M670-L674 PolarHBondContact O-N 3.4Å; Q671-L674 PolarHBondContact O-N 2.95Å; Q672-L674 VanDerWaalsContact C-N 3.32Å; Q672-L674 PolarHBondContact O-N 2.74Å; L674-E676 PolarHBondContact O-N 3.46Å; L674-I677 PolarHBondContact O-N 3.3Å; L674-I677 VanDerWaalsContact O-N 3.11Å; L674-E678 WeakPolarHBondContact O-CB 3.4Å; L674-E678 PolarHBondContact O-N 3.12Å; L674-L687 HydrophobicContact CD2-CG 4.37Å; L674-V688 HydrophobicContact CB-CG2 4.02Å; L674-R692 HydrophobicContact CD1-CB 3.92Å; L674-R692 HydrophobicContact CD1-CG 4.17Å; L674-R692 HydrophobicContact CD2-CG 4.24Å; L674-F734 HydrophobicContact CD2-CD1 3.78Å; L674-F734 HydrophobicContact CD2-CE1 3.57Å
675	R	87.8	Confident	83.5	Confident	102 Å²	102	62.6 Å²	62.6	39%	0.385	33%	0.331	S	S	.	.	H	α-helix	trans	-56.6	-38.1	174.7	-77.3	-174.8	-72.2	-90.1	0.1	112.5	Q671 Q672 A679 V688	Q671-R675 PolarHBondContact O-N 3.26Å; Q672-R675 PolarHBondContact O-N 2.97Å; Q672-R675 VanDerWaalsContact OE1-NH2 3.09Å; R675-A679 WeakPolarHBondContact O-CB 3.24Å; R675-A679 PolarHBondContact O-N 3.39Å; R675-V688 HydrophobicContact CB-CG2 4.37Å; R675-V688 HydrophobicContact CG-CG2 3.47Å; R675-V688 VanDerWaalsContact CG-CG2 3.47Å
676	E	86.9	Confident	84	Confident	110 Å²	110	66.3 Å²	66.3	51%	0.514	35%	0.347	S	S	.	.	H	α-helix	trans	-68.9	-37.4	177	-75.1	168.2	-154.4	0	0	112.6	Q672 K673 L674 I680	Q672-E676 WeakPolarHBondContact CG-OE1 3.49Å; Q672-E676 PolarHBondContact NE2-OE1 3.24Å; Q672-E676 WeakPolarHBondContact O-CG 3.49Å; Q672-E676 PolarHBondContact O-N 2.75Å; K673-E676 PolarHBondContact O-N 2.93Å; L674-E676 PolarHBondContact O-N 3.46Å; E676-I680 WeakPolarHBondContact O-CG1 3.37Å; E676-I680 PolarHBondContact O-N 2.94Å
677	I	89.3	Confident	84.7	Confident	7 Å²	7	60.9 Å²	60.9	4%	0.036	32%	0.323	C	S	.	.	H	α-helix	trans	-70.3	-41.7	174.5	-64.9	161.7	0	0	0	111.2	K673 L674 A679 I680 V681 L687 Y694 F732 F734	K673-I677 HydrophobicContact CG-CD1 4.46Å; K673-I677 VanDerWaalsContact O-CG1 3.31Å; K673-I677 WeakPolarHBondContact O-CG1 3.47Å; K673-I677 PolarHBondContact O-N 2.76Å; L674-I677 PolarHBondContact O-N 3.3Å; L674-I677 VanDerWaalsContact O-N 3.11Å; I677-A679 VanDerWaalsContact C-N 3.32Å; I677-A679 PolarHBondContact O-N 2.98Å; I677-I680 VanDerWaalsContact O-CG1 3.23Å; I677-I680 WeakPolarHBondContact O-CG1 3.35Å; I677-I680 PolarHBondContact O-N 3.33Å; I677-V681 HydrophobicContact CG2-CG2 4.35Å; I677-V681 WeakPolarHBondContact O-CG2 3.1Å; I677-V681 PolarHBondContact O-N 2.93Å; I677-L687 HydrophobicContact CB-CD2 3.77Å; I677-L687 HydrophobicContact CG2-CD2 3.64Å; I677-Y694 HydrophobicContact CD1-CD1 4.23Å; I677-Y694 HydrophobicContact CD1-CD2 3.45Å; I677-Y694 VanDerWaalsContact CD1-CD2 3.45Å; I677-Y694 HydrophobicContact CD1-CE1 4.42Å; I677-Y694 HydrophobicContact CD1-CE2 3.67Å; I677-Y694 HydrophobicContact CD1-CG 3.71Å; I677-F732 HydrophobicContact CG2-CD1 3.8Å; I677-F732 HydrophobicContact CG2-CE1 3.84Å; I677-F734 HydrophobicContact CD1-CE1 4.18Å; I677-F734 HydrophobicContact CD1-CZ 4.37Å; I677-F734 HydrophobicContact CG2-CZ 4.21Å
678	E	88.3	Confident	85.4	Confident	52 Å²	52	61.8 Å²	61.8	24%	0.243	33%	0.327	C	S	.	.	H	α-helix	trans	-58.2	-44.1	175.8	-163.6	167.5	-132.1	0	0	111.1	L674 I680 D686 L687 V688	L674-E678 WeakPolarHBondContact O-CB 3.4Å; L674-E678 PolarHBondContact O-N 3.12Å; E678-I680 VanDerWaalsContact C-N 3.3Å; E678-I680 PolarHBondContact O-N 2.64Å; E678-D686 PolarHBondContact OE1-N 3.21Å; E678-L687 HydrophobicContact CB-CB 4.05Å; E678-L687 HydrophobicContact CB-CD2 4.17Å; E678-L687 HydrophobicContact CG-CB 4.01Å; E678-L687 PolarHBondContact OE1-N 3.19Å; E678-V688 WeakPolarHBondContact OE2-CG2 3.16Å
679	A	86	Confident	85.7	Confident	90 Å²	90	59.8 Å²	59.8	74%	0.744	32%	0.319	S	S	*	.	H	α-helix	trans	-68.8	-17.1	179.1	0	0	0	0	0	115.6	R675 I677	R675-A679 WeakPolarHBondContact O-CB 3.24Å; R675-A679 PolarHBondContact O-N 3.39Å; I677-A679 VanDerWaalsContact C-N 3.32Å; I677-A679 PolarHBondContact O-N 2.98Å
680	I	86.3	Confident	85.2	Confident	55 Å²	55	57.4 Å²	57.4	28%	0.282	32%	0.316	S	S	.	.	H	α-helix	trans	-104	-12.3	-179.7	64.2	171.4	0	0	0	114.7	E676 I677 E678 F767 F772	E676-I680 WeakPolarHBondContact O-CG1 3.37Å; E676-I680 PolarHBondContact O-N 2.94Å; I677-I680 VanDerWaalsContact O-CG1 3.23Å; I677-I680 WeakPolarHBondContact O-CG1 3.35Å; I677-I680 PolarHBondContact O-N 3.33Å; E678-I680 VanDerWaalsContact C-N 3.3Å; E678-I680 PolarHBondContact O-N 2.64Å; I680-F767 HydrophobicContact CD1-CB 4.1Å; I680-F767 HydrophobicContact CD1-CD1 3.34Å; I680-F767 HydrophobicContact CD1-CE1 3.77Å; I680-F767 HydrophobicContact CD1-CG 3.76Å; I680-F772 HydrophobicContact CD1-CD2 4.43Å; I680-F772 HydrophobicContact CD1-CE2 4.47Å
681	V	87.9	Confident	84.6	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.03	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	105.9	178.8	-176.7	0	0	0	0	110.1	I677 G683 L684 F732 T741 F772 L774	I677-V681 HydrophobicContact CG2-CG2 4.35Å; I677-V681 WeakPolarHBondContact O-CG2 3.1Å; I677-V681 PolarHBondContact O-N 2.93Å; V681-G683 PolarHBondContact O-N 3.5Å; V681-L684 HydrophobicContact CB-CB 3.82Å; V681-L684 HydrophobicContact CB-CD2 3.78Å; V681-L684 HydrophobicContact CB-CG 4.5Å; V681-L684 HydrophobicContact CG1-CB 3.78Å; V681-L684 HydrophobicContact CG1-CD2 4.09Å; V681-L684 HydrophobicContact CG2-CD2 4.11Å; V681-L684 WeakPolarHBondContact O-CB 3.2Å; V681-L684 PolarHBondContact O-N 2.87Å; V681-F732 HydrophobicContact CG2-CE2 4.08Å; V681-F732 HydrophobicContact CG2-CZ 3.96Å; V681-T741 HydrophobicContact CG1-CG2 3.79Å; V681-T741 HydrophobicContact CG2-CG2 4.39Å; V681-F772 HydrophobicContact CB-CB 4.46Å; V681-F772 HydrophobicContact CG1-CB 4.5Å; V681-F772 HydrophobicContact CG2-CB 4.01Å; V681-L774 HydrophobicContact CG1-CB 4.1Å
682	E	85.7	Confident	84.7	Confident	104 Å²	104	62.5 Å²	62.5	49%	0.486	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	122.1	178.2	-171.7	-170.6	127.9	0	0	110.8	F772 K773 L774	E682-F772 WeakPolarHBondContact CB-O 3.37Å; E682-F772 PolarHBondContact N-O 3.21Å; E682-K773 HydrophobicContact CB-CB 4.18Å; E682-K773 HydrophobicContact CB-CG 4.2Å; E682-K773 WeakPolarHBondContact O-CA 3.42Å; E682-K773 WeakPolarHBondContact OE1-CE 3.42Å; E682-K773 IonicContact OE1-NZ 2.75Å; E682-K773 PolarHBondContact OE1-NZ 3.42Å; E682-L774 PolarHBondContact O-N 3.23Å
683	G	81.7	Confident	85	Confident	53 Å²	53	61.7 Å²	61.7	55%	0.546	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	16.2	-179.3	0	0	0	0	0	115.1	V681 L774	V681-G683 PolarHBondContact O-N 3.5Å; G683-L774 VanDerWaalsContact O-CD2 3.31Å; G683-L774 WeakPolarHBondContact O-CD2 3.23Å
684	L	83.9	Confident	85.3	Confident	6 Å²	6	58.2 Å²	58.2	3%	0.031	32%	0.32	C	S	.	.			trans	-101.5	110.1	172.3	-179.2	60.2	0	0	0	111	V681 L687 L739 L774 K777	V681-L684 HydrophobicContact CB-CB 3.82Å; V681-L684 HydrophobicContact CB-CD2 3.78Å; V681-L684 HydrophobicContact CB-CG 4.5Å; V681-L684 HydrophobicContact CG1-CB 3.78Å; V681-L684 HydrophobicContact CG1-CD2 4.09Å; V681-L684 HydrophobicContact CG2-CD2 4.11Å; V681-L684 WeakPolarHBondContact O-CB 3.2Å; V681-L684 PolarHBondContact O-N 2.87Å; L684-L687 HydrophobicContact CD2-CB 4.43Å; L684-L687 HydrophobicContact CD2-CD1 4.27Å; L684-L687 HydrophobicContact CD2-CD2 3.84Å; L684-L687 HydrophobicContact CD2-CG 4.4Å; L684-L687 HydrophobicContact CG-CB 4.4Å; L684-L739 HydrophobicContact CD1-CD1 3.93Å; L684-L739 HydrophobicContact CD1-CD2 4.21Å; L684-L739 HydrophobicContact CD2-CD1 3.47Å; L684-L739 VanDerWaalsContact CD2-CD1 3.47Å; L684-L739 HydrophobicContact CG-CD1 4.38Å; L684-L774 HydrophobicContact CD1-CD1 4.48Å; L684-L774 HydrophobicContact CD1-CD2 4.16Å; L684-K777 HydrophobicContact CD1-CD 4.21Å
685	D	83.6	Confident	85.3	Confident	113 Å²	113	60.8 Å²	60.8	60%	0.604	33%	0.33	S	S	*	.			trans	-111.4	164	169.8	-52.7	-59	0	0	0	110.2	K777	D685-K777 PolarHBondContact O-NZ 2.94Å
686	D	83	Confident	85.4	Confident	92 Å²	92	57.6 Å²	57.6	49%	0.492	32%	0.318	S	S	.	.			trans	52.1	52.8	179.1	-59.2	-18	0	0	0	114.1	E678 R692 K777 N1374	E678-D686 PolarHBondContact OE1-N 3.21Å; D686-R692 PolarHBondContact O-NH1 3.09Å; D686-K777 PolarHBondContact O-NZ 3.38Å; D686-N1374 WeakPolarHBondContact CB-ND2 3.43Å; D686-N1374 PolarHBondContact OD2-ND2 2.85Å
687	L	87.6	Confident	85.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.297	C	S	.	.			trans	-93.8	-33.2	173.2	-166.8	67.5	0	0	0	113.1	L674 I677 E678 L684 S689 R692 F734 L739	L674-L687 HydrophobicContact CD2-CG 4.37Å; I677-L687 HydrophobicContact CB-CD2 3.77Å; I677-L687 HydrophobicContact CG2-CD2 3.64Å; E678-L687 HydrophobicContact CB-CB 4.05Å; E678-L687 HydrophobicContact CB-CD2 4.17Å; E678-L687 HydrophobicContact CG-CB 4.01Å; E678-L687 PolarHBondContact OE1-N 3.19Å; L684-L687 HydrophobicContact CD2-CB 4.43Å; L684-L687 HydrophobicContact CD2-CD1 4.27Å; L684-L687 HydrophobicContact CD2-CD2 3.84Å; L684-L687 HydrophobicContact CD2-CG 4.4Å; L684-L687 HydrophobicContact CG-CB 4.4Å; L687-S689 PolarHBondContact O-N 2.67Å; L687-R692 VanDerWaalsContact C-NH1 3.29Å; L687-R692 WeakPolarHBondContact O-CD 3.44Å; L687-R692 PolarHBondContact O-NH1 2.96Å; L687-F734 HydrophobicContact CD1-CE1 3.97Å; L687-F734 HydrophobicContact CD1-CE2 4.28Å; L687-F734 HydrophobicContact CD1-CZ 3.84Å; L687-F734 HydrophobicContact CD2-CE1 4.18Å; L687-F734 HydrophobicContact CD2-CZ 4.1Å; L687-F734 HydrophobicContact CG-CE1 4.37Å; L687-F734 HydrophobicContact CG-CZ 4.47Å; L687-L739 HydrophobicContact CD1-CD1 4.07Å
688	V	85.7	Confident	85.7	Confident	52 Å²	52	53.1 Å²	53.1	32%	0.315	30%	0.299	S	S	.	.			trans	-75.6	120.5	-178	-176.8	0	0	0	0	111.1	Q671 L674 R675 E678	Q671-V688 HydrophobicContact CB-CG1 4.35Å; Q671-V688 HydrophobicContact CG-CG1 4.4Å; L674-V688 HydrophobicContact CB-CG2 4.02Å; R675-V688 HydrophobicContact CB-CG2 4.37Å; R675-V688 HydrophobicContact CG-CG2 3.47Å; R675-V688 VanDerWaalsContact CG-CG2 3.47Å; E678-V688 WeakPolarHBondContact OE2-CG2 3.16Å
689	S	82.2	Confident	85.9	Confident	34 Å²	34	51.9 Å²	51.9	24%	0.238	29%	0.294	C	S	.	.			trans	-142.7	142.6	172	166.1	0	0	0	0	108.7	L687 E691 R692	L687-S689 PolarHBondContact O-N 2.67Å; S689-E691 PolarHBondContact O-N 3.02Å; S689-R692 PolarHBondContact O-N 2.93Å
690	P	71	Confident	86.2	Confident	91 Å²	91	47.8 Å²	47.8	59%	0.591	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.4	-179.1	26.3	-34.7	0	0	0	113.3
691	E	75.6	Confident	86.4	Confident	150 Å²	150	49.1 Å²	49.1	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-13.4	179.7	-57.3	-64.4	143.3	0	0	113.3	S689 I693 S735	S689-E691 PolarHBondContact O-N 3.02Å; E691-I693 PolarHBondContact O-N 2.78Å; E691-S735 PolarHBondContact O-OG 2.87Å
692	R	86.7	Confident	86.3	Confident	27 Å²	27	49.1 Å²	49.1	10%	0.102	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-87.2	118.4	-168.2	-176.2	173.6	-69.3	143.6	-0.9	111.5	M670 L674 D686 L687 S689 F734 D736	M670-R692 VanDerWaalsContact CG-O 3.23Å; M670-R692 WeakPolarHBondContact CG-O 3.11Å; L674-R692 HydrophobicContact CD1-CB 3.92Å; L674-R692 HydrophobicContact CD1-CG 4.17Å; L674-R692 HydrophobicContact CD2-CG 4.24Å; D686-R692 PolarHBondContact O-NH1 3.09Å; L687-R692 VanDerWaalsContact C-NH1 3.29Å; L687-R692 WeakPolarHBondContact O-CD 3.44Å; L687-R692 PolarHBondContact O-NH1 2.96Å; S689-R692 PolarHBondContact O-N 2.93Å; R692-F734 HydrophobicContact CG-CB 4.09Å; R692-F734 HydrophobicContact CG-CD1 4.06Å; R692-F734 HydrophobicContact CG-CG 4.41Å; R692-D736 WeakPolarHBondContact CD-OD1 3.47Å; R692-D736 WeakPolarHBondContact CG-OD1 3.37Å; R692-D736 IonicContact CZ-OD1 3.74Å; R692-D736 IonicContact CZ-OD2 2.72Å; R692-D736 VanDerWaalsContact CZ-OD2 3.25Å; R692-D736 VanDerWaalsContact NE-CG 3.3Å; R692-D736 IonicContact NE-OD1 2.9Å; R692-D736 PolarHBondContact NE-OD1 3.29Å; R692-D736 IonicContact NE-OD2 3.17Å; R692-D736 PolarHBondContact NE-OD2 3.42Å; R692-D736 IonicContact NH2-OD1 3.58Å; R692-D736 IonicContact NH2-OD2 3.25Å; R692-D736 PolarHBondContact NH2-OD2 3.49Å
693	I	89.2	Confident	85.9	Confident	60 Å²	60	45.2 Å²	45.2	31%	0.308	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-100.4	134.9	175.9	-64.4	173.9	0	0	0	108.4	M670 E691 Y695 F734 S735	M670-I693 HydrophobicContact CE-CB 4.45Å; M670-I693 HydrophobicContact CE-CG2 3.91Å; E691-I693 PolarHBondContact O-N 2.78Å; I693-Y695 HydrophobicContact CB-CE2 4.29Å; I693-Y695 HydrophobicContact CG2-CD2 4.19Å; I693-Y695 HydrophobicContact CG2-CE2 3.89Å; I693-F734 CarbonylContact O-C 3.57Å; I693-F734 WeakPolarHBondContact O-CA 3.22Å; I693-F734 WeakPolarHBondContact O-CB 2.99Å; I693-S735 PolarHBondContact N-OG 2.86Å; I693-S735 PolarHBondContact O-N 2.88Å
694	Y	92.1	Very high	84.8	Confident	19 Å²	19	43.3 Å²	43.3	8%	0.075	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.1	170.5	164.8	-93.4	0	0	0	110.6	M670 K673 I677 R696 C697 F732 F734	M670-Y694 PolarHBondContact SD-N 3.23Å; K673-Y694 HydrophobicContact CD-CD1 3.91Å; K673-Y694 HydrophobicContact CD-CE1 4.49Å; I677-Y694 HydrophobicContact CD1-CD1 4.23Å; I677-Y694 HydrophobicContact CD1-CD2 3.45Å; I677-Y694 VanDerWaalsContact CD1-CD2 3.45Å; I677-Y694 HydrophobicContact CD1-CE1 4.42Å; I677-Y694 HydrophobicContact CD1-CE2 3.67Å; I677-Y694 HydrophobicContact CD1-CG 3.71Å; Y694-R696 VanDerWaalsContact CE2-O 3.29Å; Y694-R696 WeakPolarHBondContact CE2-O 3.47Å; Y694-R696 VanDerWaalsContact CZ-C 3.45Å; Y694-C697 PolarHBondContact OH-N 3.37Å; Y694-F732 HydrophobicContact CE2-CD1 4.05Å; Y694-F734 HydrophobicContact CD2-CD1 4.07Å; Y694-F734 AromaticContact CD2-CE1 3.63Å; Y694-F734 HydrophobicContact CD2-CE1 3.63Å; Y694-F734 AromaticContact CD2-CZ 3.92Å; Y694-F734 HydrophobicContact CD2-CZ 3.92Å; Y694-F734 HydrophobicContact CG-CD1 4.46Å; Y694-F734 HydrophobicContact CG-CE1 4.23Å
695	Y	90.1	Very high	83.4	Confident	55 Å²	55	44.9 Å²	44.9	22%	0.216	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-59.1	180	-73.1	-104.4	0	0	0	112	I693 L733 N887 E890 A891	I693-Y695 HydrophobicContact CB-CE2 4.29Å; I693-Y695 HydrophobicContact CG2-CD2 4.19Å; I693-Y695 HydrophobicContact CG2-CE2 3.89Å; Y695-L733 PolarHBondContact N-O 3.47Å; Y695-N887 HydrophobicContact CD1-CB 4.33Å; Y695-E890 HydrophobicContact CE1-CB 3.89Å; Y695-A891 HydrophobicContact CD2-CB 4.09Å; Y695-A891 HydrophobicContact CE1-CB 4.38Å; Y695-A891 HydrophobicContact CE2-CB 3.71Å
696	R	91.1	Very high	81.8	Confident	34 Å²	34	42.1 Å²	42.1	13%	0.128	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	163.6	-170.8	58.6	-168.2	-61.3	143.2	5.8	114	Y694 D698 F732 L733 T883	Y694-R696 VanDerWaalsContact CE2-O 3.29Å; Y694-R696 WeakPolarHBondContact CE2-O 3.47Å; Y694-R696 VanDerWaalsContact CZ-C 3.45Å; R696-D698 WeakPolarHBondContact CG-OD2 3.47Å; R696-D698 IonicContact CZ-OD1 2.63Å; R696-D698 IonicContact CZ-OD2 3.35Å; R696-D698 IonicContact NE-OD1 3.78Å; R696-D698 IonicContact NE-OD2 2.84Å; R696-D698 PolarHBondContact NE-OD2 3.04Å; R696-D698 IonicContact NH2-OD1 3.69Å; R696-D698 PolarHBondContact NH2-OD1 2.74Å; R696-D698 IonicContact NH2-OD2 2.7Å; R696-D698 PolarHBondContact NH2-OD2 3.1Å; R696-F732 WeakPolarHBondContact O-CA 3.49Å; R696-L733 HydrophobicContact CG-CB 4.13Å; R696-L733 HydrophobicContact CG-CD2 4.24Å; R696-L733 PolarHBondContact O-N 2.95Å; R696-T883 VanDerWaalsContact NH1-CG2 3.29Å; R696-T883 PolarHBondContact NH1-O 3.46Å
697	C	91.6	Very high	80.3	Confident	10 Å²	10	38.2 Å²	38.2	7%	0.068	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	139	157.8	-159	0	0	0	0	110.6	Y694 C730 L731 F732 I762	Y694-C697 PolarHBondContact OH-N 3.37Å; C697-C730 WeakPolarHBondContact CB-SG 3.42Å; C697-C730 WeakPolarHBondContact SG-CB 3.46Å; C697-C730 CovalentContact SG-SG 2.06Å; C697-C730 PolarHBondContact SG-SG 3.12Å; C697-L731 WeakPolarHBondContact CA-O 3.11Å; C697-L731 PolarHBondContact SG-O 3.24Å; C697-F732 HydrophobicContact CB-CD1 3.73Å; C697-F732 HydrophobicContact CB-CE1 4.01Å; C697-F732 HydrophobicContact CB-CG 4Å; C697-F732 VanDerWaalsContact SG-CD1 3.56Å; C697-F732 WeakPolarHBondContact SG-CD2 3.4Å; C697-F732 WeakPolarHBondContact SG-CE2 3.33Å; C697-F732 WeakPolarHBondContact SG-CG 3.42Å; C697-I762 HydrophobicContact CB-CD1 3.94Å; C697-I762 WeakPolarHBondContact O-CD1 3.39Å
698	D	91.1	Very high	78.1	Confident	13 Å²	13	42.2 Å²	42.2	7%	0.07	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.4	-177.6	-66.7	-96.1	0	0	0	111	R696 V700 C730 L731	R696-D698 WeakPolarHBondContact CG-OD2 3.47Å; R696-D698 IonicContact CZ-OD1 2.63Å; R696-D698 IonicContact CZ-OD2 3.35Å; R696-D698 IonicContact NE-OD1 3.78Å; R696-D698 IonicContact NE-OD2 2.84Å; R696-D698 PolarHBondContact NE-OD2 3.04Å; R696-D698 IonicContact NH2-OD1 3.69Å; R696-D698 PolarHBondContact NH2-OD1 2.74Å; R696-D698 IonicContact NH2-OD2 2.7Å; R696-D698 PolarHBondContact NH2-OD2 3.1Å; D698-V700 HydrophobicContact CB-CG1 4Å; D698-V700 PolarHBondContact O-N 3.27Å; D698-C730 VanDerWaalsContact O-CA 3.3Å; D698-C730 WeakPolarHBondContact O-CA 3.39Å; D698-L731 PolarHBondContact N-O 2.85Å; D698-L731 VanDerWaalsContact N-O 3.14Å; D698-L731 PolarHBondContact O-N 3.3Å
699	L	91.8	Very high	76.1	Confident	27 Å²	27	45.6 Å²	45.6	14%	0.141	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	105.6	169.4	-172.4	78.8	0	0	0	109	D728 R729 V743	L699-D728 HydrophobicContact CD1-CB 4.46Å; L699-R729 WeakPolarHBondContact CA-O 3.5Å; L699-V743 HydrophobicContact CD1-CB 4.22Å; L699-V743 HydrophobicContact CD1-CG1 4.21Å; L699-V743 HydrophobicContact CD1-CG2 3.92Å
700	V	92.2	Very high	74.6	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.024	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	164.5	-176.6	-63.2	0	0	0	0	110.6	D698 V702 D728 R729 L731 V873 F875	D698-V700 HydrophobicContact CB-CG1 4Å; D698-V700 PolarHBondContact O-N 3.27Å; V700-V702 HydrophobicContact CG2-CG2 4.09Å; V700-D728 CarbonylContact O-C 3.57Å; V700-D728 WeakPolarHBondContact O-CA 3.34Å; V700-R729 HydrophobicContact CG2-CB 4.45Å; V700-R729 PolarHBondContact N-O 2.89Å; V700-R729 PolarHBondContact O-N 3.14Å; V700-L731 HydrophobicContact CG1-CD1 4.45Å; V700-L731 HydrophobicContact CG2-CD1 3.73Å; V700-L731 HydrophobicContact CG2-CG 3.66Å; V700-V873 HydrophobicContact CB-CG1 3.82Å; V700-V873 HydrophobicContact CG1-CG1 3.99Å; V700-V873 HydrophobicContact CG2-CG1 3.83Å; V700-F875 HydrophobicContact CG1-CD1 3.57Å; V700-F875 HydrophobicContact CG1-CE1 3.65Å; V700-F875 HydrophobicContact CG1-CG 4.23Å; V700-F875 HydrophobicContact CG1-CZ 4.37Å
701	Q	90.9	Very high	73.6	Confident	82 Å²	82	43.4 Å²	43.4	38%	0.383	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	130.2	166.7	-79.2	-179.3	-7.2	0	0	109.6	I726 D728 T874	Q701-I726 HydrophobicContact CB-CG2 3.7Å; Q701-I726 HydrophobicContact CG-CG2 4.13Å; Q701-D728 WeakPolarHBondContact CG-OD1 3.44Å; Q701-D728 PolarHBondContact NE2-OD1 3.44Å; Q701-T874 PolarHBondContact N-O 3.37Å; Q701-T874 PolarHBondContact O-N 2.87Å
702	V	86.7	Confident	72.4	Confident	6 Å²	6	37 Å²	37	4%	0.036	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.2	175.6	178.9	0	0	0	0	108.3	V700 V704 R727 R729 L871	V700-V702 HydrophobicContact CG2-CG2 4.09Å; V702-V704 PolarHBondContact O-N 3.26Å; V702-R727 PolarHBondContact N-O 3.07Å; V702-R727 PolarHBondContact O-N 3.25Å; V702-R729 HydrophobicContact CB-CG 3.92Å; V702-R729 HydrophobicContact CG2-CB 4.01Å; V702-R729 HydrophobicContact CG2-CG 3.68Å; V702-L871 HydrophobicContact CG1-CD1 3.6Å
703	D	75.7	Confident	70.8	Confident	22 Å²	22	38.4 Å²	38.4	12%	0.118	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	106.4	171.4	-157.8	-30.8	0	0	0	110.4	S705 I706 I726 L872	D703-S705 VanDerWaalsContact C-N 3.25Å; D703-S705 PolarHBondContact O-N 2.82Å; D703-S705 VanDerWaalsContact OD1-CB 3.3Å; D703-S705 WeakPolarHBondContact OD1-CB 3.3Å; D703-S705 PolarHBondContact OD1-N 2.96Å; D703-S705 PolarHBondContact OD1-OG 3.41Å; D703-I706 HydrophobicContact CB-CD1 4.04Å; D703-I706 HydrophobicContact CB-CG1 4.03Å; D703-I726 HydrophobicContact CB-CG1 4.04Å; D703-I726 WeakPolarHBondContact OD2-CG1 3.1Å; D703-L872 HydrophobicContact CB-CB 4.48Å; D703-L872 HydrophobicContact CB-CD2 4.36Å; D703-L872 PolarHBondContact N-O 3.29Å
704	V	59.9	Low	69.2	Low	13 Å²	13	40.6 Å²	40.6	8%	0.079	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-78.8	-13.2	-178.5	-163.6	0	0	0	0	111.2	V702 I706 L707 F716	V702-V704 PolarHBondContact O-N 3.26Å; V704-I706 VanDerWaalsContact C-N 3.25Å; V704-I706 PolarHBondContact O-N 2.92Å; V704-L707 HydrophobicContact CG1-CD1 4.26Å; V704-F716 HydrophobicContact CG1-CD1 4.05Å; V704-F716 HydrophobicContact CG1-CE1 4.17Å
705	S	53.6	Low	67.4	Low	38 Å²	38	43.2 Å²	43.2	27%	0.266	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-72.2	-18	179.8	69.8	0	0	0	0	113.7	D703 C708	D703-S705 VanDerWaalsContact C-N 3.25Å; D703-S705 PolarHBondContact O-N 2.82Å; D703-S705 VanDerWaalsContact OD1-CB 3.3Å; D703-S705 WeakPolarHBondContact OD1-CB 3.3Å; D703-S705 PolarHBondContact OD1-N 2.96Å; D703-S705 PolarHBondContact OD1-OG 3.41Å; S705-C708 PolarHBondContact O-SG 2.67Å
706	I	50.7	Low	65.7	Low	56 Å²	56	41.9 Å²	41.9	29%	0.287	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-91.8	-1.5	-176.5	-30.7	-173.5	0	0	0	112.3	D703 V704 C708 P870 L872	D703-I706 HydrophobicContact CB-CD1 4.04Å; D703-I706 HydrophobicContact CB-CG1 4.03Å; V704-I706 VanDerWaalsContact C-N 3.25Å; V704-I706 PolarHBondContact O-N 2.92Å; I706-C708 PolarHBondContact O-N 3.39Å; I706-P870 HydrophobicContact CG2-CG 3.97Å; I706-L872 HydrophobicContact CD1-CB 3.76Å; I706-L872 HydrophobicContact CD1-CD2 3.64Å; I706-L872 HydrophobicContact CD1-CG 4.35Å
707	L	50.6	Low	64	Low	10 Å²	10	43.1 Å²	43.1	5%	0.052	24%	0.244	C	C	.	.			trans	-72.4	55.8	160.8	-65.8	175.7	0	0	0	110.2	V704 F713 E869	V704-L707 HydrophobicContact CG1-CD1 4.26Å; L707-F713 WeakPolarHBondContact O-CB 3.27Å; L707-F713 WeakPolarHBondContact O-CD2 3.22Å; L707-E869 HydrophobicContact CD2-CB 4.3Å
708	C	41.2	Very low	61.9	Low	84 Å²	84	50.7 Å²	50.7	57%	0.568	28%	0.279	S	S	*	.			trans	-80.1	131.9	-178.6	-86.9	0	0	0	0	110.9	S705 I706	S705-C708 PolarHBondContact O-SG 2.67Å; I706-C708 PolarHBondContact O-N 3.39Å
709	S	45.1	Very low	59.9	Low	122 Å²	122	54 Å²	54	85%	0.853	30%	0.295	S	S	*	.	S	Bend	trans	56.6	79.6	178.3	56.1	0	0	0	0	115.6
710	G	50.1	Low	57.9	Low	19 Å²	19	55.6 Å²	55.6	20%	0.196	30%	0.301	C	S	.	.	S	Bend	trans	-166.2	159	169.6	0	0	0	0	0	112.6	V712 F713	G710-V712 PolarHBondContact O-N 3.27Å; G710-F713 WeakPolarHBondContact O-CB 3.36Å; G710-F713 PolarHBondContact O-N 2.96Å; G710-F713 VanDerWaalsContact O-N 3.1Å
711	L	50.2	Low	55.7	Low	60 Å²	60	64.2 Å²	64.2	31%	0.314	34%	0.342	S	S	.	.	H	α-helix	trans	-63.3	-24.3	175.7	-126.1	170.1	0	0	0	111.7	F713 L714 M715 F866 V1032 V1034	L711-F713 VanDerWaalsContact C-N 3.34Å; L711-F713 PolarHBondContact O-N 3.41Å; L711-L714 PolarHBondContact O-N 2.98Å; L711-M715 PolarHBondContact O-N 2.7Å; L711-F866 HydrophobicContact CB-CD2 4.48Å; L711-F866 HydrophobicContact CB-CE1 4.34Å; L711-F866 HydrophobicContact CB-CE2 3.78Å; L711-F866 HydrophobicContact CB-CZ 3.69Å; L711-F866 HydrophobicContact CD1-CE1 3.97Å; L711-F866 HydrophobicContact CD1-CE2 4.4Å; L711-F866 HydrophobicContact CD1-CZ 3.52Å; L711-F866 HydrophobicContact CG-CZ 4.24Å; L711-V1032 HydrophobicContact CD1-CG1 3.83Å; L711-V1034 HydrophobicContact CD1-CG2 4.01Å
712	V	49.2	Very low	53.4	Low	15 Å²	15	62.9 Å²	62.9	9%	0.091	34%	0.339	C	S	.	.	H	α-helix	trans	-58.5	-42.2	171.8	-176.9	0	0	0	0	111.7	G710 M715 F716	G710-V712 PolarHBondContact O-N 3.27Å; V712-M715 PolarHBondContact O-N 2.94Å; V712-F716 HydrophobicContact CG1-CD2 4.44Å; V712-F716 WeakPolarHBondContact O-CB 3.43Å; V712-F716 PolarHBondContact O-N 2.81Å
713	F	55	Low	51.4	Low	58 Å²	58	66.9 Å²	66.9	25%	0.254	37%	0.372	S	S	.	.	H	α-helix	trans	-64.1	-42.8	177.3	-178.2	-97.2	0	0	0	111.8	L707 G710 L711 F716 M717	L707-F713 WeakPolarHBondContact O-CB 3.27Å; L707-F713 WeakPolarHBondContact O-CD2 3.22Å; G710-F713 WeakPolarHBondContact O-CB 3.36Å; G710-F713 PolarHBondContact O-N 2.96Å; G710-F713 VanDerWaalsContact O-N 3.1Å; L711-F713 VanDerWaalsContact C-N 3.34Å; L711-F713 PolarHBondContact O-N 3.41Å; F713-F716 PolarHBondContact O-N 2.8Å; F713-M717 HydrophobicContact CD1-CG 4.02Å; F713-M717 HydrophobicContact CE1-CG 3.59Å; F713-M717 HydrophobicContact CE1-SD 4.09Å; F713-M717 HydrophobicContact CE2-CG 4.22Å; F713-M717 HydrophobicContact CZ-CG 3.69Å; F713-M717 HydrophobicContact CZ-SD 3.82Å; F713-M717 WeakPolarHBondContact O-CB 3.19Å; F713-M717 WeakPolarHBondContact O-CG 3.29Å; F713-M717 PolarHBondContact O-N 2.97Å
714	L	54.5	Low	50.4	Low	106 Å²	106	71 Å²	71	56%	0.555	40%	0.395	S	S	*	.	H	α-helix	trans	-62.6	-45	176.4	-70.2	173.2	0	0	0	111.5	L711 F716 M717 Q718	L711-L714 PolarHBondContact O-N 2.98Å; L714-F716 PolarHBondContact O-N 2.87Å; L714-M717 PolarHBondContact O-N 3.46Å; L714-Q718 WeakPolarHBondContact O-CB 3.22Å; L714-Q718 PolarHBondContact O-N 2.68Å
715	M	54.4	Low	50.6	Low	74 Å²	74	71.6 Å²	71.6	37%	0.365	40%	0.403	S	S	.	.	H	α-helix	trans	-59.5	-43.3	172.4	-90.8	-174.7	59.2	0	0	112.4	L711 V712 Q718 I719 R1367	L711-M715 PolarHBondContact O-N 2.7Å; V712-M715 PolarHBondContact O-N 2.94Å; M715-Q718 PolarHBondContact O-N 2.83Å; M715-I719 HydrophobicContact CE-CD1 4.39Å; M715-I719 WeakPolarHBondContact O-CB 3.35Å; M715-I719 VanDerWaalsContact O-CG1 3.24Å; M715-I719 WeakPolarHBondContact O-CG1 3.24Å; M715-I719 PolarHBondContact O-N 3.09Å; M715-I719 VanDerWaalsContact O-N 3.12Å; M715-R1367 VanDerWaalsContact CE-O 3.23Å; M715-R1367 WeakPolarHBondContact CE-O 3.45Å
716	F	53.5	Low	51.7	Low	26 Å²	26	73 Å²	73	11%	0.114	41%	0.407	C	S	.	.	H	α-helix	trans	-62.7	-44.7	178.2	-116.3	-89.1	0	0	0	112.4	V704 V712 F713 L714 F720 L775 L776	V704-F716 HydrophobicContact CG1-CD1 4.05Å; V704-F716 HydrophobicContact CG1-CE1 4.17Å; V712-F716 HydrophobicContact CG1-CD2 4.44Å; V712-F716 WeakPolarHBondContact O-CB 3.43Å; V712-F716 PolarHBondContact O-N 2.81Å; F713-F716 PolarHBondContact O-N 2.8Å; L714-F716 PolarHBondContact O-N 2.87Å; F716-F720 HydrophobicContact CD1-CD2 4.43Å; F716-F720 PolarHBondContact O-N 3.04Å; F716-F720 VanDerWaalsContact O-N 3.11Å; F716-L775 HydrophobicContact CE1-CD1 4.38Å; F716-L775 HydrophobicContact CE1-CD2 3.91Å; F716-L775 HydrophobicContact CZ-CB 3.98Å; F716-L775 HydrophobicContact CZ-CD1 4.09Å; F716-L775 HydrophobicContact CZ-CD2 3.82Å; F716-L775 HydrophobicContact CZ-CG 4.2Å; F716-L776 HydrophobicContact CE2-CD1 4.16Å; F716-L776 HydrophobicContact CE2-CD2 4.34Å; F716-L776 HydrophobicContact CE2-CG 4.14Å
717	M	55.6	Low	53.3	Low	61 Å²	61	73.5 Å²	73.5	30%	0.3	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-46.6	177.7	-75.6	-95.1	65.3	0	0	111.7	F713 L714 I719 F720 Q721 T722	F713-M717 HydrophobicContact CD1-CG 4.02Å; F713-M717 HydrophobicContact CE1-CG 3.59Å; F713-M717 HydrophobicContact CE1-SD 4.09Å; F713-M717 HydrophobicContact CE2-CG 4.22Å; F713-M717 HydrophobicContact CZ-CG 3.69Å; F713-M717 HydrophobicContact CZ-SD 3.82Å; F713-M717 WeakPolarHBondContact O-CB 3.19Å; F713-M717 WeakPolarHBondContact O-CG 3.29Å; F713-M717 PolarHBondContact O-N 2.97Å; L714-M717 PolarHBondContact O-N 3.46Å; M717-I719 VanDerWaalsContact C-N 3.27Å; M717-I719 PolarHBondContact O-N 2.89Å; M717-F720 PolarHBondContact O-N 2.92Å; M717-Q721 WeakPolarHBondContact O-CA 3.42Å; M717-Q721 PolarHBondContact O-N 3.2Å; M717-T722 WeakPolarHBondContact CE-O 3.44Å
718	Q	48.6	Very low	55.1	Low	169 Å²	169	76.4 Å²	76.4	79%	0.79	42%	0.421	S	S	*	.	H	α-helix	trans	-69.6	-21.6	-176.3	-164.3	173.1	35.3	0	0	113.4	L714 M715	L714-Q718 WeakPolarHBondContact O-CB 3.22Å; L714-Q718 PolarHBondContact O-N 2.68Å; M715-Q718 PolarHBondContact O-N 2.83Å
719	I	49	Very low	57.4	Low	81 Å²	81	73.2 Å²	73.2	42%	0.415	40%	0.397	S	S	.	.	H	α-helix	trans	-94.7	-31.6	177.9	-63.8	173.1	0	0	0	112.5	M715 M717 M1368	M715-I719 HydrophobicContact CE-CD1 4.39Å; M715-I719 WeakPolarHBondContact O-CB 3.35Å; M715-I719 VanDerWaalsContact O-CG1 3.24Å; M715-I719 WeakPolarHBondContact O-CG1 3.24Å; M715-I719 PolarHBondContact O-N 3.09Å; M715-I719 VanDerWaalsContact O-N 3.12Å; M717-I719 VanDerWaalsContact C-N 3.27Å; M717-I719 PolarHBondContact O-N 2.89Å; I719-M1368 HydrophobicContact CD1-SD 3.54Å; I719-M1368 VanDerWaalsContact CD1-SD 3.54Å
720	F	50.2	Low	59.7	Low	61 Å²	61	67.4 Å²	67.4	27%	0.268	36%	0.356	S	S	.	.	H	α-helix	trans	-116.8	-16.6	-172.3	-72.8	-77.5	0	0	0	116.5	F716 M717 T722 L775	F716-F720 HydrophobicContact CD1-CD2 4.43Å; F716-F720 PolarHBondContact O-N 3.04Å; F716-F720 VanDerWaalsContact O-N 3.11Å; M717-F720 PolarHBondContact O-N 2.92Å; F720-T722 WeakPolarHBondContact O-CG2 3.41Å; F720-T722 PolarHBondContact O-N 2.82Å; F720-L775 HydrophobicContact CD2-CD2 4.22Å; F720-L775 HydrophobicContact CE2-CD2 3.35Å; F720-L775 HydrophobicContact CZ-CD2 3.56Å
721	Q	44.4	Very low	61.8	Low	186 Å²	186	66.5 Å²	66.5	87%	0.869	35%	0.347	S	S	*	.			trans	54.4	21.2	169.8	-144.4	172.4	29.3	0	0	115.8	M717	M717-Q721 WeakPolarHBondContact O-CA 3.42Å; M717-Q721 PolarHBondContact O-N 3.2Å
722	T	43.8	Very low	63.8	Low	54 Å²	54	63.6 Å²	63.6	33%	0.331	33%	0.332	S	S	.	.			trans	-106.7	135.1	-175.9	49.3	0	0	0	0	112.3	M717 F720 R727	M717-T722 WeakPolarHBondContact CE-O 3.44Å; F720-T722 WeakPolarHBondContact O-CG2 3.41Å; F720-T722 PolarHBondContact O-N 2.82Å; T722-R727 VanDerWaalsContact OG1-CZ 3.32Å; T722-R727 PolarHBondContact OG1-NH1 3.33Å; T722-R727 PolarHBondContact OG1-NH2 3.18Å; T722-R727 VanDerWaalsContact OG1-NH2 3.1Å
723	A	45.1	Very low	66	Low	89 Å²	89	62.9 Å²	62.9	74%	0.736	33%	0.328	S	S	*	.			trans	-53.5	158.3	175.7	0	0	0	0	0	114.9
724	N	53.8	Low	67.9	Low	110 Å²	110	60.1 Å²	60.1	59%	0.588	32%	0.315	S	S	*	.	S	Bend	trans	-57.9	138.4	-178.9	-66.5	-9.7	0	0	0	112.2
725	G	63.9	Low	69.6	Low	25 Å²	25	55.7 Å²	55.7	26%	0.258	29%	0.293	S	S	.	.			trans	159.5	163.2	173.2	0	0	0	0	0	115.3
726	I	77.1	Confident	71.1	Confident	68 Å²	68	53.8 Å²	53.8	35%	0.349	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.3	176.7	-57.1	151.4	0	0	0	110.1	Q701 D703 R853	Q701-I726 HydrophobicContact CB-CG2 3.7Å; Q701-I726 HydrophobicContact CG-CG2 4.13Å; D703-I726 HydrophobicContact CB-CG1 4.04Å; D703-I726 WeakPolarHBondContact OD2-CG1 3.1Å; I726-R853 VanDerWaalsContact CD1-NH1 3.33Å
727	R	83.8	Confident	72.9	Confident	66 Å²	66	53 Å²	53	25%	0.249	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	146.5	-179.4	-67.5	-175.7	-79.6	-179	-11.8	113.1	V702 T722	V702-R727 PolarHBondContact N-O 3.07Å; V702-R727 PolarHBondContact O-N 3.25Å; T722-R727 VanDerWaalsContact OG1-CZ 3.32Å; T722-R727 PolarHBondContact OG1-NH1 3.33Å; T722-R727 PolarHBondContact OG1-NH2 3.18Å; T722-R727 VanDerWaalsContact OG1-NH2 3.1Å
728	D	88.4	Confident	74.7	Confident	70 Å²	70	50 Å²	50	37%	0.374	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	137.6	176.5	-80.4	26.3	0	0	0	112.9	L699 V700 Q701	L699-D728 HydrophobicContact CD1-CB 4.46Å; V700-D728 CarbonylContact O-C 3.57Å; V700-D728 WeakPolarHBondContact O-CA 3.34Å; Q701-D728 WeakPolarHBondContact CG-OD1 3.44Å; Q701-D728 PolarHBondContact NE2-OD1 3.44Å
729	R	90.3	Very high	76.8	Confident	17 Å²	17	42 Å²	42	6%	0.064	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	154.6	177.6	-58.5	-64.6	178.1	-107.9	5.6	110.1	L699 V700 V702 I740 T741	L699-R729 WeakPolarHBondContact CA-O 3.5Å; V700-R729 HydrophobicContact CG2-CB 4.45Å; V700-R729 PolarHBondContact N-O 2.89Å; V700-R729 PolarHBondContact O-N 3.14Å; V702-R729 HydrophobicContact CB-CG 3.92Å; V702-R729 HydrophobicContact CG2-CB 4.01Å; V702-R729 HydrophobicContact CG2-CG 3.68Å; R729-I740 HydrophobicContact CB-CG2 4.2Å; R729-I740 HydrophobicContact CG-CG2 4.15Å; R729-T741 VanDerWaalsContact CA-O 3.29Å; R729-T741 WeakPolarHBondContact CA-O 3.48Å; R729-T741 WeakPolarHBondContact CB-O 3.32Å; R729-T741 WeakPolarHBondContact CD-O 3.47Å
730	C	92.2	Very high	78.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.8	157.4	-152.6	0	0	0	0	109.3	C697 D698 F732 T741 V743 F772	C697-C730 WeakPolarHBondContact CB-SG 3.42Å; C697-C730 WeakPolarHBondContact SG-CB 3.46Å; C697-C730 CovalentContact SG-SG 2.06Å; C697-C730 PolarHBondContact SG-SG 3.12Å; D698-C730 VanDerWaalsContact O-CA 3.3Å; D698-C730 WeakPolarHBondContact O-CA 3.39Å; C730-F732 HydrophobicContact CB-CE2 4.09Å; C730-T741 PolarHBondContact N-O 2.79Å; C730-T741 PolarHBondContact O-N 2.93Å; C730-T741 VanDerWaalsContact O-N 3.1Å; C730-T741 PolarHBondContact O-OG1 3.33Å; C730-V743 HydrophobicContact CB-CG2 4.07Å; C730-F772 HydrophobicContact CB-CD1 4.16Å; C730-F772 HydrophobicContact CB-CE1 3.93Å
731	L	94	Very high	80.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.7	170.6	-69.6	-179.6	0	0	0	108.9	C697 D698 V700 L738 L739 I740 V873 W884	C697-L731 WeakPolarHBondContact CA-O 3.11Å; C697-L731 PolarHBondContact SG-O 3.24Å; D698-L731 PolarHBondContact N-O 2.85Å; D698-L731 VanDerWaalsContact N-O 3.14Å; D698-L731 PolarHBondContact O-N 3.3Å; V700-L731 HydrophobicContact CG1-CD1 4.45Å; V700-L731 HydrophobicContact CG2-CD1 3.73Å; V700-L731 HydrophobicContact CG2-CG 3.66Å; L731-L738 HydrophobicContact CB-CD1 4.15Å; L731-L738 HydrophobicContact CD2-CD1 4.35Å; L731-L739 CarbonylContact C-O 3.6Å; L731-L739 WeakPolarHBondContact CA-O 3.42Å; L731-I740 HydrophobicContact CD2-CB 4.14Å; L731-I740 HydrophobicContact CD2-CD1 3.89Å; L731-I740 HydrophobicContact CD2-CG1 3.6Å; L731-I740 HydrophobicContact CD2-CG2 3.99Å; L731-V873 HydrophobicContact CD1-CG1 3.81Å; L731-V873 HydrophobicContact CD1-CG2 4.28Å; L731-W884 HydrophobicContact CD1-CZ2 4.31Å
732	F	94.3	Very high	82.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.4	172.3	-60.6	-109.1	0	0	0	109.4	I677 V681 Y694 R696 C697 C730 F734 L739 T741 F767 F772	I677-F732 HydrophobicContact CG2-CD1 3.8Å; I677-F732 HydrophobicContact CG2-CE1 3.84Å; V681-F732 HydrophobicContact CG2-CE2 4.08Å; V681-F732 HydrophobicContact CG2-CZ 3.96Å; Y694-F732 HydrophobicContact CE2-CD1 4.05Å; R696-F732 WeakPolarHBondContact O-CA 3.49Å; C697-F732 HydrophobicContact CB-CD1 3.73Å; C697-F732 HydrophobicContact CB-CE1 4.01Å; C697-F732 HydrophobicContact CB-CG 4Å; C697-F732 VanDerWaalsContact SG-CD1 3.56Å; C697-F732 WeakPolarHBondContact SG-CD2 3.4Å; C697-F732 WeakPolarHBondContact SG-CE2 3.33Å; C697-F732 WeakPolarHBondContact SG-CG 3.42Å; C730-F732 HydrophobicContact CB-CE2 4.09Å; F732-F734 HydrophobicContact CB-CE2 3.53Å; F732-F734 HydrophobicContact CB-CZ 3.95Å; F732-L739 HydrophobicContact CB-CB 4.16Å; F732-L739 HydrophobicContact CB-CD1 4.41Å; F732-L739 PolarHBondContact N-O 2.97Å; F732-L739 PolarHBondContact O-N 2.75Å; F732-T741 HydrophobicContact CD2-CG2 3.95Å; F732-T741 HydrophobicContact CE2-CG2 3.7Å; F732-F767 AromaticContact CE1-CE1 4Å; F732-F767 HydrophobicContact CE1-CE1 4Å; F732-F767 HydrophobicContact CE1-CZ 4.48Å; F732-F767 HydrophobicContact CZ-CE1 4.3Å; F732-F772 HydrophobicContact CE2-CD1 4.04Å; F732-F772 AromaticContact CZ-CD1 3.96Å; F732-F772 HydrophobicContact CZ-CD1 3.96Å; F732-F772 HydrophobicContact CZ-CE1 4.24Å; F732-F772 HydrophobicContact CZ-CG 4.27Å
733	L	95.2	Very high	84.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.1	-177.6	179.1	66.5	0	0	0	111.5	Y695 R696 L738 L780 N887 F888 A891	Y695-L733 PolarHBondContact N-O 3.47Å; R696-L733 HydrophobicContact CG-CB 4.13Å; R696-L733 HydrophobicContact CG-CD2 4.24Å; R696-L733 PolarHBondContact O-N 2.95Å; L733-L738 HydrophobicContact CB-CD1 4.4Å; L733-L738 HydrophobicContact CD1-CD1 4.31Å; L733-L780 HydrophobicContact CD1-CD1 4.36Å; L733-L780 HydrophobicContact CD1-CD2 4.1Å; L733-N887 HydrophobicContact CD2-CB 4.16Å; L733-F888 HydrophobicContact CD1-CD2 4.14Å; L733-F888 HydrophobicContact CD2-CB 4.28Å; L733-A891 HydrophobicContact CD1-CB 4.44Å
734	F	94.2	Very high	86.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	174.8	179.5	-55.1	-96.4	0	0	0	110.9	L674 I677 L687 R692 I693 Y694 F732 D736 L737 L739 L780	L674-F734 HydrophobicContact CD2-CD1 3.78Å; L674-F734 HydrophobicContact CD2-CE1 3.57Å; I677-F734 HydrophobicContact CD1-CE1 4.18Å; I677-F734 HydrophobicContact CD1-CZ 4.37Å; I677-F734 HydrophobicContact CG2-CZ 4.21Å; L687-F734 HydrophobicContact CD1-CE1 3.97Å; L687-F734 HydrophobicContact CD1-CE2 4.28Å; L687-F734 HydrophobicContact CD1-CZ 3.84Å; L687-F734 HydrophobicContact CD2-CE1 4.18Å; L687-F734 HydrophobicContact CD2-CZ 4.1Å; L687-F734 HydrophobicContact CG-CE1 4.37Å; L687-F734 HydrophobicContact CG-CZ 4.47Å; R692-F734 HydrophobicContact CG-CB 4.09Å; R692-F734 HydrophobicContact CG-CD1 4.06Å; R692-F734 HydrophobicContact CG-CG 4.41Å; I693-F734 CarbonylContact O-C 3.57Å; I693-F734 WeakPolarHBondContact O-CA 3.22Å; I693-F734 WeakPolarHBondContact O-CB 2.99Å; Y694-F734 HydrophobicContact CD2-CD1 4.07Å; Y694-F734 AromaticContact CD2-CE1 3.63Å; Y694-F734 HydrophobicContact CD2-CE1 3.63Å; Y694-F734 AromaticContact CD2-CZ 3.92Å; Y694-F734 HydrophobicContact CD2-CZ 3.92Å; Y694-F734 HydrophobicContact CG-CD1 4.46Å; Y694-F734 HydrophobicContact CG-CE1 4.23Å; F732-F734 HydrophobicContact CB-CE2 3.53Å; F732-F734 HydrophobicContact CB-CZ 3.95Å; F734-D736 PolarHBondContact O-N 3.18Å; F734-L737 HydrophobicContact CB-CB 4.28Å; F734-L737 HydrophobicContact CD2-CB 4.13Å; F734-L737 PolarHBondContact N-O 3.14Å; F734-L739 HydrophobicContact CD2-CG 4.37Å; F734-L739 HydrophobicContact CE2-CD1 3.58Å; F734-L739 HydrophobicContact CE2-CG 3.71Å; F734-L739 HydrophobicContact CZ-CD1 3.99Å; F734-L780 WeakPolarHBondContact O-CD1 3.42Å
735	S	89.7	Confident	87.8	Confident	13 Å²	13	24.3 Å²	24.3	9%	0.091	15%	0.145	C	C	.	.	S	Bend	trans	-67.1	-12.2	176	50.5	0	0	0	0	114.7	E691 I693 F895	E691-S735 PolarHBondContact O-OG 2.87Å; I693-S735 PolarHBondContact N-OG 2.86Å; I693-S735 PolarHBondContact O-N 2.88Å; S735-F895 WeakPolarHBondContact O-CB 3.44Å; S735-F895 WeakPolarHBondContact O-CD2 3.3Å
736	D	87	Confident	88.1	Confident	34 Å²	34	27.1 Å²	27.1	18%	0.182	15%	0.15	C	C	.	.	S	Bend	trans	-138.9	-9.6	-178.1	65.4	-25.1	0	0	0	114.7	R692 F734 L780 F895	R692-D736 WeakPolarHBondContact CD-OD1 3.47Å; R692-D736 WeakPolarHBondContact CG-OD1 3.37Å; R692-D736 IonicContact CZ-OD1 3.74Å; R692-D736 IonicContact CZ-OD2 2.72Å; R692-D736 VanDerWaalsContact CZ-OD2 3.25Å; R692-D736 VanDerWaalsContact NE-CG 3.3Å; R692-D736 IonicContact NE-OD1 2.9Å; R692-D736 PolarHBondContact NE-OD1 3.29Å; R692-D736 IonicContact NE-OD2 3.17Å; R692-D736 PolarHBondContact NE-OD2 3.42Å; R692-D736 IonicContact NH2-OD1 3.58Å; R692-D736 IonicContact NH2-OD2 3.25Å; R692-D736 PolarHBondContact NH2-OD2 3.49Å; F734-D736 PolarHBondContact O-N 3.18Å; D736-L780 PolarHBondContact O-N 3.4Å; D736-F895 HydrophobicContact CB-CD2 3.73Å; D736-F895 HydrophobicContact CB-CE2 3.67Å
737	L	91.3	Very high	86.9	Confident	8 Å²	8	29.1 Å²	29.1	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	151.4	-172.5	-67.5	178.5	0	0	0	113	F734 K777 L778	F734-L737 HydrophobicContact CB-CB 4.28Å; F734-L737 HydrophobicContact CD2-CB 4.13Å; F734-L737 PolarHBondContact N-O 3.14Å; L737-K777 HydrophobicContact CD1-CG 4.33Å; L737-K777 HydrophobicContact CD2-CG 4.34Å; L737-L778 WeakPolarHBondContact CA-O 3.43Å; L737-L778 WeakPolarHBondContact CD2-O 3.48Å
738	L	93.6	Very high	85.5	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120	159.3	-177.8	63.5	0	0	0	109	L731 L733 L778 L783 L860 W884	L731-L738 HydrophobicContact CB-CD1 4.15Å; L731-L738 HydrophobicContact CD2-CD1 4.35Å; L733-L738 HydrophobicContact CB-CD1 4.4Å; L733-L738 HydrophobicContact CD1-CD1 4.31Å; L738-L778 PolarHBondContact N-O 2.75Å; L738-L778 PolarHBondContact O-N 3.36Å; L738-L783 HydrophobicContact CB-CD1 3.62Å; L738-L783 HydrophobicContact CD2-CD1 3.68Å; L738-L783 HydrophobicContact CG-CD1 4.3Å; L738-L860 HydrophobicContact CD2-CD1 4.15Å; L738-W884 HydrophobicContact CD1-CZ2 4Å; L738-W884 HydrophobicContact CD2-CZ2 4.27Å
739	L	92.1	Very high	83.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	134.5	172.7	-50.3	178.2	0	0	0	110.3	L684 L687 L731 F732 F734 L774 L776 K777	L684-L739 HydrophobicContact CD1-CD1 3.93Å; L684-L739 HydrophobicContact CD1-CD2 4.21Å; L684-L739 HydrophobicContact CD2-CD1 3.47Å; L684-L739 VanDerWaalsContact CD2-CD1 3.47Å; L684-L739 HydrophobicContact CG-CD1 4.38Å; L687-L739 HydrophobicContact CD1-CD1 4.07Å; L731-L739 CarbonylContact C-O 3.6Å; L731-L739 WeakPolarHBondContact CA-O 3.42Å; F732-L739 HydrophobicContact CB-CB 4.16Å; F732-L739 HydrophobicContact CB-CD1 4.41Å; F732-L739 PolarHBondContact N-O 2.97Å; F732-L739 PolarHBondContact O-N 2.75Å; F734-L739 HydrophobicContact CD2-CG 4.37Å; F734-L739 HydrophobicContact CE2-CD1 3.58Å; F734-L739 HydrophobicContact CE2-CG 3.71Å; F734-L739 HydrophobicContact CZ-CD1 3.99Å; L739-L774 HydrophobicContact CB-CD1 4.31Å; L739-L774 HydrophobicContact CD2-CD1 4.26Å; L739-L776 WeakPolarHBondContact CA-O 3.47Å; L739-K777 HydrophobicContact CD2-CB 3.76Å; L739-K777 HydrophobicContact CD2-CD 4.19Å; L739-K777 HydrophobicContact CD2-CG 3.56Å
740	I	91.4	Very high	81.9	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.2	171.7	-43.5	-164.8	0	0	0	108.2	R729 L731 L775 L776 L778 L871	R729-I740 HydrophobicContact CB-CG2 4.2Å; R729-I740 HydrophobicContact CG-CG2 4.15Å; L731-I740 HydrophobicContact CD2-CB 4.14Å; L731-I740 HydrophobicContact CD2-CD1 3.89Å; L731-I740 HydrophobicContact CD2-CG1 3.6Å; L731-I740 HydrophobicContact CD2-CG2 3.99Å; I740-L775 WeakPolarHBondContact O-CB 3.49Å; I740-L775 PolarHBondContact O-N 3.38Å; I740-L776 HydrophobicContact CB-CB 4.17Å; I740-L776 HydrophobicContact CD1-CD1 4.12Å; I740-L776 HydrophobicContact CG1-CB 4.2Å; I740-L776 PolarHBondContact N-O 3.34Å; I740-L776 PolarHBondContact O-N 3.25Å; I740-L778 HydrophobicContact CD1-CD1 4.22Å; I740-L871 HydrophobicContact CD1-CD1 4.42Å; I740-L871 HydrophobicContact CD1-CD2 3.72Å
741	T	90.2	Very high	79.7	Confident	0 Å²	0	40 Å²	40	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.8	-176.1	61.1	0	0	0	0	112.4	V681 R729 C730 F732 K773	V681-T741 HydrophobicContact CG1-CG2 3.79Å; V681-T741 HydrophobicContact CG2-CG2 4.39Å; R729-T741 VanDerWaalsContact CA-O 3.29Å; R729-T741 WeakPolarHBondContact CA-O 3.48Å; R729-T741 WeakPolarHBondContact CB-O 3.32Å; R729-T741 WeakPolarHBondContact CD-O 3.47Å; C730-T741 PolarHBondContact N-O 2.79Å; C730-T741 PolarHBondContact O-N 2.93Å; C730-T741 VanDerWaalsContact O-N 3.1Å; C730-T741 PolarHBondContact O-OG1 3.33Å; F732-T741 HydrophobicContact CD2-CG2 3.95Å; F732-T741 HydrophobicContact CE2-CG2 3.7Å; T741-K773 CarbonylContact C-O 3.55Å; T741-K773 WeakPolarHBondContact CA-O 3.46Å; T741-K773 WeakPolarHBondContact CB-O 3.49Å
742	T	87.8	Confident	77.3	Confident	23 Å²	23	45.6 Å²	45.6	14%	0.141	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	141	159.9	58.6	0	0	0	0	109.2	F772 K773 L775	T742-F772 WeakPolarHBondContact O-CA 3.11Å; T742-K773 PolarHBondContact N-O 2.93Å; T742-K773 PolarHBondContact O-N 3.26Å; T742-K773 WeakPolarHBondContact OG1-CB 3.43Å; T742-L775 HydrophobicContact CG2-CD1 3.66Å; T742-L775 HydrophobicContact CG2-CD2 3.87Å; T742-L775 HydrophobicContact CG2-CG 3.86Å
743	V	86.1	Confident	74.5	Confident	29 Å²	29	56.2 Å²	56.2	18%	0.176	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133	165.4	154.9	0	0	0	0	109.4	L699 C730 F772	L699-V743 HydrophobicContact CD1-CB 4.22Å; L699-V743 HydrophobicContact CD1-CG1 4.21Å; L699-V743 HydrophobicContact CD1-CG2 3.92Å; C730-V743 HydrophobicContact CB-CG2 4.07Å; V743-F772 HydrophobicContact CG2-CD1 3.77Å; V743-F772 HydrophobicContact CG2-CE1 3.6Å
744	T	83.7	Confident	71.5	Confident	75 Å²	75	60 Å²	60	46%	0.46	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	147.6	165.2	53.6	0	0	0	0	109.9	R770 K771	T744-R770 CarbonylContact O-C 3.59Å; T744-R770 WeakPolarHBondContact O-CA 3.32Å; T744-K771 PolarHBondContact N-O 3.38Å; T744-K771 PolarHBondContact O-N 3.23Å
745	A	78.2	Confident	68.6	Low	78 Å²	78	66 Å²	66	65%	0.645	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	142.8	173.1	0	0	0	0	0	110.2
746	K	70	Confident	66	Low	84 Å²	84	74.4 Å²	74.4	37%	0.365	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-70.1	134.1	167.8	-73	176.8	-173.7	155.4	0	109.4	G748 A749 E768 T769 R770 K771	K746-G748 PolarHBondContact O-N 3.4Å; K746-A749 WeakPolarHBondContact O-CB 3.38Å; K746-A749 PolarHBondContact O-N 3.12Å; K746-A749 VanDerWaalsContact O-N 3.13Å; K746-E768 WeakPolarHBondContact CD-O 3.01Å; K746-E768 WeakPolarHBondContact CE-O 3.32Å; K746-E768 PolarHBondContact NZ-O 2.85Å; K746-T769 WeakPolarHBondContact CB-O 3.26Å; K746-T769 PolarHBondContact N-O 3.09Å; K746-R770 WeakPolarHBondContact CE-O 3.45Å; K746-R770 PolarHBondContact NZ-O 3.33Å; K746-K771 HydrophobicContact CG-CG 3.92Å
747	A	51.7	Low	63.3	Low	110 Å²	110	80.2 Å²	80.2	91%	0.909	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	130.7	171.4	0	0	0	0	0	109.8
748	G	55.4	Low	60.3	Low	73 Å²	73	84.4 Å²	84.4	75%	0.753	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	-19	-173.7	0	0	0	0	0	115.4	K746 A750	K746-G748 PolarHBondContact O-N 3.4Å; G748-A750 PolarHBondContact O-N 3.01Å
749	A	53.8	Low	57.4	Low	46 Å²	46	90.5 Å²	90.5	38%	0.38	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	5.2	-177	0	0	0	0	0	115.7	K746 T769	K746-A749 WeakPolarHBondContact O-CB 3.38Å; K746-A749 PolarHBondContact O-N 3.12Å; K746-A749 VanDerWaalsContact O-N 3.13Å; A749-T769 HydrophobicContact CB-CG2 4.47Å
750	A	48	Very low	54.7	Low	97 Å²	97	94.6 Å²	94.6	80%	0.802	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-7.1	-172.7	0	0	0	0	0	115	G748 T752	G748-A750 PolarHBondContact O-N 3.01Å; A750-T752 PolarHBondContact O-N 2.99Å
751	L	45.6	Very low	52.3	Low	167 Å²	167	97 Å²	97	87%	0.874	62%	0.621	S	S	*	*	S	Bend	trans	-87.8	2.9	-165.6	-136.2	75.6	0	0	0	115.9
752	T	43.6	Very low	50.5	Low	116 Å²	116	100.1 Å²	100.1	71%	0.712	64%	0.636	S	S	*	*			trans	-122.6	91.3	-179.7	55	0	0	0	0	112.3	A750 A754	A750-T752 PolarHBondContact O-N 2.99Å; T752-A754 PolarHBondContact O-N 3.01Å; T752-A754 VanDerWaalsContact O-N 3.09Å
753	K	35.7	Very low	48.7	Very low	224 Å²	224	103.6 Å²	103.6	97%	0.974	66%	0.658	S	S	*	*			trans	-72.5	89.9	160.2	-76.5	-175.4	176.6	-179.7	0	108.9
754	A	33	Very low	47	Very low	80 Å²	80	111.5 Å²	111.5	66%	0.661	69%	0.685	S	S	*	*			trans	-128.6	116.1	177.2	0	0	0	0	0	111.1	T752	T752-A754 PolarHBondContact O-N 3.01Å; T752-A754 VanDerWaalsContact O-N 3.09Å
755	T	32.7	Very low	45.7	Very low	125 Å²	125	113 Å²	113	77%	0.767	69%	0.69	S	S	*	*			trans	36.9	99.3	160.1	-43.4	0	0	0	0	118.1	N757	T755-N757 PolarHBondContact O-N 2.76Å
756	Q	34.8	Very low	45.4	Very low	190 Å²	190	111.4 Å²	111.4	89%	0.888	67%	0.668	S	S	*	*	S	Bend	trans	-68.8	93.9	153.8	-64.2	175.7	6.7	0	0	108.7
757	N	31.4	Very low	45.5	Very low	156 Å²	156	109.8 Å²	109.8	83%	0.834	66%	0.661	S	S	*	*			trans	173	89.5	153.6	-91.3	-14.7	0	0	0	109.2	T755	T755-N757 PolarHBondContact O-N 2.76Å
758	A	28.1	Very low	46.4	Very low	95 Å²	95	109.5 Å²	109.5	79%	0.785	64%	0.642	S	S	*	*			trans	-143.2	128.7	170.3	0	0	0	0	0	109
759	T	32.7	Very low	47.2	Very low	129 Å²	129	108.9 Å²	108.9	79%	0.791	62%	0.623	S	S	*	*			trans	-60	151.4	177.4	15	0	0	0	0	111.4	G761	T759-G761 PolarHBondContact O-N 3.17Å
760	P	35.4	Very low	48.5	Very low	86 Å²	86	110 Å²	110	56%	0.558	62%	0.617	S	S	*	*	S	Bend	trans	-77.4	48.2	-172.4	32.9	-36.5	0	0	0	114.3
761	G	40	Very low	50.2	Low	54 Å²	54	110.9 Å²	110.9	56%	0.557	60%	0.603	S	S	*	*	S	Bend	trans	-88	122.1	155.2	0	0	0	0	0	108.8	T759 T763	T759-G761 PolarHBondContact O-N 3.17Å; G761-T763 PolarHBondContact O-N 3.23Å
762	I	52.3	Low	52.3	Low	65 Å²	65	103.1 Å²	103.1	33%	0.333	56%	0.562	S	S	.	*			trans	-67.3	99.9	-173.1	-49.6	177.8	0	0	0	110.4	C697 F766 F767	C697-I762 HydrophobicContact CB-CD1 3.94Å; C697-I762 WeakPolarHBondContact O-CD1 3.39Å; I762-F766 HydrophobicContact CG2-CB 3.67Å; I762-F766 HydrophobicContact CG2-CD1 3.6Å; I762-F766 HydrophobicContact CG2-CG 3.88Å; I762-F767 HydrophobicContact CB-CE2 4.36Å; I762-F767 HydrophobicContact CD1-CE2 4.31Å; I762-F767 HydrophobicContact CD1-CZ 3.75Å; I762-F767 HydrophobicContact CG2-CD2 4.04Å; I762-F767 HydrophobicContact CG2-CE2 3.6Å; I762-F767 HydrophobicContact CG2-CZ 3.88Å
763	T	50.3	Low	54.4	Low	97 Å²	97	101.7 Å²	101.7	60%	0.595	55%	0.546	S	S	*	.			trans	-68.3	144.5	169.6	38.2	0	0	0	0	110.4	G761 N765 F766	G761-T763 PolarHBondContact O-N 3.23Å; T763-N765 PolarHBondContact O-N 3.47Å; T763-F766 WeakPolarHBondContact O-CB 3.48Å; T763-F766 PolarHBondContact O-N 2.94Å
764	R	51.2	Low	56.8	Low	194 Å²	194	91.5 Å²	91.5	73%	0.732	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.8	-41	-174	-165.4	-179.5	-177.5	135.6	7	113.7	F766 F767 E768	R764-F766 PolarHBondContact O-N 2.88Å; R764-F766 VanDerWaalsContact O-N 3.12Å; R764-F767 PolarHBondContact O-N 3.38Å; R764-E768 WeakPolarHBondContact CG-OE1 3.34Å; R764-E768 IonicContact NE-OE1 3.06Å; R764-E768 PolarHBondContact NE-OE1 2.91Å; R764-E768 VanDerWaalsContact NE-OE1 3.12Å; R764-E768 PolarHBondContact O-N 3.17Å
765	N	56.8	Low	59.2	Low	107 Å²	107	87.9 Å²	87.9	57%	0.572	47%	0.472	S	S	*	.	H	α-helix	trans	-55.8	-27.2	179.3	-55.6	19.3	0	0	0	114	T763 E768 T769	T763-N765 PolarHBondContact O-N 3.47Å; N765-E768 PolarHBondContact O-N 3.02Å; N765-T769 WeakPolarHBondContact O-CB 3.4Å; N765-T769 VanDerWaalsContact O-CG2 3.3Å; N765-T769 WeakPolarHBondContact O-CG2 3.47Å; N765-T769 PolarHBondContact O-N 3.29Å; N765-T769 PolarHBondContact O-OG1 3.44Å
766	F	70.7	Confident	61.6	Low	44 Å²	44	82.8 Å²	82.8	19%	0.193	44%	0.44	C	S	.	.	H	α-helix	trans	-65.4	-44.3	-178.8	178.1	-95.7	0	0	0	112.6	I762 T763 R764 T769 R770 F772	I762-F766 HydrophobicContact CG2-CB 3.67Å; I762-F766 HydrophobicContact CG2-CD1 3.6Å; I762-F766 HydrophobicContact CG2-CG 3.88Å; T763-F766 WeakPolarHBondContact O-CB 3.48Å; T763-F766 PolarHBondContact O-N 2.94Å; R764-F766 PolarHBondContact O-N 2.88Å; R764-F766 VanDerWaalsContact O-N 3.12Å; F766-T769 PolarHBondContact O-OG1 3.11Å; F766-R770 WeakPolarHBondContact O-CB 3.22Å; F766-F772 HydrophobicContact CD1-CZ 4.19Å; F766-F772 HydrophobicContact CE1-CE1 4.03Å; F766-F772 AromaticContact CE1-CZ 3.69Å; F766-F772 HydrophobicContact CE1-CZ 3.69Å; F766-F772 HydrophobicContact CZ-CE1 4.48Å; F766-F772 HydrophobicContact CZ-CZ 4.37Å
767	F	72.7	Confident	64	Low	50 Å²	50	74.9 Å²	74.9	22%	0.219	40%	0.403	C	S	.	.	H	α-helix	trans	-75.8	-32.9	176.5	-63.3	-56.2	0	0	0	111.6	I680 F732 I762 R764 F772	I680-F767 HydrophobicContact CD1-CB 4.1Å; I680-F767 HydrophobicContact CD1-CD1 3.34Å; I680-F767 HydrophobicContact CD1-CE1 3.77Å; I680-F767 HydrophobicContact CD1-CG 3.76Å; F732-F767 AromaticContact CE1-CE1 4Å; F732-F767 HydrophobicContact CE1-CE1 4Å; F732-F767 HydrophobicContact CE1-CZ 4.48Å; F732-F767 HydrophobicContact CZ-CE1 4.3Å; I762-F767 HydrophobicContact CB-CE2 4.36Å; I762-F767 HydrophobicContact CD1-CE2 4.31Å; I762-F767 HydrophobicContact CD1-CZ 3.75Å; I762-F767 HydrophobicContact CG2-CD2 4.04Å; I762-F767 HydrophobicContact CG2-CE2 3.6Å; I762-F767 HydrophobicContact CG2-CZ 3.88Å; R764-F767 PolarHBondContact O-N 3.38Å; F767-F772 AromaticContact CD1-CE2 3.77Å; F767-F772 HydrophobicContact CD1-CE2 3.77Å; F767-F772 AromaticContact CD1-CZ 3.79Å; F767-F772 HydrophobicContact CD1-CZ 3.79Å; F767-F772 HydrophobicContact CE1-CZ 4.25Å
768	E	70	Confident	66.5	Low	105 Å²	105	67.8 Å²	67.8	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-69.6	-34.1	178.3	-69.2	177	-177.5	0	0	112.6	K746 R764 N765	K746-E768 WeakPolarHBondContact CD-O 3.01Å; K746-E768 WeakPolarHBondContact CE-O 3.32Å; K746-E768 PolarHBondContact NZ-O 2.85Å; R764-E768 WeakPolarHBondContact CG-OE1 3.34Å; R764-E768 IonicContact NE-OE1 3.06Å; R764-E768 PolarHBondContact NE-OE1 2.91Å; R764-E768 VanDerWaalsContact NE-OE1 3.12Å; R764-E768 PolarHBondContact O-N 3.17Å; N765-E768 PolarHBondContact O-N 3.02Å
769	T	71.6	Confident	69.1	Low	59 Å²	59	63.9 Å²	63.9	36%	0.362	33%	0.332	S	S	.	.	H	α-helix	trans	-86.7	-13.4	-178.4	52.6	0	0	0	0	115.4	K746 A749 N765 F766	K746-T769 WeakPolarHBondContact CB-O 3.26Å; K746-T769 PolarHBondContact N-O 3.09Å; A749-T769 HydrophobicContact CB-CG2 4.47Å; N765-T769 WeakPolarHBondContact O-CB 3.4Å; N765-T769 VanDerWaalsContact O-CG2 3.3Å; N765-T769 WeakPolarHBondContact O-CG2 3.47Å; N765-T769 PolarHBondContact O-N 3.29Å; N765-T769 PolarHBondContact O-OG1 3.44Å; F766-T769 PolarHBondContact O-OG1 3.11Å
770	R	81.2	Confident	71.6	Confident	70 Å²	70	57.8 Å²	57.8	26%	0.264	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	160.5	-174	-64.9	177.9	177.4	-137.6	-7	112.3	T744 K746 F766 F772	T744-R770 CarbonylContact O-C 3.59Å; T744-R770 WeakPolarHBondContact O-CA 3.32Å; K746-R770 WeakPolarHBondContact CE-O 3.45Å; K746-R770 PolarHBondContact NZ-O 3.33Å; F766-R770 WeakPolarHBondContact O-CB 3.22Å; R770-F772 HydrophobicContact CB-CE2 3.88Å; R770-F772 HydrophobicContact CB-CZ 3.86Å
771	K	84.1	Confident	73.4	Confident	116 Å²	116	55.3 Å²	55.3	50%	0.504	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139	164.1	-76.1	-173.8	174.7	-168.8	0	108.9	T744 K746	T744-K771 PolarHBondContact N-O 3.38Å; T744-K771 PolarHBondContact O-N 3.23Å; K746-K771 HydrophobicContact CG-CG 3.92Å
772	F	89.8	Confident	75.2	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.1	176.3	-53.3	-95.2	0	0	0	108.2	I680 V681 E682 C730 F732 T742 V743 F766 F767 R770	I680-F772 HydrophobicContact CD1-CD2 4.43Å; I680-F772 HydrophobicContact CD1-CE2 4.47Å; V681-F772 HydrophobicContact CB-CB 4.46Å; V681-F772 HydrophobicContact CG1-CB 4.5Å; V681-F772 HydrophobicContact CG2-CB 4.01Å; E682-F772 WeakPolarHBondContact CB-O 3.37Å; E682-F772 PolarHBondContact N-O 3.21Å; C730-F772 HydrophobicContact CB-CD1 4.16Å; C730-F772 HydrophobicContact CB-CE1 3.93Å; F732-F772 HydrophobicContact CE2-CD1 4.04Å; F732-F772 AromaticContact CZ-CD1 3.96Å; F732-F772 HydrophobicContact CZ-CD1 3.96Å; F732-F772 HydrophobicContact CZ-CE1 4.24Å; F732-F772 HydrophobicContact CZ-CG 4.27Å; T742-F772 WeakPolarHBondContact O-CA 3.11Å; V743-F772 HydrophobicContact CG2-CD1 3.77Å; V743-F772 HydrophobicContact CG2-CE1 3.6Å; F766-F772 HydrophobicContact CD1-CZ 4.19Å; F766-F772 HydrophobicContact CE1-CE1 4.03Å; F766-F772 AromaticContact CE1-CZ 3.69Å; F766-F772 HydrophobicContact CE1-CZ 3.69Å; F766-F772 HydrophobicContact CZ-CE1 4.48Å; F766-F772 HydrophobicContact CZ-CZ 4.37Å; F767-F772 AromaticContact CD1-CE2 3.77Å; F767-F772 HydrophobicContact CD1-CE2 3.77Å; F767-F772 AromaticContact CD1-CZ 3.79Å; F767-F772 HydrophobicContact CD1-CZ 3.79Å; F767-F772 HydrophobicContact CE1-CZ 4.25Å; R770-F772 HydrophobicContact CB-CE2 3.88Å; R770-F772 HydrophobicContact CB-CZ 3.86Å
773	K	87.5	Confident	76.5	Confident	86 Å²	86	51.9 Å²	51.9	37%	0.374	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	135.6	172.1	-178.3	173.1	-175.2	141.1	0	108.6	E682 T741 T742	E682-K773 HydrophobicContact CB-CB 4.18Å; E682-K773 HydrophobicContact CB-CG 4.2Å; E682-K773 WeakPolarHBondContact O-CA 3.42Å; E682-K773 WeakPolarHBondContact OE1-CE 3.42Å; E682-K773 IonicContact OE1-NZ 2.75Å; E682-K773 PolarHBondContact OE1-NZ 3.42Å; T741-K773 CarbonylContact C-O 3.55Å; T741-K773 WeakPolarHBondContact CA-O 3.46Å; T741-K773 WeakPolarHBondContact CB-O 3.49Å; T742-K773 PolarHBondContact N-O 2.93Å; T742-K773 PolarHBondContact O-N 3.26Å; T742-K773 WeakPolarHBondContact OG1-CB 3.43Å
774	L	86.8	Confident	77.7	Confident	9 Å²	9	50.4 Å²	50.4	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	134.7	-177.3	-172.1	64.1	0	0	0	110.7	V681 E682 G683 L684 L739 L776 K777 M1368	V681-L774 HydrophobicContact CG1-CB 4.1Å; E682-L774 PolarHBondContact O-N 3.23Å; G683-L774 VanDerWaalsContact O-CD2 3.31Å; G683-L774 WeakPolarHBondContact O-CD2 3.23Å; L684-L774 HydrophobicContact CD1-CD1 4.48Å; L684-L774 HydrophobicContact CD1-CD2 4.16Å; L739-L774 HydrophobicContact CB-CD1 4.31Å; L739-L774 HydrophobicContact CD2-CD1 4.26Å; L774-L776 WeakPolarHBondContact CD1-O 3.18Å; L774-K777 HydrophobicContact CD2-CB 4.38Å; L774-M1368 WeakPolarHBondContact O-CE 3.32Å
775	L	82.8	Confident	79.2	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	-48.7	168.5	-70.3	168.2	0	0	0	111.2	F716 F720 I740 T742 M1368	F716-L775 HydrophobicContact CE1-CD1 4.38Å; F716-L775 HydrophobicContact CE1-CD2 3.91Å; F716-L775 HydrophobicContact CZ-CB 3.98Å; F716-L775 HydrophobicContact CZ-CD1 4.09Å; F716-L775 HydrophobicContact CZ-CD2 3.82Å; F716-L775 HydrophobicContact CZ-CG 4.2Å; F720-L775 HydrophobicContact CD2-CD2 4.22Å; F720-L775 HydrophobicContact CE2-CD2 3.35Å; F720-L775 HydrophobicContact CZ-CD2 3.56Å; I740-L775 WeakPolarHBondContact O-CB 3.49Å; I740-L775 PolarHBondContact O-N 3.38Å; T742-L775 HydrophobicContact CG2-CD1 3.66Å; T742-L775 HydrophobicContact CG2-CD2 3.87Å; T742-L775 HydrophobicContact CG2-CG 3.86Å; L775-M1368 WeakPolarHBondContact O-CE 3.45Å
776	L	83.3	Confident	79.9	Confident	18 Å²	18	39.6 Å²	39.6	9%	0.094	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	138.8	-177.5	-65.7	169	0	0	0	110	F716 L739 I740 L774 L778 L1370	F716-L776 HydrophobicContact CE2-CD1 4.16Å; F716-L776 HydrophobicContact CE2-CD2 4.34Å; F716-L776 HydrophobicContact CE2-CG 4.14Å; L739-L776 WeakPolarHBondContact CA-O 3.47Å; I740-L776 HydrophobicContact CB-CB 4.17Å; I740-L776 HydrophobicContact CD1-CD1 4.12Å; I740-L776 HydrophobicContact CG1-CB 4.2Å; I740-L776 PolarHBondContact N-O 3.34Å; I740-L776 PolarHBondContact O-N 3.25Å; L774-L776 WeakPolarHBondContact CD1-O 3.18Å; L776-L778 HydrophobicContact CB-CD2 4.23Å; L776-L778 HydrophobicContact CB-CG 4.16Å; L776-L1370 HydrophobicContact CD2-CD1 3.92Å
777	K	85.1	Confident	79.4	Confident	25 Å²	25	43.7 Å²	43.7	11%	0.109	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	90.1	170.8	177.6	169.4	-171.4	-177.3	0	106.7	L684 D685 D686 L737 L739 L774 N1371	L684-K777 HydrophobicContact CD1-CD 4.21Å; D685-K777 PolarHBondContact O-NZ 2.94Å; D686-K777 PolarHBondContact O-NZ 3.38Å; L737-K777 HydrophobicContact CD1-CG 4.33Å; L737-K777 HydrophobicContact CD2-CG 4.34Å; L739-K777 HydrophobicContact CD2-CB 3.76Å; L739-K777 HydrophobicContact CD2-CD 4.19Å; L739-K777 HydrophobicContact CD2-CG 3.56Å; L774-K777 HydrophobicContact CD2-CB 4.38Å; K777-N1371 PolarHBondContact O-ND2 2.89Å
778	L	84.4	Confident	79.1	Confident	6 Å²	6	44 Å²	44	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	143.2	-176	-56.2	179.2	0	0	0	109.9	L737 L738 I740 L776 L783 V862 L1370	L737-L778 WeakPolarHBondContact CA-O 3.43Å; L737-L778 WeakPolarHBondContact CD2-O 3.48Å; L738-L778 PolarHBondContact N-O 2.75Å; L738-L778 PolarHBondContact O-N 3.36Å; I740-L778 HydrophobicContact CD1-CD1 4.22Å; L776-L778 HydrophobicContact CB-CD2 4.23Å; L776-L778 HydrophobicContact CB-CG 4.16Å; L778-L783 HydrophobicContact CB-CD1 4.15Å; L778-L783 HydrophobicContact CD1-CD2 4.08Å; L778-V862 HydrophobicContact CD1-CG1 4.13Å; L778-V862 HydrophobicContact CD1-CG2 4.05Å; L778-V862 HydrophobicContact CD2-CG1 4Å; L778-L1370 HydrophobicContact CD2-CD1 4.11Å
779	S	83.1	Confident	79.7	Confident	14 Å²	14	41.6 Å²	41.6	10%	0.098	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	145.1	170.3	-165.6	0	0	0	0	110	Q781 D782 L783	S779-Q781 PolarHBondContact O-N 2.79Å; S779-Q781 WeakPolarHBondContact OG-CB 3.48Å; S779-Q781 PolarHBondContact OG-N 2.88Å; S779-Q781 VanDerWaalsContact OG-N 3.16Å; S779-D782 WeakPolarHBondContact CB-OD2 3.4Å; S779-D782 PolarHBondContact O-N 3.2Å; S779-L783 WeakPolarHBondContact O-CD1 2.84Å
780	L	84	Confident	80.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.1	163.1	-88.2	-177.7	0	0	0	111.8	L733 F734 D736 L783 F888 A891 K892 F895	L733-L780 HydrophobicContact CD1-CD1 4.36Å; L733-L780 HydrophobicContact CD1-CD2 4.1Å; F734-L780 WeakPolarHBondContact O-CD1 3.42Å; D736-L780 PolarHBondContact O-N 3.4Å; L780-L783 HydrophobicContact CD2-CD1 4.34Å; L780-F888 HydrophobicContact CD2-CD2 3.73Å; L780-F888 HydrophobicContact CD2-CE2 3.33Å; L780-F888 HydrophobicContact CD2-CZ 4.06Å; L780-A891 HydrophobicContact CD1-CB 3.57Å; L780-K892 WeakPolarHBondContact O-CE 3.4Å; L780-K892 PolarHBondContact O-NZ 2.86Å; L780-F895 HydrophobicContact CB-CG 4.43Å
781	Q	74.4	Confident	80.4	Confident	35 Å²	35	46.3 Å²	46.3	16%	0.164	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-53.3	170.8	-164.6	129.4	28.3	0	0	111.3	S779 L783 K892 F895 Q899 Q1311	S779-Q781 PolarHBondContact O-N 2.79Å; S779-Q781 WeakPolarHBondContact OG-CB 3.48Å; S779-Q781 PolarHBondContact OG-N 2.88Å; S779-Q781 VanDerWaalsContact OG-N 3.16Å; Q781-L783 VanDerWaalsContact C-N 3.33Å; Q781-L783 PolarHBondContact O-N 3.1Å; Q781-K892 PolarHBondContact O-NZ 2.75Å; Q781-F895 HydrophobicContact CB-CE1 3.61Å; Q781-F895 HydrophobicContact CB-CZ 3.8Å; Q781-F895 HydrophobicContact CG-CE1 4.09Å; Q781-F895 HydrophobicContact CG-CZ 4.45Å; Q781-Q899 VanDerWaalsContact CD-NE2 3.34Å; Q781-Q1311 HydrophobicContact CG-CG 3.65Å; Q781-Q1311 VanDerWaalsContact NE2-CG 3.33Å
782	D	77.5	Confident	80.6	Confident	45 Å²	45	44.5 Å²	44.5	24%	0.241	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-9.9	-165.4	-45.1	-41.3	0	0	0	114	S779 T863	S779-D782 WeakPolarHBondContact CB-OD2 3.4Å; S779-D782 PolarHBondContact O-N 3.2Å; D782-T863 VanDerWaalsContact O-CB 3.27Å; D782-T863 WeakPolarHBondContact O-CB 3.23Å; D782-T863 PolarHBondContact O-N 2.97Å; D782-T863 PolarHBondContact O-OG1 3.33Å
783	L	79.4	Confident	80.6	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	139.1	-172.5	-74.5	164.4	0	0	0	113	L738 L778 S779 L780 Q781 L861 V862 F888 K892	L738-L783 HydrophobicContact CB-CD1 3.62Å; L738-L783 HydrophobicContact CD2-CD1 3.68Å; L738-L783 HydrophobicContact CG-CD1 4.3Å; L778-L783 HydrophobicContact CB-CD1 4.15Å; L778-L783 HydrophobicContact CD1-CD2 4.08Å; S779-L783 WeakPolarHBondContact O-CD1 2.84Å; L780-L783 HydrophobicContact CD2-CD1 4.34Å; Q781-L783 VanDerWaalsContact C-N 3.33Å; Q781-L783 PolarHBondContact O-N 3.1Å; L783-L861 CarbonylContact C-O 3.57Å; L783-L861 WeakPolarHBondContact CA-O 3.35Å; L783-V862 HydrophobicContact CD2-CG2 3.93Å; L783-F888 HydrophobicContact CB-CE2 4.2Å; L783-F888 HydrophobicContact CB-CZ 3.97Å; L783-F888 HydrophobicContact CD1-CE2 4.35Å; L783-K892 WeakPolarHBondContact O-CE 3.33Å; L783-K892 PolarHBondContact O-NZ 3.42Å
784	C	76.5	Confident	80.8	Confident	66 Å²	66	45.4 Å²	45.4	45%	0.446	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	155.9	168.4	-163.9	0	0	0	0	110.9	L860 L861	C784-L860 CarbonylContact O-C 3.53Å; C784-L860 WeakPolarHBondContact O-CA 3.4Å; C784-L861 HydrophobicContact CB-CB 4.3Å; C784-L861 PolarHBondContact N-O 3.17Å; C784-L861 PolarHBondContact O-N 3.11Å
785	V	82.1	Confident	81	Confident	40 Å²	40	50.3 Å²	50.3	24%	0.242	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	136.8	165	171.2	0	0	0	0	108.3	N788 L858 L860 F888	V785-N788 HydrophobicContact CG1-CB 4Å; V785-L858 HydrophobicContact CG1-CD1 3.71Å; V785-L860 HydrophobicContact CG2-CD2 3.85Å; V785-F888 HydrophobicContact CG2-CD1 4.14Å; V785-F888 HydrophobicContact CG2-CE1 3.88Å
786	V	70.5	Confident	81.5	Confident	34 Å²	34	50.2 Å²	50.2	21%	0.206	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.7	177.2	173.7	0	0	0	0	109	N859 L861	V786-N859 HydrophobicContact CB-CB 4.43Å; V786-N859 PolarHBondContact N-O 3.13Å; V786-N859 WeakPolarHBondContact O-CB 3.39Å; V786-L861 HydrophobicContact CG2-CB 3.72Å; V786-L861 HydrophobicContact CG2-CD1 4.5Å; V786-L861 HydrophobicContact CG2-CD2 4.04Å; V786-L861 HydrophobicContact CG2-CG 4.32Å
787	D	61.1	Low	82	Confident	129 Å²	129	52.5 Å²	52.5	69%	0.69	27%	0.267	S	S	*	.	S	Bend	trans	48.8	71.5	179.9	-59.2	-29.9	0	0	0	114.4	N789	D787-N789 PolarHBondContact O-N 3.15Å
788	N	65.1	Low	82.5	Confident	56 Å²	56	57 Å²	57	30%	0.299	29%	0.289	S	S	.	.			trans	-87.6	94.5	-171.8	-162.4	-4.7	0	0	0	114.5	V785 K790 R881 E885	V785-N788 HydrophobicContact CG1-CB 4Å; N788-K790 PolarHBondContact O-N 3.46Å; N788-K790 WeakPolarHBondContact OD1-CB 3.38Å; N788-K790 PolarHBondContact OD1-N 2.94Å; N788-R881 PolarHBondContact OD1-NH2 3.13Å; N788-E885 PolarHBondContact ND2-OE2 2.71Å; N788-E885 PolarHBondContact OD1-OE1 2.82Å; N788-E885 PolarHBondContact OD1-OE2 3.01Å
789	N	83.9	Confident	83	Confident	55 Å²	55	58.9 Å²	58.9	29%	0.294	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	1.6	168.7	-72.7	-11.5	0	0	0	115.9	D787 Q791 L792 I793 S854 L855	D787-N789 PolarHBondContact O-N 3.15Å; N789-Q791 VanDerWaalsContact C-N 3.27Å; N789-Q791 PolarHBondContact O-N 3.07Å; N789-L792 WeakPolarHBondContact O-CA 3.35Å; N789-L792 WeakPolarHBondContact O-CB 3.45Å; N789-L792 PolarHBondContact O-N 2.93Å; N789-I793 WeakPolarHBondContact O-CG1 3.31Å; N789-I793 PolarHBondContact O-N 3.02Å; N789-S854 PolarHBondContact ND2-O 3.27Å; N789-S854 PolarHBondContact ND2-OG 3.35Å; N789-L855 HydrophobicContact CB-CD2 4.22Å
790	K	82.9	Confident	83.6	Confident	56 Å²	56	58.8 Å²	58.8	24%	0.243	30%	0.296	C	S	.	.	H	α-helix	trans	-46.4	-43.8	175.1	-178.4	-175.1	-157.3	-178.2	0	113.6	N788 L792 I793 M794 L882 E885 E889	N788-K790 PolarHBondContact O-N 3.46Å; N788-K790 WeakPolarHBondContact OD1-CB 3.38Å; N788-K790 PolarHBondContact OD1-N 2.94Å; K790-L792 PolarHBondContact O-N 3.48Å; K790-I793 PolarHBondContact O-N 2.95Å; K790-M794 WeakPolarHBondContact O-CB 3.45Å; K790-M794 VanDerWaalsContact O-CG 3.26Å; K790-M794 WeakPolarHBondContact O-CG 3.47Å; K790-M794 PolarHBondContact O-N 3.5Å; K790-L882 HydrophobicContact CB-CD2 4.42Å; K790-L882 HydrophobicContact CG-CD2 3.81Å; K790-E885 WeakPolarHBondContact CD-OE2 3.44Å; K790-E889 IonicContact NZ-OE1 3.51Å; K790-E889 PolarHBondContact NZ-OE1 3.33Å; K790-E889 IonicContact NZ-OE2 3.16Å; K790-E889 PolarHBondContact NZ-OE2 3.33Å
791	Q	84.1	Confident	84.2	Confident	172 Å²	172	61 Å²	61	80%	0.804	31%	0.314	S	S	*	.	H	α-helix	trans	-64.4	-39.4	177.4	-73.8	-171.3	-11.5	0	0	112.7	N789 M794 K795	N789-Q791 VanDerWaalsContact C-N 3.27Å; N789-Q791 PolarHBondContact O-N 3.07Å; Q791-M794 PolarHBondContact O-N 2.78Å; Q791-K795 WeakPolarHBondContact O-CB 3.4Å; Q791-K795 PolarHBondContact O-N 3.35Å
792	L	88.9	Confident	85.3	Confident	78 Å²	78	63.6 Å²	63.6	41%	0.408	33%	0.329	S	S	.	.	H	α-helix	trans	-66.7	-42.5	176.3	-179.1	58.2	0	0	0	111.3	N789 K790 M794 K795 V796 L855	N789-L792 WeakPolarHBondContact O-CA 3.35Å; N789-L792 WeakPolarHBondContact O-CB 3.45Å; N789-L792 PolarHBondContact O-N 2.93Å; K790-L792 PolarHBondContact O-N 3.48Å; L792-M794 PolarHBondContact O-N 2.89Å; L792-K795 PolarHBondContact O-N 3.12Å; L792-V796 HydrophobicContact CD1-CG2 4.25Å; L792-V796 WeakPolarHBondContact O-CG2 3.44Å; L792-V796 PolarHBondContact O-N 2.87Å; L792-L855 HydrophobicContact CD2-CD2 3.84Å; L792-L855 HydrophobicContact CG-CD2 4.12Å
793	I	90.4	Very high	86.3	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-43.9	175.3	-59.3	169.6	0	0	0	111	N789 K790 V796 K797 L849 L855 T878 L882	N789-I793 WeakPolarHBondContact O-CG1 3.31Å; N789-I793 PolarHBondContact O-N 3.02Å; K790-I793 PolarHBondContact O-N 2.95Å; I793-V796 PolarHBondContact O-N 2.93Å; I793-K797 WeakPolarHBondContact O-CB 3.33Å; I793-K797 WeakPolarHBondContact O-CG 3.49Å; I793-K797 PolarHBondContact O-N 3.48Å; I793-L849 HydrophobicContact CG2-CD2 4.13Å; I793-L855 HydrophobicContact CD1-CB 4.36Å; I793-L855 WeakPolarHBondContact CD1-O 3.46Å; I793-L855 HydrophobicContact CG1-CB 4.12Å; I793-L855 HydrophobicContact CG1-CD2 3.98Å; I793-L855 HydrophobicContact CG1-CG 4.47Å; I793-T878 HydrophobicContact CD1-CG2 4.17Å; I793-T878 HydrophobicContact CG1-CG2 4.37Å; I793-T878 HydrophobicContact CG2-CG2 4.23Å; I793-L882 HydrophobicContact CG2-CD1 3.72Å; I793-L882 HydrophobicContact CG2-CD2 4.43Å; I793-L882 HydrophobicContact CG2-CG 4.2Å
794	M	90.4	Very high	87.1	Confident	109 Å²	109	67.8 Å²	67.8	54%	0.537	35%	0.348	S	S	.	.	H	α-helix	trans	-61.3	-45.8	176.7	-70.8	-63.1	-64.8	0	0	111.1	K790 Q791 L792 K797 E798 L882	K790-M794 WeakPolarHBondContact O-CB 3.45Å; K790-M794 VanDerWaalsContact O-CG 3.26Å; K790-M794 WeakPolarHBondContact O-CG 3.47Å; K790-M794 PolarHBondContact O-N 3.5Å; Q791-M794 PolarHBondContact O-N 2.78Å; L792-M794 PolarHBondContact O-N 2.89Å; M794-K797 WeakPolarHBondContact O-CB 3.21Å; M794-K797 PolarHBondContact O-N 3.47Å; M794-E798 WeakPolarHBondContact O-CB 3.41Å; M794-E798 PolarHBondContact O-N 2.9Å; M794-L882 HydrophobicContact SD-CD1 4.44Å
795	K	92.1	Very high	88.1	Confident	112 Å²	112	66.8 Å²	66.8	49%	0.487	34%	0.336	S	S	.	.	H	α-helix	trans	-62.3	-43.7	176.8	-173	174.8	-171.2	-83.3	0	112.8	Q791 L792 K797 E798 E799	Q791-K795 WeakPolarHBondContact O-CB 3.4Å; Q791-K795 PolarHBondContact O-N 3.35Å; L792-K795 PolarHBondContact O-N 3.12Å; K795-K797 VanDerWaalsContact C-N 3.3Å; K795-K797 PolarHBondContact O-N 2.95Å; K795-E798 WeakPolarHBondContact O-CB 3.4Å; K795-E798 PolarHBondContact O-N 3.31Å; K795-E799 IonicContact NZ-OE1 2.67Å; K795-E799 PolarHBondContact NZ-OE1 3.42Å; K795-E799 WeakPolarHBondContact O-CG 3.36Å; K795-E799 PolarHBondContact O-N 3.48Å
796	V	93.4	Very high	88.8	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.012	34%	0.343	C	S	.	.	H	α-helix	trans	-66	-34	177.4	173.4	0	0	0	0	111.2	L792 I793 I800 R845 L849	L792-V796 HydrophobicContact CD1-CG2 4.25Å; L792-V796 WeakPolarHBondContact O-CG2 3.44Å; L792-V796 PolarHBondContact O-N 2.87Å; I793-V796 PolarHBondContact O-N 2.93Å; V796-I800 HydrophobicContact CG1-CD1 4.18Å; V796-I800 WeakPolarHBondContact O-CD1 3.42Å; V796-I800 VanDerWaalsContact O-CG1 3.26Å; V796-I800 WeakPolarHBondContact O-CG1 3.47Å; V796-I800 PolarHBondContact O-N 3.12Å; V796-R845 HydrophobicContact CG1-CB 4.33Å; V796-L849 HydrophobicContact CB-CD2 4.08Å; V796-L849 HydrophobicContact CG1-CD1 4.18Å; V796-L849 HydrophobicContact CG1-CD2 3.72Å; V796-L849 HydrophobicContact CG1-CG 3.67Å
797	K	93.4	Very high	90	Very high	66 Å²	66	69 Å²	69	29%	0.287	35%	0.346	S	S	.	.	H	α-helix	trans	-67.3	-41.3	171.9	-78.2	-174.3	165.6	-151.6	0	113.2	I793 M794 K795 I800 A801 L849 D879 L882	I793-K797 WeakPolarHBondContact O-CB 3.33Å; I793-K797 WeakPolarHBondContact O-CG 3.49Å; I793-K797 PolarHBondContact O-N 3.48Å; M794-K797 WeakPolarHBondContact O-CB 3.21Å; M794-K797 PolarHBondContact O-N 3.47Å; K795-K797 VanDerWaalsContact C-N 3.3Å; K795-K797 PolarHBondContact O-N 2.95Å; K797-I800 PolarHBondContact O-N 3.39Å; K797-A801 PolarHBondContact O-N 3.43Å; K797-L849 HydrophobicContact CG-CD1 3.95Å; K797-D879 IonicContact NZ-OD1 2.75Å; K797-D879 PolarHBondContact NZ-OD1 2.81Å; K797-L882 HydrophobicContact CD-CD1 4.35Å
798	E	94.8	Very high	91.7	Very high	120 Å²	120	66.8 Å²	66.8	56%	0.561	33%	0.327	S	S	*	.	H	α-helix	trans	-63.1	-44.4	175	-173.9	178.5	-175.8	0	0	111	M794 K795 I800 A801 N802	M794-E798 WeakPolarHBondContact O-CB 3.41Å; M794-E798 PolarHBondContact O-N 2.9Å; K795-E798 WeakPolarHBondContact O-CB 3.4Å; K795-E798 PolarHBondContact O-N 3.31Å; E798-I800 VanDerWaalsContact C-N 3.32Å; E798-I800 PolarHBondContact O-N 2.92Å; E798-A801 PolarHBondContact O-N 3.39Å; E798-N802 WeakPolarHBondContact O-CB 3.45Å; E798-N802 VanDerWaalsContact O-CG 3.23Å; E798-N802 PolarHBondContact O-N 2.6Å; E798-N802 PolarHBondContact O-ND2 2.93Å
799	E	95.1	Very high	93.2	Very high	45 Å²	45	65.5 Å²	65.5	21%	0.21	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-38.5	171.7	-73.6	-178.9	-147.9	0	0	112.4	K795 L803 R845	K795-E799 IonicContact NZ-OE1 2.67Å; K795-E799 PolarHBondContact NZ-OE1 3.42Å; K795-E799 WeakPolarHBondContact O-CG 3.36Å; K795-E799 PolarHBondContact O-N 3.48Å; E799-L803 WeakPolarHBondContact O-CB 3.41Å; E799-L803 WeakPolarHBondContact O-CD1 3.42Å; E799-L803 WeakPolarHBondContact O-CG 3.5Å; E799-L803 PolarHBondContact O-N 3.43Å; E799-R845 IonicContact OE1-NH2 2.81Å; E799-R845 IonicContact OE2-CZ 2.79Å; E799-R845 IonicContact OE2-NE 3.14Å; E799-R845 PolarHBondContact OE2-NE 3.25Å; E799-R845 IonicContact OE2-NH2 2.67Å; E799-R845 PolarHBondContact OE2-NH2 2.82Å
800	I	96.1	Very high	93.7	Very high	13 Å²	13	63 Å²	63	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-66.2	-43.7	174.5	-72.1	164.7	0	0	0	111.7	V796 K797 E798 N802 L803 Q804 R845 L849	V796-I800 HydrophobicContact CG1-CD1 4.18Å; V796-I800 WeakPolarHBondContact O-CD1 3.42Å; V796-I800 VanDerWaalsContact O-CG1 3.26Å; V796-I800 WeakPolarHBondContact O-CG1 3.47Å; V796-I800 PolarHBondContact O-N 3.12Å; K797-I800 PolarHBondContact O-N 3.39Å; E798-I800 VanDerWaalsContact C-N 3.32Å; E798-I800 PolarHBondContact O-N 2.92Å; I800-N802 VanDerWaalsContact C-N 3.35Å; I800-N802 PolarHBondContact O-N 2.94Å; I800-L803 PolarHBondContact O-N 2.73Å; I800-Q804 HydrophobicContact CG2-CG 4.41Å; I800-Q804 WeakPolarHBondContact O-CB 3.43Å; I800-Q804 VanDerWaalsContact O-CG 3.28Å; I800-Q804 WeakPolarHBondContact O-CG 3.31Å; I800-Q804 PolarHBondContact O-N 3.49Å; I800-R845 HydrophobicContact CD1-CB 4.02Å; I800-R845 HydrophobicContact CG1-CB 3.62Å; I800-L849 HydrophobicContact CD1-CD1 3.48Å; I800-L849 VanDerWaalsContact CD1-CD1 3.48Å; I800-L849 HydrophobicContact CD1-CG 4.22Å
801	A	96.4	Very high	94.2	Very high	47 Å²	47	61.8 Å²	61.8	39%	0.388	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-42.5	178.6	0	0	0	0	0	111.5	K797 E798 Q804 E805	K797-A801 PolarHBondContact O-N 3.43Å; E798-A801 PolarHBondContact O-N 3.39Å; A801-Q804 WeakPolarHBondContact O-CB 3.44Å; A801-Q804 PolarHBondContact O-N 2.84Å; A801-E805 PolarHBondContact O-N 3Å
802	N	97.2	Very high	94.7	Very high	89 Å²	89	58.2 Å²	58.2	48%	0.476	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-46.9	174.5	-66.1	-18.8	0	0	0	111.2	E798 I800 Q804 E805 D806	E798-N802 WeakPolarHBondContact O-CB 3.45Å; E798-N802 VanDerWaalsContact O-CG 3.23Å; E798-N802 PolarHBondContact O-N 2.6Å; E798-N802 PolarHBondContact O-ND2 2.93Å; I800-N802 VanDerWaalsContact C-N 3.35Å; I800-N802 PolarHBondContact O-N 2.94Å; N802-Q804 PolarHBondContact O-N 3.46Å; N802-E805 PolarHBondContact O-N 3.17Å; N802-E805 VanDerWaalsContact O-N 3.1Å; N802-D806 PolarHBondContact O-N 3.28Å
803	L	97.6	Very high	95	Very high	23 Å²	23	58.3 Å²	58.3	12%	0.12	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-26.3	175.8	-72.1	165.7	0	0	0	113.4	E799 I800 L807 I838 T841 L842 R845	E799-L803 WeakPolarHBondContact O-CB 3.41Å; E799-L803 WeakPolarHBondContact O-CD1 3.42Å; E799-L803 WeakPolarHBondContact O-CG 3.5Å; E799-L803 PolarHBondContact O-N 3.43Å; I800-L803 PolarHBondContact O-N 2.73Å; L803-L807 VanDerWaalsContact O-CB 3.3Å; L803-L807 WeakPolarHBondContact O-CB 3.38Å; L803-L807 PolarHBondContact O-N 2.92Å; L803-I838 HydrophobicContact CD2-CG2 4.22Å; L803-I838 WeakPolarHBondContact O-CG2 3.49Å; L803-T841 HydrophobicContact CD1-CG2 3.83Å; L803-T841 HydrophobicContact CD2-CG2 4.18Å; L803-L842 HydrophobicContact CB-CB 4.22Å; L803-L842 HydrophobicContact CB-CD1 4.25Å; L803-L842 HydrophobicContact CB-CG 4.35Å; L803-L842 HydrophobicContact CD1-CB 4.44Å; L803-R845 HydrophobicContact CD1-CG 4.31Å
804	Q	97.4	Very high	95.1	Very high	112 Å²	112	60 Å²	60	52%	0.523	31%	0.309	S	S	.	.	H	α-helix	trans	-73.5	-36.9	173	-76	174.1	-52	0	0	112.1	I800 A801 N802 R808 L842	I800-Q804 HydrophobicContact CG2-CG 4.41Å; I800-Q804 WeakPolarHBondContact O-CB 3.43Å; I800-Q804 VanDerWaalsContact O-CG 3.28Å; I800-Q804 WeakPolarHBondContact O-CG 3.31Å; I800-Q804 PolarHBondContact O-N 3.49Å; A801-Q804 WeakPolarHBondContact O-CB 3.44Å; A801-Q804 PolarHBondContact O-N 2.84Å; N802-Q804 PolarHBondContact O-N 3.46Å; Q804-R808 PolarHBondContact O-N 2.72Å; Q804-L842 HydrophobicContact CG-CD1 3.78Å
805	E	96.7	Very high	95.2	Very high	44 Å²	44	61.4 Å²	61.4	21%	0.206	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-50	167.9	170.4	59.6	-27	0	0	111	N406 A801 N802 L807 R808 V809	N406-E805 VanDerWaalsContact CB-OE1 3.28Å; N406-E805 WeakPolarHBondContact CB-OE1 3.47Å; N406-E805 WeakPolarHBondContact CB-OE2 3.41Å; N406-E805 PolarHBondContact ND2-OE1 3.1Å; A801-E805 PolarHBondContact O-N 3Å; N802-E805 PolarHBondContact O-N 3.17Å; N802-E805 VanDerWaalsContact O-N 3.1Å; E805-L807 PolarHBondContact O-N 2.99Å; E805-R808 VanDerWaalsContact CD-NH2 3.26Å; E805-R808 CarbonylContact O-C 3.59Å; E805-R808 WeakPolarHBondContact O-CA 3.23Å; E805-R808 WeakPolarHBondContact O-CB 3.43Å; E805-R808 PolarHBondContact O-N 3.36Å; E805-R808 IonicContact OE1-CZ 3.19Å; E805-R808 IonicContact OE1-NE 3.5Å; E805-R808 PolarHBondContact OE1-NE 2.93Å; E805-R808 IonicContact OE1-NH2 2.76Å; E805-R808 PolarHBondContact OE1-NH2 3.33Å; E805-R808 IonicContact OE2-CZ 2.65Å; E805-R808 IonicContact OE2-NH2 3.85Å; E805-R808 PolarHBondContact OE2-NH2 3.15Å; E805-V809 HydrophobicContact CG-CG2 4.1Å; E805-V809 WeakPolarHBondContact O-CB 3.23Å; E805-V809 WeakPolarHBondContact O-CG2 3.4Å; E805-V809 PolarHBondContact O-N 2.84Å
806	D	96.5	Very high	95.2	Very high	71 Å²	71	60.8 Å²	60.8	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-55.8	-37.9	179	-69.6	-28.9	0	0	0	112.1	N802 V809 A810 I838	N802-D806 PolarHBondContact O-N 3.28Å; D806-V809 WeakPolarHBondContact O-CB 3.33Å; D806-V809 PolarHBondContact O-N 3.48Å; D806-A810 VanDerWaalsContact O-CB 3.26Å; D806-A810 WeakPolarHBondContact O-CB 3.01Å; D806-A810 PolarHBondContact O-N 3.43Å; D806-I838 HydrophobicContact CB-CD1 4.09Å; D806-I838 HydrophobicContact CB-CG2 4.36Å
807	L	96.8	Very high	95.2	Very high	51 Å²	51	61 Å²	61	27%	0.267	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-39.8	176.1	-176.5	58.3	0	0	0	112.4	L803 E805 G811 V835 I838 K839 L842	L803-L807 VanDerWaalsContact O-CB 3.3Å; L803-L807 WeakPolarHBondContact O-CB 3.38Å; L803-L807 PolarHBondContact O-N 2.92Å; E805-L807 PolarHBondContact O-N 2.99Å; L807-G811 PolarHBondContact O-N 3.15Å; L807-V835 HydrophobicContact CD1-CG1 4.19Å; L807-I838 HydrophobicContact CB-CG2 3.8Å; L807-I838 HydrophobicContact CD1-CG2 4.3Å; L807-K839 HydrophobicContact CD1-CG 3.91Å; L807-K839 HydrophobicContact CD2-CG 4.38Å; L807-L842 HydrophobicContact CD2-CD1 4.25Å
808	R	96.8	Very high	94.9	Very high	81 Å²	81	64.4 Å²	64.4	31%	0.306	34%	0.335	S	S	.	.	H	α-helix	trans	-70.3	-39.3	176.3	-173.2	-152.2	65.5	113.4	0.2	111.1	N406 Q804 E805 G811 K812	N406-R808 PolarHBondContact O-NH1 2.9Å; N406-R808 PolarHBondContact O-NH2 3.41Å; Q804-R808 PolarHBondContact O-N 2.72Å; E805-R808 VanDerWaalsContact CD-NH2 3.26Å; E805-R808 CarbonylContact O-C 3.59Å; E805-R808 WeakPolarHBondContact O-CA 3.23Å; E805-R808 WeakPolarHBondContact O-CB 3.43Å; E805-R808 PolarHBondContact O-N 3.36Å; E805-R808 IonicContact OE1-CZ 3.19Å; E805-R808 IonicContact OE1-NE 3.5Å; E805-R808 PolarHBondContact OE1-NE 2.93Å; E805-R808 IonicContact OE1-NH2 2.76Å; E805-R808 PolarHBondContact OE1-NH2 3.33Å; E805-R808 IonicContact OE2-CZ 2.65Å; E805-R808 IonicContact OE2-NH2 3.85Å; E805-R808 PolarHBondContact OE2-NH2 3.15Å; R808-G811 PolarHBondContact O-N 3.41Å; R808-K812 PolarHBondContact O-N 2.82Å; R808-K812 VanDerWaalsContact O-N 3.08Å
809	V	96.5	Very high	94.8	Very high	30 Å²	30	65 Å²	65	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-56.4	-53.8	170.7	154.4	0	0	0	0	110.9	F408 E805 D806 G811 K812 L813	F408-V809 HydrophobicContact CD2-CG2 4.05Å; F408-V809 HydrophobicContact CE1-CG1 4.42Å; F408-V809 HydrophobicContact CE2-CB 3.91Å; F408-V809 HydrophobicContact CE2-CG1 3.58Å; F408-V809 HydrophobicContact CE2-CG2 3.63Å; F408-V809 HydrophobicContact CZ-CB 4.16Å; F408-V809 HydrophobicContact CZ-CG1 3.39Å; F408-V809 HydrophobicContact CZ-CG2 3.92Å; E805-V809 HydrophobicContact CG-CG2 4.1Å; E805-V809 WeakPolarHBondContact O-CB 3.23Å; E805-V809 WeakPolarHBondContact O-CG2 3.4Å; E805-V809 PolarHBondContact O-N 2.84Å; D806-V809 WeakPolarHBondContact O-CB 3.33Å; D806-V809 PolarHBondContact O-N 3.48Å; V809-G811 PolarHBondContact O-N 3.38Å; V809-K812 PolarHBondContact O-N 3.26Å; V809-L813 PolarHBondContact O-N 3.03Å
810	A	94.5	Very high	94.5	Very high	2 Å²	2	67 Å²	67	2%	0.017	35%	0.353	C	S	.	.	H	α-helix	trans	-68.8	-33	-179	0	0	0	0	0	112.4	D806 L813 A814 L834 V835 I838	D806-A810 VanDerWaalsContact O-CB 3.26Å; D806-A810 WeakPolarHBondContact O-CB 3.01Å; D806-A810 PolarHBondContact O-N 3.43Å; A810-L813 WeakPolarHBondContact O-CB 3.39Å; A810-L813 PolarHBondContact O-N 2.94Å; A810-A814 PolarHBondContact O-N 3.36Å; A810-L834 HydrophobicContact CB-CD2 4.44Å; A810-V835 HydrophobicContact CB-CG2 3.58Å; A810-I838 HydrophobicContact CB-CD1 3.87Å
811	G	93.9	Very high	94.2	Very high	30 Å²	30	76.6 Å²	76.6	31%	0.309	39%	0.394	S	S	.	.	H	α-helix	trans	-58.6	-45.8	169.5	0	0	0	0	0	112.5	L807 R808 V809 L813 A814 E815	L807-G811 PolarHBondContact O-N 3.15Å; R808-G811 PolarHBondContact O-N 3.41Å; V809-G811 PolarHBondContact O-N 3.38Å; G811-L813 VanDerWaalsContact C-N 3.31Å; G811-L813 PolarHBondContact O-N 2.93Å; G811-A814 WeakPolarHBondContact O-CB 3.43Å; G811-A814 PolarHBondContact O-N 3.35Å; G811-E815 PolarHBondContact O-N 2.91Å
812	K	94.8	Very high	93.9	Very high	98 Å²	98	80 Å²	80	43%	0.426	41%	0.41	S	S	.	.	H	α-helix	trans	-66.7	-31.6	175.4	-165.5	174.7	-175.9	-179.9	0	112.6	R808 V809 A814 E815 L816	R808-K812 PolarHBondContact O-N 2.82Å; R808-K812 VanDerWaalsContact O-N 3.08Å; V809-K812 PolarHBondContact O-N 3.26Å; K812-A814 VanDerWaalsContact C-N 3.35Å; K812-E815 PolarHBondContact O-N 2.94Å; K812-L816 VanDerWaalsContact O-CG 3.29Å; K812-L816 WeakPolarHBondContact O-CG 3.39Å; K812-L816 PolarHBondContact O-N 3.23Å
813	L	94.7	Very high	93.5	Very high	79 Å²	79	81.7 Å²	81.7	41%	0.414	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-37.8	172.2	-171.4	66.3	0	0	0	111.8	V809 A810 G811 L816 T817 V831	V809-L813 PolarHBondContact O-N 3.03Å; A810-L813 WeakPolarHBondContact O-CB 3.39Å; A810-L813 PolarHBondContact O-N 2.94Å; G811-L813 VanDerWaalsContact C-N 3.31Å; G811-L813 PolarHBondContact O-N 2.93Å; L813-L816 PolarHBondContact O-N 2.88Å; L813-T817 WeakPolarHBondContact O-CB 3.37Å; L813-T817 PolarHBondContact O-N 2.78Å; L813-T817 PolarHBondContact O-OG1 2.97Å; L813-V831 HydrophobicContact CB-CG1 4.28Å; L813-V831 HydrophobicContact CD2-CG1 4.25Å; L813-V831 HydrophobicContact CD2-CG2 3.78Å; L813-V831 HydrophobicContact CG-CG1 4.19Å; L813-V831 HydrophobicContact CG-CG2 3.93Å
814	A	92	Very high	93.1	Very high	37 Å²	37	82.8 Å²	82.8	31%	0.306	42%	0.424	S	S	.	.	H	α-helix	trans	-66.4	-44.8	174.3	0	0	0	0	0	111.9	A810 G811 K812 L816 T817 M818 V831	A810-A814 PolarHBondContact O-N 3.36Å; G811-A814 WeakPolarHBondContact O-CB 3.43Å; G811-A814 PolarHBondContact O-N 3.35Å; K812-A814 VanDerWaalsContact C-N 3.35Å; A814-L816 VanDerWaalsContact C-N 3.33Å; A814-L816 PolarHBondContact O-N 3.46Å; A814-T817 PolarHBondContact O-N 2.84Å; A814-M818 PolarHBondContact O-N 3.27Å; A814-M818 VanDerWaalsContact O-N 3.11Å; A814-V831 HydrophobicContact CB-CG1 3.81Å
815	E	92.7	Very high	92.8	Very high	137 Å²	137	87 Å²	87	64%	0.64	43%	0.434	S	S	*	.	H	α-helix	trans	-56.6	-44.7	173.6	-69.8	179.6	166	0	0	112.1	G811 K812 M818	G811-E815 PolarHBondContact O-N 2.91Å; K812-E815 PolarHBondContact O-N 2.94Å; E815-M818 PolarHBondContact O-N 3.37Å
816	L	92.8	Very high	92.5	Very high	99 Å²	99	90 Å²	90	52%	0.518	46%	0.457	S	S	.	.	H	α-helix	trans	-68.4	-35.6	177.8	-70.9	170.9	0	0	0	112.6	K812 L813 A814 M818 L819	K812-L816 VanDerWaalsContact O-CG 3.29Å; K812-L816 WeakPolarHBondContact O-CG 3.39Å; K812-L816 PolarHBondContact O-N 3.23Å; L813-L816 PolarHBondContact O-N 2.88Å; A814-L816 VanDerWaalsContact C-N 3.33Å; A814-L816 PolarHBondContact O-N 3.46Å; L816-M818 VanDerWaalsContact C-N 3.33Å; L816-M818 PolarHBondContact O-N 3.15Å; L816-L819 HydrophobicContact CD2-CD1 4.36Å; L816-L819 WeakPolarHBondContact O-CB 3.25Å; L816-L819 PolarHBondContact O-N 3.43Å; L816-L819 VanDerWaalsContact O-N 3.15Å
817	T	92.4	Very high	92.2	Very high	8 Å²	8	90.3 Å²	90.3	5%	0.049	46%	0.46	C	S	.	.	H	α-helix	trans	-64.2	-38.4	177.8	-59.5	0	0	0	0	111.4	L813 A814 L819 L820 V827	L813-T817 WeakPolarHBondContact O-CB 3.37Å; L813-T817 PolarHBondContact O-N 2.78Å; L813-T817 PolarHBondContact O-OG1 2.97Å; A814-T817 PolarHBondContact O-N 2.84Å; T817-L819 PolarHBondContact O-N 3.29Å; T817-L819 VanDerWaalsContact O-N 3.14Å; T817-L820 HydrophobicContact CG2-CD1 4.26Å; T817-L820 WeakPolarHBondContact O-CB 3.14Å; T817-L820 WeakPolarHBondContact O-CG 3.37Å; T817-L820 PolarHBondContact O-N 3.15Å; T817-L820 VanDerWaalsContact O-N 3.12Å; T817-V827 HydrophobicContact CG2-CB 4.34Å; T817-V827 HydrophobicContact CG2-CG1 4Å
818	M	88.3	Confident	92	Very high	137 Å²	137	88.8 Å²	88.8	68%	0.675	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.7	174.6	-75.4	-74.8	-161.7	0	0	114.5	A814 E815 L816	A814-M818 PolarHBondContact O-N 3.27Å; A814-M818 VanDerWaalsContact O-N 3.11Å; E815-M818 PolarHBondContact O-N 3.37Å; L816-M818 VanDerWaalsContact C-N 3.33Å; L816-M818 PolarHBondContact O-N 3.15Å
819	L	92.2	Very high	91.8	Very high	132 Å²	132	90.6 Å²	90.6	69%	0.691	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-5.3	176.8	-58.4	177	0	0	0	113.3	L816 T817	L816-L819 HydrophobicContact CD2-CD1 4.36Å; L816-L819 WeakPolarHBondContact O-CB 3.25Å; L816-L819 PolarHBondContact O-N 3.43Å; L816-L819 VanDerWaalsContact O-N 3.15Å; T817-L819 PolarHBondContact O-N 3.29Å; T817-L819 VanDerWaalsContact O-N 3.14Å
820	L	88.9	Confident	91.7	Very high	87 Å²	87	94.1 Å²	94.1	46%	0.455	48%	0.479	S	S	.	.			trans	-75.4	128.4	-177.8	-63	176.3	0	0	0	111.9	T817 H824	T817-L820 HydrophobicContact CG2-CD1 4.26Å; T817-L820 WeakPolarHBondContact O-CB 3.14Å; T817-L820 WeakPolarHBondContact O-CG 3.37Å; T817-L820 PolarHBondContact O-N 3.15Å; T817-L820 VanDerWaalsContact O-N 3.12Å; L820-H824 HydrophobicContact CB-CB 4.16Å; L820-H824 HydrophobicContact CD1-CB 3.97Å; L820-H824 PolarHBondContact O-CE1 3.41Å; L820-H824 PolarHBondContact O-ND1 3.35Å
821	K	89.6	Confident	91.7	Very high	214 Å²	214	94.6 Å²	94.6	93%	0.93	48%	0.481	S	S	*	.	S	Bend	trans	-89.8	-1.9	-178.2	-61.8	-175.4	-179.7	-180	0	114.8
822	V	90	Very high	91.7	Very high	120 Å²	120	98.1 Å²	98.1	73%	0.727	49%	0.49	S	S	*	.	S	Bend	trans	-97.8	162.2	175	-172.3	0	0	0	0	108	H824	V822-H824 PolarHBondContact O-N 3.41Å; V822-H824 VanDerWaalsContact O-N 3.08Å; V822-H824 PolarHBondContact O-ND1 2.92Å
823	D	88.9	Confident	91.7	Very high	123 Å²	123	97 Å²	97	66%	0.658	49%	0.488	S	S	*	.			trans	-59.8	116.1	170.1	-171.3	1.6	0	0	0	110	R825	D823-R825 WeakPolarHBondContact OD1-CB 3.08Å; D823-R825 VanDerWaalsContact OD1-CD 3.29Å; D823-R825 WeakPolarHBondContact OD1-CD 3.43Å; D823-R825 WeakPolarHBondContact OD1-CG 3.27Å; D823-R825 PolarHBondContact OD1-N 2.78Å; D823-R825 VanDerWaalsContact OD1-N 3.11Å; D823-R825 IonicContact OD1-NE 2.66Å
824	H	88.5	Confident	91.7	Very high	47 Å²	47	96.9 Å²	96.9	22%	0.218	49%	0.488	C	S	.	.			trans	-122	14	-174.6	55.1	-91.3	0	0	0	111.9	L820 V822 T826 V827 S828	L820-H824 HydrophobicContact CB-CB 4.16Å; L820-H824 HydrophobicContact CD1-CB 3.97Å; L820-H824 PolarHBondContact O-CE1 3.41Å; L820-H824 PolarHBondContact O-ND1 3.35Å; V822-H824 PolarHBondContact O-N 3.41Å; V822-H824 VanDerWaalsContact O-N 3.08Å; V822-H824 PolarHBondContact O-ND1 2.92Å; H824-T826 VanDerWaalsContact C-N 3.27Å; H824-T826 PolarHBondContact O-N 2.9Å; H824-V827 PolarHBondContact O-N 2.66Å; H824-S828 PolarHBondContact O-N 2.82Å
825	R	90.4	Very high	91.9	Very high	199 Å²	199	96.1 Å²	96.1	75%	0.751	48%	0.479	S	S	*	.	H	α-helix	trans	-50.7	-43.5	-177.6	-75	165.7	-179.5	-149.5	-1.6	113.3	D823 K829	D823-R825 WeakPolarHBondContact OD1-CB 3.08Å; D823-R825 VanDerWaalsContact OD1-CD 3.29Å; D823-R825 WeakPolarHBondContact OD1-CD 3.43Å; D823-R825 WeakPolarHBondContact OD1-CG 3.27Å; D823-R825 PolarHBondContact OD1-N 2.78Å; D823-R825 VanDerWaalsContact OD1-N 3.11Å; D823-R825 IonicContact OD1-NE 2.66Å; R825-K829 WeakPolarHBondContact O-CB 3.3Å; R825-K829 PolarHBondContact O-N 3.22Å; R825-K829 VanDerWaalsContact O-N 3.08Å
826	T	91.2	Very high	92	Very high	109 Å²	109	93.7 Å²	93.7	67%	0.669	47%	0.471	S	S	*	.	H	α-helix	trans	-63.8	-45.5	177.2	-43.9	0	0	0	0	111.4	H824 K829 E830	H824-T826 VanDerWaalsContact C-N 3.27Å; H824-T826 PolarHBondContact O-N 2.9Å; T826-K829 PolarHBondContact O-N 3.13Å; T826-E830 WeakPolarHBondContact O-CG 3.21Å; T826-E830 PolarHBondContact O-N 3.15Å
827	V	90.9	Very high	92.2	Very high	76 Å²	76	95.5 Å²	95.5	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-45.9	-179.8	-176.8	0	0	0	0	110.8	T817 H824 K829 E830 V831	T817-V827 HydrophobicContact CG2-CB 4.34Å; T817-V827 HydrophobicContact CG2-CG1 4Å; H824-V827 PolarHBondContact O-N 2.66Å; V827-K829 VanDerWaalsContact C-N 3.27Å; V827-K829 PolarHBondContact O-N 3.41Å; V827-E830 PolarHBondContact O-N 3.39Å; V827-V831 HydrophobicContact CG1-CG2 4.41Å; V827-V831 WeakPolarHBondContact O-CG2 3.38Å; V827-V831 PolarHBondContact O-N 2.86Å
828	S	91.5	Very high	92.4	Very high	20 Å²	20	95.6 Å²	95.6	14%	0.14	48%	0.475	C	S	.	.	H	α-helix	trans	-55.5	-45.1	175.8	-161.8	0	0	0	0	111.2	H824 V831 E832	H824-S828 PolarHBondContact O-N 2.82Å; S828-V831 PolarHBondContact O-N 2.89Å; S828-E832 WeakPolarHBondContact O-CB 3.42Å; S828-E832 WeakPolarHBondContact O-CG 3.47Å; S828-E832 PolarHBondContact O-N 3.48Å; S828-E832 PolarHBondContact OG-OE1 2.87Å; S828-E832 VanDerWaalsContact OG-OE1 3.07Å
829	K	93.4	Very high	92.8	Very high	118 Å²	118	93.9 Å²	93.9	51%	0.513	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-42.8	178.9	-167.8	-170.4	176.6	-160.6	0	112.6	R825 T826 V827 V831 E832 N833	R825-K829 WeakPolarHBondContact O-CB 3.3Å; R825-K829 PolarHBondContact O-N 3.22Å; R825-K829 VanDerWaalsContact O-N 3.08Å; T826-K829 PolarHBondContact O-N 3.13Å; V827-K829 VanDerWaalsContact C-N 3.27Å; V827-K829 PolarHBondContact O-N 3.41Å; K829-V831 VanDerWaalsContact C-N 3.33Å; K829-E832 PolarHBondContact O-N 3.24Å; K829-N833 WeakPolarHBondContact O-CB 3.3Å; K829-N833 PolarHBondContact O-N 3.03Å; K829-N833 PolarHBondContact O-ND2 2.97Å; K829-N833 PolarHBondContact O-OD1 2.89Å
830	E	95.1	Very high	93.1	Very high	105 Å²	105	92.7 Å²	92.7	49%	0.491	46%	0.461	S	S	.	.	H	α-helix	trans	-70.8	-29.3	177.9	-60.4	-44.4	134.4	0	0	112.7	T826 V827 N833 L834	T826-E830 WeakPolarHBondContact O-CG 3.21Å; T826-E830 PolarHBondContact O-N 3.15Å; V827-E830 PolarHBondContact O-N 3.39Å; E830-N833 VanDerWaalsContact CD-ND2 3.27Å; E830-N833 PolarHBondContact OE1-ND2 3.29Å; E830-N833 PolarHBondContact OE2-ND2 3.44Å; E830-L834 WeakPolarHBondContact O-CB 3.34Å; E830-L834 PolarHBondContact O-N 3.28Å
831	V	94.1	Very high	93.4	Very high	11 Å²	11	90.5 Å²	90.5	7%	0.067	45%	0.452	C	S	.	.	H	α-helix	trans	-70.6	-40.1	170.7	177.8	0	0	0	0	111.3	L813 A814 V827 S828 K829 L834 V835	L813-V831 HydrophobicContact CB-CG1 4.28Å; L813-V831 HydrophobicContact CD2-CG1 4.25Å; L813-V831 HydrophobicContact CD2-CG2 3.78Å; L813-V831 HydrophobicContact CG-CG1 4.19Å; L813-V831 HydrophobicContact CG-CG2 3.93Å; A814-V831 HydrophobicContact CB-CG1 3.81Å; V827-V831 HydrophobicContact CG1-CG2 4.41Å; V827-V831 WeakPolarHBondContact O-CG2 3.38Å; V827-V831 PolarHBondContact O-N 2.86Å; S828-V831 PolarHBondContact O-N 2.89Å; K829-V831 VanDerWaalsContact C-N 3.33Å; V831-L834 PolarHBondContact O-N 3.23Å; V831-V835 HydrophobicContact CG1-CG2 4.45Å; V831-V835 WeakPolarHBondContact O-CB 3.36Å; V831-V835 VanDerWaalsContact O-CG2 3.3Å; V831-V835 WeakPolarHBondContact O-CG2 3.22Å; V831-V835 PolarHBondContact O-N 2.86Å
832	E	93.3	Very high	93.7	Very high	105 Å²	105	81.8 Å²	81.8	49%	0.491	42%	0.415	S	S	.	.	H	α-helix	trans	-61	-46.3	171.7	-74.7	161.9	-152.6	0	0	111.3	S828 K829 L834 V835 D836	S828-E832 WeakPolarHBondContact O-CB 3.42Å; S828-E832 WeakPolarHBondContact O-CG 3.47Å; S828-E832 PolarHBondContact O-N 3.48Å; S828-E832 PolarHBondContact OG-OE1 2.87Å; S828-E832 VanDerWaalsContact OG-OE1 3.07Å; K829-E832 PolarHBondContact O-N 3.24Å; E832-L834 VanDerWaalsContact C-N 3.33Å; E832-L834 PolarHBondContact O-N 3Å; E832-V835 PolarHBondContact O-N 3.28Å; E832-D836 PolarHBondContact O-N 2.73Å
833	N	95	Very high	93.9	Very high	73 Å²	73	77.8 Å²	77.8	39%	0.39	40%	0.398	S	S	.	.	H	α-helix	trans	-56.2	-45.2	174.3	-67.5	-22.3	0	0	0	111.6	K829 E830 F837	K829-N833 WeakPolarHBondContact O-CB 3.3Å; K829-N833 PolarHBondContact O-N 3.03Å; K829-N833 PolarHBondContact O-ND2 2.97Å; K829-N833 PolarHBondContact O-OD1 2.89Å; E830-N833 VanDerWaalsContact CD-ND2 3.27Å; E830-N833 PolarHBondContact OE1-ND2 3.29Å; E830-N833 PolarHBondContact OE2-ND2 3.44Å; N833-F837 WeakPolarHBondContact O-CB 3.44Å; N833-F837 PolarHBondContact O-N 3.39Å
834	L	95.1	Very high	94.2	Very high	78 Å²	78	75.4 Å²	75.4	41%	0.408	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-46.7	178.3	176.7	61.5	0	0	0	111.9	A810 E830 V831 E832 D836 F837 I838	A810-L834 HydrophobicContact CB-CD2 4.44Å; E830-L834 WeakPolarHBondContact O-CB 3.34Å; E830-L834 PolarHBondContact O-N 3.28Å; V831-L834 PolarHBondContact O-N 3.23Å; E832-L834 VanDerWaalsContact C-N 3.33Å; E832-L834 PolarHBondContact O-N 3Å; L834-D836 VanDerWaalsContact C-N 3.31Å; L834-D836 PolarHBondContact O-N 2.88Å; L834-F837 PolarHBondContact O-N 3.42Å; L834-I838 HydrophobicContact CD1-CD1 3.91Å; L834-I838 HydrophobicContact CD1-CG1 4.24Å; L834-I838 HydrophobicContact CG-CD1 3.91Å; L834-I838 VanDerWaalsContact O-CG1 3.29Å; L834-I838 WeakPolarHBondContact O-CG1 3.49Å; L834-I838 PolarHBondContact O-N 3.23Å
835	V	95.5	Very high	94.4	Very high	21 Å²	21	76.7 Å²	76.7	13%	0.127	39%	0.394	C	S	.	.	H	α-helix	trans	-58.5	-43.6	177.6	163.5	0	0	0	0	110.9	L807 A810 V831 E832 K839	L807-V835 HydrophobicContact CD1-CG1 4.19Å; A810-V835 HydrophobicContact CB-CG2 3.58Å; V831-V835 HydrophobicContact CG1-CG2 4.45Å; V831-V835 WeakPolarHBondContact O-CB 3.36Å; V831-V835 VanDerWaalsContact O-CG2 3.3Å; V831-V835 WeakPolarHBondContact O-CG2 3.22Å; V831-V835 PolarHBondContact O-N 2.86Å; E832-V835 PolarHBondContact O-N 3.28Å; V835-K839 HydrophobicContact CG1-CD 4.45Å; V835-K839 VanDerWaalsContact CG1-CE 3.4Å; V835-K839 WeakPolarHBondContact O-CG 3.33Å; V835-K839 PolarHBondContact O-N 3.25Å
836	D	95.7	Very high	94.5	Very high	86 Å²	86	72 Å²	72	46%	0.46	38%	0.381	S	S	.	.	H	α-helix	trans	-74.6	-34	178.8	-77.7	-5.4	0	0	0	112.8	E832 L834 I838 K839 V840	E832-D836 PolarHBondContact O-N 2.73Å; L834-D836 VanDerWaalsContact C-N 3.31Å; L834-D836 PolarHBondContact O-N 2.88Å; D836-I838 PolarHBondContact O-N 2.95Å; D836-K839 PolarHBondContact O-N 3Å; D836-K839 WeakPolarHBondContact OD1-CD 3.48Å; D836-K839 WeakPolarHBondContact OD1-CE 3.37Å; D836-K839 IonicContact OD1-NZ 2.89Å; D836-K839 PolarHBondContact OD1-NZ 2.85Å; D836-V840 WeakPolarHBondContact O-CG2 2.98Å; D836-V840 PolarHBondContact O-N 3.38Å
837	F	96.7	Very high	94.6	Very high	136 Å²	136	71.4 Å²	71.4	60%	0.596	37%	0.371	S	S	*	.	H	α-helix	trans	-60.1	-43.6	170	174.5	-98.2	0	0	0	112.2	N833 L834 V840 T841	N833-F837 WeakPolarHBondContact O-CB 3.44Å; N833-F837 PolarHBondContact O-N 3.39Å; L834-F837 PolarHBondContact O-N 3.42Å; F837-V840 PolarHBondContact O-N 3.18Å; F837-T841 WeakPolarHBondContact O-CB 3.32Å; F837-T841 PolarHBondContact O-N 3.43Å; F837-T841 PolarHBondContact O-OG1 3.45Å
838	I	96.8	Very high	94.6	Very high	10 Å²	10	70.2 Å²	70.2	5%	0.051	36%	0.36	C	S	.	.	H	α-helix	trans	-64.2	-45.5	176.6	-65.6	161.3	0	0	0	110.2	L803 D806 L807 A810 L834 D836 V840 T841 L842	L803-I838 HydrophobicContact CD2-CG2 4.22Å; L803-I838 WeakPolarHBondContact O-CG2 3.49Å; D806-I838 HydrophobicContact CB-CD1 4.09Å; D806-I838 HydrophobicContact CB-CG2 4.36Å; L807-I838 HydrophobicContact CB-CG2 3.8Å; L807-I838 HydrophobicContact CD1-CG2 4.3Å; A810-I838 HydrophobicContact CB-CD1 3.87Å; L834-I838 HydrophobicContact CD1-CD1 3.91Å; L834-I838 HydrophobicContact CD1-CG1 4.24Å; L834-I838 HydrophobicContact CG-CD1 3.91Å; L834-I838 VanDerWaalsContact O-CG1 3.29Å; L834-I838 WeakPolarHBondContact O-CG1 3.49Å; L834-I838 PolarHBondContact O-N 3.23Å; D836-I838 PolarHBondContact O-N 2.95Å; I838-V840 VanDerWaalsContact C-N 3.35Å; I838-V840 PolarHBondContact O-N 2.85Å; I838-T841 PolarHBondContact O-N 2.84Å; I838-L842 WeakPolarHBondContact O-CB 3.44Å; I838-L842 PolarHBondContact O-N 3.26Å
839	K	96.9	Very high	94.5	Very high	102 Å²	102	70 Å²	70	44%	0.443	36%	0.357	S	S	.	.	H	α-helix	trans	-57.6	-43.8	175.4	-71	170.4	-161.8	157.8	0	112.7	L807 V835 D836 G843	L807-K839 HydrophobicContact CD1-CG 3.91Å; L807-K839 HydrophobicContact CD2-CG 4.38Å; V835-K839 HydrophobicContact CG1-CD 4.45Å; V835-K839 VanDerWaalsContact CG1-CE 3.4Å; V835-K839 WeakPolarHBondContact O-CG 3.33Å; V835-K839 PolarHBondContact O-N 3.25Å; D836-K839 PolarHBondContact O-N 3Å; D836-K839 WeakPolarHBondContact OD1-CD 3.48Å; D836-K839 WeakPolarHBondContact OD1-CE 3.37Å; D836-K839 IonicContact OD1-NZ 2.89Å; D836-K839 PolarHBondContact OD1-NZ 2.85Å; K839-G843 PolarHBondContact O-N 3.4Å
840	V	97.1	Very high	94.2	Very high	106 Å²	106	69.7 Å²	69.7	64%	0.642	36%	0.36	S	S	*	.	H	α-helix	trans	-66.4	-44.7	179.6	169.3	0	0	0	0	110.8	D836 F837 I838 G843 S844	D836-V840 WeakPolarHBondContact O-CG2 2.98Å; D836-V840 PolarHBondContact O-N 3.38Å; F837-V840 PolarHBondContact O-N 3.18Å; I838-V840 VanDerWaalsContact C-N 3.35Å; I838-V840 PolarHBondContact O-N 2.85Å; V840-G843 PolarHBondContact O-N 3.17Å; V840-S844 WeakPolarHBondContact O-CB 3.36Å; V840-S844 PolarHBondContact O-N 3.06Å
841	T	95.9	Very high	93.7	Very high	42 Å²	42	71.3 Å²	71.3	26%	0.258	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-45.6	177.1	-54.3	0	0	0	0	111.9	L803 F837 I838 S844 R845	L803-T841 HydrophobicContact CD1-CG2 3.83Å; L803-T841 HydrophobicContact CD2-CG2 4.18Å; F837-T841 WeakPolarHBondContact O-CB 3.32Å; F837-T841 PolarHBondContact O-N 3.43Å; F837-T841 PolarHBondContact O-OG1 3.45Å; I838-T841 PolarHBondContact O-N 2.84Å; T841-S844 WeakPolarHBondContact O-CB 3.22Å; T841-S844 PolarHBondContact O-N 3.11Å; T841-R845 PolarHBondContact O-N 2.96Å
842	L	95.6	Very high	93.2	Very high	30 Å²	30	73.6 Å²	73.6	16%	0.157	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-44.7	175.6	-172.7	164.4	0	0	0	111.1	L803 Q804 L807 I838 S844 R845 H846	L803-L842 HydrophobicContact CB-CB 4.22Å; L803-L842 HydrophobicContact CB-CD1 4.25Å; L803-L842 HydrophobicContact CB-CG 4.35Å; L803-L842 HydrophobicContact CD1-CB 4.44Å; Q804-L842 HydrophobicContact CG-CD1 3.78Å; L807-L842 HydrophobicContact CD2-CD1 4.25Å; I838-L842 WeakPolarHBondContact O-CB 3.44Å; I838-L842 PolarHBondContact O-N 3.26Å; L842-S844 VanDerWaalsContact C-N 3.33Å; L842-S844 PolarHBondContact O-N 2.84Å; L842-R845 PolarHBondContact O-N 2.94Å; L842-H846 WeakPolarHBondContact O-CB 3.47Å; L842-H846 PolarHBondContact O-N 3.38Å
843	G	94.5	Very high	92.8	Very high	36 Å²	36	73.6 Å²	73.6	37%	0.371	37%	0.372	S	S	.	.	H	α-helix	trans	-58.3	-43.2	174.4	0	0	0	0	0	112.4	K839 V840 H846 E847	K839-G843 PolarHBondContact O-N 3.4Å; V840-G843 PolarHBondContact O-N 3.17Å; G843-H846 PolarHBondContact O-N 3.45Å; G843-E847 VanDerWaalsContact O-CB 3.27Å; G843-E847 WeakPolarHBondContact O-CB 3.2Å; G843-E847 PolarHBondContact O-N 3.01Å
844	S	94.9	Very high	92.4	Very high	74 Å²	74	72.6 Å²	72.6	52%	0.517	37%	0.371	S	S	.	.	H	α-helix	trans	-61.6	-46.8	175.9	-169.6	0	0	0	0	112.5	V840 T841 L842 E847 E848	V840-S844 WeakPolarHBondContact O-CB 3.36Å; V840-S844 PolarHBondContact O-N 3.06Å; T841-S844 WeakPolarHBondContact O-CB 3.22Å; T841-S844 PolarHBondContact O-N 3.11Å; L842-S844 VanDerWaalsContact C-N 3.33Å; L842-S844 PolarHBondContact O-N 2.84Å; S844-E847 WeakPolarHBondContact O-CB 3.27Å; S844-E847 PolarHBondContact O-N 3.03Å; S844-E848 PolarHBondContact O-N 2.93Å
845	R	93.5	Very high	92.2	Very high	73 Å²	73	68.9 Å²	68.9	28%	0.275	35%	0.352	S	S	.	.	H	α-helix	trans	-67	-35.7	176.5	-69.8	-52.7	-159.1	-160.6	1.3	113.3	V796 E799 I800 L803 T841 L842 E847 E848 L849	V796-R845 HydrophobicContact CG1-CB 4.33Å; E799-R845 IonicContact OE1-NH2 2.81Å; E799-R845 IonicContact OE2-CZ 2.79Å; E799-R845 IonicContact OE2-NE 3.14Å; E799-R845 PolarHBondContact OE2-NE 3.25Å; E799-R845 IonicContact OE2-NH2 2.67Å; E799-R845 PolarHBondContact OE2-NH2 2.82Å; I800-R845 HydrophobicContact CD1-CB 4.02Å; I800-R845 HydrophobicContact CG1-CB 3.62Å; L803-R845 HydrophobicContact CD1-CG 4.31Å; T841-R845 PolarHBondContact O-N 2.96Å; L842-R845 PolarHBondContact O-N 2.94Å; R845-E847 VanDerWaalsContact C-N 3.35Å; R845-E848 WeakPolarHBondContact CD-OE2 3.26Å; R845-E848 IonicContact CZ-OE2 3.83Å; R845-E848 IonicContact NE-OE2 3.13Å; R845-E848 IonicContact NH1-OE1 2.66Å; R845-E848 IonicContact NH1-OE2 3.12Å; R845-E848 PolarHBondContact NH1-OE2 3.28Å; R845-E848 WeakPolarHBondContact O-CB 3.47Å; R845-E848 PolarHBondContact O-N 3.05Å; R845-L849 PolarHBondContact O-N 3.44Å
846	H	92.9	Very high	92	Very high	101 Å²	101	68.5 Å²	68.5	47%	0.468	35%	0.35	S	S	.	.	H	α-helix	trans	-69.2	-36.4	174.2	-158.5	75.7	0	0	0	111.5	L842 G843 I850	L842-H846 WeakPolarHBondContact O-CB 3.47Å; L842-H846 PolarHBondContact O-N 3.38Å; G843-H846 PolarHBondContact O-N 3.45Å; H846-I850 WeakPolarHBondContact O-CG1 3.43Å; H846-I850 PolarHBondContact O-N 3.34Å
847	E	92.1	Very high	91.7	Very high	97 Å²	97	65.1 Å²	65.1	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-64.3	-40.3	172.3	177.6	161.7	148	0	0	112.2	G843 S844 R845 L849 I850 K851	G843-E847 VanDerWaalsContact O-CB 3.27Å; G843-E847 WeakPolarHBondContact O-CB 3.2Å; G843-E847 PolarHBondContact O-N 3.01Å; S844-E847 WeakPolarHBondContact O-CB 3.27Å; S844-E847 PolarHBondContact O-N 3.03Å; R845-E847 VanDerWaalsContact C-N 3.35Å; E847-L849 PolarHBondContact O-N 3.36Å; E847-I850 PolarHBondContact O-N 3.32Å; E847-I850 VanDerWaalsContact O-N 3.14Å; E847-K851 HydrophobicContact CG-CB 4.43Å; E847-K851 HydrophobicContact CG-CD 3.57Å; E847-K851 HydrophobicContact CG-CG 3.95Å; E847-K851 WeakPolarHBondContact O-CB 3.25Å; E847-K851 PolarHBondContact O-N 3.26Å; E847-K851 WeakPolarHBondContact OE1-CD 3.34Å; E847-K851 WeakPolarHBondContact OE1-CE 3.49Å; E847-K851 IonicContact OE1-NZ 3.47Å; E847-K851 PolarHBondContact OE1-NZ 2.72Å; E847-K851 WeakPolarHBondContact OE2-CE 3.32Å; E847-K851 IonicContact OE2-NZ 2.74Å; E847-K851 PolarHBondContact OE2-NZ 2.73Å
848	E	90.9	Very high	91.4	Very high	51 Å²	51	58.7 Å²	58.7	24%	0.238	30%	0.304	C	S	.	.	H	α-helix	trans	-56.1	-49.2	175.1	-173.1	177.9	172.3	0	0	111.8	S844 R845 I850 D852 L855	S844-E848 PolarHBondContact O-N 2.93Å; R845-E848 WeakPolarHBondContact CD-OE2 3.26Å; R845-E848 IonicContact CZ-OE2 3.83Å; R845-E848 IonicContact NE-OE2 3.13Å; R845-E848 IonicContact NH1-OE1 2.66Å; R845-E848 IonicContact NH1-OE2 3.12Å; R845-E848 PolarHBondContact NH1-OE2 3.28Å; R845-E848 WeakPolarHBondContact O-CB 3.47Å; R845-E848 PolarHBondContact O-N 3.05Å; E848-I850 PolarHBondContact O-N 2.83Å; E848-D852 WeakPolarHBondContact O-CB 3.41Å; E848-D852 PolarHBondContact O-N 3.22Å; E848-L855 HydrophobicContact CG-CD1 4.15Å
849	L	89.5	Confident	90.9	Very high	15 Å²	15	60.9 Å²	60.9	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-22.1	177.2	-68.8	-177.2	0	0	0	114.6	I793 V796 K797 I800 R845 E847 L855 T878	I793-L849 HydrophobicContact CG2-CD2 4.13Å; V796-L849 HydrophobicContact CB-CD2 4.08Å; V796-L849 HydrophobicContact CG1-CD1 4.18Å; V796-L849 HydrophobicContact CG1-CD2 3.72Å; V796-L849 HydrophobicContact CG1-CG 3.67Å; K797-L849 HydrophobicContact CG-CD1 3.95Å; I800-L849 HydrophobicContact CD1-CD1 3.48Å; I800-L849 VanDerWaalsContact CD1-CD1 3.48Å; I800-L849 HydrophobicContact CD1-CG 4.22Å; R845-L849 PolarHBondContact O-N 3.44Å; E847-L849 PolarHBondContact O-N 3.36Å; L849-L855 HydrophobicContact CD2-CD1 4.09Å; L849-T878 HydrophobicContact CD2-CG2 4.15Å
850	I	87.3	Confident	90.3	Very high	112 Å²	112	56 Å²	56	57%	0.574	30%	0.295	S	S	*	.	H	α-helix	trans	-96.2	-42.4	-177.1	-69.7	172	0	0	0	111.8	H846 E847 E848	H846-I850 WeakPolarHBondContact O-CG1 3.43Å; H846-I850 PolarHBondContact O-N 3.34Å; E847-I850 PolarHBondContact O-N 3.32Å; E847-I850 VanDerWaalsContact O-N 3.14Å; E848-I850 PolarHBondContact O-N 2.83Å
851	K	83.6	Confident	89.3	Confident	138 Å²	138	51.5 Å²	51.5	60%	0.6	27%	0.267	S	S	*	.	H	α-helix	trans	-95.2	-26.6	-172.7	-65.1	-170	-167.5	167.1	0	113.6	E847 R853	E847-K851 HydrophobicContact CG-CB 4.43Å; E847-K851 HydrophobicContact CG-CD 3.57Å; E847-K851 HydrophobicContact CG-CG 3.95Å; E847-K851 WeakPolarHBondContact O-CB 3.25Å; E847-K851 PolarHBondContact O-N 3.26Å; E847-K851 WeakPolarHBondContact OE1-CD 3.34Å; E847-K851 WeakPolarHBondContact OE1-CE 3.49Å; E847-K851 IonicContact OE1-NZ 3.47Å; E847-K851 PolarHBondContact OE1-NZ 2.72Å; E847-K851 WeakPolarHBondContact OE2-CE 3.32Å; E847-K851 IonicContact OE2-NZ 2.74Å; E847-K851 PolarHBondContact OE2-NZ 2.73Å; K851-R853 PolarHBondContact O-N 3.3Å; K851-R853 VanDerWaalsContact O-N 3.11Å
852	D	85.7	Confident	88.3	Confident	59 Å²	59	50 Å²	50	32%	0.316	26%	0.258	S	S	.	.			trans	-74	109.8	177.9	-171.1	8.7	0	0	0	111.6	E848 S854 L855 T856	E848-D852 WeakPolarHBondContact O-CB 3.41Å; E848-D852 PolarHBondContact O-N 3.22Å; D852-S854 PolarHBondContact O-N 2.98Å; D852-S854 VanDerWaalsContact OD1-CB 3.28Å; D852-S854 WeakPolarHBondContact OD1-CB 3.44Å; D852-S854 PolarHBondContact OD1-N 3.38Å; D852-S854 PolarHBondContact OD1-OG 3.23Å; D852-S854 WeakPolarHBondContact OD2-CB 3.43Å; D852-S854 PolarHBondContact OD2-OG 3.42Å; D852-L855 HydrophobicContact CB-CB 4.47Å; D852-L855 HydrophobicContact CB-CD1 4.2Å; D852-L855 HydrophobicContact CB-CG 4Å; D852-L855 PolarHBondContact O-N 2.89Å; D852-T856 PolarHBondContact O-N 2.81Å; D852-T856 PolarHBondContact O-OG1 3.24Å
853	R	84.5	Confident	86.8	Confident	105 Å²	105	49.7 Å²	49.7	40%	0.396	26%	0.257	S	S	.	.	H	α-helix	trans	-67	-20.7	175.4	-167.1	169.3	173.4	-142	-12.1	112.7	I726 K851 T856 S857 T874	I726-R853 VanDerWaalsContact CD1-NH1 3.33Å; K851-R853 PolarHBondContact O-N 3.3Å; K851-R853 VanDerWaalsContact O-N 3.11Å; R853-T856 WeakPolarHBondContact CA-OG1 3.38Å; R853-T856 PolarHBondContact O-OG1 2.91Å; R853-S857 WeakPolarHBondContact O-CB 3.35Å; R853-S857 PolarHBondContact O-N 3.05Å; R853-S857 PolarHBondContact O-OG 3Å; R853-T874 HydrophobicContact CG-CG2 4.19Å; R853-T874 PolarHBondContact NE-OG1 2.89Å; R853-T874 PolarHBondContact NH2-OG1 2.99Å; R853-T874 VanDerWaalsContact NH2-OG1 3.13Å
854	S	86.6	Confident	85.1	Confident	52 Å²	52	49 Å²	49	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-70.2	-31.1	173.9	101.6	0	0	0	0	112.5	N789 D852 R881	N789-S854 PolarHBondContact ND2-O 3.27Å; N789-S854 PolarHBondContact ND2-OG 3.35Å; D852-S854 PolarHBondContact O-N 2.98Å; D852-S854 VanDerWaalsContact OD1-CB 3.28Å; D852-S854 WeakPolarHBondContact OD1-CB 3.44Å; D852-S854 PolarHBondContact OD1-N 3.38Å; D852-S854 PolarHBondContact OD1-OG 3.23Å; D852-S854 WeakPolarHBondContact OD2-CB 3.43Å; D852-S854 PolarHBondContact OD2-OG 3.42Å; S854-R881 PolarHBondContact O-NH1 2.98Å
855	L	90.4	Very high	83	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-80.7	-37	176.4	-58.5	-174.5	0	0	0	111.4	N789 L792 I793 E848 L849 D852 S857 T878 R881	N789-L855 HydrophobicContact CB-CD2 4.22Å; L792-L855 HydrophobicContact CD2-CD2 3.84Å; L792-L855 HydrophobicContact CG-CD2 4.12Å; I793-L855 HydrophobicContact CD1-CB 4.36Å; I793-L855 WeakPolarHBondContact CD1-O 3.46Å; I793-L855 HydrophobicContact CG1-CB 4.12Å; I793-L855 HydrophobicContact CG1-CD2 3.98Å; I793-L855 HydrophobicContact CG1-CG 4.47Å; E848-L855 HydrophobicContact CG-CD1 4.15Å; L849-L855 HydrophobicContact CD2-CD1 4.09Å; D852-L855 HydrophobicContact CB-CB 4.47Å; D852-L855 HydrophobicContact CB-CD1 4.2Å; D852-L855 HydrophobicContact CB-CG 4Å; D852-L855 PolarHBondContact O-N 2.89Å; L855-S857 VanDerWaalsContact C-N 3.33Å; L855-S857 PolarHBondContact O-N 3.1Å; L855-T878 HydrophobicContact CB-CG2 3.81Å; L855-R881 WeakPolarHBondContact O-CD 3.39Å; L855-R881 PolarHBondContact O-NH1 2.91Å
856	T	91.3	Very high	80.8	Confident	13 Å²	13	52.6 Å²	52.6	8%	0.08	26%	0.257	C	S	.	.	H	α-helix	trans	-78.8	-11.2	176.1	52	0	0	0	0	114.3	D852 R853 F875 T878	D852-T856 PolarHBondContact O-N 2.81Å; D852-T856 PolarHBondContact O-OG1 3.24Å; R853-T856 WeakPolarHBondContact CA-OG1 3.38Å; R853-T856 PolarHBondContact O-OG1 2.91Å; T856-F875 PolarHBondContact O-N 3.24Å; T856-T878 HydrophobicContact CG2-CG2 4.13Å
857	S	89.9	Confident	78.7	Confident	15 Å²	15	48.5 Å²	48.5	11%	0.105	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	149.4	179.4	-52.3	0	0	0	0	114	R853 L855 V873 T874 R881	R853-S857 WeakPolarHBondContact O-CB 3.35Å; R853-S857 PolarHBondContact O-N 3.05Å; R853-S857 PolarHBondContact O-OG 3Å; L855-S857 VanDerWaalsContact C-N 3.33Å; L855-S857 PolarHBondContact O-N 3.1Å; S857-V873 CarbonylContact C-O 3.54Å; S857-V873 VanDerWaalsContact CA-O 3.32Å; S857-V873 WeakPolarHBondContact CA-O 3.4Å; S857-T874 WeakPolarHBondContact OG-CB 3.31Å; S857-T874 PolarHBondContact OG-OG1 3.14Å; S857-R881 VanDerWaalsContact O-CZ 3.29Å; S857-R881 PolarHBondContact O-NH1 3.3Å
858	L	90.1	Very high	77.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.2	178.8	-179	61.3	0	0	0	109.4	V785 L860 V873 F875 W884 E885	V785-L858 HydrophobicContact CG1-CD1 3.71Å; L858-L860 HydrophobicContact CD2-CD2 4.01Å; L858-L860 HydrophobicContact CD2-CG 4.47Å; L858-L860 HydrophobicContact CG-CD2 4.28Å; L858-V873 PolarHBondContact N-O 2.89Å; L858-V873 PolarHBondContact O-N 2.83Å; L858-F875 HydrophobicContact CB-CE2 3.94Å; L858-F875 HydrophobicContact CD2-CE2 4.16Å; L858-W884 HydrophobicContact CD2-CE3 3.82Å; L858-W884 HydrophobicContact CD2-CZ3 3.66Å; L858-E885 HydrophobicContact CD1-CG 4.32Å; L858-E885 WeakPolarHBondContact CD1-OE1 3.39Å; L858-E885 HydrophobicContact CD2-CG 3.84Å
859	N	86.1	Confident	75.9	Confident	56 Å²	56	43.5 Å²	43.5	30%	0.299	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	112.8	167.1	-88.6	-36.7	0	0	0	109.4	V786 L872	V786-N859 HydrophobicContact CB-CB 4.43Å; V786-N859 PolarHBondContact N-O 3.13Å; V786-N859 WeakPolarHBondContact O-CB 3.39Å; N859-L872 WeakPolarHBondContact OD1-CD1 3.42Å
860	L	84.5	Confident	75.1	Confident	1 Å²	1	45 Å²	45	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	154.4	160.9	-62.4	177.8	0	0	0	109.1	L738 C784 V785 L858 L871 V873 W884	L738-L860 HydrophobicContact CD2-CD1 4.15Å; C784-L860 CarbonylContact O-C 3.53Å; C784-L860 WeakPolarHBondContact O-CA 3.4Å; V785-L860 HydrophobicContact CG2-CD2 3.85Å; L858-L860 HydrophobicContact CD2-CD2 4.01Å; L858-L860 HydrophobicContact CD2-CG 4.47Å; L858-L860 HydrophobicContact CG-CD2 4.28Å; L860-L871 HydrophobicContact CB-CB 4.16Å; L860-L871 HydrophobicContact CB-CD2 4.34Å; L860-L871 HydrophobicContact CB-CG 4.48Å; L860-L871 HydrophobicContact CD1-CD2 4.26Å; L860-L871 PolarHBondContact N-O 2.98Å; L860-L871 PolarHBondContact O-N 2.81Å; L860-V873 HydrophobicContact CD1-CG2 4.05Å; L860-V873 HydrophobicContact CG-CG2 4.48Å; L860-W884 HydrophobicContact CD1-CH2 3.76Å; L860-W884 HydrophobicContact CD1-CZ2 4.5Å; L860-W884 HydrophobicContact CD1-CZ3 4.38Å; L860-W884 HydrophobicContact CD2-CH2 4.1Å; L860-W884 HydrophobicContact CD2-CZ3 4.07Å
861	L	75	Confident	74.9	Confident	10 Å²	10	39.9 Å²	39.9	5%	0.052	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122.9	174.8	-168	78.8	0	0	0	108.4	L783 C784 V786 N868 Q1315	L783-L861 CarbonylContact C-O 3.57Å; L783-L861 WeakPolarHBondContact CA-O 3.35Å; C784-L861 HydrophobicContact CB-CB 4.3Å; C784-L861 PolarHBondContact N-O 3.17Å; C784-L861 PolarHBondContact O-N 3.11Å; V786-L861 HydrophobicContact CG2-CB 3.72Å; V786-L861 HydrophobicContact CG2-CD1 4.5Å; V786-L861 HydrophobicContact CG2-CD2 4.04Å; V786-L861 HydrophobicContact CG2-CG 4.32Å; L861-N868 HydrophobicContact CD1-CB 3.97Å; L861-N868 HydrophobicContact CD2-CB 3.87Å; L861-N868 WeakPolarHBondContact CD2-ND2 3.49Å; L861-N868 HydrophobicContact CG-CB 3.89Å; L861-Q1315 HydrophobicContact CD2-CB 4.13Å; L861-Q1315 HydrophobicContact CD2-CG 3.9Å
862	V	74.8	Confident	75	Confident	12 Å²	12	34.8 Å²	34.8	7%	0.073	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.1	179.2	-169.3	0	0	0	0	108.2	L778 L783 T864 N868 E869 L871	L778-V862 HydrophobicContact CD1-CG1 4.13Å; L778-V862 HydrophobicContact CD1-CG2 4.05Å; L778-V862 HydrophobicContact CD2-CG1 4Å; L783-V862 HydrophobicContact CD2-CG2 3.93Å; V862-T864 HydrophobicContact CG1-CG2 4.12Å; V862-N868 CarbonylContact O-C 3.57Å; V862-N868 WeakPolarHBondContact O-CA 3.45Å; V862-E869 PolarHBondContact N-O 2.98Å; V862-E869 PolarHBondContact O-N 3.32Å; V862-L871 HydrophobicContact CG2-CB 3.98Å; V862-L871 HydrophobicContact CG2-CD2 4.03Å
863	T	64	Low	75.2	Confident	22 Å²	22	32 Å²	32	14%	0.135	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.7	170.9	-49.7	0	0	0	0	108.3	D782 A1313	D782-T863 VanDerWaalsContact O-CB 3.27Å; D782-T863 WeakPolarHBondContact O-CB 3.23Å; D782-T863 PolarHBondContact O-N 2.97Å; D782-T863 PolarHBondContact O-OG1 3.33Å; T863-A1313 HydrophobicContact CG2-CB 3.76Å; T863-A1313 VanDerWaalsContact OG1-CB 3.3Å; T863-A1313 WeakPolarHBondContact OG1-CB 3.49Å
864	T	60.1	Low	75.6	Confident	22 Å²	22	27.5 Å²	27.5	14%	0.135	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	170.7	174.6	75.7	0	0	0	0	109.5	V862 F866 G867 E869	V862-T864 HydrophobicContact CG1-CG2 4.12Å; T864-F866 PolarHBondContact O-N 3.33Å; T864-F866 VanDerWaalsContact O-N 3.1Å; T864-F866 PolarHBondContact OG1-N 3Å; T864-G867 PolarHBondContact N-O 3.36Å; T864-G867 PolarHBondContact O-N 3.4Å; T864-G867 VanDerWaalsContact O-O 3.12Å; T864-G867 PolarHBondContact OG1-O 2.9Å; T864-E869 HydrophobicContact CG2-CG 4.33Å; T864-E869 PolarHBondContact OG1-OE1 3.5Å
865	E	50.7	Low	75.9	Confident	134 Å²	134	25.4 Å²	25.4	63%	0.626	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-10.1	174.7	65.6	-173.9	149.4	0	0	113.9	V1032	E865-V1032 HydrophobicContact CG-CG2 4.07Å; E865-V1032 WeakPolarHBondContact OE1-CG2 3.32Å; E865-V1032 WeakPolarHBondContact OE2-CG2 3.33Å
866	F	47.7	Very low	75.9	Confident	88 Å²	88	32.4 Å²	32.4	39%	0.386	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-18.3	-180	-56.2	-76.8	0	0	0	113.9	L711 T864 V1032	L711-F866 HydrophobicContact CB-CD2 4.48Å; L711-F866 HydrophobicContact CB-CE1 4.34Å; L711-F866 HydrophobicContact CB-CE2 3.78Å; L711-F866 HydrophobicContact CB-CZ 3.69Å; L711-F866 HydrophobicContact CD1-CE1 3.97Å; L711-F866 HydrophobicContact CD1-CE2 4.4Å; L711-F866 HydrophobicContact CD1-CZ 3.52Å; L711-F866 HydrophobicContact CG-CZ 4.24Å; T864-F866 PolarHBondContact O-N 3.33Å; T864-F866 VanDerWaalsContact O-N 3.1Å; T864-F866 PolarHBondContact OG1-N 3Å; F866-V1032 HydrophobicContact CE1-CB 4.13Å; F866-V1032 HydrophobicContact CE1-CG1 3.99Å; F866-V1032 HydrophobicContact CE1-CG2 3.81Å; F866-V1032 HydrophobicContact CZ-CB 4.27Å; F866-V1032 HydrophobicContact CZ-CG1 3.95Å; F866-V1032 HydrophobicContact CZ-CG2 3.63Å
867	G	47.3	Very low	76	Confident	15 Å²	15	33.4 Å²	33.4	16%	0.155	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.3	-156.8	-169.9	0	0	0	0	0	112.2	T864	T864-G867 PolarHBondContact N-O 3.36Å; T864-G867 PolarHBondContact O-N 3.4Å; T864-G867 VanDerWaalsContact O-O 3.12Å; T864-G867 PolarHBondContact OG1-O 2.9Å
868	N	58.9	Low	76.1	Confident	32 Å²	32	33 Å²	33	17%	0.171	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.3	176.3	-74.9	24.7	0	0	0	109.7	L861 V862 H1314 Q1315	L861-N868 HydrophobicContact CD1-CB 3.97Å; L861-N868 HydrophobicContact CD2-CB 3.87Å; L861-N868 WeakPolarHBondContact CD2-ND2 3.49Å; L861-N868 HydrophobicContact CG-CB 3.89Å; V862-N868 CarbonylContact O-C 3.57Å; V862-N868 WeakPolarHBondContact O-CA 3.45Å; N868-H1314 WeakPolarHBondContact OD1-CB 3.42Å; N868-H1314 PolarHBondContact OD1-CD2 3.32Å; N868-H1314 VanDerWaalsContact OD1-CD2 3.23Å; N868-H1314 PolarHBondContact OD1-N 3.39Å; N868-Q1315 PolarHBondContact ND2-N 3Å
869	E	65.9	Low	76.2	Confident	12 Å²	12	36.5 Å²	36.5	6%	0.056	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.1	-178.5	-66.4	175.2	-154.1	0	0	110.2	L707 V862 T864	L707-E869 HydrophobicContact CD2-CB 4.3Å; V862-E869 PolarHBondContact N-O 2.98Å; V862-E869 PolarHBondContact O-N 3.32Å; T864-E869 HydrophobicContact CG2-CG 4.33Å; T864-E869 PolarHBondContact OG1-OE1 3.5Å
870	P	73.8	Confident	76.4	Confident	46 Å²	46	35.2 Å²	35.2	30%	0.299	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	142.9	177	32.1	-34	0	0	0	111.8	I706	I706-P870 HydrophobicContact CG2-CG 3.97Å
871	L	81.5	Confident	76.8	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	96.6	-178.3	175.7	68.4	0	0	0	109.3	V702 I740 L860 V862 V873	V702-L871 HydrophobicContact CG1-CD1 3.6Å; I740-L871 HydrophobicContact CD1-CD1 4.42Å; I740-L871 HydrophobicContact CD1-CD2 3.72Å; L860-L871 HydrophobicContact CB-CB 4.16Å; L860-L871 HydrophobicContact CB-CD2 4.34Å; L860-L871 HydrophobicContact CB-CG 4.48Å; L860-L871 HydrophobicContact CD1-CD2 4.26Å; L860-L871 PolarHBondContact N-O 2.98Å; L860-L871 PolarHBondContact O-N 2.81Å; V862-L871 HydrophobicContact CG2-CB 3.98Å; V862-L871 HydrophobicContact CG2-CD2 4.03Å; L871-V873 HydrophobicContact CG-CG2 4.27Å
872	L	86.8	Confident	77.6	Confident	31 Å²	31	35.8 Å²	35.8	16%	0.162	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	121.7	178.6	-177	68.8	0	0	0	111.1	D703 I706 N859	D703-L872 HydrophobicContact CB-CB 4.48Å; D703-L872 HydrophobicContact CB-CD2 4.36Å; D703-L872 PolarHBondContact N-O 3.29Å; I706-L872 HydrophobicContact CD1-CB 3.76Å; I706-L872 HydrophobicContact CD1-CD2 3.64Å; I706-L872 HydrophobicContact CD1-CG 4.35Å; N859-L872 WeakPolarHBondContact OD1-CD1 3.42Å
873	V	90.4	Very high	78.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	111.2	179.1	-177.1	0	0	0	0	109.7	V700 L731 S857 L858 L860 L871 F875	V700-V873 HydrophobicContact CB-CG1 3.82Å; V700-V873 HydrophobicContact CG1-CG1 3.99Å; V700-V873 HydrophobicContact CG2-CG1 3.83Å; L731-V873 HydrophobicContact CD1-CG1 3.81Å; L731-V873 HydrophobicContact CD1-CG2 4.28Å; S857-V873 CarbonylContact C-O 3.54Å; S857-V873 VanDerWaalsContact CA-O 3.32Å; S857-V873 WeakPolarHBondContact CA-O 3.4Å; L858-V873 PolarHBondContact N-O 2.89Å; L858-V873 PolarHBondContact O-N 2.83Å; L860-V873 HydrophobicContact CD1-CG2 4.05Å; L860-V873 HydrophobicContact CG-CG2 4.48Å; L871-V873 HydrophobicContact CG-CG2 4.27Å; V873-F875 HydrophobicContact CB-CE2 4.22Å; V873-F875 HydrophobicContact CG1-CD2 4.19Å; V873-F875 HydrophobicContact CG1-CE1 4.47Å; V873-F875 HydrophobicContact CG1-CE2 3.66Å; V873-F875 HydrophobicContact CG1-CZ 3.81Å
874	T	91.4	Very high	79.8	Confident	10 Å²	10	36.8 Å²	36.8	6%	0.061	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	120.6	171.5	-56.1	0	0	0	0	110.2	Q701 R853 S857	Q701-T874 PolarHBondContact N-O 3.37Å; Q701-T874 PolarHBondContact O-N 2.87Å; R853-T874 HydrophobicContact CG-CG2 4.19Å; R853-T874 PolarHBondContact NE-OG1 2.89Å; R853-T874 PolarHBondContact NH2-OG1 2.99Å; R853-T874 VanDerWaalsContact NH2-OG1 3.13Å; S857-T874 WeakPolarHBondContact OG-CB 3.31Å; S857-T874 PolarHBondContact OG-OG1 3.14Å
875	F	93.3	Very high	81.3	Confident	9 Å²	9	35.9 Å²	35.9	4%	0.039	19%	0.187	C	C	.	.			trans	-89	166.2	173.4	-65.5	-94.6	0	0	0	111.3	V700 T856 L858 V873 S877 N880 R881 W884	V700-F875 HydrophobicContact CG1-CD1 3.57Å; V700-F875 HydrophobicContact CG1-CE1 3.65Å; V700-F875 HydrophobicContact CG1-CG 4.23Å; V700-F875 HydrophobicContact CG1-CZ 4.37Å; T856-F875 PolarHBondContact O-N 3.24Å; L858-F875 HydrophobicContact CB-CE2 3.94Å; L858-F875 HydrophobicContact CD2-CE2 4.16Å; V873-F875 HydrophobicContact CB-CE2 4.22Å; V873-F875 HydrophobicContact CG1-CD2 4.19Å; V873-F875 HydrophobicContact CG1-CE1 4.47Å; V873-F875 HydrophobicContact CG1-CE2 3.66Å; V873-F875 HydrophobicContact CG1-CZ 3.81Å; F875-S877 VanDerWaalsContact C-N 3.35Å; F875-N880 HydrophobicContact CB-CB 4.4Å; F875-N880 HydrophobicContact CD1-CB 4.47Å; F875-R881 HydrophobicContact CB-CB 4.02Å; F875-R881 HydrophobicContact CD2-CB 3.7Å; F875-R881 HydrophobicContact CD2-CG 3.82Å; F875-R881 HydrophobicContact CE2-CB 4.34Å; F875-R881 HydrophobicContact CE2-CG 4.12Å; F875-R881 HydrophobicContact CG-CB 3.87Å; F875-R881 HydrophobicContact CG-CG 4.48Å; F875-W884 HydrophobicContact CD1-CB 4.4Å; F875-W884 HydrophobicContact CE1-CB 3.51Å; F875-W884 AromaticContact CE1-CD1 3.8Å; F875-W884 HydrophobicContact CE1-CD2 4.08Å; F875-W884 AromaticContact CE1-CG 3.5Å; F875-W884 HydrophobicContact CE1-CG 3.5Å; F875-W884 VanDerWaalsContact CE1-CG 3.5Å; F875-W884 HydrophobicContact CZ-CB 3.78Å; F875-W884 AromaticContact CZ-CD2 3.65Å; F875-W884 HydrophobicContact CZ-CD2 3.65Å; F875-W884 AromaticContact CZ-CE3 3.93Å; F875-W884 HydrophobicContact CZ-CE3 3.93Å; F875-W884 AromaticContact CZ-CG 3.57Å; F875-W884 HydrophobicContact CZ-CG 3.57Å
876	K	90.8	Very high	83.1	Confident	146 Å²	146	35.7 Å²	35.7	64%	0.635	18%	0.18	S	C	*	.	S	Bend	trans	-75.8	-19.8	-179.8	-61.9	-173.7	178	-173.3	0	114.9
877	S	92.5	Very high	85.3	Confident	34 Å²	34	32.4 Å²	32.4	24%	0.238	17%	0.167	C	C	.	.	S	Bend	trans	-159.1	159.9	-179.6	62.9	0	0	0	0	109.3	F875 D879 N880 R881	F875-S877 VanDerWaalsContact C-N 3.35Å; S877-D879 VanDerWaalsContact C-N 3.27Å; S877-D879 PolarHBondContact O-N 2.99Å; S877-N880 PolarHBondContact O-N 2.74Å; S877-N880 PolarHBondContact OG-N 2.42Å; S877-N880 VanDerWaalsContact OG-N 3.16Å; S877-R881 PolarHBondContact O-N 2.88Å; S877-R881 VanDerWaalsContact O-N 3.13Å
878	T	92.3	Very high	87.5	Confident	6 Å²	6	32 Å²	32	4%	0.037	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-33.4	173.1	48.1	0	0	0	0	111.7	I793 L849 L855 T856 R881 L882	I793-T878 HydrophobicContact CD1-CG2 4.17Å; I793-T878 HydrophobicContact CG1-CG2 4.37Å; I793-T878 HydrophobicContact CG2-CG2 4.23Å; L849-T878 HydrophobicContact CD2-CG2 4.15Å; L855-T878 HydrophobicContact CB-CG2 3.81Å; T856-T878 HydrophobicContact CG2-CG2 4.13Å; T878-R881 PolarHBondContact O-N 2.88Å; T878-L882 WeakPolarHBondContact O-CB 3.41Å; T878-L882 WeakPolarHBondContact O-CG 3.46Å; T878-L882 PolarHBondContact O-N 3.22Å
879	D	91.8	Very high	88.6	Confident	76 Å²	76	34 Å²	34	41%	0.406	17%	0.169	S	C	.	.	H	α-helix	trans	-60.9	-46.5	172.2	-56	-66.2	0	0	0	112.9	K797 S877 R881 L882 T883	K797-D879 IonicContact NZ-OD1 2.75Å; K797-D879 PolarHBondContact NZ-OD1 2.81Å; S877-D879 VanDerWaalsContact C-N 3.27Å; S877-D879 PolarHBondContact O-N 2.99Å; D879-R881 VanDerWaalsContact C-N 3.3Å; D879-R881 PolarHBondContact O-N 3.4Å; D879-L882 PolarHBondContact O-N 3.49Å; D879-T883 WeakPolarHBondContact O-CB 3.32Å; D879-T883 PolarHBondContact O-N 3.4Å; D879-T883 PolarHBondContact O-OG1 2.94Å
880	N	91.6	Very high	89.5	Confident	29 Å²	29	37 Å²	37	16%	0.155	18%	0.183	C	C	.	.	H	α-helix	trans	-64.7	-39.5	179.6	-75	2.8	0	0	0	110.7	F875 S877 W884	F875-N880 HydrophobicContact CB-CB 4.4Å; F875-N880 HydrophobicContact CD1-CB 4.47Å; S877-N880 PolarHBondContact O-N 2.74Å; S877-N880 PolarHBondContact OG-N 2.42Å; S877-N880 VanDerWaalsContact OG-N 3.16Å; N880-W884 VanDerWaalsContact O-CB 3.3Å; N880-W884 WeakPolarHBondContact O-CB 3.4Å; N880-W884 PolarHBondContact O-N 3.17Å
881	R	92.3	Very high	90.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-56.2	172.8	-179.7	-167.3	156.6	164.7	6.6	111.6	N788 S854 L855 S857 F875 S877 T878 D879 T883 W884 E885	N788-R881 PolarHBondContact OD1-NH2 3.13Å; S854-R881 PolarHBondContact O-NH1 2.98Å; L855-R881 WeakPolarHBondContact O-CD 3.39Å; L855-R881 PolarHBondContact O-NH1 2.91Å; S857-R881 VanDerWaalsContact O-CZ 3.29Å; S857-R881 PolarHBondContact O-NH1 3.3Å; F875-R881 HydrophobicContact CB-CB 4.02Å; F875-R881 HydrophobicContact CD2-CB 3.7Å; F875-R881 HydrophobicContact CD2-CG 3.82Å; F875-R881 HydrophobicContact CE2-CB 4.34Å; F875-R881 HydrophobicContact CE2-CG 4.12Å; F875-R881 HydrophobicContact CG-CB 3.87Å; F875-R881 HydrophobicContact CG-CG 4.48Å; S877-R881 PolarHBondContact O-N 2.88Å; S877-R881 VanDerWaalsContact O-N 3.13Å; T878-R881 PolarHBondContact O-N 2.88Å; D879-R881 VanDerWaalsContact C-N 3.3Å; D879-R881 PolarHBondContact O-N 3.4Å; R881-T883 VanDerWaalsContact C-N 3.31Å; R881-T883 PolarHBondContact O-N 2.99Å; R881-W884 WeakPolarHBondContact O-CA 3.5Å; R881-W884 WeakPolarHBondContact O-CB 3.38Å; R881-W884 PolarHBondContact O-N 2.86Å; R881-E885 IonicContact CZ-OE1 3.75Å; R881-E885 VanDerWaalsContact CZ-OE1 3.29Å; R881-E885 IonicContact NE-OE1 3.45Å; R881-E885 PolarHBondContact NE-OE1 2.89Å; R881-E885 IonicContact NH2-OE1 2.79Å; R881-E885 PolarHBondContact NH2-OE1 3.13Å; R881-E885 PolarHBondContact O-N 3.25Å
882	L	91.4	Very high	90.2	Very high	23 Å²	23	37.5 Å²	37.5	12%	0.12	18%	0.18	C	C	.	.	H	α-helix	trans	-57.5	-42.5	-178.6	-74.5	175.2	0	0	0	112.1	K790 I793 M794 K797 T878 D879 W884 E885 R886	K790-L882 HydrophobicContact CB-CD2 4.42Å; K790-L882 HydrophobicContact CG-CD2 3.81Å; I793-L882 HydrophobicContact CG2-CD1 3.72Å; I793-L882 HydrophobicContact CG2-CD2 4.43Å; I793-L882 HydrophobicContact CG2-CG 4.2Å; M794-L882 HydrophobicContact SD-CD1 4.44Å; K797-L882 HydrophobicContact CD-CD1 4.35Å; T878-L882 WeakPolarHBondContact O-CB 3.41Å; T878-L882 WeakPolarHBondContact O-CG 3.46Å; T878-L882 PolarHBondContact O-N 3.22Å; D879-L882 PolarHBondContact O-N 3.49Å; L882-W884 VanDerWaalsContact C-N 3.31Å; L882-W884 PolarHBondContact O-N 2.85Å; L882-E885 PolarHBondContact O-N 3.46Å; L882-R886 PolarHBondContact O-N 3.09Å
883	T	92.5	Very high	89.6	Confident	55 Å²	55	39.9 Å²	39.9	34%	0.337	20%	0.199	S	C	.	.	H	α-helix	trans	-72.6	-25.6	178.6	-38.8	0	0	0	0	112	R696 D879 R881 N887	R696-T883 VanDerWaalsContact NH1-CG2 3.29Å; R696-T883 PolarHBondContact NH1-O 3.46Å; D879-T883 WeakPolarHBondContact O-CB 3.32Å; D879-T883 PolarHBondContact O-N 3.4Å; D879-T883 PolarHBondContact O-OG1 2.94Å; R881-T883 VanDerWaalsContact C-N 3.31Å; R881-T883 PolarHBondContact O-N 2.99Å; T883-N887 WeakPolarHBondContact O-CB 3.48Å; T883-N887 PolarHBondContact O-N 3.36Å; T883-N887 PolarHBondContact O-OD1 2.92Å
884	W	94.1	Very high	88.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-74.6	-45.8	170.9	-171.4	97.8	0	0	0	111	L731 L738 L858 L860 F875 N880 R881 L882 R886 N887 F888	L731-W884 HydrophobicContact CD1-CZ2 4.31Å; L738-W884 HydrophobicContact CD1-CZ2 4Å; L738-W884 HydrophobicContact CD2-CZ2 4.27Å; L858-W884 HydrophobicContact CD2-CE3 3.82Å; L858-W884 HydrophobicContact CD2-CZ3 3.66Å; L860-W884 HydrophobicContact CD1-CH2 3.76Å; L860-W884 HydrophobicContact CD1-CZ2 4.5Å; L860-W884 HydrophobicContact CD1-CZ3 4.38Å; L860-W884 HydrophobicContact CD2-CH2 4.1Å; L860-W884 HydrophobicContact CD2-CZ3 4.07Å; F875-W884 HydrophobicContact CD1-CB 4.4Å; F875-W884 HydrophobicContact CE1-CB 3.51Å; F875-W884 AromaticContact CE1-CD1 3.8Å; F875-W884 HydrophobicContact CE1-CD2 4.08Å; F875-W884 AromaticContact CE1-CG 3.5Å; F875-W884 HydrophobicContact CE1-CG 3.5Å; F875-W884 VanDerWaalsContact CE1-CG 3.5Å; F875-W884 HydrophobicContact CZ-CB 3.78Å; F875-W884 AromaticContact CZ-CD2 3.65Å; F875-W884 HydrophobicContact CZ-CD2 3.65Å; F875-W884 AromaticContact CZ-CE3 3.93Å; F875-W884 HydrophobicContact CZ-CE3 3.93Å; F875-W884 AromaticContact CZ-CG 3.57Å; F875-W884 HydrophobicContact CZ-CG 3.57Å; N880-W884 VanDerWaalsContact O-CB 3.3Å; N880-W884 WeakPolarHBondContact O-CB 3.4Å; N880-W884 PolarHBondContact O-N 3.17Å; R881-W884 WeakPolarHBondContact O-CA 3.5Å; R881-W884 WeakPolarHBondContact O-CB 3.38Å; R881-W884 PolarHBondContact O-N 2.86Å; L882-W884 VanDerWaalsContact C-N 3.31Å; L882-W884 PolarHBondContact O-N 2.85Å; W884-R886 PolarHBondContact O-N 3.1Å; W884-N887 PolarHBondContact O-N 3.4Å; W884-F888 HydrophobicContact CE3-CB 3.99Å; W884-F888 HydrophobicContact CH2-CB 4.02Å; W884-F888 AromaticContact CH2-CD2 3.33Å; W884-F888 HydrophobicContact CH2-CD2 3.33Å; W884-F888 AromaticContact CH2-CE2 3.94Å; W884-F888 HydrophobicContact CH2-CE2 3.94Å; W884-F888 AromaticContact CH2-CG 3.81Å; W884-F888 HydrophobicContact CH2-CG 3.81Å; W884-F888 HydrophobicContact CZ2-CD2 4.06Å; W884-F888 HydrophobicContact CZ3-CB 3.68Å; W884-F888 HydrophobicContact CZ3-CD1 4.45Å; W884-F888 AromaticContact CZ3-CD2 3.76Å; W884-F888 HydrophobicContact CZ3-CD2 3.76Å; W884-F888 AromaticContact CZ3-CG 3.72Å; W884-F888 HydrophobicContact CZ3-CG 3.72Å; W884-F888 WeakPolarHBondContact O-CB 3.37Å; W884-F888 PolarHBondContact O-N 2.85Å
885	E	90.7	Very high	88.1	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.009	21%	0.214	C	C	.	.	H	α-helix	trans	-56.5	-48.4	175.9	-78.7	-175.8	-149.3	0	0	111.8	N788 K790 L858 R881 L882 N887 F888 E889	N788-E885 PolarHBondContact ND2-OE2 2.71Å; N788-E885 PolarHBondContact OD1-OE1 2.82Å; N788-E885 PolarHBondContact OD1-OE2 3.01Å; K790-E885 WeakPolarHBondContact CD-OE2 3.44Å; L858-E885 HydrophobicContact CD1-CG 4.32Å; L858-E885 WeakPolarHBondContact CD1-OE1 3.39Å; L858-E885 HydrophobicContact CD2-CG 3.84Å; R881-E885 IonicContact CZ-OE1 3.75Å; R881-E885 VanDerWaalsContact CZ-OE1 3.29Å; R881-E885 IonicContact NE-OE1 3.45Å; R881-E885 PolarHBondContact NE-OE1 2.89Å; R881-E885 IonicContact NH2-OE1 2.79Å; R881-E885 PolarHBondContact NH2-OE1 3.13Å; R881-E885 PolarHBondContact O-N 3.25Å; L882-E885 PolarHBondContact O-N 3.46Å; E885-N887 PolarHBondContact O-N 3.1Å; E885-F888 CarbonylContact O-C 3.57Å; E885-F888 WeakPolarHBondContact O-CB 3.43Å; E885-F888 PolarHBondContact O-N 3.3Å; E885-F888 VanDerWaalsContact O-N 3.1Å; E885-E889 WeakPolarHBondContact O-CG 3.49Å; E885-E889 PolarHBondContact O-N 3.37Å
886	R	89.3	Confident	86.6	Confident	131 Å²	131	44.7 Å²	44.7	49%	0.494	24%	0.237	S	C	.	.	H	α-helix	trans	-59.4	-45.6	177.9	-165.3	-160.7	69.8	-152.1	-12.4	111.6	L882 W884 F888 E889 E890	L882-R886 PolarHBondContact O-N 3.09Å; W884-R886 PolarHBondContact O-N 3.1Å; R886-F888 VanDerWaalsContact C-N 3.29Å; R886-F888 PolarHBondContact O-N 2.83Å; R886-E889 WeakPolarHBondContact O-CB 3.38Å; R886-E889 PolarHBondContact O-N 2.94Å; R886-E890 WeakPolarHBondContact CD-OE1 3.49Å; R886-E890 IonicContact CZ-OE1 3.72Å; R886-E890 IonicContact NE-OE1 3.14Å; R886-E890 PolarHBondContact NE-OE1 3.4Å; R886-E890 IonicContact NH2-OE1 3.65Å; R886-E890 WeakPolarHBondContact O-CB 3.46Å; R886-E890 VanDerWaalsContact O-CG 3.28Å; R886-E890 WeakPolarHBondContact O-CG 3.45Å; R886-E890 PolarHBondContact O-N 3.39Å
887	N	93.9	Very high	85.2	Confident	18 Å²	18	41.3 Å²	41.3	10%	0.096	23%	0.229	C	C	.	.	H	α-helix	trans	-67.7	-27.9	177.3	-76.2	47.7	0	0	0	112.6	Y695 L733 T883 W884 E885 A891	Y695-N887 HydrophobicContact CD1-CB 4.33Å; L733-N887 HydrophobicContact CD2-CB 4.16Å; T883-N887 WeakPolarHBondContact O-CB 3.48Å; T883-N887 PolarHBondContact O-N 3.36Å; T883-N887 PolarHBondContact O-OD1 2.92Å; W884-N887 PolarHBondContact O-N 3.4Å; E885-N887 PolarHBondContact O-N 3.1Å; N887-A891 VanDerWaalsContact O-CB 3.3Å; N887-A891 WeakPolarHBondContact O-CB 3.47Å; N887-A891 PolarHBondContact O-N 3.09Å
888	F	92.6	Very high	83.8	Confident	6 Å²	6	42.2 Å²	42.2	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-73.4	-38.9	172.5	177.8	-88.6	0	0	0	111.7	L733 L780 L783 V785 W884 E885 R886 A891 K892	L733-F888 HydrophobicContact CD1-CD2 4.14Å; L733-F888 HydrophobicContact CD2-CB 4.28Å; L780-F888 HydrophobicContact CD2-CD2 3.73Å; L780-F888 HydrophobicContact CD2-CE2 3.33Å; L780-F888 HydrophobicContact CD2-CZ 4.06Å; L783-F888 HydrophobicContact CB-CE2 4.2Å; L783-F888 HydrophobicContact CB-CZ 3.97Å; L783-F888 HydrophobicContact CD1-CE2 4.35Å; V785-F888 HydrophobicContact CG2-CD1 4.14Å; V785-F888 HydrophobicContact CG2-CE1 3.88Å; W884-F888 HydrophobicContact CE3-CB 3.99Å; W884-F888 HydrophobicContact CH2-CB 4.02Å; W884-F888 AromaticContact CH2-CD2 3.33Å; W884-F888 HydrophobicContact CH2-CD2 3.33Å; W884-F888 AromaticContact CH2-CE2 3.94Å; W884-F888 HydrophobicContact CH2-CE2 3.94Å; W884-F888 AromaticContact CH2-CG 3.81Å; W884-F888 HydrophobicContact CH2-CG 3.81Å; W884-F888 HydrophobicContact CZ2-CD2 4.06Å; W884-F888 HydrophobicContact CZ3-CB 3.68Å; W884-F888 HydrophobicContact CZ3-CD1 4.45Å; W884-F888 AromaticContact CZ3-CD2 3.76Å; W884-F888 HydrophobicContact CZ3-CD2 3.76Å; W884-F888 AromaticContact CZ3-CG 3.72Å; W884-F888 HydrophobicContact CZ3-CG 3.72Å; W884-F888 WeakPolarHBondContact O-CB 3.37Å; W884-F888 PolarHBondContact O-N 2.85Å; E885-F888 CarbonylContact O-C 3.57Å; E885-F888 WeakPolarHBondContact O-CB 3.43Å; E885-F888 PolarHBondContact O-N 3.3Å; E885-F888 VanDerWaalsContact O-N 3.1Å; R886-F888 VanDerWaalsContact C-N 3.29Å; R886-F888 PolarHBondContact O-N 2.83Å; F888-A891 PolarHBondContact O-N 3.33Å; F888-K892 HydrophobicContact CD1-CG 4.26Å; F888-K892 HydrophobicContact CE1-CG 3.85Å; F888-K892 HydrophobicContact CZ-CG 4.16Å; F888-K892 WeakPolarHBondContact O-CB 3.2Å; F888-K892 PolarHBondContact O-N 3.02Å
889	E	83	Confident	82.3	Confident	76 Å²	76	43.6 Å²	43.6	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-62.9	-47.3	171.6	-71	166	170.3	0	0	111	K790 E885 R886 A891 K892 C893	K790-E889 IonicContact NZ-OE1 3.51Å; K790-E889 PolarHBondContact NZ-OE1 3.33Å; K790-E889 IonicContact NZ-OE2 3.16Å; K790-E889 PolarHBondContact NZ-OE2 3.33Å; E885-E889 WeakPolarHBondContact O-CG 3.49Å; E885-E889 PolarHBondContact O-N 3.37Å; R886-E889 WeakPolarHBondContact O-CB 3.38Å; R886-E889 PolarHBondContact O-N 2.94Å; E889-A891 VanDerWaalsContact C-N 3.35Å; E889-A891 PolarHBondContact O-N 3.48Å; E889-K892 PolarHBondContact O-N 2.99Å; E889-C893 WeakPolarHBondContact O-CB 3.35Å; E889-C893 PolarHBondContact O-N 2.97Å; E889-C893 PolarHBondContact O-SG 3.42Å; E889-C893 VanDerWaalsContact O-SG 3.35Å
890	E	84.7	Confident	80.3	Confident	75 Å²	75	42.6 Å²	42.6	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-54.9	-47.7	172.2	-72.8	163.5	-147.6	0	0	111.8	Y695 R886 C893 A894	Y695-E890 HydrophobicContact CE1-CB 3.89Å; R886-E890 WeakPolarHBondContact CD-OE1 3.49Å; R886-E890 IonicContact CZ-OE1 3.72Å; R886-E890 IonicContact NE-OE1 3.14Å; R886-E890 PolarHBondContact NE-OE1 3.4Å; R886-E890 IonicContact NH2-OE1 3.65Å; R886-E890 WeakPolarHBondContact O-CB 3.46Å; R886-E890 VanDerWaalsContact O-CG 3.28Å; R886-E890 WeakPolarHBondContact O-CG 3.45Å; R886-E890 PolarHBondContact O-N 3.39Å; E890-C893 PolarHBondContact O-N 2.82Å; E890-A894 WeakPolarHBondContact O-CB 3.49Å; E890-A894 PolarHBondContact O-N 2.83Å
891	A	88.6	Confident	78.2	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.2	-40.2	-180	0	0	0	0	0	112.5	Y695 L733 L780 N887 F888 E889 C893 A894 F895	Y695-A891 HydrophobicContact CD2-CB 4.09Å; Y695-A891 HydrophobicContact CE1-CB 4.38Å; Y695-A891 HydrophobicContact CE2-CB 3.71Å; L733-A891 HydrophobicContact CD1-CB 4.44Å; L780-A891 HydrophobicContact CD1-CB 3.57Å; N887-A891 VanDerWaalsContact O-CB 3.3Å; N887-A891 WeakPolarHBondContact O-CB 3.47Å; N887-A891 PolarHBondContact O-N 3.09Å; F888-A891 PolarHBondContact O-N 3.33Å; E889-A891 VanDerWaalsContact C-N 3.35Å; E889-A891 PolarHBondContact O-N 3.48Å; A891-C893 VanDerWaalsContact C-N 3.35Å; A891-C893 PolarHBondContact O-N 3.27Å; A891-A894 PolarHBondContact O-N 3.26Å; A891-F895 VanDerWaalsContact O-CB 3.32Å; A891-F895 WeakPolarHBondContact O-CB 3.33Å; A891-F895 PolarHBondContact O-N 2.99Å
892	K	79.8	Confident	76.5	Confident	60 Å²	60	52.9 Å²	52.9	26%	0.261	28%	0.283	S	S	.	.	H	α-helix	trans	-59.8	-42.1	171.9	-90.9	-71.4	-158	175.7	0	112.2	L780 Q781 L783 F888 E889 F895 A896	L780-K892 WeakPolarHBondContact O-CE 3.4Å; L780-K892 PolarHBondContact O-NZ 2.86Å; Q781-K892 PolarHBondContact O-NZ 2.75Å; L783-K892 WeakPolarHBondContact O-CE 3.33Å; L783-K892 PolarHBondContact O-NZ 3.42Å; F888-K892 HydrophobicContact CD1-CG 4.26Å; F888-K892 HydrophobicContact CE1-CG 3.85Å; F888-K892 HydrophobicContact CZ-CG 4.16Å; F888-K892 WeakPolarHBondContact O-CB 3.2Å; F888-K892 PolarHBondContact O-N 3.02Å; E889-K892 PolarHBondContact O-N 2.99Å; K892-F895 PolarHBondContact O-N 2.7Å; K892-A896 WeakPolarHBondContact O-CB 3.34Å; K892-A896 PolarHBondContact O-N 2.67Å
893	C	73.9	Confident	75	Confident	82 Å²	82	59.9 Å²	59.9	55%	0.554	32%	0.315	S	S	*	.	H	α-helix	trans	-66.1	-45.8	176.2	-73.9	0	0	0	0	111.5	E889 E890 A891 F895 A896 V897	E889-C893 WeakPolarHBondContact O-CB 3.35Å; E889-C893 PolarHBondContact O-N 2.97Å; E889-C893 PolarHBondContact O-SG 3.42Å; E889-C893 VanDerWaalsContact O-SG 3.35Å; E890-C893 PolarHBondContact O-N 2.82Å; A891-C893 VanDerWaalsContact C-N 3.35Å; A891-C893 PolarHBondContact O-N 3.27Å; C893-F895 VanDerWaalsContact C-N 3.31Å; C893-F895 PolarHBondContact O-N 2.82Å; C893-A896 PolarHBondContact O-N 2.98Å; C893-V897 WeakPolarHBondContact O-CG2 3.43Å; C893-V897 PolarHBondContact O-N 2.71Å
894	A	72.9	Confident	73.9	Confident	35 Å²	35	61.2 Å²	61.2	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-59.5	-41.2	174.9	0	0	0	0	0	112.1	E890 A891 V897 S898	E890-A894 WeakPolarHBondContact O-CB 3.49Å; E890-A894 PolarHBondContact O-N 2.83Å; A891-A894 PolarHBondContact O-N 3.26Å; A894-V897 PolarHBondContact O-N 2.66Å; A894-S898 PolarHBondContact O-N 2.78Å; A894-S898 PolarHBondContact O-OG 2.83Å
895	F	77.5	Confident	73.2	Confident	22 Å²	22	61.7 Å²	61.7	10%	0.096	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-43.2	175.6	-169.2	-110	0	0	0	112.9	S735 D736 L780 Q781 A891 K892 C893 V897 S898 Q899	S735-F895 WeakPolarHBondContact O-CB 3.44Å; S735-F895 WeakPolarHBondContact O-CD2 3.3Å; D736-F895 HydrophobicContact CB-CD2 3.73Å; D736-F895 HydrophobicContact CB-CE2 3.67Å; L780-F895 HydrophobicContact CB-CG 4.43Å; Q781-F895 HydrophobicContact CB-CE1 3.61Å; Q781-F895 HydrophobicContact CB-CZ 3.8Å; Q781-F895 HydrophobicContact CG-CE1 4.09Å; Q781-F895 HydrophobicContact CG-CZ 4.45Å; A891-F895 VanDerWaalsContact O-CB 3.32Å; A891-F895 WeakPolarHBondContact O-CB 3.33Å; A891-F895 PolarHBondContact O-N 2.99Å; K892-F895 PolarHBondContact O-N 2.7Å; C893-F895 VanDerWaalsContact C-N 3.31Å; C893-F895 PolarHBondContact O-N 2.82Å; F895-V897 VanDerWaalsContact C-N 3.34Å; F895-S898 PolarHBondContact O-N 2.93Å; F895-S898 PolarHBondContact O-OG 3.39Å; F895-S898 VanDerWaalsContact O-OG 3.1Å; F895-Q899 HydrophobicContact CE1-CG 4.32Å; F895-Q899 VanDerWaalsContact CE1-NE2 3.26Å; F895-Q899 HydrophobicContact CZ-CG 4.4Å; F895-Q899 WeakPolarHBondContact O-CG 3.29Å; F895-Q899 PolarHBondContact O-N 3.22Å
896	A	62.6	Low	72.9	Confident	63 Å²	63	65.5 Å²	65.5	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-64.1	-40.6	176.4	0	0	0	0	0	111.7	K892 C893 S900	K892-A896 WeakPolarHBondContact O-CB 3.34Å; K892-A896 PolarHBondContact O-N 2.67Å; C893-A896 PolarHBondContact O-N 2.98Å; A896-S900 PolarHBondContact O-N 3.19Å; A896-S900 VanDerWaalsContact O-N 3.08Å
897	V	61	Low	72.7	Confident	75 Å²	75	62.8 Å²	62.8	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-46.8	175.2	172.6	0	0	0	0	111	C893 A894 F895 Q899 S900 Q901	C893-V897 WeakPolarHBondContact O-CG2 3.43Å; C893-V897 PolarHBondContact O-N 2.71Å; A894-V897 PolarHBondContact O-N 2.66Å; F895-V897 VanDerWaalsContact C-N 3.34Å; V897-Q899 PolarHBondContact O-N 3.46Å; V897-S900 CarbonylContact O-C 3.56Å; V897-S900 WeakPolarHBondContact O-CA 3.26Å; V897-S900 WeakPolarHBondContact O-CB 3.18Å; V897-S900 PolarHBondContact O-N 2.97Å; V897-S900 PolarHBondContact O-OG 3.25Å; V897-Q901 WeakPolarHBondContact O-CG 3.5Å; V897-Q901 PolarHBondContact O-N 3.5Å
898	S	64.4	Low	72.3	Confident	53 Å²	53	65.2 Å²	65.2	37%	0.371	36%	0.358	S	S	.	.	H	α-helix	trans	-66.3	-34.7	179.8	67	0	0	0	0	112.9	A894 F895 S900 Q901 R902	A894-S898 PolarHBondContact O-N 2.78Å; A894-S898 PolarHBondContact O-OG 2.83Å; F895-S898 PolarHBondContact O-N 2.93Å; F895-S898 PolarHBondContact O-OG 3.39Å; F895-S898 VanDerWaalsContact O-OG 3.1Å; S898-S900 VanDerWaalsContact C-N 3.31Å; S898-S900 PolarHBondContact O-N 2.93Å; S898-Q901 CarbonylContact O-C 3.55Å; S898-Q901 PolarHBondContact O-N 2.81Å; S898-Q901 VanDerWaalsContact O-N 3.09Å; S898-R902 PolarHBondContact O-N 2.99Å
899	Q	60	Low	72	Confident	35 Å²	35	68.1 Å²	68.1	16%	0.164	37%	0.37	C	S	.	.	H	α-helix	trans	-67.1	-29.6	170.5	-67.5	-148.8	-2.5	0	0	113.5	Q781 F895 V897 Q901	Q781-Q899 VanDerWaalsContact CD-NE2 3.34Å; F895-Q899 HydrophobicContact CE1-CG 4.32Å; F895-Q899 VanDerWaalsContact CE1-NE2 3.26Å; F895-Q899 HydrophobicContact CZ-CG 4.4Å; F895-Q899 WeakPolarHBondContact O-CG 3.29Å; F895-Q899 PolarHBondContact O-N 3.22Å; V897-Q899 PolarHBondContact O-N 3.46Å; Q899-Q901 VanDerWaalsContact C-N 3.28Å
900	S	49.3	Very low	72.1	Confident	54 Å²	54	68.3 Å²	68.3	38%	0.378	37%	0.37	S	S	.	.	H	α-helix	trans	-75.4	-16	170.8	80.7	0	0	0	0	113.7	A896 V897 S898	A896-S900 PolarHBondContact O-N 3.19Å; A896-S900 VanDerWaalsContact O-N 3.08Å; V897-S900 CarbonylContact O-C 3.56Å; V897-S900 WeakPolarHBondContact O-CA 3.26Å; V897-S900 WeakPolarHBondContact O-CB 3.18Å; V897-S900 PolarHBondContact O-N 2.97Å; V897-S900 PolarHBondContact O-OG 3.25Å; S898-S900 VanDerWaalsContact C-N 3.31Å; S898-S900 PolarHBondContact O-N 2.93Å
901	Q	47.2	Very low	71.9	Confident	143 Å²	143	65.3 Å²	65.3	67%	0.668	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	9.9	176.8	-68.4	-177.6	-2.9	0	0	113.6	V897 S898 Q899 Q903	V897-Q901 WeakPolarHBondContact O-CG 3.5Å; V897-Q901 PolarHBondContact O-N 3.5Å; S898-Q901 CarbonylContact O-C 3.55Å; S898-Q901 PolarHBondContact O-N 2.81Å; S898-Q901 VanDerWaalsContact O-N 3.09Å; Q899-Q901 VanDerWaalsContact C-N 3.28Å; Q901-Q903 PolarHBondContact O-N 2.9Å
902	R	56.3	Low	71.4	Confident	103 Å²	103	66.1 Å²	66.1	39%	0.389	36%	0.363	S	S	.	.	S	Bend	trans	-49.8	133.8	165.2	-78.4	-172.9	180	-179.5	4.8	108.4	S898 K1292 D1293	S898-R902 PolarHBondContact O-N 2.99Å; R902-K1292 PolarHBondContact NH1-O 3.02Å; R902-K1292 VanDerWaalsContact NH1-O 3.13Å; R902-D1293 IonicContact CZ-OD2 3.18Å; R902-D1293 IonicContact NH1-OD2 3.51Å; R902-D1293 PolarHBondContact NH1-OD2 2.88Å; R902-D1293 IonicContact NH2-OD2 3.06Å; R902-D1293 PolarHBondContact NH2-OD2 3.39Å; R902-D1293 VanDerWaalsContact NH2-OD2 3.09Å
903	Q	60	Low	71	Confident	170 Å²	170	63.8 Å²	63.8	79%	0.794	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-55.2	137.8	-173.2	-69.3	-170.4	-1.2	0	0	111.1	Q901	Q901-Q903 PolarHBondContact O-N 2.9Å
904	P	69.4	Low	70.4	Confident	82 Å²	82	62.2 Å²	62.2	53%	0.532	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-62.2	147.3	179.7	27.6	-35.2	0	0	0	110.2	V906 Y1306	P904-V906 PolarHBondContact O-N 2.73Å; P904-Y1306 WeakPolarHBondContact CB-OH 3.45Å
905	P	80.3	Confident	69.5	Low	11 Å²	11	63.3 Å²	63.3	7%	0.071	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-51.8	124.8	177.7	-28.1	36.7	0	0	0	111.7	M1294 W1296 Y1306 W1416 K1417 V1418	P905-M1294 HydrophobicContact CG-CE 3.81Å; P905-W1296 HydrophobicContact CB-CH2 3.51Å; P905-W1296 HydrophobicContact CB-CZ2 3.51Å; P905-W1296 HydrophobicContact CG-CH2 3.73Å; P905-W1296 HydrophobicContact CG-CZ2 3.37Å; P905-Y1306 HydrophobicContact CG-CD1 4.22Å; P905-Y1306 HydrophobicContact CG-CD2 4.29Å; P905-Y1306 HydrophobicContact CG-CE1 4.17Å; P905-Y1306 HydrophobicContact CG-CE2 4.22Å; P905-Y1306 HydrophobicContact CG-CG 4.29Å; P905-W1416 HydrophobicContact CB-CB 4.36Å; P905-W1416 HydrophobicContact CB-CE3 4.14Å; P905-K1417 CarbonylContact C-O 3.54Å; P905-K1417 WeakPolarHBondContact CA-O 3.15Å; P905-V1418 HydrophobicContact CB-CG2 4.36Å
906	V	83.4	Confident	67.8	Low	81 Å²	81	64.8 Å²	64.8	49%	0.491	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.4	-174.5	-179.4	0	0	0	0	108.5	P904 V908 W1416 K1417	P904-V906 PolarHBondContact O-N 2.73Å; V906-V908 PolarHBondContact O-N 3.02Å; V906-W1416 CarbonylContact O-C 3.55Å; V906-W1416 WeakPolarHBondContact O-CA 3.47Å; V906-K1417 HydrophobicContact CB-CB 4.48Å; V906-K1417 PolarHBondContact N-O 3.17Å; V906-K1417 PolarHBondContact O-N 3.21Å
907	F	86.9	Confident	66.7	Low	74 Å²	74	72.5 Å²	72.5	33%	0.325	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	130.4	170.9	171.9	-106.4	0	0	0	110.1	K909 F910 I1330 I1414 W1416	F907-K909 VanDerWaalsContact CZ-C 3.41Å; F907-K909 VanDerWaalsContact CZ-CA 3.45Å; F907-F910 HydrophobicContact CE2-CD1 4.35Å; F907-F910 AromaticContact CZ-CD1 3.77Å; F907-F910 HydrophobicContact CZ-CD1 3.77Å; F907-I1330 HydrophobicContact CD1-CD1 3.9Å; F907-I1330 HydrophobicContact CD2-CD1 3.89Å; F907-I1330 HydrophobicContact CE1-CD1 3.85Å; F907-I1330 HydrophobicContact CE2-CD1 3.83Å; F907-I1330 HydrophobicContact CG-CD1 3.91Å; F907-I1330 HydrophobicContact CZ-CD1 3.81Å; F907-I1414 HydrophobicContact CD2-CG2 4.07Å; F907-I1414 HydrophobicContact CE2-CG2 3.93Å; F907-W1416 HydrophobicContact CB-CE3 4.06Å; F907-W1416 HydrophobicContact CB-CH2 3.87Å; F907-W1416 HydrophobicContact CB-CZ3 3.58Å; F907-W1416 HydrophobicContact CD2-CH2 4.21Å; F907-W1416 HydrophobicContact CD2-CZ2 4.22Å; F907-W1416 HydrophobicContact CG-CH2 4.45Å
908	V	85	Confident	65.8	Low	70 Å²	70	73.7 Å²	73.7	42%	0.424	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-59.6	-176.8	-175.3	0	0	0	0	110.8	V906 Y1381 I1415 K1417	V906-V908 PolarHBondContact O-N 3.02Å; V908-Y1381 HydrophobicContact CG1-CE1 4.49Å; V908-Y1381 HydrophobicContact CG2-CD1 4.14Å; V908-Y1381 HydrophobicContact CG2-CE1 3.97Å; V908-I1415 HydrophobicContact CB-CB 4.37Å; V908-I1415 HydrophobicContact CB-CG2 4.1Å; V908-I1415 WeakPolarHBondContact CB-O 3.34Å; V908-I1415 HydrophobicContact CG2-CG2 4.32Å; V908-I1415 PolarHBondContact N-O 3.48Å; V908-K1417 HydrophobicContact CG2-CB 3.74Å
909	K	85.5	Confident	64.9	Low	66 Å²	66	71.4 Å²	71.4	29%	0.287	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	166.2	172.6	66.3	174.1	-174.3	171.8	0	110.3	F907 I911 V976 I1415	F907-K909 VanDerWaalsContact CZ-C 3.41Å; F907-K909 VanDerWaalsContact CZ-CA 3.45Å; K909-I911 HydrophobicContact CD-CG1 4.42Å; K909-V976 PolarHBondContact NZ-O 3.21Å; K909-I1415 HydrophobicContact CG-CD1 4.29Å; K909-I1415 WeakPolarHBondContact O-CB 3.48Å; K909-I1415 PolarHBondContact O-N 3.09Å
910	F	85.4	Confident	64.2	Low	81 Å²	81	70.1 Å²	70.1	36%	0.355	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	166.4	158.5	58.8	-101.6	0	0	0	110.9	F907 L1389 M1406 Y1412 L1413	F907-F910 HydrophobicContact CE2-CD1 4.35Å; F907-F910 AromaticContact CZ-CD1 3.77Å; F907-F910 HydrophobicContact CZ-CD1 3.77Å; F910-L1389 HydrophobicContact CB-CD1 4Å; F910-L1389 HydrophobicContact CB-CD2 4.48Å; F910-L1389 HydrophobicContact CD1-CD1 4.14Å; F910-L1389 HydrophobicContact CD1-CD2 3.4Å; F910-L1389 HydrophobicContact CD1-CG 4.41Å; F910-L1389 HydrophobicContact CD2-CD2 3.95Å; F910-L1389 HydrophobicContact CE1-CD2 3.43Å; F910-L1389 VanDerWaalsContact CE1-CD2 3.43Å; F910-L1389 HydrophobicContact CE2-CD2 3.96Å; F910-L1389 HydrophobicContact CG-CD1 4.09Å; F910-L1389 HydrophobicContact CG-CD2 3.69Å; F910-L1389 HydrophobicContact CZ-CD2 3.72Å; F910-M1406 HydrophobicContact CE2-CE 4.24Å; F910-Y1412 AromaticContact CD2-CD1 3.99Å; F910-Y1412 HydrophobicContact CD2-CD1 3.99Å; F910-Y1412 HydrophobicContact CD2-CE1 4.06Å; F910-Y1412 HydrophobicContact CE2-CE1 4.34Å; F910-L1413 CarbonylContact C-O 3.44Å; F910-L1413 WeakPolarHBondContact CA-O 3.46Å; F910-L1413 WeakPolarHBondContact CB-O 3.35Å
911	I	80.8	Confident	63.9	Low	12 Å²	12	73.2 Å²	73.2	6%	0.062	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	124.8	174.4	-49.4	177.7	0	0	0	108	K909 V922 L970 V976 Y1412 L1413 I1415	K909-I911 HydrophobicContact CD-CG1 4.42Å; I911-V922 HydrophobicContact CG2-CB 4.38Å; I911-V922 HydrophobicContact CG2-CG1 3.48Å; I911-V922 VanDerWaalsContact CG2-CG1 3.48Å; I911-V922 HydrophobicContact CG2-CG2 3.9Å; I911-L970 HydrophobicContact CD1-CD1 3.95Å; I911-V976 HydrophobicContact CD1-CG1 3.82Å; I911-Y1412 WeakPolarHBondContact O-CA 3.22Å; I911-L1413 HydrophobicContact CB-CB 4.24Å; I911-L1413 PolarHBondContact N-O 2.89Å; I911-L1413 PolarHBondContact O-N 3.03Å; I911-I1415 HydrophobicContact CD1-CD1 3.95Å; I911-I1415 HydrophobicContact CG1-CD1 4.45Å
912	A	77.6	Confident	63.8	Low	16 Å²	16	68.7 Å²	68.7	13%	0.132	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	131.8	172.1	0	0	0	0	0	110.4	T1410 Y1412	A912-T1410 HydrophobicContact CB-CG2 4.3Å; A912-Y1412 HydrophobicContact CB-CD1 4.15Å; A912-Y1412 HydrophobicContact CB-CE1 3.61Å
913	A	72.2	Confident	63	Low	12 Å²	12	66.8 Å²	66.8	10%	0.099	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	96.1	173.2	0	0	0	0	0	109.5	F920 F940 N1411	A913-F920 HydrophobicContact CB-CD1 3.94Å; A913-F920 HydrophobicContact CB-CE1 4.22Å; A913-F920 WeakPolarHBondContact O-CD1 3.19Å; A913-F920 VanDerWaalsContact O-CE1 3.29Å; A913-F920 WeakPolarHBondContact O-CE1 3.33Å; A913-F940 HydrophobicContact CB-CZ 3.8Å; A913-N1411 HydrophobicContact CB-CB 4.39Å; A913-N1411 PolarHBondContact N-O 3.46Å
914	N	59.9	Low	61.9	Low	48 Å²	48	65.9 Å²	65.9	26%	0.257	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.7	-175.7	-62.5	-7.4	0	0	0	111.2	F920 H921 S923 T1410	N914-F920 VanDerWaalsContact C-CD1 3.42Å; N914-F920 WeakPolarHBondContact O-CA 3.48Å; N914-F920 WeakPolarHBondContact O-CD1 3.48Å; N914-H921 PolarHBondContact O-N 3.3Å; N914-S923 PolarHBondContact ND2-OG 3.11Å; N914-T1410 WeakPolarHBondContact OD1-CG2 3.39Å
915	R	53.8	Low	60.1	Low	58 Å²	58	69 Å²	69	22%	0.219	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	119.7	-177	-177.5	179.8	172	168.9	-5.9	111.1	F920 M935 E936 F938	R915-F920 HydrophobicContact CB-CD1 4.31Å; R915-F920 HydrophobicContact CB-CE1 3.78Å; R915-F920 HydrophobicContact CB-CE2 4.17Å; R915-F920 HydrophobicContact CB-CZ 3.71Å; R915-F920 HydrophobicContact CG-CE2 4.17Å; R915-F920 HydrophobicContact CG-CZ 4.14Å; R915-M935 HydrophobicContact CB-CE 4.12Å; R915-M935 HydrophobicContact CB-CG 4.35Å; R915-M935 HydrophobicContact CB-SD 4.4Å; R915-E936 IonicContact CZ-OE2 3.18Å; R915-E936 PolarHBondContact NH1-O 3.44Å; R915-E936 IonicContact NH1-OE2 3.23Å; R915-E936 IonicContact NH2-OE2 2.71Å; R915-E936 PolarHBondContact NH2-OE2 3.21Å; R915-F938 VanDerWaalsContact CZ-CE2 3.49Å
916	T	42.8	Very low	57.6	Low	53 Å²	53	77.4 Å²	77.4	33%	0.325	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	165.6	162.4	81.4	0	0	0	0	110.4	S918 G919 H921	T916-S918 PolarHBondContact O-N 2.72Å; T916-S918 VanDerWaalsContact O-N 3.11Å; T916-S918 PolarHBondContact OG1-N 3.2Å; T916-G919 WeakPolarHBondContact CA-O 3.43Å; T916-G919 WeakPolarHBondContact CB-O 3.35Å; T916-G919 PolarHBondContact N-O 3.47Å; T916-G919 PolarHBondContact O-N 2.99Å; T916-G919 PolarHBondContact OG1-O 2.88Å; T916-H921 HydrophobicContact CG2-CB 4.21Å
917	R	39.5	Very low	55.1	Low	226 Å²	226	78.5 Å²	78.5	85%	0.853	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.9	178.4	-86.9	-170.9	170.6	-147.9	-2.8	114.6
918	S	42.1	Very low	52.3	Low	99 Å²	99	81.6 Å²	81.6	69%	0.692	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	20.2	179.5	49.8	0	0	0	0	113.1	T916	T916-S918 PolarHBondContact O-N 2.72Å; T916-S918 VanDerWaalsContact O-N 3.11Å; T916-S918 PolarHBondContact OG1-N 3.2Å
919	G	44.8	Very low	49.6	Very low	5 Å²	5	85.6 Å²	85.6	5%	0.052	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	122.4	-179.5	176.9	0	0	0	0	0	114.1	T916 N982	T916-G919 WeakPolarHBondContact CA-O 3.43Å; T916-G919 WeakPolarHBondContact CB-O 3.35Å; T916-G919 PolarHBondContact N-O 3.47Å; T916-G919 PolarHBondContact O-N 2.99Å; T916-G919 PolarHBondContact OG1-O 2.88Å; G919-N982 WeakPolarHBondContact CA-OD1 3.39Å
920	F	46.6	Very low	46.8	Very low	9 Å²	9	90.5 Å²	90.5	4%	0.039	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.4	-178.1	-81.4	-99.9	0	0	0	111.7	A913 N914 R915 F938 F968 N980	A913-F920 HydrophobicContact CB-CD1 3.94Å; A913-F920 HydrophobicContact CB-CE1 4.22Å; A913-F920 WeakPolarHBondContact O-CD1 3.19Å; A913-F920 VanDerWaalsContact O-CE1 3.29Å; A913-F920 WeakPolarHBondContact O-CE1 3.33Å; N914-F920 VanDerWaalsContact C-CD1 3.42Å; N914-F920 WeakPolarHBondContact O-CA 3.48Å; N914-F920 WeakPolarHBondContact O-CD1 3.48Å; R915-F920 HydrophobicContact CB-CD1 4.31Å; R915-F920 HydrophobicContact CB-CE1 3.78Å; R915-F920 HydrophobicContact CB-CE2 4.17Å; R915-F920 HydrophobicContact CB-CZ 3.71Å; R915-F920 HydrophobicContact CG-CE2 4.17Å; R915-F920 HydrophobicContact CG-CZ 4.14Å; F920-F938 HydrophobicContact CE2-CB 4.42Å; F920-F938 HydrophobicContact CE2-CD2 4.35Å; F920-F938 HydrophobicContact CZ-CB 4.14Å; F920-F968 HydrophobicContact CB-CE1 4.12Å; F920-F968 AromaticContact CD2-CE1 3.53Å; F920-F968 HydrophobicContact CD2-CE1 3.53Å; F920-F968 AromaticContact CD2-CZ 3.44Å; F920-F968 HydrophobicContact CD2-CZ 3.44Å; F920-F968 VanDerWaalsContact CD2-CZ 3.44Å; F920-F968 HydrophobicContact CE2-CE1 4.31Å; F920-F968 AromaticContact CE2-CZ 3.76Å; F920-F968 HydrophobicContact CE2-CZ 3.76Å; F920-F968 HydrophobicContact CG-CE1 4.13Å; F920-F968 HydrophobicContact CG-CZ 4.26Å; F920-N980 PolarHBondContact N-OD1 3.4Å; F920-N980 WeakPolarHBondContact O-CB 3.16Å; F920-N980 PolarHBondContact O-ND2 3.31Å; F920-N980 PolarHBondContact O-OD1 2.94Å
921	H	43	Very low	44.1	Very low	119 Å²	119	92.5 Å²	92.5	55%	0.551	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.1	171.8	-97	-85.8	0	0	0	109.8	N914 T916 S923	N914-H921 PolarHBondContact O-N 3.3Å; T916-H921 HydrophobicContact CG2-CB 4.21Å; H921-S923 PolarHBondContact O-N 3.3Å
922	V	44.3	Very low	41.6	Very low	47 Å²	47	102 Å²	102	29%	0.285	52%	0.519	S	S	.	.			trans	-79.5	107.4	171.2	173.5	0	0	0	0	109.2	I911 K924 V978	I911-V922 HydrophobicContact CG2-CB 4.38Å; I911-V922 HydrophobicContact CG2-CG1 3.48Å; I911-V922 VanDerWaalsContact CG2-CG1 3.48Å; I911-V922 HydrophobicContact CG2-CG2 3.9Å; V922-K924 PolarHBondContact O-N 3.41Å; V922-V978 HydrophobicContact CG2-CB 3.66Å; V922-V978 HydrophobicContact CG2-CG1 4.24Å; V922-V978 HydrophobicContact CG2-CG2 3.64Å
923	S	40.5	Very low	39.1	Very low	63 Å²	63	110.4 Å²	110.4	44%	0.441	55%	0.553	S	S	.	*			trans	-80	111.8	168.5	49.2	0	0	0	0	110.1	N914 H921 H925	N914-S923 PolarHBondContact ND2-OG 3.11Å; H921-S923 PolarHBondContact O-N 3.3Å; S923-H925 PolarHBondContact O-N 2.9Å
924	K	36.7	Very low	37.1	Very low	151 Å²	151	117 Å²	117	66%	0.657	59%	0.585	S	S	*	*			trans	-58.6	132.2	155.9	-79.6	-177.8	174.9	177.5	0	107.3	V922 E926 E975	V922-K924 PolarHBondContact O-N 3.41Å; K924-E926 PolarHBondContact O-N 3.04Å; K924-E975 IonicContact NZ-OE2 2.79Å; K924-E975 PolarHBondContact NZ-OE2 3.44Å
925	H	32.3	Very low	36	Very low	148 Å²	148	118.1 Å²	118.1	69%	0.685	59%	0.59	S	S	*	*			trans	-83.8	86.6	-159	-161.8	-84.9	0	0	0	113.2	S923	S923-H925 PolarHBondContact O-N 2.9Å
926	E	26.4	Very low	35.6	Very low	187 Å²	187	121.3 Å²	121.3	87%	0.874	61%	0.608	S	S	*	*			trans	-107.1	144.9	153.1	-76.2	-168.9	139	0	0	109.6	K924	K924-E926 PolarHBondContact O-N 3.04Å
927	S	30.3	Very low	36.1	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	62%	0.624	S	S	*	*			trans	-80.8	134.5	-160.3	46.2	0	0	0	0	114.5
928	T	28.7	Very low	37.2	Very low	138 Å²	138	117 Å²	117	85%	0.847	59%	0.585	S	S	*	*			trans	-162.1	122.2	150.9	-2.8	0	0	0	0	112.2
929	N	28.7	Very low	39	Very low	154 Å²	154	114.8 Å²	114.8	82%	0.824	56%	0.564	S	S	*	*			trans	-75.4	119.5	170.7	-68.7	-39.3	0	0	0	110.2
930	H	27.2	Very low	41	Very low	169 Å²	169	114.7 Å²	114.7	78%	0.782	56%	0.562	S	S	*	*			trans	-165.4	105.8	151.6	-100.1	-62.1	0	0	0	114
931	V	27.8	Very low	42.9	Very low	123 Å²	123	115.6 Å²	115.6	75%	0.745	57%	0.569	S	S	*	*			trans	42.5	97.2	144.5	-168.6	0	0	0	0	118.3
932	W	28.8	Very low	45.2	Very low	213 Å²	213	110.9 Å²	110.9	81%	0.807	55%	0.549	S	S	*	.			trans	-131.8	99.8	156.8	-81.8	90.9	0	0	0	112
933	F	25.4	Very low	47.4	Very low	192 Å²	192	109.6 Å²	109.6	84%	0.842	54%	0.543	S	S	*	.			trans	-82.3	149.7	165.8	-112.6	-110.6	0	0	0	110
934	L	28.8	Very low	49.8	Very low	150 Å²	150	108 Å²	108	79%	0.785	53%	0.531	S	S	*	.			trans	76	56.6	-179.8	-55.8	164.6	0	0	0	116.5
935	M	37	Very low	52.2	Low	71 Å²	71	102.7 Å²	102.7	35%	0.35	51%	0.513	S	S	.	.			trans	-82.8	104.8	151.1	-92.3	-179.8	61	0	0	110.7	R915	R915-M935 HydrophobicContact CB-CE 4.12Å; R915-M935 HydrophobicContact CB-CG 4.35Å; R915-M935 HydrophobicContact CB-SD 4.4Å
936	E	45.6	Very low	54.4	Low	126 Å²	126	96 Å²	96	59%	0.589	48%	0.482	S	S	*	.			trans	-64.6	135.3	158.7	-78.3	168.1	169	0	0	109.7	R915 F938	R915-E936 IonicContact CZ-OE2 3.18Å; R915-E936 PolarHBondContact NH1-O 3.44Å; R915-E936 IonicContact NH1-OE2 3.23Å; R915-E936 IonicContact NH2-OE2 2.71Å; R915-E936 PolarHBondContact NH2-OE2 3.21Å; E936-F938 PolarHBondContact O-N 3.19Å
937	R	54.2	Low	56.5	Low	178 Å²	178	90.1 Å²	90.1	67%	0.672	45%	0.453	S	S	*	.			trans	-82.5	81.5	-169.6	-67	-177.6	176.5	-173.7	-5.2	113
938	F	63	Low	58	Low	9 Å²	9	85.2 Å²	85.2	4%	0.039	42%	0.418	C	S	.	.			trans	-67.4	127.7	160.1	-93.1	-45	0	0	0	109.4	R915 F920 E936 S959 D961 S964 Q966 N1411	R915-F938 VanDerWaalsContact CZ-CE2 3.49Å; F920-F938 HydrophobicContact CE2-CB 4.42Å; F920-F938 HydrophobicContact CE2-CD2 4.35Å; F920-F938 HydrophobicContact CZ-CB 4.14Å; E936-F938 PolarHBondContact O-N 3.19Å; F938-S959 WeakPolarHBondContact CB-OG 3.45Å; F938-D961 HydrophobicContact CD1-CB 3.93Å; F938-D961 HydrophobicContact CE1-CB 3.84Å; F938-S964 WeakPolarHBondContact CE1-OG 3.46Å; F938-S964 VanDerWaalsContact CZ-OG 3.31Å; F938-S964 WeakPolarHBondContact CZ-OG 3.35Å; F938-Q966 VanDerWaalsContact CE2-CD 3.42Å; F938-Q966 HydrophobicContact CE2-CG 4.16Å; F938-Q966 VanDerWaalsContact CE2-NE2 3.29Å; F938-Q966 HydrophobicContact CZ-CG 4.06Å; F938-N1411 PolarHBondContact O-ND2 3.21Å
939	Q	78.1	Confident	59.3	Low	53 Å²	53	84.1 Å²	84.1	25%	0.248	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	144.8	179.8	-66.7	177.6	-28.7	0	0	110.4	T941 S959 S960 R1337 E1387	Q939-T941 PolarHBondContact O-OG1 3.46Å; Q939-S959 PolarHBondContact N-OG 2.81Å; Q939-S959 VanDerWaalsContact O-CA 3.26Å; Q939-S959 WeakPolarHBondContact O-CA 3.09Å; Q939-S959 WeakPolarHBondContact O-CB 3.23Å; Q939-S959 PolarHBondContact O-OG 3.47Å; Q939-S960 PolarHBondContact N-O 3.28Å; Q939-S960 PolarHBondContact O-N 3.42Å; Q939-S960 VanDerWaalsContact O-N 3.15Å; Q939-R1337 VanDerWaalsContact NE2-NH2 3.15Å; Q939-E1387 PolarHBondContact NE2-OE1 3.02Å; Q939-E1387 PolarHBondContact NE2-OE2 3.48Å
940	F	87	Confident	60.8	Low	3 Å²	3	82.7 Å²	82.7	1%	0.013	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	143.9	171.2	-71.8	-42.3	0	0	0	111.4	A913 M957 R1337 F1338 N1411 L1413	A913-F940 HydrophobicContact CB-CZ 3.8Å; F940-M957 HydrophobicContact CD1-CE 4.07Å; F940-M957 HydrophobicContact CE1-CE 3.28Å; F940-M957 HydrophobicContact CE2-CE 4.31Å; F940-M957 HydrophobicContact CZ-CE 3.43Å; F940-M957 VanDerWaalsContact CZ-CE 3.43Å; F940-R1337 HydrophobicContact CB-CB 3.9Å; F940-R1337 HydrophobicContact CB-CG 4.05Å; F940-R1337 WeakPolarHBondContact O-CB 3.3Å; F940-R1337 VanDerWaalsContact O-CG 3.25Å; F940-R1337 WeakPolarHBondContact O-CG 3.49Å; F940-R1337 PolarHBondContact O-NH1 3.36Å; F940-R1337 VanDerWaalsContact O-NH1 3.15Å; F940-F1338 HydrophobicContact CB-CD1 4.11Å; F940-F1338 HydrophobicContact CB-CE1 3.87Å; F940-F1338 HydrophobicContact CD1-CE1 4.19Å; F940-F1338 HydrophobicContact CD2-CE1 4.15Å; F940-F1338 AromaticContact CG-CE1 3.83Å; F940-F1338 HydrophobicContact CG-CE1 3.83Å; F940-N1411 HydrophobicContact CD2-CB 3.75Å; F940-N1411 HydrophobicContact CE2-CB 3.5Å; F940-N1411 HydrophobicContact CG-CB 4.48Å; F940-N1411 HydrophobicContact CZ-CB 4.01Å; F940-N1411 PolarHBondContact N-OD1 3.07Å; F940-L1413 HydrophobicContact CE2-CD2 3.82Å; F940-L1413 HydrophobicContact CE2-CG 4.29Å; F940-L1413 HydrophobicContact CZ-CD2 4.05Å; F940-L1413 HydrophobicContact CZ-CG 4.36Å
941	T	87.4	Confident	62.5	Low	29 Å²	29	75.3 Å²	75.3	18%	0.178	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	-45	-172.4	-59.3	0	0	0	0	113	Q939 C958 I989	Q939-T941 PolarHBondContact O-OG1 3.46Å; T941-C958 PolarHBondContact N-O 3.17Å; T941-I989 VanDerWaalsContact CG2-O 3.25Å; T941-I989 WeakPolarHBondContact CG2-O 3.42Å
942	C	90.5	Very high	64.2	Low	19 Å²	19	71.9 Å²	71.9	13%	0.128	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	168.7	174.9	56.8	0	0	0	0	111.8	C958	C942-C958 PolarHBondContact N-O 3.41Å; C942-C958 PolarHBondContact O-N 3.2Å
943	A	91.8	Very high	66.4	Low	21 Å²	21	61.9 Å²	61.9	17%	0.174	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	160.9	175.3	0	0	0	0	0	111.2	V955 W956 M957 F1338 V1340	A943-V955 HydrophobicContact CB-CG1 4.23Å; A943-W956 CarbonylContact C-O 3.49Å; A943-W956 WeakPolarHBondContact CA-O 3.47Å; A943-W956 WeakPolarHBondContact CB-O 3.44Å; A943-M957 HydrophobicContact CB-CG 4.07Å; A943-F1338 HydrophobicContact CB-CB 4.36Å; A943-F1338 HydrophobicContact CB-CD1 4Å; A943-F1338 HydrophobicContact CB-CD2 3.44Å; A943-F1338 VanDerWaalsContact CB-CD2 3.44Å; A943-F1338 HydrophobicContact CB-CE1 4.08Å; A943-F1338 HydrophobicContact CB-CE2 3.55Å; A943-F1338 HydrophobicContact CB-CG 3.68Å; A943-F1338 HydrophobicContact CB-CZ 3.86Å; A943-V1340 HydrophobicContact CB-CB 4.36Å; A943-V1340 HydrophobicContact CB-CG1 4.18Å
944	T	89.9	Confident	69	Low	28 Å²	28	52.8 Å²	52.8	17%	0.172	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	144.3	172.8	-165.5	0	0	0	0	110.6	W956 L992 T1086	T944-W956 HydrophobicContact CG2-CB 4Å; T944-W956 PolarHBondContact N-O 3.17Å; T944-W956 PolarHBondContact O-N 3.5Å; T944-L992 HydrophobicContact CG2-CB 3.89Å; T944-L992 HydrophobicContact CG2-CD1 4.31Å; T944-L992 HydrophobicContact CG2-CD2 4.28Å; T944-L992 HydrophobicContact CG2-CG 4.42Å; T944-T1086 HydrophobicContact CG2-CG2 4.23Å
945	S	87.2	Confident	71.7	Confident	41 Å²	41	45.6 Å²	45.6	29%	0.287	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	140.7	177.9	41.4	0	0	0	0	111.5	Y994 S1341	S945-Y994 WeakPolarHBondContact O-CB 3.42Å; S945-Y994 WeakPolarHBondContact O-CD1 3.15Å; S945-S1341 VanDerWaalsContact CB-O 3.26Å; S945-S1341 WeakPolarHBondContact CB-O 3.38Å; S945-S1341 PolarHBondContact OG-O 3.1Å
946	S	78.7	Confident	74	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.042	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146.2	-178.1	67.2	0	0	0	0	111.1	D954 W956 Y994	S946-D954 WeakPolarHBondContact CA-O 3.46Å; S946-D954 PolarHBondContact N-O 3.25Å; S946-D954 PolarHBondContact O-N 3.36Å; S946-D954 VanDerWaalsContact O-O 3.13Å; S946-D954 PolarHBondContact OG-O 3.45Å; S946-W956 VanDerWaalsContact OG-CD1 3.26Å; S946-W956 PolarHBondContact OG-NE1 3.15Å; S946-Y994 VanDerWaalsContact CB-CD2 3.47Å
947	W	70	Confident	76	Confident	65 Å²	65	36.8 Å²	36.8	25%	0.246	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	111.8	-177.4	-165.8	88.8	0	0	0	109.7	Y994 L1026	W947-Y994 PolarHBondContact O-OH 3.15Å; W947-L1026 HydrophobicContact CD2-CD1 4.12Å; W947-L1026 HydrophobicContact CE3-CD1 3.66Å; W947-L1026 HydrophobicContact CH2-CD1 3.53Å; W947-L1026 HydrophobicContact CH2-CD2 4.41Å; W947-L1026 HydrophobicContact CH2-CG 3.73Å; W947-L1026 HydrophobicContact CZ2-CD1 3.98Å; W947-L1026 HydrophobicContact CZ2-CD2 4.05Å; W947-L1026 HydrophobicContact CZ2-CG 3.87Å; W947-L1026 HydrophobicContact CZ3-CD1 3.35Å; W947-L1026 HydrophobicContact CZ3-CG 4.11Å
948	S	62.8	Low	77.5	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.007	16%	0.155	C	C	.	.			trans	-80.7	151	179.9	66.1	0	0	0	0	111.6	N950 G951 I952	S948-N950 PolarHBondContact O-N 3.45Å; S948-G951 PolarHBondContact O-N 2.97Å; S948-I952 PolarHBondContact N-O 2.95Å; S948-I952 VanDerWaalsContact N-O 3.07Å; S948-I952 WeakPolarHBondContact OG-CA 3.48Å; S948-I952 WeakPolarHBondContact OG-CB 3.41Å; S948-I952 PolarHBondContact OG-N 2.92Å; S948-I952 VanDerWaalsContact OG-N 3.07Å; S948-I952 PolarHBondContact OG-O 3.21Å
949	M	55.3	Low	78.5	Confident	116 Å²	116	27.9 Å²	27.9	57%	0.571	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-19.3	173.6	-80.2	-77.3	168.7	0	0	113.8	G951 P997	M949-G951 VanDerWaalsContact C-N 3.26Å; M949-G951 PolarHBondContact O-N 3.44Å; M949-P997 HydrophobicContact CE-CB 4.5Å; M949-P997 HydrophobicContact CE-CG 3.69Å; M949-P997 HydrophobicContact CG-CG 4.49Å
950	N	60	Low	78.7	Confident	124 Å²	124	25.5 Å²	25.5	66%	0.663	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	2.6	177.3	-61.6	-27.4	0	0	0	113.4	S948 I952	S948-N950 PolarHBondContact O-N 3.45Å; N950-I952 VanDerWaalsContact C-N 3.27Å; N950-I952 HydrophobicContact CB-CD1 4.32Å; N950-I952 HydrophobicContact CB-CG1 4.12Å; N950-I952 PolarHBondContact O-N 3.37Å
951	G	62.4	Low	78.4	Confident	14 Å²	14	27.5 Å²	27.5	14%	0.144	15%	0.153	C	C	.	.	S	Bend	trans	81.1	-0.9	-177.4	0	0	0	0	0	114.7	S948 M949 C953	S948-G951 PolarHBondContact O-N 2.97Å; M949-G951 VanDerWaalsContact C-N 3.26Å; M949-G951 PolarHBondContact O-N 3.44Å; G951-C953 PolarHBondContact O-N 3.2Å
952	I	65.1	Low	77.7	Confident	50 Å²	50	35.1 Å²	35.1	26%	0.256	19%	0.186	S	C	.	.			trans	-78.7	121.9	178.7	-38.6	175.3	0	0	0	109.1	S948 N950 D954 S971 H973 R1100	S948-I952 PolarHBondContact N-O 2.95Å; S948-I952 VanDerWaalsContact N-O 3.07Å; S948-I952 WeakPolarHBondContact OG-CA 3.48Å; S948-I952 WeakPolarHBondContact OG-CB 3.41Å; S948-I952 PolarHBondContact OG-N 2.92Å; S948-I952 VanDerWaalsContact OG-N 3.07Å; S948-I952 PolarHBondContact OG-O 3.21Å; N950-I952 VanDerWaalsContact C-N 3.27Å; N950-I952 HydrophobicContact CB-CD1 4.32Å; N950-I952 HydrophobicContact CB-CG1 4.12Å; N950-I952 PolarHBondContact O-N 3.37Å; I952-D954 WeakPolarHBondContact CG2-OD1 3.32Å; I952-S971 WeakPolarHBondContact CG2-OG 3.41Å; I952-H973 HydrophobicContact CG2-CB 4.34Å; I952-R1100 PolarHBondContact O-NH1 3.03Å
953	C	74.8	Confident	77.1	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.027	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	120.7	178	-52.5	0	0	0	0	110	G951 L972 I1342 D1343 V1344	G951-C953 PolarHBondContact O-N 3.2Å; C953-L972 PolarHBondContact O-N 2.97Å; C953-I1342 HydrophobicContact CB-CD1 3.78Å; C953-I1342 HydrophobicContact CB-CG1 3.86Å; C953-D1343 PolarHBondContact SG-O 3.16Å; C953-V1344 HydrophobicContact CB-CG2 4.46Å
954	D	79.2	Confident	76.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149.7	-177.9	-78	45.6	0	0	0	111.5	S946 I952 L969 L970 S971 R1100	S946-D954 WeakPolarHBondContact CA-O 3.46Å; S946-D954 PolarHBondContact N-O 3.25Å; S946-D954 PolarHBondContact O-N 3.36Å; S946-D954 VanDerWaalsContact O-O 3.13Å; S946-D954 PolarHBondContact OG-O 3.45Å; I952-D954 WeakPolarHBondContact CG2-OD1 3.32Å; D954-L969 HydrophobicContact CB-CD1 3.73Å; D954-L969 HydrophobicContact CB-CG 4.34Å; D954-L969 WeakPolarHBondContact OD2-CD2 3.41Å; D954-L969 WeakPolarHBondContact OD2-CG 3.26Å; D954-L970 CarbonylContact C-O 3.54Å; D954-L970 VanDerWaalsContact CA-O 3.24Å; D954-L970 WeakPolarHBondContact CA-O 3.46Å; D954-S971 VanDerWaalsContact CG-OG 3.28Å; D954-S971 WeakPolarHBondContact OD1-CB 3.13Å; D954-S971 PolarHBondContact OD1-OG 3Å; D954-S971 VanDerWaalsContact OD2-CB 3.26Å; D954-S971 WeakPolarHBondContact OD2-CB 3.35Å; D954-S971 PolarHBondContact OD2-OG 2.77Å; D954-R1100 IonicContact OD1-CZ 3.89Å; D954-R1100 IonicContact OD1-NH1 2.73Å; D954-R1100 PolarHBondContact OD1-NH1 3.02Å; D954-R1100 IonicContact OD1-NH2 3.3Å; D954-R1100 PolarHBondContact OD1-NH2 3.47Å; D954-R1100 IonicContact OD2-CZ 3.79Å; D954-R1100 VanDerWaalsContact OD2-CZ 3.26Å; D954-R1100 IonicContact OD2-NH1 3.8Å; D954-R1100 PolarHBondContact OD2-NH1 3.15Å; D954-R1100 IonicContact OD2-NH2 3.71Å; D954-R1100 PolarHBondContact OD2-NH2 3.46Å
955	V	85.2	Confident	76.1	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.5	172.8	180	0	0	0	0	109.4	A943 M957 L970 V1340 I1342 I1383	A943-V955 HydrophobicContact CB-CG1 4.23Å; V955-M957 HydrophobicContact CG1-CG 3.91Å; V955-L970 HydrophobicContact CB-CB 4.31Å; V955-L970 HydrophobicContact CB-CD2 4.36Å; V955-L970 PolarHBondContact N-O 3.44Å; V955-L970 PolarHBondContact O-N 3.36Å; V955-V1340 HydrophobicContact CG1-CG1 3.66Å; V955-V1340 HydrophobicContact CG1-CG2 4.28Å; V955-V1340 HydrophobicContact CG2-CG1 4.37Å; V955-I1342 HydrophobicContact CG2-CD1 3.63Å; V955-I1342 HydrophobicContact CG2-CG2 4.4Å; V955-I1383 HydrophobicContact CG2-CD1 4.12Å
956	W	85.8	Confident	75.7	Confident	4 Å²	4	39 Å²	39	2%	0.015	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	136	166.8	-67.3	74.9	0	0	0	108.9	A943 T944 S946 V967 F968 L969 F983 L992 T1086 R1100	A943-W956 CarbonylContact C-O 3.49Å; A943-W956 WeakPolarHBondContact CA-O 3.47Å; A943-W956 WeakPolarHBondContact CB-O 3.44Å; T944-W956 HydrophobicContact CG2-CB 4Å; T944-W956 PolarHBondContact N-O 3.17Å; T944-W956 PolarHBondContact O-N 3.5Å; S946-W956 VanDerWaalsContact OG-CD1 3.26Å; S946-W956 PolarHBondContact OG-NE1 3.15Å; W956-V967 HydrophobicContact CE3-CG1 3.73Å; W956-V967 HydrophobicContact CZ3-CG1 4.23Å; W956-F968 WeakPolarHBondContact CA-O 3.2Å; W956-L969 HydrophobicContact CD2-CD1 3.84Å; W956-L969 HydrophobicContact CG-CD1 3.97Å; W956-L969 HydrophobicContact CZ2-CD1 4.16Å; W956-F983 HydrophobicContact CH2-CE2 4.34Å; W956-F983 HydrophobicContact CH2-CZ 4.26Å; W956-F983 AromaticContact CZ3-CE2 3.76Å; W956-F983 HydrophobicContact CZ3-CE2 3.76Å; W956-F983 HydrophobicContact CZ3-CZ 4.05Å; W956-L992 HydrophobicContact CB-CD1 4.48Å; W956-T1086 HydrophobicContact CB-CG2 4.15Å; W956-T1086 HydrophobicContact CD2-CG2 3.77Å; W956-T1086 HydrophobicContact CE3-CG2 3.96Å; W956-T1086 HydrophobicContact CG-CG2 3.86Å; W956-T1086 PolarHBondContact NE1-OG1 3.35Å; W956-T1086 VanDerWaalsContact NE1-OG1 3.13Å; W956-R1100 HydrophobicContact CZ2-CB 4.18Å
957	M	86.6	Confident	75.8	Confident	7 Å²	7	38.7 Å²	38.7	3%	0.034	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.7	-176.9	-67.2	170.4	28.7	0	0	110.4	F940 A943 V955 V967 F968 L970 F1338 L1413	F940-M957 HydrophobicContact CD1-CE 4.07Å; F940-M957 HydrophobicContact CE1-CE 3.28Å; F940-M957 HydrophobicContact CE2-CE 4.31Å; F940-M957 HydrophobicContact CZ-CE 3.43Å; F940-M957 VanDerWaalsContact CZ-CE 3.43Å; A943-M957 HydrophobicContact CB-CG 4.07Å; V955-M957 HydrophobicContact CG1-CG 3.91Å; M957-V967 CarbonylContact O-C 3.59Å; M957-V967 WeakPolarHBondContact O-CA 3.44Å; M957-F968 HydrophobicContact CB-CB 4.49Å; M957-F968 PolarHBondContact N-O 2.99Å; M957-F968 PolarHBondContact O-N 3.45Å; M957-L970 HydrophobicContact SD-CB 4.35Å; M957-F1338 HydrophobicContact CE-CZ 4.18Å; M957-F1338 HydrophobicContact CG-CE1 4.47Å; M957-F1338 HydrophobicContact CG-CZ 3.91Å; M957-F1338 HydrophobicContact SD-CZ 4.04Å; M957-L1413 HydrophobicContact CE-CD1 3.86Å; M957-L1413 HydrophobicContact CE-CD2 3.62Å; M957-L1413 HydrophobicContact CE-CG 4.16Å; M957-L1413 HydrophobicContact SD-CD1 3.71Å; M957-L1413 HydrophobicContact SD-CD2 3.75Å; M957-L1413 HydrophobicContact SD-CG 4.36Å
958	C	86.5	Confident	76.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.3	175.6	-69	0	0	0	0	112	T941 C942 Q966 I989 L992	T941-C958 PolarHBondContact N-O 3.17Å; C942-C958 PolarHBondContact N-O 3.41Å; C942-C958 PolarHBondContact O-N 3.2Å; C958-Q966 CarbonylContact C-O 3.44Å; C958-Q966 VanDerWaalsContact CA-O 3.29Å; C958-Q966 WeakPolarHBondContact CA-O 3.5Å; C958-I989 HydrophobicContact CB-CB 4.31Å; C958-I989 HydrophobicContact CB-CD1 3.86Å; C958-I989 HydrophobicContact CB-CG2 3.93Å; C958-L992 HydrophobicContact CB-CD1 4.2Å; C958-L992 WeakPolarHBondContact SG-CD1 3.14Å; C958-L992 VanDerWaalsContact SG-CG 3.59Å
959	S	83.6	Confident	76.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	156.4	159.9	-171.5	0	0	0	0	109.9	F938 Q939 G965 Q966	F938-S959 WeakPolarHBondContact CB-OG 3.45Å; Q939-S959 PolarHBondContact N-OG 2.81Å; Q939-S959 VanDerWaalsContact O-CA 3.26Å; Q939-S959 WeakPolarHBondContact O-CA 3.09Å; Q939-S959 WeakPolarHBondContact O-CB 3.23Å; Q939-S959 PolarHBondContact O-OG 3.47Å; S959-G965 WeakPolarHBondContact O-CA 2.77Å; S959-Q966 PolarHBondContact N-O 2.92Å; S959-Q966 PolarHBondContact O-N 3.24Å
960	S	83.5	Confident	77.9	Confident	4 Å²	4	31 Å²	31	3%	0.028	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	157.3	172.1	-65.7	0	0	0	0	110.6	Q939 S964 G965 I989	Q939-S960 PolarHBondContact N-O 3.28Å; Q939-S960 PolarHBondContact O-N 3.42Å; Q939-S960 VanDerWaalsContact O-N 3.15Å; S960-S964 VanDerWaalsContact CA-O 3.28Å; S960-S964 WeakPolarHBondContact CA-O 3.41Å; S960-S964 WeakPolarHBondContact CB-O 3.49Å; S960-G965 WeakPolarHBondContact OG-CA 3.28Å; S960-I989 WeakPolarHBondContact OG-CB 3.42Å; S960-I989 PolarHBondContact OG-N 2.98Å
961	D	79.4	Confident	78.7	Confident	45 Å²	45	25.6 Å²	25.6	24%	0.241	13%	0.133	C	C	.	.			trans	-111.2	-149.1	164.6	66.5	14.6	0	0	0	109.3	F938 M963 S964 R988	F938-D961 HydrophobicContact CD1-CB 3.93Å; F938-D961 HydrophobicContact CE1-CB 3.84Å; D961-M963 PolarHBondContact OD1-N 2.99Å; D961-S964 PolarHBondContact N-O 2.86Å; D961-S964 PolarHBondContact OD1-N 2.83Å; D961-S964 PolarHBondContact OD1-OG 3.4Å; D961-S964 PolarHBondContact OD2-OG 2.87Å; D961-R988 WeakPolarHBondContact O-CD 3.39Å
962	Q	74.3	Confident	79	Confident	188 Å²	188	25.7 Å²	25.7	88%	0.879	13%	0.13	S	C	*	.	S	Bend	trans	-86.8	-11.3	178.9	-62.5	-178.1	21.2	0	0	113.7
963	M	76.3	Confident	78.9	Confident	148 Å²	148	27.3 Å²	27.3	73%	0.729	14%	0.136	S	C	*	.	S	Bend	trans	-123.8	-24.1	-170.3	-62.8	-59.1	-58.6	0	0	112.9	D961 N986 S987	D961-M963 PolarHBondContact OD1-N 2.99Å; M963-N986 CarbonylContact O-C 3.58Å; M963-S987 PolarHBondContact O-N 2.98Å
964	S	80.9	Confident	77.9	Confident	24 Å²	24	33 Å²	33	17%	0.168	17%	0.173	C	C	.	.			trans	-149.7	160	-167.6	64.6	0	0	0	0	112.9	F938 S960 D961 C985 S987	F938-S964 WeakPolarHBondContact CE1-OG 3.46Å; F938-S964 VanDerWaalsContact CZ-OG 3.31Å; F938-S964 WeakPolarHBondContact CZ-OG 3.35Å; S960-S964 VanDerWaalsContact CA-O 3.28Å; S960-S964 WeakPolarHBondContact CA-O 3.41Å; S960-S964 WeakPolarHBondContact CB-O 3.49Å; D961-S964 PolarHBondContact N-O 2.86Å; D961-S964 PolarHBondContact OD1-N 2.83Å; D961-S964 PolarHBondContact OD1-OG 3.4Å; D961-S964 PolarHBondContact OD2-OG 2.87Å; S964-C985 CarbonylContact C-O 3.59Å; S964-C985 VanDerWaalsContact CA-O 3.27Å; S964-C985 WeakPolarHBondContact CA-O 3.43Å; S964-S987 CarbonylContact C-O 3.52Å
965	G	80.8	Confident	76.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.1	177.3	0	0	0	0	0	111.8	S959 S960 L984 C985 S987	S959-G965 WeakPolarHBondContact O-CA 2.77Å; S960-G965 WeakPolarHBondContact OG-CA 3.28Å; G965-L984 WeakPolarHBondContact O-CA 3.23Å; G965-C985 PolarHBondContact N-O 2.69Å; G965-C985 PolarHBondContact O-N 3.31Å; G965-S987 PolarHBondContact N-O 3.16Å; G965-S987 VanDerWaalsContact N-O 3.09Å
966	Q	79.4	Confident	75.6	Confident	19 Å²	19	40.6 Å²	40.6	9%	0.089	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	129.6	176.5	-66.1	-172.6	-18.6	0	0	109.4	F938 C958 S959 F968 F983 L984	F938-Q966 VanDerWaalsContact CE2-CD 3.42Å; F938-Q966 HydrophobicContact CE2-CG 4.16Å; F938-Q966 VanDerWaalsContact CE2-NE2 3.29Å; F938-Q966 HydrophobicContact CZ-CG 4.06Å; C958-Q966 CarbonylContact C-O 3.44Å; C958-Q966 VanDerWaalsContact CA-O 3.29Å; C958-Q966 WeakPolarHBondContact CA-O 3.5Å; S959-Q966 PolarHBondContact N-O 2.92Å; S959-Q966 PolarHBondContact O-N 3.24Å; Q966-F968 HydrophobicContact CB-CE1 4.21Å; Q966-F968 HydrophobicContact CB-CE2 3.85Å; Q966-F968 HydrophobicContact CB-CZ 3.47Å; Q966-F968 VanDerWaalsContact CB-CZ 3.47Å; Q966-F968 HydrophobicContact CG-CZ 4.48Å; Q966-F983 WeakPolarHBondContact CA-O 3.33Å; Q966-L984 HydrophobicContact CG-CD2 3.87Å
967	V	79.6	Confident	74.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	148.4	173.6	-165.7	0	0	0	0	109.2	W956 M957 F983 I989 V1088	W956-V967 HydrophobicContact CE3-CG1 3.73Å; W956-V967 HydrophobicContact CZ3-CG1 4.23Å; M957-V967 CarbonylContact O-C 3.59Å; M957-V967 WeakPolarHBondContact O-CA 3.44Å; V967-F983 HydrophobicContact CB-CB 4.01Å; V967-F983 HydrophobicContact CB-CD2 3.83Å; V967-F983 HydrophobicContact CB-CG 4.32Å; V967-F983 HydrophobicContact CG1-CD2 4.33Å; V967-F983 HydrophobicContact CG2-CB 4.07Å; V967-F983 PolarHBondContact N-O 3.47Å; V967-I989 HydrophobicContact CG2-CD1 3.86Å; V967-V1088 HydrophobicContact CG2-CG2 3.98Å
968	F	76.6	Confident	73.1	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.026	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	160.6	179.6	-48	-80.9	0	0	0	111	F920 W956 M957 Q966	F920-F968 HydrophobicContact CB-CE1 4.12Å; F920-F968 AromaticContact CD2-CE1 3.53Å; F920-F968 HydrophobicContact CD2-CE1 3.53Å; F920-F968 AromaticContact CD2-CZ 3.44Å; F920-F968 HydrophobicContact CD2-CZ 3.44Å; F920-F968 VanDerWaalsContact CD2-CZ 3.44Å; F920-F968 HydrophobicContact CE2-CE1 4.31Å; F920-F968 AromaticContact CE2-CZ 3.76Å; F920-F968 HydrophobicContact CE2-CZ 3.76Å; F920-F968 HydrophobicContact CG-CE1 4.13Å; F920-F968 HydrophobicContact CG-CZ 4.26Å; W956-F968 WeakPolarHBondContact CA-O 3.2Å; M957-F968 HydrophobicContact CB-CB 4.49Å; M957-F968 PolarHBondContact N-O 2.99Å; M957-F968 PolarHBondContact O-N 3.45Å; Q966-F968 HydrophobicContact CB-CE1 4.21Å; Q966-F968 HydrophobicContact CB-CE2 3.85Å; Q966-F968 HydrophobicContact CB-CZ 3.47Å; Q966-F968 VanDerWaalsContact CB-CZ 3.47Å; Q966-F968 HydrophobicContact CG-CZ 4.48Å
969	L	78.3	Confident	71.8	Confident	13 Å²	13	49.5 Å²	49.5	7%	0.068	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	121.7	178.4	-171.4	68	0	0	0	110.5	D954 W956 L979	D954-L969 HydrophobicContact CB-CD1 3.73Å; D954-L969 HydrophobicContact CB-CG 4.34Å; D954-L969 WeakPolarHBondContact OD2-CD2 3.41Å; D954-L969 WeakPolarHBondContact OD2-CG 3.26Å; W956-L969 HydrophobicContact CD2-CD1 3.84Å; W956-L969 HydrophobicContact CG-CD1 3.97Å; W956-L969 HydrophobicContact CZ2-CD1 4.16Å; L969-L979 HydrophobicContact CB-CB 4.21Å; L969-L979 HydrophobicContact CD2-CB 4.38Å; L969-L979 HydrophobicContact CD2-CD1 4.02Å; L969-L979 HydrophobicContact CG-CB 4.5Å; L969-L979 PolarHBondContact N-O 2.83Å; L969-L979 CarbonylContact O-C 3.51Å; L969-L979 WeakPolarHBondContact O-CA 3.43Å; L969-L979 PolarHBondContact O-N 3.4Å
970	L	78.8	Confident	70.5	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	113.5	172.3	174.5	78.7	0	0	0	108.2	I911 D954 V955 M957 L972 V976 V978 I1383 L1413	I911-L970 HydrophobicContact CD1-CD1 3.95Å; D954-L970 CarbonylContact C-O 3.54Å; D954-L970 VanDerWaalsContact CA-O 3.24Å; D954-L970 WeakPolarHBondContact CA-O 3.46Å; V955-L970 HydrophobicContact CB-CB 4.31Å; V955-L970 HydrophobicContact CB-CD2 4.36Å; V955-L970 PolarHBondContact N-O 3.44Å; V955-L970 PolarHBondContact O-N 3.36Å; M957-L970 HydrophobicContact SD-CB 4.35Å; L970-L972 HydrophobicContact CD2-CD2 3.81Å; L970-L972 HydrophobicContact CG-CD2 3.95Å; L970-V976 HydrophobicContact CD1-CG1 3.89Å; L970-V976 HydrophobicContact CG-CG1 4.45Å; L970-V978 HydrophobicContact CD1-CG2 3.46Å; L970-V978 VanDerWaalsContact CD1-CG2 3.46Å; L970-I1383 HydrophobicContact CD2-CD1 3.55Å; L970-L1413 HydrophobicContact CD1-CD1 4.45Å; L970-L1413 HydrophobicContact CD2-CD1 4.27Å
971	S	75.7	Confident	69.1	Low	11 Å²	11	53.1 Å²	53.1	8%	0.077	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	140.3	173.2	-161.6	0	0	0	0	110.4	I952 D954 V976 D977	I952-S971 WeakPolarHBondContact CG2-OG 3.41Å; D954-S971 VanDerWaalsContact CG-OG 3.28Å; D954-S971 WeakPolarHBondContact OD1-CB 3.13Å; D954-S971 PolarHBondContact OD1-OG 3Å; D954-S971 VanDerWaalsContact OD2-CB 3.26Å; D954-S971 WeakPolarHBondContact OD2-CB 3.35Å; D954-S971 PolarHBondContact OD2-OG 2.77Å; S971-V976 WeakPolarHBondContact O-CA 3.28Å; S971-D977 PolarHBondContact N-O 3.24Å; S971-D977 PolarHBondContact O-N 3.45Å
972	L	69	Low	68.2	Low	16 Å²	16	53.2 Å²	53.2	8%	0.084	28%	0.28	C	S	.	.			trans	-101	3.5	-174.7	-56.9	-174.9	0	0	0	114.3	C953 L970 V976 I1342 V1344 I1383	C953-L972 PolarHBondContact O-N 2.97Å; L970-L972 HydrophobicContact CD2-CD2 3.81Å; L970-L972 HydrophobicContact CG-CD2 3.95Å; L972-V976 HydrophobicContact CB-CG2 4.27Å; L972-V976 HydrophobicContact CD2-CB 4.28Å; L972-V976 HydrophobicContact CD2-CG1 3.65Å; L972-V976 HydrophobicContact CD2-CG2 3.85Å; L972-I1342 HydrophobicContact CD1-CB 4.38Å; L972-I1342 HydrophobicContact CD1-CD1 3.83Å; L972-I1342 HydrophobicContact CD1-CG1 4.14Å; L972-I1342 HydrophobicContact CD1-CG2 3.41Å; L972-I1342 VanDerWaalsContact CD1-CG2 3.41Å; L972-V1344 HydrophobicContact CD1-CG2 4.18Å; L972-I1383 HydrophobicContact CD1-CD1 4.49Å; L972-I1383 HydrophobicContact CD2-CD1 4.11Å
973	H	62.6	Low	67.7	Low	83 Å²	83	44.8 Å²	44.8	38%	0.384	24%	0.241	S	C	.	.	S	Bend	trans	-145.9	134.9	-170.6	-162.4	76.6	0	0	0	111.9	I952 H1347	I952-H973 HydrophobicContact CG2-CB 4.34Å; H973-H1347 AromaticContact CE1-CD2 3.78Å
974	P	53.1	Low	67.2	Low	124 Å²	124	42.9 Å²	42.9	81%	0.805	23%	0.233	S	C	*	.	S	Bend	cis	-81.3	-28.1	2.1	32.3	-35.4	0	0	0	114.2
975	E	55.8	Low	66.8	Low	123 Å²	123	41.8 Å²	41.8	58%	0.575	23%	0.225	S	C	*	.	S	Bend	trans	-106.1	155.5	161.5	-84.8	-165.9	-155.3	0	0	109.3	K924 D977	K924-E975 IonicContact NZ-OE2 2.79Å; K924-E975 PolarHBondContact NZ-OE2 3.44Å; E975-D977 PolarHBondContact O-N 3.17Å
976	V	61.9	Low	66.8	Low	37 Å²	37	48.9 Å²	48.9	22%	0.224	26%	0.263	C	S	.	.			trans	-76.6	108.7	173.1	175.6	0	0	0	0	109.9	K909 I911 L970 S971 L972 I1415	K909-V976 PolarHBondContact NZ-O 3.21Å; I911-V976 HydrophobicContact CD1-CG1 3.82Å; L970-V976 HydrophobicContact CD1-CG1 3.89Å; L970-V976 HydrophobicContact CG-CG1 4.45Å; S971-V976 WeakPolarHBondContact O-CA 3.28Å; L972-V976 HydrophobicContact CB-CG2 4.27Å; L972-V976 HydrophobicContact CD2-CB 4.28Å; L972-V976 HydrophobicContact CD2-CG1 3.65Å; L972-V976 HydrophobicContact CD2-CG2 3.85Å; V976-I1415 HydrophobicContact CG1-CD1 3.8Å
977	D	59	Low	67.1	Low	91 Å²	91	48.8 Å²	48.8	49%	0.487	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	152.7	-174.9	-160.5	7.4	0	0	0	112.2	S971 E975	S971-D977 PolarHBondContact N-O 3.24Å; S971-D977 PolarHBondContact O-N 3.45Å; E975-D977 PolarHBondContact O-N 3.17Å
978	V	59.2	Low	67.4	Low	28 Å²	28	52.9 Å²	52.9	17%	0.17	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	108.1	-179.2	174	0	0	0	0	110.1	V922 L970 N980	V922-V978 HydrophobicContact CG2-CB 3.66Å; V922-V978 HydrophobicContact CG2-CG1 4.24Å; V922-V978 HydrophobicContact CG2-CG2 3.64Å; L970-V978 HydrophobicContact CD1-CG2 3.46Å; L970-V978 VanDerWaalsContact CD1-CG2 3.46Å; V978-N980 PolarHBondContact O-N 3.25Å
979	L	60.3	Low	68.1	Low	79 Å²	79	52.6 Å²	52.6	41%	0.414	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	92.3	169.4	-62.1	175.7	0	0	0	108.4	L969 V981	L969-L979 HydrophobicContact CB-CB 4.21Å; L969-L979 HydrophobicContact CD2-CB 4.38Å; L969-L979 HydrophobicContact CD2-CD1 4.02Å; L969-L979 HydrophobicContact CG-CB 4.5Å; L969-L979 PolarHBondContact N-O 2.83Å; L969-L979 CarbonylContact O-C 3.51Å; L969-L979 WeakPolarHBondContact O-CA 3.43Å; L969-L979 PolarHBondContact O-N 3.4Å; L979-V981 PolarHBondContact O-N 2.93Å
980	N	55.1	Low	68.6	Low	46 Å²	46	53.3 Å²	53.3	25%	0.246	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	89.7	-178.9	179.9	32.4	0	0	0	111.6	F920 V978 N982	F920-N980 PolarHBondContact N-OD1 3.4Å; F920-N980 WeakPolarHBondContact O-CB 3.16Å; F920-N980 PolarHBondContact O-ND2 3.31Å; F920-N980 PolarHBondContact O-OD1 2.94Å; V978-N980 PolarHBondContact O-N 3.25Å; N980-N982 VanDerWaalsContact CG-ND2 3.34Å; N980-N982 PolarHBondContact ND2-ND2 2.82Å; N980-N982 PolarHBondContact OD1-ND2 3.48Å; N980-N982 PolarHBondContact OD1-OD1 3.08Å
981	V	55.3	Low	69.2	Low	33 Å²	33	53.8 Å²	53.8	20%	0.2	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	94.9	178.1	-171.8	0	0	0	0	109.1	L979 F983 G1107	L979-V981 PolarHBondContact O-N 2.93Å; V981-F983 VanDerWaalsContact C-N 3.34Å; V981-F983 HydrophobicContact CB-CD2 4.24Å; V981-F983 HydrophobicContact CB-CE2 3.77Å; V981-F983 HydrophobicContact CB-CZ 4.38Å; V981-F983 HydrophobicContact CG1-CD2 3.89Å; V981-F983 HydrophobicContact CG1-CE1 4.16Å; V981-F983 HydrophobicContact CG1-CE2 3.37Å; V981-F983 HydrophobicContact CG1-CG 4.5Å; V981-F983 HydrophobicContact CG1-CZ 3.55Å; V981-F983 WeakPolarHBondContact O-CD2 3.5Å; V981-F983 PolarHBondContact O-N 3.14Å; V981-G1107 VanDerWaalsContact CG1-CA 3.49Å
982	N	59.7	Low	70	Confident	48 Å²	48	54 Å²	54	26%	0.257	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	75.9	-169.9	-64.5	-88.1	0	0	0	112.7	G919 N980 L984	G919-N982 WeakPolarHBondContact CA-OD1 3.39Å; N980-N982 VanDerWaalsContact CG-ND2 3.34Å; N980-N982 PolarHBondContact ND2-ND2 2.82Å; N980-N982 PolarHBondContact OD1-ND2 3.48Å; N980-N982 PolarHBondContact OD1-OD1 3.08Å; N982-L984 PolarHBondContact O-N 3.04Å
983	F	64.3	Low	70.9	Confident	11 Å²	11	53.8 Å²	53.8	5%	0.048	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	115.8	167.5	-51.9	-90.2	0	0	0	109.2	W956 Q966 V967 V981 Y1098 G1107	W956-F983 HydrophobicContact CH2-CE2 4.34Å; W956-F983 HydrophobicContact CH2-CZ 4.26Å; W956-F983 AromaticContact CZ3-CE2 3.76Å; W956-F983 HydrophobicContact CZ3-CE2 3.76Å; W956-F983 HydrophobicContact CZ3-CZ 4.05Å; Q966-F983 WeakPolarHBondContact CA-O 3.33Å; V967-F983 HydrophobicContact CB-CB 4.01Å; V967-F983 HydrophobicContact CB-CD2 3.83Å; V967-F983 HydrophobicContact CB-CG 4.32Å; V967-F983 HydrophobicContact CG1-CD2 4.33Å; V967-F983 HydrophobicContact CG2-CB 4.07Å; V967-F983 PolarHBondContact N-O 3.47Å; V981-F983 VanDerWaalsContact C-N 3.34Å; V981-F983 HydrophobicContact CB-CD2 4.24Å; V981-F983 HydrophobicContact CB-CE2 3.77Å; V981-F983 HydrophobicContact CB-CZ 4.38Å; V981-F983 HydrophobicContact CG1-CD2 3.89Å; V981-F983 HydrophobicContact CG1-CE1 4.16Å; V981-F983 HydrophobicContact CG1-CE2 3.37Å; V981-F983 HydrophobicContact CG1-CG 4.5Å; V981-F983 HydrophobicContact CG1-CZ 3.55Å; V981-F983 WeakPolarHBondContact O-CD2 3.5Å; V981-F983 PolarHBondContact O-N 3.14Å; F983-Y1098 HydrophobicContact CB-CE1 3.99Å; F983-Y1098 AromaticContact CD1-CD1 3.27Å; F983-Y1098 HydrophobicContact CD1-CD1 3.27Å; F983-Y1098 AromaticContact CD1-CE1 3.16Å; F983-Y1098 HydrophobicContact CD1-CE1 3.16Å; F983-Y1098 HydrophobicContact CD1-CG 4.26Å; F983-Y1098 AromaticContact CE1-CD1 3.24Å; F983-Y1098 HydrophobicContact CE1-CD1 3.24Å; F983-Y1098 AromaticContact CE1-CE1 3.68Å; F983-Y1098 HydrophobicContact CE1-CE1 3.68Å; F983-Y1098 HydrophobicContact CE1-CG 4.11Å; F983-Y1098 HydrophobicContact CG-CD1 4.04Å; F983-Y1098 AromaticContact CG-CE1 3.8Å; F983-Y1098 HydrophobicContact CG-CE1 3.8Å; F983-Y1098 HydrophobicContact CZ-CD1 4.03Å; F983-G1107 VanDerWaalsContact CD1-C 3.47Å; F983-G1107 WeakPolarHBondContact CD1-O 3.42Å; F983-G1107 WeakPolarHBondContact CE1-O 3.26Å
984	L	65.6	Low	72	Confident	108 Å²	108	51.1 Å²	51.1	57%	0.565	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	113.1	-177.3	-85.1	160	0	0	0	111.7	G965 Q966 N982	G965-L984 WeakPolarHBondContact O-CA 3.23Å; Q966-L984 HydrophobicContact CG-CD2 3.87Å; N982-L984 PolarHBondContact O-N 3.04Å
985	C	72.7	Confident	73.4	Confident	1 Å²	1	46 Å²	46	1%	0.007	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	131.2	170.8	-50.9	0	0	0	0	109.5	S964 G965 S987 I989 Q1096	S964-C985 CarbonylContact C-O 3.59Å; S964-C985 VanDerWaalsContact CA-O 3.27Å; S964-C985 WeakPolarHBondContact CA-O 3.43Å; G965-C985 PolarHBondContact N-O 2.69Å; G965-C985 PolarHBondContact O-N 3.31Å; C985-S987 WeakPolarHBondContact CB-O 3.4Å; C985-S987 PolarHBondContact O-N 2.84Å; C985-I989 HydrophobicContact CB-CG1 4.22Å; C985-Q1096 PolarHBondContact SG-OE1 3.14Å
986	N	79.9	Confident	74	Confident	149 Å²	149	42.7 Å²	42.7	80%	0.797	23%	0.23	S	C	*	.	S	Bend	trans	-78.4	32.1	172.8	-68.6	-31.4	0	0	0	112.8	M963	M963-N986 CarbonylContact O-C 3.58Å
987	S	86.1	Confident	73.7	Confident	16 Å²	16	42.2 Å²	42.2	11%	0.112	23%	0.228	C	C	.	.	S	Bend	trans	-162.5	157.7	177.8	-169.4	0	0	0	0	109.1	M963 S964 G965 C985 I989 N1092	M963-S987 PolarHBondContact O-N 2.98Å; S964-S987 CarbonylContact C-O 3.52Å; G965-S987 PolarHBondContact N-O 3.16Å; G965-S987 VanDerWaalsContact N-O 3.09Å; C985-S987 WeakPolarHBondContact CB-O 3.4Å; C985-S987 PolarHBondContact O-N 2.84Å; S987-I989 PolarHBondContact O-N 3.26Å; S987-N1092 VanDerWaalsContact CB-CG 3.46Å; S987-N1092 WeakPolarHBondContact OG-CB 3.41Å; S987-N1092 PolarHBondContact OG-N 3Å; S987-N1092 VanDerWaalsContact OG-N 3.12Å
988	R	86.8	Confident	73.4	Confident	87 Å²	87	41.6 Å²	41.6	33%	0.328	22%	0.219	S	C	.	.			trans	-61.5	130.7	170.2	176.4	163.4	-170.7	-133.9	9.8	110.5	D961 T1090 E1091	D961-R988 WeakPolarHBondContact O-CD 3.39Å; R988-T1090 WeakPolarHBondContact O-CA 3.38Å; R988-E1091 HydrophobicContact CB-CB 4.41Å; R988-E1091 HydrophobicContact CB-CG 4.2Å; R988-E1091 WeakPolarHBondContact CD-OE1 3.35Å; R988-E1091 WeakPolarHBondContact CD-OE2 3.41Å; R988-E1091 HydrophobicContact CG-CG 4.2Å; R988-E1091 IonicContact CZ-OE1 3.09Å; R988-E1091 IonicContact NE-OE1 3.98Å; R988-E1091 IonicContact NH1-OE1 2.89Å; R988-E1091 PolarHBondContact NH1-OE1 3.4Å; R988-E1091 IonicContact NH1-OE2 3.5Å; R988-E1091 PolarHBondContact O-N 3.12Å
989	I	90.2	Very high	72.7	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	134.4	172.6	-62.3	164.3	0	0	0	108.3	T941 C958 S960 V967 C985 S987 V1088	T941-I989 VanDerWaalsContact CG2-O 3.25Å; T941-I989 WeakPolarHBondContact CG2-O 3.42Å; C958-I989 HydrophobicContact CB-CB 4.31Å; C958-I989 HydrophobicContact CB-CD1 3.86Å; C958-I989 HydrophobicContact CB-CG2 3.93Å; S960-I989 WeakPolarHBondContact OG-CB 3.42Å; S960-I989 PolarHBondContact OG-N 2.98Å; V967-I989 HydrophobicContact CG2-CD1 3.86Å; C985-I989 HydrophobicContact CB-CG1 4.22Å; S987-I989 PolarHBondContact O-N 3.26Å; I989-V1088 HydrophobicContact CB-CG1 4.32Å; I989-V1088 HydrophobicContact CD1-CG1 4.04Å; I989-V1088 HydrophobicContact CG1-CG1 3.76Å; I989-V1088 HydrophobicContact CG2-CG1 3.68Å
990	S	90	Very high	71.3	Confident	27 Å²	27	50 Å²	50	19%	0.189	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-35.5	179.1	57.1	0	0	0	0	112.7	G1089 I1119	S990-G1089 PolarHBondContact N-O 3.05Å; S990-G1089 PolarHBondContact OG-O 3.49Å; S990-G1089 VanDerWaalsContact OG-O 3.13Å; S990-I1119 VanDerWaalsContact CB-O 3.23Å; S990-I1119 WeakPolarHBondContact CB-O 3.33Å; S990-I1119 PolarHBondContact OG-O 3.32Å
991	C	91.6	Very high	70.1	Confident	11 Å²	11	50.2 Å²	50.2	7%	0.074	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	159.7	-177	54.3	0	0	0	0	113.3	G1089	C991-G1089 PolarHBondContact N-O 3Å; C991-G1089 PolarHBondContact O-N 2.76Å
992	L	90.9	Very high	68.9	Low	17 Å²	17	54 Å²	54	9%	0.089	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.5	178.7	-94.2	171.5	0	0	0	109.1	T944 W956 C958 T1086 W1087 V1088	T944-L992 HydrophobicContact CG2-CB 3.89Å; T944-L992 HydrophobicContact CG2-CD1 4.31Å; T944-L992 HydrophobicContact CG2-CD2 4.28Å; T944-L992 HydrophobicContact CG2-CG 4.42Å; W956-L992 HydrophobicContact CB-CD1 4.48Å; C958-L992 HydrophobicContact CB-CD1 4.2Å; C958-L992 WeakPolarHBondContact SG-CD1 3.14Å; C958-L992 VanDerWaalsContact SG-CG 3.59Å; L992-T1086 HydrophobicContact CD2-CG2 3.57Å; L992-W1087 WeakPolarHBondContact CA-O 3.47Å; L992-V1088 HydrophobicContact CD2-CG2 3.75Å
993	C	89.5	Confident	67.4	Low	10 Å²	10	59.9 Å²	59.9	7%	0.068	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	126.2	169.9	-160.4	0	0	0	0	111	W1087 M1122 Y1124	C993-W1087 PolarHBondContact N-O 2.79Å; C993-W1087 PolarHBondContact O-N 2.88Å; C993-M1122 HydrophobicContact CB-CB 3.98Å; C993-M1122 HydrophobicContact CB-CE 4.19Å; C993-Y1124 PolarHBondContact SG-N 3.37Å
994	Y	85.7	Confident	65.5	Low	28 Å²	28	68.6 Å²	68.6	11%	0.11	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	137	171.9	175.5	-112.2	0	0	0	111.2	S945 S946 W947 C1084 T1085	S945-Y994 WeakPolarHBondContact O-CB 3.42Å; S945-Y994 WeakPolarHBondContact O-CD1 3.15Å; S946-Y994 VanDerWaalsContact CB-CD2 3.47Å; W947-Y994 PolarHBondContact O-OH 3.15Å; Y994-C1084 HydrophobicContact CE2-CB 4.14Å; Y994-C1084 WeakPolarHBondContact OH-CB 3.46Å; Y994-C1084 PolarHBondContact OH-SG 3.11Å; Y994-T1085 WeakPolarHBondContact CD2-O 3.38Å
995	I	81.4	Confident	63.8	Low	16 Å²	16	69 Å²	69	8%	0.082	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	110.4	177.6	-65.5	122.7	0	0	0	109.8	T1085 W1087 Y1124 I1129	I995-T1085 PolarHBondContact N-O 2.91Å; I995-T1085 PolarHBondContact O-N 2.99Å; I995-W1087 HydrophobicContact CD1-CB 4.28Å; I995-W1087 HydrophobicContact CD1-CD2 3.79Å; I995-W1087 HydrophobicContact CD1-CG 3.56Å; I995-W1087 HydrophobicContact CD1-CZ2 4.45Å; I995-Y1124 HydrophobicContact CG1-CD2 3.92Å; I995-Y1124 HydrophobicContact CG1-CE2 4.44Å; I995-Y1124 HydrophobicContact CG1-CG 4.05Å; I995-Y1124 HydrophobicContact CG2-CD2 4.3Å; I995-Y1124 HydrophobicContact CG2-CE2 3.98Å; I995-I1129 HydrophobicContact CD1-CD1 3.47Å; I995-I1129 VanDerWaalsContact CD1-CD1 3.47Å; I995-I1129 HydrophobicContact CD1-CG1 4.02Å; I995-I1129 HydrophobicContact CG1-CD1 3.83Å; I995-I1129 HydrophobicContact CG1-CG1 3.99Å
996	S	69.7	Low	61.6	Low	53 Å²	53	78.4 Å²	78.4	37%	0.371	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-68.4	135.8	172.5	178.4	0	0	0	0	110.7
997	P	55.1	Low	59.1	Low	28 Å²	28	76.3 Å²	76.3	18%	0.182	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-63.3	154.5	172.3	28.7	-35.9	0	0	0	111.6	M949 C1084	M949-P997 HydrophobicContact CE-CB 4.5Å; M949-P997 HydrophobicContact CE-CG 3.69Å; M949-P997 HydrophobicContact CG-CG 4.49Å; P997-C1084 VanDerWaalsContact CD-SG 3.57Å
998	R	51.6	Low	56.2	Low	78 Å²	78	81.5 Å²	81.5	29%	0.294	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-56.9	142.8	179.4	-82.6	-176.7	157.4	149.8	-5.4	112.9	L1000 E1127 C1143	R998-L1000 VanDerWaalsContact C-N 3.3Å; R998-L1000 PolarHBondContact O-N 3.02Å; R998-E1127 VanDerWaalsContact CG-OE1 3.3Å; R998-E1127 WeakPolarHBondContact CG-OE1 3.4Å; R998-E1127 IonicContact CZ-OE1 2.79Å; R998-E1127 IonicContact CZ-OE2 3.19Å; R998-E1127 VanDerWaalsContact NE-CD 3.25Å; R998-E1127 IonicContact NE-OE1 2.66Å; R998-E1127 PolarHBondContact NE-OE1 2.97Å; R998-E1127 IonicContact NE-OE2 3.29Å; R998-E1127 PolarHBondContact NE-OE2 3.07Å; R998-E1127 IonicContact NH2-OE1 3.38Å; R998-E1127 IonicContact NH2-OE2 2.78Å; R998-E1127 PolarHBondContact NH2-OE2 2.87Å; R998-C1143 PolarHBondContact NH1-O 2.82Å; R998-C1143 PolarHBondContact NH2-O 3.2Å
999	K	44.7	Very low	53.2	Low	163 Å²	163	87.6 Å²	87.6	71%	0.709	45%	0.447	S	S	*	.			trans	-69.6	81.7	166.2	-66.8	168.8	-174.4	154	0	109.7	G1001	K999-G1001 PolarHBondContact O-N 2.06Å
1000	L	31.7	Very low	50.2	Low	121 Å²	121	96.4 Å²	96.4	63%	0.634	49%	0.489	S	S	*	.			trans	-60.9	110.9	168.3	-88.4	96.4	0	0	0	109.3	R998	R998-L1000 VanDerWaalsContact C-N 3.3Å; R998-L1000 PolarHBondContact O-N 3.02Å
1001	G	30	Very low	47.1	Very low	50 Å²	50	101.1 Å²	101.1	52%	0.515	52%	0.522	S	S	.	.			trans	-55.6	151.5	164.3	0	0	0	0	0	110.2	K999 R1003	K999-G1001 PolarHBondContact O-N 2.06Å; G1001-R1003 VanDerWaalsContact C-N 3.34Å; G1001-R1003 PolarHBondContact O-N 3.23Å
1002	P	30.4	Very low	44.2	Very low	112 Å²	112	106.2 Å²	106.2	73%	0.727	56%	0.557	S	S	*	*			trans	-69.1	86.1	-168.5	28.2	-35.9	0	0	0	112.3	K1004	P1002-K1004 PolarHBondContact O-N 2.95Å; P1002-K1004 VanDerWaalsContact O-N 3.11Å
1003	R	27.1	Very low	41.1	Very low	171 Å²	171	114.8 Å²	114.8	65%	0.645	59%	0.594	S	S	*	*			trans	-55.2	115.5	167.1	-75.5	-177	171.8	145.7	6.4	107.6	G1001 E1145	G1001-R1003 VanDerWaalsContact C-N 3.34Å; G1001-R1003 PolarHBondContact O-N 3.23Å; R1003-E1145 IonicContact CZ-OE1 3.92Å; R1003-E1145 IonicContact NH1-OE1 3.81Å; R1003-E1145 IonicContact NH1-OE2 3.65Å; R1003-E1145 IonicContact NH2-OE1 2.78Å; R1003-E1145 PolarHBondContact NH2-OE1 3.02Å; R1003-E1145 IonicContact NH2-OE2 3.02Å
1004	K	25.2	Very low	38.1	Very low	195 Å²	195	122.8 Å²	122.8	85%	0.848	63%	0.63	S	S	*	*			trans	-59.2	126.1	174.4	-64.5	176	-177.7	173.8	0	107.7	P1002 K1006	P1002-K1004 PolarHBondContact O-N 2.95Å; P1002-K1004 VanDerWaalsContact O-N 3.11Å; K1004-K1006 PolarHBondContact O-N 2.86Å
1005	P	30.2	Very low	35.2	Very low	115 Å²	115	129 Å²	129	75%	0.747	67%	0.665	S	S	*	*			trans	-65.2	121	175.7	26.5	-32.7	0	0	0	109	V1007	P1005-V1007 PolarHBondContact O-N 3.37Å
1006	K	25	Very low	32.5	Very low	199 Å²	199	137.9 Å²	137.9	87%	0.865	70%	0.704	S	S	*	*			trans	-67.2	112.2	161.3	-82	-172	174.7	-176.7	0	106.8	K1004 T1008	K1004-K1006 PolarHBondContact O-N 2.86Å; K1006-T1008 PolarHBondContact O-N 3.34Å; K1006-T1008 VanDerWaalsContact O-N 3.13Å
1007	V	27.6	Very low	30.4	Very low	106 Å²	106	144.3 Å²	144.3	64%	0.642	73%	0.728	S	S	*	*			trans	-78.7	93.2	173.3	180	0	0	0	0	108	P1005 Y1009	P1005-V1007 PolarHBondContact O-N 3.37Å; V1007-Y1009 HydrophobicContact CG1-CD2 3.9Å; V1007-Y1009 HydrophobicContact CG1-CE2 3.9Å
1008	T	25.7	Very low	28.9	Very low	124 Å²	124	151.5 Å²	151.5	76%	0.761	76%	0.759	S	S	*	*			trans	-78	119.1	160.5	-43	0	0	0	0	107.2	K1006 E1010	K1006-T1008 PolarHBondContact O-N 3.34Å; K1006-T1008 VanDerWaalsContact O-N 3.13Å; T1008-E1010 PolarHBondContact O-N 2.86Å
1009	Y	24.5	Very low	27.6	Very low	215 Å²	215	154.9 Å²	154.9	84%	0.843	78%	0.781	S	S	*	*			trans	-80.7	109	174.8	-91.9	-91.9	0	0	0	109.7	V1007	V1007-Y1009 HydrophobicContact CG1-CD2 3.9Å; V1007-Y1009 HydrophobicContact CG1-CE2 3.9Å
1010	E	27.3	Very low	26.6	Very low	185 Å²	185	152.8 Å²	152.8	86%	0.864	78%	0.782	S	S	*	*			trans	-123.1	135	154.4	-72.6	-161.5	139.9	0	0	109.1	T1008	T1008-E1010 PolarHBondContact O-N 2.86Å
1011	S	24.5	Very low	26.1	Very low	127 Å²	127	152.1 Å²	152.1	89%	0.888	79%	0.786	S	S	*	*			trans	-99.6	104.8	-169.5	60	0	0	0	0	112
1012	S	29.6	Very low	25.9	Very low	117 Å²	117	155.4 Å²	155.4	82%	0.818	80%	0.798	S	S	*	*			trans	-131.9	144.9	157.8	55.9	0	0	0	0	109.8
1013	K	25.8	Very low	25.5	Very low	197 Å²	197	159.6 Å²	159.6	86%	0.857	81%	0.805	S	S	*	*			trans	-97	128.9	-177.9	-59.2	171.3	-176.8	171.1	0	108.6
1014	E	27.4	Very low	25.4	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	81%	0.809	S	S	*	*				177	161.4	111.7	-95.5	173.1	-168.1	0	0	112.9
1015	N	24.7	Very low	25.2	Very low	158 Å²	158	149.6 Å²	149.6	85%	0.845	80%	0.796	S	S	*	*			trans	-9.2	113.5	179.7	-66	-33.2	0	0	0	119
1016	K	24.9	Very low	24.9	Very low	204 Å²	204	149.3 Å²	149.3	89%	0.887	79%	0.788	S	S	*	*			trans	-128.5	125.2	149.8	-73.2	-172	176.2	180	0	110.4
1017	Q	24.7	Very low	24.8	Very low	188 Å²	188	142.6 Å²	142.6	88%	0.879	77%	0.766	S	S	*	*			trans	-69.5	133.6	165.6	-73.2	-178.7	-13.6	0	0	109	I1019	Q1017-I1019 PolarHBondContact O-N 3.43Å
1018	Q	24.4	Very low	24.6	Very low	179 Å²	179	143.3 Å²	143.3	84%	0.836	77%	0.765	S	S	*	*			trans	-96	86.2	-167.5	-163.2	172.4	41.9	0	0	111	V1020	Q1018-V1020 HydrophobicContact CG-CG2 4.42Å
1019	I	23.7	Very low	24.4	Very low	149 Å²	149	143 Å²	143	76%	0.764	77%	0.767	S	S	*	*			trans	-74.9	123.9	172	-60.7	178.1	0	0	0	108.8	Q1017	Q1017-I1019 PolarHBondContact O-N 3.43Å
1020	V	23.9	Very low	24.4	Very low	119 Å²	119	138.2 Å²	138.2	72%	0.721	75%	0.752	S	S	*	*			trans	-110.5	101.9	-178.7	179.3	0	0	0	0	109.3	Q1018	Q1018-V1020 HydrophobicContact CG-CG2 4.42Å
1021	C	21.7	Very low	24.2	Very low	106 Å²	106	135.3 Å²	135.3	72%	0.716	74%	0.738	S	S	*	*			trans	-77.2	128.1	175	-59.6	0	0	0	0	110.9
1022	P	24.8	Very low	24.1	Very low	119 Å²	119	131.9 Å²	131.9	77%	0.773	71%	0.712	S	S	*	*			trans	-73.1	147.3	174.8	30.6	-34.1	0	0	0	111.4
1023	K	23.6	Very low	23.8	Very low	200 Å²	200	134.2 Å²	134.2	87%	0.87	72%	0.715	S	S	*	*			trans	-89.2	113.6	177.1	-65	178.9	179.8	179.2	0	110.1
1024	G	23.4	Very low	23.7	Very low	71 Å²	71	129.4 Å²	129.4	73%	0.732	70%	0.702	S	S	*	*			trans	-162.3	131.9	177.8	0	0	0	0	0	115.4
1025	C	22.2	Very low	23.5	Very low	86 Å²	86	125.4 Å²	125.4	58%	0.581	69%	0.693	S	S	*	*			trans	58.8	97.1	158.2	-150.4	0	0	0	0	119
1026	L	22.8	Very low	23.4	Very low	109 Å²	109	123.3 Å²	123.3	57%	0.571	69%	0.691	S	S	*	*			trans	-136.9	133.7	142.7	-115.5	-160.6	0	0	0	110.4	W947	W947-L1026 HydrophobicContact CD2-CD1 4.12Å; W947-L1026 HydrophobicContact CE3-CD1 3.66Å; W947-L1026 HydrophobicContact CH2-CD1 3.53Å; W947-L1026 HydrophobicContact CH2-CD2 4.41Å; W947-L1026 HydrophobicContact CH2-CG 3.73Å; W947-L1026 HydrophobicContact CZ2-CD1 3.98Å; W947-L1026 HydrophobicContact CZ2-CD2 4.05Å; W947-L1026 HydrophobicContact CZ2-CG 3.87Å; W947-L1026 HydrophobicContact CZ3-CD1 3.35Å; W947-L1026 HydrophobicContact CZ3-CG 4.11Å
1027	S	23.6	Very low	23.4	Very low	57 Å²	57	121 Å²	121	40%	0.399	69%	0.687	S	S	.	*			trans	-156.4	117.6	171.6	60.3	0	0	0	0	110.2	R1378	S1027-R1378 PolarHBondContact O-NH1 3.1Å; S1027-R1378 PolarHBondContact OG-NH2 2.92Å
1028	L	23.2	Very low	23.3	Very low	121 Å²	121	120.7 Å²	120.7	63%	0.634	69%	0.685	S	S	*	*			trans	-148.5	145.9	159.9	-159.8	73.9	0	0	0	107
1029	C	22.3	Very low	23.4	Very low	119 Å²	119	119.9 Å²	119.9	80%	0.804	69%	0.686	S	S	*	*	S	Bend	trans	28.2	83.6	166.6	-62.5	0	0	0	0	119.3
1030	Q	24.7	Very low	23.4	Very low	113 Å²	113	120.3 Å²	120.3	53%	0.528	69%	0.69	S	S	.	*			trans	-164.4	109.4	145	-108.2	165.5	-21	0	0	105.8	D1126	Q1030-D1126 PolarHBondContact NE2-OD1 3.43Å
1031	H	23.1	Very low	23.6	Very low	124 Å²	124	120 Å²	120	57%	0.574	69%	0.693	S	S	*	*				54.2	116.8	87.3	-87.6	-56.7	0	0	0	114.2
1032	V	22.4	Very low	23.7	Very low	55 Å²	55	123 Å²	123	33%	0.333	70%	0.701	S	S	.	*			trans	-55.8	128.6	-177.1	-174	0	0	0	0	112.9	L711 E865 F866 V1034	L711-V1032 HydrophobicContact CD1-CG1 3.83Å; E865-V1032 HydrophobicContact CG-CG2 4.07Å; E865-V1032 WeakPolarHBondContact OE1-CG2 3.32Å; E865-V1032 WeakPolarHBondContact OE2-CG2 3.33Å; F866-V1032 HydrophobicContact CE1-CB 4.13Å; F866-V1032 HydrophobicContact CE1-CG1 3.99Å; F866-V1032 HydrophobicContact CE1-CG2 3.81Å; F866-V1032 HydrophobicContact CZ-CB 4.27Å; F866-V1032 HydrophobicContact CZ-CG1 3.95Å; F866-V1032 HydrophobicContact CZ-CG2 3.63Å; V1032-V1034 HydrophobicContact CG1-CG2 3.94Å
1033	L	22.1	Very low	23.8	Very low	167 Å²	167	123.1 Å²	123.1	87%	0.874	71%	0.705	S	S	*	*			trans	-88.5	104.3	157	-84.2	167	0	0	0	109.1	S1035	L1033-S1035 PolarHBondContact O-N 3.34Å
1034	V	23.2	Very low	24	Very low	96 Å²	96	119 Å²	119	58%	0.582	70%	0.701	S	S	*	*			trans	-76.8	97.7	163.7	-179.8	0	0	0	0	107.2	L711 V1032 S1036	L711-V1034 HydrophobicContact CD1-CG2 4.01Å; V1032-V1034 HydrophobicContact CG1-CG2 3.94Å; V1034-S1036 PolarHBondContact O-N 3.23Å; V1034-S1036 VanDerWaalsContact O-N 3.1Å
1035	S	23.8	Very low	24	Very low	94 Å²	94	122 Å²	122	66%	0.657	71%	0.71	S	S	*	*			trans	-76.8	91.7	172.8	59	0	0	0	0	109.9	L1033 I1037	L1033-S1035 PolarHBondContact O-N 3.34Å; S1035-I1037 PolarHBondContact O-N 2.9Å; S1035-I1037 VanDerWaalsContact O-N 3.16Å
1036	S	23.6	Very low	24.5	Very low	113 Å²	113	121 Å²	121	79%	0.79	72%	0.715	S	S	*	*			trans	-62.1	112.1	162	-61.7	0	0	0	0	108.6	V1034	V1034-S1036 PolarHBondContact O-N 3.23Å; V1034-S1036 VanDerWaalsContact O-N 3.1Å
1037	I	23.9	Very low	24.8	Very low	156 Å²	156	124.7 Å²	124.7	80%	0.8	73%	0.729	S	S	*	*			trans	-97.9	100	170.2	-62	174.7	0	0	0	106.8	S1035	S1035-I1037 PolarHBondContact O-N 2.9Å; S1035-I1037 VanDerWaalsContact O-N 3.16Å
1038	E	22.8	Very low	25	Very low	182 Å²	182	127 Å²	127	85%	0.85	75%	0.745	S	S	*	*			trans	-158	105.3	161.1	-127.6	171.7	-128.1	0	0	108.6
1039	L	27.4	Very low	25	Very low	162 Å²	162	126.8 Å²	126.8	85%	0.848	75%	0.753	S	S	*	*			trans	167.8	101.4	143.3	-93.6	170.1	0	0	0	108.8
1040	D	22.9	Very low	25.5	Very low	158 Å²	158	125.7 Å²	125.7	85%	0.845	75%	0.753	S	S	*	*			trans	-68.9	136.1	165.5	-58.4	-65.9	0	0	0	109.6
1041	S	28.7	Very low	25.6	Very low	112 Å²	112	129.2 Å²	129.2	78%	0.783	77%	0.77	S	S	*	*			trans	-160	85.6	169.2	-78.1	0	0	0	0	109.2	S1043	S1041-S1043 PolarHBondContact O-N 2.9Å
1042	D	23.4	Very low	26	Very low	168 Å²	168	128.4 Å²	128.4	90%	0.898	78%	0.778	S	S	*	*			trans	-61.3	131.3	170.3	-73.6	-56.4	0	0	0	110.6
1043	S	26.8	Very low	26.2	Very low	123 Å²	123	132.3 Å²	132.3	86%	0.86	80%	0.802	S	S	*	*			trans	-143	83.5	164.8	-166	0	0	0	0	108.8	S1041	S1041-S1043 PolarHBondContact O-N 2.9Å
1044	S	27.7	Very low	26.4	Very low	112 Å²	112	129.9 Å²	129.9	78%	0.783	80%	0.799	S	S	*	*			trans	-82.7	137.1	173.2	52.9	0	0	0	0	110.5
1045	C	23.5	Very low	26.5	Very low	134 Å²	134	129.4 Å²	129.4	91%	0.905	81%	0.805	S	S	*	*			trans	-61.6	145.3	179	49.5	0	0	0	0	113.9
1046	G	31.8	Very low	26.5	Very low	67 Å²	67	129.2 Å²	129.2	69%	0.691	80%	0.804	S	S	*	*			trans	-152.9	115.7	166.4	0	0	0	0	0	111.6
1047	E	30.7	Very low	26.5	Very low	186 Å²	186	131.5 Å²	131.5	87%	0.869	80%	0.802	S	S	*	*			trans	45.6	111.1	149.5	-62	168.9	-169.5	0	0	118.8
1048	S	26.7	Very low	26.5	Very low	106 Å²	106	129.7 Å²	129.7	74%	0.741	80%	0.798	S	S	*	*				62.7	134.7	66.5	76.4	0	0	0	0	115.1
1049	S	24.5	Very low	26.8	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	80%	0.798	S	S	*	*			cis	-178	141.4	-8.3	46.8	0	0	0	0	110.8
1050	A	32.2	Very low	26.6	Very low	97 Å²	97	131.7 Å²	131.7	80%	0.802	80%	0.797	S	S	*	*			trans	-171.9	153.2	164.8	0	0	0	0	0	109.1
1051	E	26.4	Very low	26.9	Very low	186 Å²	186	130.4 Å²	130.4	87%	0.869	79%	0.789	S	S	*	*			cis	178.7	111.8	-30.8	-117.8	-164.6	156.9	0	0	105.9
1052	S	30.7	Very low	26.7	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	79%	0.791	S	S	*	*			trans	170.3	128.9	154.9	28.4	0	0	0	0	108.6
1053	T	26.5	Very low	26.8	Very low	138 Å²	138	127.8 Å²	127.8	85%	0.847	78%	0.783	S	S	*	*				59	128.7	63	58.9	0	0	0	0	114
1054	S	27.9	Very low	26.8	Very low	116 Å²	116	127.4 Å²	127.4	81%	0.811	78%	0.78	S	S	*	*			cis	-154.7	175.8	4.9	60.2	0	0	0	0	114.3
1055	A	23.7	Very low	27	Very low	86 Å²	86	129.8 Å²	129.8	71%	0.711	78%	0.783	S	S	*	*			trans	-60.6	179	163.8	0	0	0	0	0	113.4
1056	S	24.7	Very low	27.4	Very low	89 Å²	89	128.4 Å²	128.4	62%	0.622	77%	0.772	S	S	*	*			cis	-158.8	164.9	11.5	-145	0	0	0	0	114
1057	E	24.2	Very low	27.1	Very low	162 Å²	162	133 Å²	133	76%	0.757	78%	0.781	S	S	*	*			trans	40.3	123.6	143.4	-72.8	167.5	116	0	0	125.4
1058	T	24.2	Very low	26.9	Very low	117 Å²	117	127.6 Å²	127.6	72%	0.718	78%	0.775	S	S	*	*				63.6	122.9	121.7	-50.1	0	0	0	0	122.4
1059	I	27.6	Very low	27	Very low	164 Å²	164	130.5 Å²	130.5	84%	0.841	78%	0.78	S	S	*	*			trans	-175.9	176.6	133.3	-98.7	158.9	0	0	0	111
1060	R	23.8	Very low	27.1	Very low	222 Å²	222	133.1 Å²	133.1	84%	0.838	78%	0.78	S	S	*	*			trans	-129.5	-178.5	-172.9	-52.9	178.5	-179	161.7	-0.4	110.2
1061	I	28.1	Very low	26.8	Very low	132 Å²	132	138.1 Å²	138.1	68%	0.677	79%	0.787	S	S	*	*			cis	-164.3	166.4	18.8	-155.1	170.1	0	0	0	111.8
1062	N	24.7	Very low	26.8	Very low	153 Å²	153	135.1 Å²	135.1	82%	0.818	78%	0.781	S	S	*	*			trans	67.3	132.8	162.8	-69.2	-13.4	0	0	0	120.9
1063	G	25.4	Very low	26.7	Very low	71 Å²	71	134.4 Å²	134.4	73%	0.732	78%	0.782	S	S	*	*			trans	165.7	70.9	167.4	0	0	0	0	0	118
1064	S	28.2	Very low	26.7	Very low	115 Å²	115	135.7 Å²	135.7	80%	0.804	78%	0.782	S	S	*	*			trans	34	107.2	155.7	56.9	0	0	0	0	122.9
1065	I	30.7	Very low	26.7	Very low	163 Å²	163	136.1 Å²	136.1	84%	0.836	77%	0.774	S	S	*	*				25.5	133.8	113	-71.8	172	0	0	0	117.3
1066	P	31.7	Very low	27	Very low	104 Å²	104	137.4 Å²	137.4	68%	0.675	77%	0.769	S	S	*	*			cis	-142.8	176	47.3	34.7	-12.7	0	0	0	120.2
1067	D	26.1	Very low	27.5	Very low	165 Å²	165	137.6 Å²	137.6	88%	0.882	77%	0.768	S	S	*	*			trans	64.4	119.1	155.9	-64	-13.7	0	0	0	122.5
1068	G	26	Very low	27.9	Very low	72 Å²	72	136.9 Å²	136.9	74%	0.742	77%	0.77	S	S	*	*			trans	136.1	127.2	151	0	0	0	0	0	116.7
1069	I	29.2	Very low	28.7	Very low	166 Å²	166	137.4 Å²	137.4	85%	0.851	77%	0.768	S	S	*	*			trans	69.1	94.5	158.3	-49	174.2	0	0	0	117.1
1070	Q	27.7	Very low	29.1	Very low	171 Å²	171	134.3 Å²	134.3	80%	0.799	75%	0.746	S	S	*	*			trans	36	108.1	131.9	-160.4	164.1	16	0	0	118.9	T1072	Q1070-T1072 PolarHBondContact O-N 2.87Å
1071	E	24.9	Very low	29.9	Very low	201 Å²	201	128.5 Å²	128.5	94%	0.939	73%	0.731	S	S	*	*			trans	-55.8	116.8	172.3	-64.4	-180	121.5	0	0	112.2
1072	T	27.2	Very low	30.9	Very low	124 Å²	124	125.8 Å²	125.8	76%	0.761	71%	0.714	S	S	*	*			trans	-97.5	122.7	162.2	39.8	0	0	0	0	108.6	Q1070 I1074	Q1070-T1072 PolarHBondContact O-N 2.87Å; T1072-I1074 PolarHBondContact O-N 3.03Å; T1072-I1074 VanDerWaalsContact O-N 3.15Å
1073	A	28.9	Very low	32.1	Very low	91 Å²	91	122.8 Å²	122.8	75%	0.752	70%	0.695	S	S	*	*			trans	-66.1	114.6	-175	0	0	0	0	0	111.3	L1075	A1073-L1075 PolarHBondContact O-N 3.2Å
1074	I	25.9	Very low	33.7	Very low	166 Å²	166	119.6 Å²	119.6	85%	0.851	66%	0.662	S	S	*	*			trans	-75.2	96.8	177.3	-56.4	177.6	0	0	0	108.7	T1072	T1072-I1074 PolarHBondContact O-N 3.03Å; T1072-I1074 VanDerWaalsContact O-N 3.15Å
1075	L	27.2	Very low	36	Very low	124 Å²	124	114.6 Å²	114.6	65%	0.649	63%	0.626	S	S	*	*			trans	-98.2	151.4	172.1	-69.1	173.2	0	0	0	111.8	A1073 R1080	A1073-L1075 PolarHBondContact O-N 3.2Å; L1075-R1080 PolarHBondContact O-NH2 3.09Å
1076	D	31.1	Very low	38.5	Very low	114 Å²	114	106.9 Å²	106.9	61%	0.61	59%	0.586	S	S	*	*			trans	-53.4	146.2	-170.3	-133	-33.9	0	0	0	113.1	N1078 R1080	D1076-N1078 VanDerWaalsContact C-N 3.25Å; D1076-N1078 PolarHBondContact O-N 2.89Å; D1076-R1080 PolarHBondContact O-NE 3.3Å
1077	P	33.6	Very low	41.3	Very low	92 Å²	92	102.7 Å²	102.7	60%	0.597	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-66.8	-19.6	-178.1	-25.4	37.6	0	0	0	115.4
1078	N	34.4	Very low	44.3	Very low	148 Å²	148	94.8 Å²	94.8	79%	0.791	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-84.1	-22.1	-168.2	-72	-39.2	0	0	0	115.5	D1076 R1080	D1076-N1078 VanDerWaalsContact C-N 3.25Å; D1076-N1078 PolarHBondContact O-N 2.89Å; N1078-R1080 VanDerWaalsContact C-N 3.29Å; N1078-R1080 PolarHBondContact O-N 3.44Å
1079	D	39.1	Very low	47.4	Very low	128 Å²	128	91.4 Å²	91.4	68%	0.684	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-85.8	8	-177.8	-83.1	-22.4	0	0	0	114.2	L1081	D1079-L1081 PolarHBondContact O-N 2.7Å
1080	R	37.7	Very low	50.4	Low	99 Å²	99	83.5 Å²	83.5	37%	0.374	44%	0.44	S	S	.	.			trans	-88.7	18.2	-159.6	-64.9	-173.6	177	-144.4	2.1	116.8	L1075 D1076 N1078 K1148 G1149	L1075-R1080 PolarHBondContact O-NH2 3.09Å; D1076-R1080 PolarHBondContact O-NE 3.3Å; N1078-R1080 VanDerWaalsContact C-N 3.29Å; N1078-R1080 PolarHBondContact O-N 3.44Å; R1080-K1148 CarbonylContact O-C 3.38Å; R1080-G1149 PolarHBondContact O-N 2.73Å
1081	L	40.8	Very low	53.4	Low	99 Å²	99	78.9 Å²	78.9	52%	0.518	42%	0.418	S	S	.	.			trans	-96.5	104.1	174.1	-73.5	170.5	0	0	0	111	D1079 H1083 K1148	D1079-L1081 PolarHBondContact O-N 2.7Å; L1081-H1083 VanDerWaalsContact C-N 3.33Å; L1081-H1083 WeakPolarHBondContact CB-NE2 3.39Å; L1081-H1083 PolarHBondContact O-CD2 3.08Å; L1081-H1083 VanDerWaalsContact O-CD2 3.32Å; L1081-H1083 PolarHBondContact O-N 2.94Å; L1081-K1148 HydrophobicContact CD2-CD 4.21Å
1082	F	48.2	Very low	56.5	Low	75 Å²	75	72.7 Å²	72.7	33%	0.329	39%	0.391	S	S	.	.			trans	-68.3	88.7	168.5	-68.7	-52.9	0	0	0	110.7	T1085 G1149	F1082-T1085 HydrophobicContact CB-CG2 3.95Å; F1082-T1085 HydrophobicContact CD1-CG2 3.9Å; F1082-T1085 HydrophobicContact CG-CG2 4.24Å; F1082-G1149 VanDerWaalsContact CE2-C 3.43Å; F1082-G1149 VanDerWaalsContact CE2-CA 3.47Å
1083	H	50.8	Low	59.5	Low	91 Å²	91	66.8 Å²	66.8	42%	0.421	36%	0.355	S	S	.	.			trans	-79.5	139.2	163.5	-60.4	-70.3	0	0	0	108.7	L1081 T1085	L1081-H1083 VanDerWaalsContact C-N 3.33Å; L1081-H1083 WeakPolarHBondContact CB-NE2 3.39Å; L1081-H1083 PolarHBondContact O-CD2 3.08Å; L1081-H1083 VanDerWaalsContact O-CD2 3.32Å; L1081-H1083 PolarHBondContact O-N 2.94Å; H1083-T1085 PolarHBondContact O-N 2.74Å; H1083-T1085 VanDerWaalsContact O-N 3.16Å
1084	C	58.3	Low	62.5	Low	4 Å²	4	62.5 Å²	62.5	3%	0.027	32%	0.319	C	S	.	.	S	Bend	trans	36.9	62.3	164.8	-63.8	0	0	0	0	117	Y994 P997	Y994-C1084 HydrophobicContact CE2-CB 4.14Å; Y994-C1084 WeakPolarHBondContact OH-CB 3.46Å; Y994-C1084 PolarHBondContact OH-SG 3.11Å; P997-C1084 VanDerWaalsContact CD-SG 3.57Å
1085	T	75.9	Confident	65.5	Low	10 Å²	10	54.6 Å²	54.6	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	145.5	-176.6	63.2	0	0	0	0	114.2	Y994 I995 F1082 H1083 W1087 I1097 Y1098 D1099	Y994-T1085 WeakPolarHBondContact CD2-O 3.38Å; I995-T1085 PolarHBondContact N-O 2.91Å; I995-T1085 PolarHBondContact O-N 2.99Å; F1082-T1085 HydrophobicContact CB-CG2 3.95Å; F1082-T1085 HydrophobicContact CD1-CG2 3.9Å; F1082-T1085 HydrophobicContact CG-CG2 4.24Å; H1083-T1085 PolarHBondContact O-N 2.74Å; H1083-T1085 VanDerWaalsContact O-N 3.16Å; T1085-W1087 PolarHBondContact OG1-NE1 3.29Å; T1085-I1097 HydrophobicContact CG2-CG2 4.18Å; T1085-Y1098 CarbonylContact C-O 3.58Å; T1085-Y1098 VanDerWaalsContact CA-O 3.27Å; T1085-Y1098 WeakPolarHBondContact CA-O 3.3Å; T1085-Y1098 WeakPolarHBondContact CB-O 3.49Å; T1085-D1099 HydrophobicContact CG2-CB 4.47Å
1086	T	84.6	Confident	68.4	Low	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.2	171.2	-66.2	0	0	0	0	109.4	T944 W956 L992 Y1098	T944-T1086 HydrophobicContact CG2-CG2 4.23Å; W956-T1086 HydrophobicContact CB-CG2 4.15Å; W956-T1086 HydrophobicContact CD2-CG2 3.77Å; W956-T1086 HydrophobicContact CE3-CG2 3.96Å; W956-T1086 HydrophobicContact CG-CG2 3.86Å; W956-T1086 PolarHBondContact NE1-OG1 3.35Å; W956-T1086 VanDerWaalsContact NE1-OG1 3.13Å; L992-T1086 HydrophobicContact CD2-CG2 3.57Å; T1086-Y1098 PolarHBondContact N-O 2.72Å; T1086-Y1098 PolarHBondContact O-N 3.48Å
1087	W	89	Confident	70.9	Confident	16 Å²	16	44 Å²	44	6%	0.061	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	136.1	179.9	-70.6	31	0	0	0	110.4	L992 C993 I995 T1085 I1095 I1097 M1122 I1129 I1131 Y1141 L1151	L992-W1087 WeakPolarHBondContact CA-O 3.47Å; C993-W1087 PolarHBondContact N-O 2.79Å; C993-W1087 PolarHBondContact O-N 2.88Å; I995-W1087 HydrophobicContact CD1-CB 4.28Å; I995-W1087 HydrophobicContact CD1-CD2 3.79Å; I995-W1087 HydrophobicContact CD1-CG 3.56Å; I995-W1087 HydrophobicContact CD1-CZ2 4.45Å; T1085-W1087 PolarHBondContact OG1-NE1 3.29Å; W1087-I1095 HydrophobicContact CD2-CG2 4.21Å; W1087-I1095 HydrophobicContact CE3-CG2 3.65Å; W1087-I1095 HydrophobicContact CZ3-CD1 4.37Å; W1087-I1095 HydrophobicContact CZ3-CG2 4.2Å; W1087-I1097 HydrophobicContact CD2-CD1 3.97Å; W1087-I1097 HydrophobicContact CD2-CG1 3.94Å; W1087-I1097 VanDerWaalsContact CE2-CD1 3.45Å; W1087-I1097 HydrophobicContact CG-CD1 4.48Å; W1087-I1097 HydrophobicContact CG-CG1 3.99Å; W1087-I1097 HydrophobicContact CH2-CD1 4.26Å; W1087-I1097 HydrophobicContact CZ2-CD1 3.63Å; W1087-I1097 HydrophobicContact CZ2-CG1 4.49Å; W1087-M1122 HydrophobicContact CB-CE 4.12Å; W1087-M1122 WeakPolarHBondContact O-CE 3.5Å; W1087-I1129 HydrophobicContact CD2-CD1 4.14Å; W1087-I1129 HydrophobicContact CE3-CD1 4.14Å; W1087-I1129 HydrophobicContact CE3-CG2 4.1Å; W1087-I1129 HydrophobicContact CH2-CD1 3.34Å; W1087-I1129 HydrophobicContact CZ2-CD1 3.35Å; W1087-I1129 HydrophobicContact CZ3-CB 4.47Å; W1087-I1129 HydrophobicContact CZ3-CD1 3.78Å; W1087-I1129 HydrophobicContact CZ3-CG2 4.06Å; W1087-I1131 HydrophobicContact CZ3-CD1 4.49Å; W1087-Y1141 AromaticContact CH2-CD2 3.87Å; W1087-Y1141 HydrophobicContact CH2-CD2 3.87Å; W1087-Y1141 HydrophobicContact CH2-CE2 4.42Å; W1087-Y1141 HydrophobicContact CH2-CG 4.13Å; W1087-Y1141 AromaticContact CZ3-CD2 3.57Å; W1087-Y1141 HydrophobicContact CZ3-CD2 3.57Å; W1087-Y1141 AromaticContact CZ3-CE2 3.91Å; W1087-Y1141 HydrophobicContact CZ3-CE2 3.91Å; W1087-Y1141 HydrophobicContact CZ3-CG 4.3Å; W1087-L1151 HydrophobicContact CH2-CD1 3.33Å; W1087-L1151 HydrophobicContact CH2-CG 4.31Å; W1087-L1151 HydrophobicContact CZ2-CD1 3.61Å; W1087-L1151 HydrophobicContact CZ3-CD1 4.15Å
1088	V	90	Very high	73.1	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.1	179.9	178.9	0	0	0	0	108.7	V967 I989 L992 T1090 I1095 Q1096 Y1098	V967-V1088 HydrophobicContact CG2-CG2 3.98Å; I989-V1088 HydrophobicContact CB-CG1 4.32Å; I989-V1088 HydrophobicContact CD1-CG1 4.04Å; I989-V1088 HydrophobicContact CG1-CG1 3.76Å; I989-V1088 HydrophobicContact CG2-CG1 3.68Å; L992-V1088 HydrophobicContact CD2-CG2 3.75Å; V1088-T1090 HydrophobicContact CG1-CG2 4.47Å; V1088-I1095 WeakPolarHBondContact O-CA 3.17Å; V1088-Q1096 HydrophobicContact CB-CB 4.38Å; V1088-Q1096 PolarHBondContact N-O 2.8Å; V1088-Q1096 PolarHBondContact O-N 3.16Å; V1088-Y1098 HydrophobicContact CB-CD2 4.45Å; V1088-Y1098 HydrophobicContact CB-CE2 4.06Å; V1088-Y1098 HydrophobicContact CG2-CD2 3.68Å; V1088-Y1098 HydrophobicContact CG2-CE2 3.6Å
1089	G	91.7	Very high	75	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	142.7	173.4	0	0	0	0	0	111	S990 C991	S990-G1089 PolarHBondContact N-O 3.05Å; S990-G1089 PolarHBondContact OG-O 3.49Å; S990-G1089 VanDerWaalsContact OG-O 3.13Å; C991-G1089 PolarHBondContact N-O 3Å; C991-G1089 PolarHBondContact O-N 2.76Å
1090	T	91.6	Very high	76.4	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	158.8	-171.7	56.2	0	0	0	0	113.1	R988 V1088 N1092 G1093 A1094 I1119	R988-T1090 WeakPolarHBondContact O-CA 3.38Å; V1088-T1090 HydrophobicContact CG1-CG2 4.47Å; T1090-N1092 VanDerWaalsContact C-N 3.31Å; T1090-N1092 PolarHBondContact O-N 2.86Å; T1090-N1092 PolarHBondContact OG1-OD1 2.8Å; T1090-G1093 PolarHBondContact O-N 3.12Å; T1090-A1094 PolarHBondContact N-O 3.13Å; T1090-A1094 WeakPolarHBondContact OG1-CA 3.31Å; T1090-A1094 WeakPolarHBondContact OG1-CB 3.4Å; T1090-A1094 PolarHBondContact OG1-N 3.41Å; T1090-A1094 PolarHBondContact OG1-O 2.91Å; T1090-I1119 PolarHBondContact O-N 3.03Å
1091	E	90.7	Very high	77.5	Confident	73 Å²	73	28 Å²	28	34%	0.341	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.2	178.4	-69.2	-170.9	169.8	0	0	113.5	R988 G1093 P1118	R988-E1091 HydrophobicContact CB-CB 4.41Å; R988-E1091 HydrophobicContact CB-CG 4.2Å; R988-E1091 WeakPolarHBondContact CD-OE1 3.35Å; R988-E1091 WeakPolarHBondContact CD-OE2 3.41Å; R988-E1091 HydrophobicContact CG-CG 4.2Å; R988-E1091 IonicContact CZ-OE1 3.09Å; R988-E1091 IonicContact NE-OE1 3.98Å; R988-E1091 IonicContact NH1-OE1 2.89Å; R988-E1091 PolarHBondContact NH1-OE1 3.4Å; R988-E1091 IonicContact NH1-OE2 3.5Å; R988-E1091 PolarHBondContact O-N 3.12Å; E1091-G1093 VanDerWaalsContact C-N 3.34Å; E1091-P1118 WeakPolarHBondContact O-CA 3.4Å; E1091-P1118 VanDerWaalsContact O-CB 3.23Å; E1091-P1118 WeakPolarHBondContact O-CB 3.41Å; E1091-P1118 WeakPolarHBondContact O-CG 3.32Å
1092	N	90.4	Very high	78.2	Confident	72 Å²	72	25 Å²	25	39%	0.385	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.2	171.8	76.2	-12.5	0	0	0	114.2	S987 T1090 A1094 Q1114	S987-N1092 VanDerWaalsContact CB-CG 3.46Å; S987-N1092 WeakPolarHBondContact OG-CB 3.41Å; S987-N1092 PolarHBondContact OG-N 3Å; S987-N1092 VanDerWaalsContact OG-N 3.12Å; T1090-N1092 VanDerWaalsContact C-N 3.31Å; T1090-N1092 PolarHBondContact O-N 2.86Å; T1090-N1092 PolarHBondContact OG1-OD1 2.8Å; N1092-A1094 PolarHBondContact OD1-N 3.36Å; N1092-Q1114 PolarHBondContact O-NE2 3.24Å
1093	G	90.4	Very high	77.9	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	93	14.5	176.2	0	0	0	0	0	116.4	T1090 E1091 Q1114 L1115 T1117	T1090-G1093 PolarHBondContact O-N 3.12Å; E1091-G1093 VanDerWaalsContact C-N 3.34Å; G1093-Q1114 PolarHBondContact O-OE1 3.45Å; G1093-L1115 PolarHBondContact O-N 2.01Å; G1093-T1117 WeakPolarHBondContact CA-O 3.39Å
1094	A	90.5	Very high	77.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	137	170.4	0	0	0	0	0	111.8	T1090 N1092 E1112 I1119	T1090-A1094 PolarHBondContact N-O 3.13Å; T1090-A1094 WeakPolarHBondContact OG1-CA 3.31Å; T1090-A1094 WeakPolarHBondContact OG1-CB 3.4Å; T1090-A1094 PolarHBondContact OG1-N 3.41Å; T1090-A1094 PolarHBondContact OG1-O 2.91Å; N1092-A1094 PolarHBondContact OD1-N 3.36Å; A1094-E1112 HydrophobicContact CB-CG 4.39Å; A1094-I1119 WeakPolarHBondContact O-CD1 3.4Å
1095	I	90.1	Very high	77.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.6	156.3	-59.4	176.6	0	0	0	107	W1087 V1088 I1097 E1112 T1113 L1115 I1119 I1131 Y1141	W1087-I1095 HydrophobicContact CD2-CG2 4.21Å; W1087-I1095 HydrophobicContact CE3-CG2 3.65Å; W1087-I1095 HydrophobicContact CZ3-CD1 4.37Å; W1087-I1095 HydrophobicContact CZ3-CG2 4.2Å; V1088-I1095 WeakPolarHBondContact O-CA 3.17Å; I1095-I1097 HydrophobicContact CG2-CG1 4.09Å; I1095-E1112 CarbonylContact O-C 3.55Å; I1095-E1112 VanDerWaalsContact O-CA 3.3Å; I1095-E1112 WeakPolarHBondContact O-CA 3.15Å; I1095-T1113 PolarHBondContact N-O 3.29Å; I1095-T1113 PolarHBondContact O-N 2.9Å; I1095-L1115 HydrophobicContact CD1-CD1 3.8Å; I1095-L1115 HydrophobicContact CD1-CG 4.44Å; I1095-L1115 HydrophobicContact CG1-CD1 4.29Å; I1095-I1119 HydrophobicContact CB-CD1 4.41Å; I1095-I1119 HydrophobicContact CD1-CD1 4.26Å; I1095-I1119 HydrophobicContact CG1-CD1 3.31Å; I1095-I1131 HydrophobicContact CD1-CD1 3.51Å; I1095-I1131 HydrophobicContact CG1-CD1 4.49Å; I1095-Y1141 HydrophobicContact CD1-CE2 3.55Å
1096	Q	87.1	Confident	75.8	Confident	14 Å²	14	37.3 Å²	37.3	7%	0.065	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.1	172.6	-67.4	-179.3	-11.9	0	0	109.7	C985 V1088 Y1098 E1112	C985-Q1096 PolarHBondContact SG-OE1 3.14Å; V1088-Q1096 HydrophobicContact CB-CB 4.38Å; V1088-Q1096 PolarHBondContact N-O 2.8Å; V1088-Q1096 PolarHBondContact O-N 3.16Å; Q1096-Y1098 HydrophobicContact CB-CE2 3.63Å; Q1096-Y1098 PolarHBondContact OE1-OH 3.49Å; Q1096-E1112 HydrophobicContact CG-CB 4.42Å; Q1096-E1112 HydrophobicContact CG-CG 3.96Å; Q1096-E1112 WeakPolarHBondContact CG-OE1 3.3Å; Q1096-E1112 PolarHBondContact NE2-OE1 3.11Å
1097	I	85.1	Confident	74.3	Confident	3 Å²	3	39 Å²	39	2%	0.015	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.8	-173.9	-57.7	-179.5	0	0	0	109.9	T1085 W1087 I1095 K1110 L1111 L1151	T1085-I1097 HydrophobicContact CG2-CG2 4.18Å; W1087-I1097 HydrophobicContact CD2-CD1 3.97Å; W1087-I1097 HydrophobicContact CD2-CG1 3.94Å; W1087-I1097 VanDerWaalsContact CE2-CD1 3.45Å; W1087-I1097 HydrophobicContact CG-CD1 4.48Å; W1087-I1097 HydrophobicContact CG-CG1 3.99Å; W1087-I1097 HydrophobicContact CH2-CD1 4.26Å; W1087-I1097 HydrophobicContact CZ2-CD1 3.63Å; W1087-I1097 HydrophobicContact CZ2-CG1 4.49Å; I1095-I1097 HydrophobicContact CG2-CG1 4.09Å; I1097-K1110 PolarHBondContact O-N 3.39Å; I1097-L1111 HydrophobicContact CB-CB 4.35Å; I1097-L1111 HydrophobicContact CD1-CB 4.31Å; I1097-L1111 HydrophobicContact CD1-CD2 4.23Å; I1097-L1111 PolarHBondContact N-O 3.31Å; I1097-L1151 HydrophobicContact CD1-CD1 3.54Å
1098	Y	79.1	Confident	72.9	Confident	7 Å²	7	46.1 Å²	46.1	3%	0.027	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144.6	-179.5	-60.3	-76.3	0	0	0	110.3	F983 T1085 T1086 V1088 Q1096 C1109	F983-Y1098 HydrophobicContact CB-CE1 3.99Å; F983-Y1098 AromaticContact CD1-CD1 3.27Å; F983-Y1098 HydrophobicContact CD1-CD1 3.27Å; F983-Y1098 AromaticContact CD1-CE1 3.16Å; F983-Y1098 HydrophobicContact CD1-CE1 3.16Å; F983-Y1098 HydrophobicContact CD1-CG 4.26Å; F983-Y1098 AromaticContact CE1-CD1 3.24Å; F983-Y1098 HydrophobicContact CE1-CD1 3.24Å; F983-Y1098 AromaticContact CE1-CE1 3.68Å; F983-Y1098 HydrophobicContact CE1-CE1 3.68Å; F983-Y1098 HydrophobicContact CE1-CG 4.11Å; F983-Y1098 HydrophobicContact CG-CD1 4.04Å; F983-Y1098 AromaticContact CG-CE1 3.8Å; F983-Y1098 HydrophobicContact CG-CE1 3.8Å; F983-Y1098 HydrophobicContact CZ-CD1 4.03Å; T1085-Y1098 CarbonylContact C-O 3.58Å; T1085-Y1098 VanDerWaalsContact CA-O 3.27Å; T1085-Y1098 WeakPolarHBondContact CA-O 3.3Å; T1085-Y1098 WeakPolarHBondContact CB-O 3.49Å; T1086-Y1098 PolarHBondContact N-O 2.72Å; T1086-Y1098 PolarHBondContact O-N 3.48Å; V1088-Y1098 HydrophobicContact CB-CD2 4.45Å; V1088-Y1098 HydrophobicContact CB-CE2 4.06Å; V1088-Y1098 HydrophobicContact CG2-CD2 3.68Å; V1088-Y1098 HydrophobicContact CG2-CE2 3.6Å; Q1096-Y1098 HydrophobicContact CB-CE2 3.63Å; Q1096-Y1098 PolarHBondContact OE1-OH 3.49Å; Y1098-C1109 HydrophobicContact CD1-CB 4.22Å; Y1098-C1109 VanDerWaalsContact CE1-CA 3.43Å; Y1098-C1109 HydrophobicContact CE1-CB 3.51Å
1099	D	74.5	Confident	72.1	Confident	11 Å²	11	48 Å²	48	6%	0.059	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	140	175.8	-173	-23.2	0	0	0	107.6	T1085 D1101 K1110	T1085-D1099 HydrophobicContact CG2-CB 4.47Å; D1099-D1101 PolarHBondContact OD1-N 2.91Å; D1099-K1110 HydrophobicContact CB-CD 3.74Å; D1099-K1110 HydrophobicContact CB-CG 4.36Å; D1099-K1110 WeakPolarHBondContact OD2-CE 3.29Å; D1099-K1110 IonicContact OD2-NZ 3.57Å; D1099-K1110 PolarHBondContact OD2-NZ 3.42Å
1100	R	67	Low	71.1	Confident	43 Å²	43	51.5 Å²	51.5	16%	0.162	27%	0.274	C	S	.	.	S	Bend	trans	-75.1	-38.8	177.9	-175.9	-171.3	175	145.8	10.7	111.6	I952 D954 W956	I952-R1100 PolarHBondContact O-NH1 3.03Å; D954-R1100 IonicContact OD1-CZ 3.89Å; D954-R1100 IonicContact OD1-NH1 2.73Å; D954-R1100 PolarHBondContact OD1-NH1 3.02Å; D954-R1100 IonicContact OD1-NH2 3.3Å; D954-R1100 PolarHBondContact OD1-NH2 3.47Å; D954-R1100 IonicContact OD2-CZ 3.79Å; D954-R1100 VanDerWaalsContact OD2-CZ 3.26Å; D954-R1100 IonicContact OD2-NH1 3.8Å; D954-R1100 PolarHBondContact OD2-NH1 3.15Å; D954-R1100 IonicContact OD2-NH2 3.71Å; D954-R1100 PolarHBondContact OD2-NH2 3.46Å; W956-R1100 HydrophobicContact CZ2-CB 4.18Å
1101	D	61.6	Low	70.4	Confident	69 Å²	69	54 Å²	54	37%	0.369	29%	0.287	S	S	.	.			trans	-101.3	18.4	-161.1	-61.1	-31.1	0	0	0	111.9	D1099 C1103	D1099-D1101 PolarHBondContact OD1-N 2.91Å; D1101-C1103 PolarHBondContact O-N 3.33Å
1102	D	56	Low	70.1	Confident	35 Å²	35	55.7 Å²	55.7	19%	0.187	29%	0.294	C	S	.	.			trans	-67.7	90.8	171.5	-165.1	-49.9	0	0	0	110.7	N1104 H1105 P1106 K1110	D1102-N1104 PolarHBondContact O-N 2.86Å; D1102-N1104 PolarHBondContact OD1-N 3.4Å; D1102-N1104 VanDerWaalsContact OD1-N 3.11Å; D1102-H1105 PolarHBondContact OD1-N 3.38Å; D1102-P1106 WeakPolarHBondContact O-CD 3.47Å; D1102-K1110 WeakPolarHBondContact OD2-CE 3.38Å; D1102-K1110 IonicContact OD2-NZ 2.66Å
1103	C	40.8	Very low	69.9	Low	118 Å²	118	54.1 Å²	54.1	80%	0.797	29%	0.288	S	S	*	.	S	Bend	trans	-66.4	-11.9	-177.7	60.2	0	0	0	0	114.8	D1101	D1101-C1103 PolarHBondContact O-N 3.33Å
1104	N	42.2	Very low	69.8	Low	117 Å²	117	59.2 Å²	59.2	63%	0.626	31%	0.311	S	S	*	.	S	Bend	trans	-90.1	-52.7	178.4	-73.3	-44.1	0	0	0	111.1	D1102	D1102-N1104 PolarHBondContact O-N 2.86Å; D1102-N1104 PolarHBondContact OD1-N 3.4Å; D1102-N1104 VanDerWaalsContact OD1-N 3.11Å
1105	H	51	Low	69.6	Low	111 Å²	111	61.2 Å²	61.2	51%	0.514	32%	0.322	S	S	.	.			trans	-136.7	75.4	-176.2	-71.7	10	0	0	0	111.9	D1102 G1107 R1108	D1102-H1105 PolarHBondContact OD1-N 3.38Å; H1105-G1107 PolarHBondContact O-N 3.45Å; H1105-R1108 HydrophobicContact CB-CB 4.15Å; H1105-R1108 PolarHBondContact O-N 3.13Å; H1105-R1108 VanDerWaalsContact O-N 3.1Å
1106	P	48.1	Very low	69.3	Low	93 Å²	93	63.9 Å²	63.9	60%	0.604	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	104.1	172.9	27.4	-34	0	0	0	109.5	D1102	D1102-P1106 WeakPolarHBondContact O-CD 3.47Å
1107	G	53.2	Low	69.5	Low	37 Å²	37	64.9 Å²	64.9	38%	0.381	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	134	-5.7	-167.8	0	0	0	0	0	115.4	V981 F983 H1105	V981-G1107 VanDerWaalsContact CG1-CA 3.49Å; F983-G1107 VanDerWaalsContact CD1-C 3.47Å; F983-G1107 WeakPolarHBondContact CD1-O 3.42Å; F983-G1107 WeakPolarHBondContact CE1-O 3.26Å; H1105-G1107 PolarHBondContact O-N 3.45Å
1108	R	59.9	Low	69.9	Low	165 Å²	165	67.3 Å²	67.3	62%	0.623	37%	0.373	S	S	*	.			trans	-96.5	136.5	178.7	-157.1	172.8	-173.1	164.8	1.5	112.6	H1105 K1110	H1105-R1108 HydrophobicContact CB-CB 4.15Å; H1105-R1108 PolarHBondContact O-N 3.13Å; H1105-R1108 VanDerWaalsContact O-N 3.1Å; R1108-K1110 PolarHBondContact O-N 3.07Å
1109	C	72.9	Confident	70.5	Confident	38 Å²	38	67 Å²	67	26%	0.257	37%	0.372	S	S	.	.			trans	-67.5	121.9	163.7	-174.5	0	0	0	0	108.6	Y1098 L1111	Y1098-C1109 HydrophobicContact CD1-CB 4.22Å; Y1098-C1109 VanDerWaalsContact CE1-CA 3.43Å; Y1098-C1109 HydrophobicContact CE1-CB 3.51Å; C1109-L1111 PolarHBondContact SG-O 3.49Å
1110	K	72	Confident	71.4	Confident	75 Å²	75	71.2 Å²	71.2	33%	0.326	39%	0.387	S	S	.	.	S	Bend	trans	-77.5	-36.9	179.7	-80.6	-161.2	173.5	179.6	0	112.3	I1097 D1099 D1102 R1108	I1097-K1110 PolarHBondContact O-N 3.39Å; D1099-K1110 HydrophobicContact CB-CD 3.74Å; D1099-K1110 HydrophobicContact CB-CG 4.36Å; D1099-K1110 WeakPolarHBondContact OD2-CE 3.29Å; D1099-K1110 IonicContact OD2-NZ 3.57Å; D1099-K1110 PolarHBondContact OD2-NZ 3.42Å; D1102-K1110 WeakPolarHBondContact OD2-CE 3.38Å; D1102-K1110 IonicContact OD2-NZ 2.66Å; R1108-K1110 PolarHBondContact O-N 3.07Å
1111	L	76.7	Confident	72.6	Confident	54 Å²	54	70.2 Å²	70.2	28%	0.283	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	134.3	178	-171.4	68	0	0	0	110.2	I1097 C1109 L1151	I1097-L1111 HydrophobicContact CB-CB 4.35Å; I1097-L1111 HydrophobicContact CD1-CB 4.31Å; I1097-L1111 HydrophobicContact CD1-CD2 4.23Å; I1097-L1111 PolarHBondContact N-O 3.31Å; C1109-L1111 PolarHBondContact SG-O 3.49Å; L1111-L1151 HydrophobicContact CD2-CB 4.02Å; L1111-L1151 HydrophobicContact CD2-CD1 4.22Å
1112	E	83.6	Confident	74.1	Confident	107 Å²	107	67.5 Å²	67.5	50%	0.5	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142.8	169.8	-178	161.5	-147.3	0	0	109.1	A1094 I1095 Q1096	A1094-E1112 HydrophobicContact CB-CG 4.39Å; I1095-E1112 CarbonylContact O-C 3.55Å; I1095-E1112 VanDerWaalsContact O-CA 3.3Å; I1095-E1112 WeakPolarHBondContact O-CA 3.15Å; Q1096-E1112 HydrophobicContact CG-CB 4.42Å; Q1096-E1112 HydrophobicContact CG-CG 3.96Å; Q1096-E1112 WeakPolarHBondContact CG-OE1 3.3Å; Q1096-E1112 PolarHBondContact NE2-OE1 3.11Å
1113	T	85.7	Confident	75.8	Confident	40 Å²	40	67.1 Å²	67.1	25%	0.245	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	125	179.5	-65.5	0	0	0	0	110.2	I1095 L1115 L1151	I1095-T1113 PolarHBondContact N-O 3.29Å; I1095-T1113 PolarHBondContact O-N 2.9Å; T1113-L1115 HydrophobicContact CG2-CD2 4.46Å; T1113-L1151 HydrophobicContact CG2-CD2 3.85Å
1114	Q	88.2	Confident	78	Confident	106 Å²	106	64.6 Å²	64.6	50%	0.495	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	114.1	-171.5	-178.1	60.4	18.7	0	0	111.1	N1092 G1093	N1092-Q1114 PolarHBondContact O-NE2 3.24Å; G1093-Q1114 PolarHBondContact O-OE1 3.45Å
1115	L	86.9	Confident	80.1	Confident	42 Å²	42	61.4 Å²	61.4	22%	0.22	32%	0.324	C	S	.	.			trans	-95.4	0.6	179	-61.9	-177.4	0	0	0	113.7	G1093 I1095 T1113 T1117 I1119 L1133 L1154	G1093-L1115 PolarHBondContact O-N 2.01Å; I1095-L1115 HydrophobicContact CD1-CD1 3.8Å; I1095-L1115 HydrophobicContact CD1-CG 4.44Å; I1095-L1115 HydrophobicContact CG1-CD1 4.29Å; T1113-L1115 HydrophobicContact CG2-CD2 4.46Å; L1115-T1117 PolarHBondContact O-N 3.22Å; L1115-T1117 PolarHBondContact O-OG1 2.88Å; L1115-I1119 HydrophobicContact CD1-CD1 4.49Å; L1115-L1133 HydrophobicContact CD1-CD2 4Å; L1115-L1154 HydrophobicContact CD1-CD2 3.77Å; L1115-L1154 HydrophobicContact CD2-CD2 3.74Å; L1115-L1154 HydrophobicContact CG-CD2 4.4Å
1116	G	83.7	Confident	81.7	Confident	57 Å²	57	59.5 Å²	59.5	59%	0.588	32%	0.318	S	S	*	.	S	Bend	trans	64.9	1.3	173.6	0	0	0	0	0	115.8
1117	T	91.5	Very high	83.2	Confident	34 Å²	34	58.3 Å²	58.3	21%	0.209	30%	0.304	C	S	.	.	S	Bend	trans	-136.3	140.8	-179.2	52.6	0	0	0	0	109.8	G1093 L1115 I1119 N1135	G1093-T1117 WeakPolarHBondContact CA-O 3.39Å; L1115-T1117 PolarHBondContact O-N 3.22Å; L1115-T1117 PolarHBondContact O-OG1 2.88Å; T1117-I1119 PolarHBondContact O-N 3.39Å; T1117-N1135 HydrophobicContact CG2-CB 4.39Å
1118	P	92.7	Very high	84.8	Confident	55 Å²	55	58.4 Å²	58.4	36%	0.357	29%	0.294	S	S	.	.			trans	-56.5	130.4	-173.5	-25.8	33.2	0	0	0	112.2	E1091 L1133 G1134	E1091-P1118 WeakPolarHBondContact O-CA 3.4Å; E1091-P1118 VanDerWaalsContact O-CB 3.23Å; E1091-P1118 WeakPolarHBondContact O-CB 3.41Å; E1091-P1118 WeakPolarHBondContact O-CG 3.32Å; P1118-L1133 CarbonylContact O-C 3.54Å; P1118-G1134 WeakPolarHBondContact O-CA 3.36Å; P1118-G1134 PolarHBondContact O-N 2.6Å
1119	I	93.5	Very high	86.3	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.7	174.8	-51.4	-168.9	0	0	0	107.8	S990 T1090 A1094 I1095 L1115 T1117 M1122 I1131 L1133	S990-I1119 VanDerWaalsContact CB-O 3.23Å; S990-I1119 WeakPolarHBondContact CB-O 3.33Å; S990-I1119 PolarHBondContact OG-O 3.32Å; T1090-I1119 PolarHBondContact O-N 3.03Å; A1094-I1119 WeakPolarHBondContact O-CD1 3.4Å; I1095-I1119 HydrophobicContact CB-CD1 4.41Å; I1095-I1119 HydrophobicContact CD1-CD1 4.26Å; I1095-I1119 HydrophobicContact CG1-CD1 3.31Å; L1115-I1119 HydrophobicContact CD1-CD1 4.49Å; T1117-I1119 PolarHBondContact O-N 3.39Å; I1119-M1122 HydrophobicContact CG2-CG 3.98Å; I1119-M1122 HydrophobicContact CG2-SD 4.37Å; I1119-I1131 HydrophobicContact CG2-CG2 3.77Å; I1119-L1133 HydrophobicContact CG1-CD2 4.33Å
1120	R	91.5	Very high	87.2	Confident	99 Å²	99	48.8 Å²	48.8	37%	0.374	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-41.2	-173.3	-62.5	-66.2	-67.1	153.9	-3	112.9	A1132 V1166	R1120-A1132 HydrophobicContact CB-CB 4.3Å; R1120-A1132 PolarHBondContact N-O 2.85Å; R1120-V1166 WeakPolarHBondContact CB-O 3.34Å
1121	C	92.5	Very high	88.3	Confident	21 Å²	21	45.3 Å²	45.3	14%	0.142	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	147.4	-179.2	-175.8	0	0	0	0	108.8	A1132 M1169	C1121-A1132 HydrophobicContact CB-CB 4.14Å; C1121-A1132 PolarHBondContact O-N 2.79Å; C1121-M1169 HydrophobicContact CB-CE 3.93Å; C1121-M1169 HydrophobicContact CB-CG 4.34Å; C1121-M1169 WeakPolarHBondContact O-CE 3.49Å
1122	M	93.2	Very high	89.1	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.059	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.1	171.8	-64.6	-172.2	-60.8	0	0	108.6	C993 W1087 I1119 F1130 I1131	C993-M1122 HydrophobicContact CB-CB 3.98Å; C993-M1122 HydrophobicContact CB-CE 4.19Å; W1087-M1122 HydrophobicContact CB-CE 4.12Å; W1087-M1122 WeakPolarHBondContact O-CE 3.5Å; I1119-M1122 HydrophobicContact CG2-CG 3.98Å; I1119-M1122 HydrophobicContact CG2-SD 4.37Å; M1122-F1130 CarbonylContact C-O 3.53Å; M1122-F1130 VanDerWaalsContact CA-O 3.29Å; M1122-F1130 WeakPolarHBondContact CA-O 3.3Å; M1122-I1131 HydrophobicContact CG-CD1 4.38Å; M1122-I1131 HydrophobicContact CG-CG1 4.06Å; M1122-I1131 HydrophobicContact CG-CG2 4.2Å; M1122-I1131 HydrophobicContact SD-CD1 4.13Å; M1122-I1131 HydrophobicContact SD-CG1 4.43Å
1123	T	91.2	Very high	89.5	Confident	27 Å²	27	38 Å²	38	17%	0.166	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	140.6	170.8	-171.2	0	0	0	0	111.3	F1130 M1169 V1171 L1176	T1123-F1130 HydrophobicContact CG2-CB 4.02Å; T1123-F1130 PolarHBondContact N-O 3.43Å; T1123-F1130 PolarHBondContact O-N 2.68Å; T1123-M1169 HydrophobicContact CG2-CB 4.36Å; T1123-M1169 HydrophobicContact CG2-CE 4.13Å; T1123-V1171 HydrophobicContact CG2-CG2 4.43Å; T1123-L1176 HydrophobicContact CG2-CD1 3.67Å
1124	Y	88	Confident	89.7	Confident	66 Å²	66	37.3 Å²	37.3	26%	0.259	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.6	179.3	175	-112.4	0	0	0	110.2	C993 I995 K1128 I1129	C993-Y1124 PolarHBondContact SG-N 3.37Å; I995-Y1124 HydrophobicContact CG1-CD2 3.92Å; I995-Y1124 HydrophobicContact CG1-CE2 4.44Å; I995-Y1124 HydrophobicContact CG1-CG 4.05Å; I995-Y1124 HydrophobicContact CG2-CD2 4.3Å; I995-Y1124 HydrophobicContact CG2-CE2 3.98Å; Y1124-K1128 WeakPolarHBondContact CD2-O 3.33Å; Y1124-I1129 HydrophobicContact CD2-CG1 3.77Å; Y1124-I1129 HydrophobicContact CE2-CG1 4.46Å
1125	Y	86.7	Confident	89.7	Confident	49 Å²	49	36.4 Å²	36.4	19%	0.192	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	134.1	174.7	-178.1	-90	0	0	0	110.8	E1127 K1128 V1171 N1174 L1189	Y1125-E1127 PolarHBondContact O-N 3.49Å; Y1125-K1128 PolarHBondContact N-O 2.9Å; Y1125-K1128 PolarHBondContact O-N 2.95Å; Y1125-K1128 VanDerWaalsContact O-O 3.08Å; Y1125-V1171 HydrophobicContact CD2-CB 4.26Å; Y1125-V1171 HydrophobicContact CD2-CG1 3.6Å; Y1125-V1171 HydrophobicContact CD2-CG2 4.45Å; Y1125-V1171 HydrophobicContact CE2-CG1 3.69Å; Y1125-V1171 HydrophobicContact CG-CG1 4.05Å; Y1125-V1171 HydrophobicContact CG-CG2 4.39Å; Y1125-N1174 WeakPolarHBondContact CE1-OD1 3.26Å; Y1125-N1174 PolarHBondContact OH-OD1 2.86Å; Y1125-L1189 HydrophobicContact CD1-CD1 3.55Å; Y1125-L1189 HydrophobicContact CE1-CB 4.35Å; Y1125-L1189 HydrophobicContact CE1-CD1 3.66Å; Y1125-L1189 HydrophobicContact CG-CD1 4.11Å
1126	D	83.9	Confident	89.7	Confident	72 Å²	72	35 Å²	35	39%	0.385	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.5	58.2	174.5	-155.1	59.3	0	0	0	113.8	Q1030 K1128	Q1030-D1126 PolarHBondContact NE2-OD1 3.43Å; D1126-K1128 PolarHBondContact O-N 3.38Å; D1126-K1128 PolarHBondContact O-NZ 2.93Å
1127	E	80.8	Confident	90	Very high	67 Å²	67	34.6 Å²	34.6	31%	0.313	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	10.6	177.7	-47.4	-169.5	141.1	0	0	114.8	R998 Y1125 C1143	R998-E1127 VanDerWaalsContact CG-OE1 3.3Å; R998-E1127 WeakPolarHBondContact CG-OE1 3.4Å; R998-E1127 IonicContact CZ-OE1 2.79Å; R998-E1127 IonicContact CZ-OE2 3.19Å; R998-E1127 VanDerWaalsContact NE-CD 3.25Å; R998-E1127 IonicContact NE-OE1 2.66Å; R998-E1127 PolarHBondContact NE-OE1 2.97Å; R998-E1127 IonicContact NE-OE2 3.29Å; R998-E1127 PolarHBondContact NE-OE2 3.07Å; R998-E1127 IonicContact NH2-OE1 3.38Å; R998-E1127 IonicContact NH2-OE2 2.78Å; R998-E1127 PolarHBondContact NH2-OE2 2.87Å; Y1125-E1127 PolarHBondContact O-N 3.49Å; E1127-C1143 HydrophobicContact CB-CB 4.5Å; E1127-C1143 WeakPolarHBondContact O-CB 3.49Å; E1127-C1143 PolarHBondContact O-N 3.01Å; E1127-C1143 PolarHBondContact O-SG 3.38Å
1128	K	86.5	Confident	90.1	Very high	39 Å²	39	33.2 Å²	33.2	17%	0.17	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140	177.8	-62.8	173	-165.5	77.7	0	111.1	Y1124 Y1125 D1126 F1130 F1140 Y1141 E1142	Y1124-K1128 WeakPolarHBondContact CD2-O 3.33Å; Y1125-K1128 PolarHBondContact N-O 2.9Å; Y1125-K1128 PolarHBondContact O-N 2.95Å; Y1125-K1128 VanDerWaalsContact O-O 3.08Å; D1126-K1128 PolarHBondContact O-N 3.38Å; D1126-K1128 PolarHBondContact O-NZ 2.93Å; K1128-F1130 HydrophobicContact CB-CD2 4.27Å; K1128-F1130 HydrophobicContact CB-CE2 3.58Å; K1128-F1130 HydrophobicContact CB-CZ 3.91Å; K1128-F1130 HydrophobicContact CD-CE2 4.47Å; K1128-F1130 HydrophobicContact CD-CZ 4.04Å; K1128-F1140 HydrophobicContact CB-CD2 4.25Å; K1128-F1140 HydrophobicContact CD-CD2 3.91Å; K1128-F1140 HydrophobicContact CD-CE2 3.98Å; K1128-F1140 HydrophobicContact CG-CD2 4.03Å; K1128-F1140 HydrophobicContact CG-CE2 4.42Å; K1128-Y1141 CarbonylContact C-O 3.57Å; K1128-Y1141 WeakPolarHBondContact CA-O 3.3Å; K1128-E1142 WeakPolarHBondContact CE-OE1 3.48Å; K1128-E1142 HydrophobicContact CG-CB 4.46Å; K1128-E1142 HydrophobicContact CG-CG 4.29Å
1129	I	89.9	Confident	90	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	101.8	178.1	-57.7	160.2	0	0	0	106.8	I995 W1087 Y1124 I1131 F1140 Y1141	I995-I1129 HydrophobicContact CD1-CD1 3.47Å; I995-I1129 VanDerWaalsContact CD1-CD1 3.47Å; I995-I1129 HydrophobicContact CD1-CG1 4.02Å; I995-I1129 HydrophobicContact CG1-CD1 3.83Å; I995-I1129 HydrophobicContact CG1-CG1 3.99Å; W1087-I1129 HydrophobicContact CD2-CD1 4.14Å; W1087-I1129 HydrophobicContact CE3-CD1 4.14Å; W1087-I1129 HydrophobicContact CE3-CG2 4.1Å; W1087-I1129 HydrophobicContact CH2-CD1 3.34Å; W1087-I1129 HydrophobicContact CZ2-CD1 3.35Å; W1087-I1129 HydrophobicContact CZ3-CB 4.47Å; W1087-I1129 HydrophobicContact CZ3-CD1 3.78Å; W1087-I1129 HydrophobicContact CZ3-CG2 4.06Å; Y1124-I1129 HydrophobicContact CD2-CG1 3.77Å; Y1124-I1129 HydrophobicContact CE2-CG1 4.46Å; I1129-I1131 HydrophobicContact CG2-CD1 4.44Å; I1129-I1131 HydrophobicContact CG2-CG1 4.24Å; I1129-F1140 WeakPolarHBondContact O-CA 3.49Å; I1129-Y1141 PolarHBondContact N-O 3.33Å; I1129-Y1141 PolarHBondContact O-N 2.7Å
1130	F	93.2	Very high	89.9	Confident	1 Å²	1	31 Å²	31	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	133.1	-179.9	-66.9	-87.6	0	0	0	110.2	M1122 T1123 K1128 G1139 F1140 L1176 L1189 L1192	M1122-F1130 CarbonylContact C-O 3.53Å; M1122-F1130 VanDerWaalsContact CA-O 3.29Å; M1122-F1130 WeakPolarHBondContact CA-O 3.3Å; T1123-F1130 HydrophobicContact CG2-CB 4.02Å; T1123-F1130 PolarHBondContact N-O 3.43Å; T1123-F1130 PolarHBondContact O-N 2.68Å; K1128-F1130 HydrophobicContact CB-CD2 4.27Å; K1128-F1130 HydrophobicContact CB-CE2 3.58Å; K1128-F1130 HydrophobicContact CB-CZ 3.91Å; K1128-F1130 HydrophobicContact CD-CE2 4.47Å; K1128-F1130 HydrophobicContact CD-CZ 4.04Å; F1130-G1139 WeakPolarHBondContact CA-O 3.42Å; F1130-F1140 HydrophobicContact CD1-CB 3.71Å; F1130-F1140 HydrophobicContact CD1-CG 4.45Å; F1130-F1140 HydrophobicContact CE1-CB 3.83Å; F1130-F1140 HydrophobicContact CE1-CD1 4.32Å; F1130-F1140 HydrophobicContact CE1-CG 4.1Å; F1130-F1140 HydrophobicContact CG-CB 4.24Å; F1130-F1140 HydrophobicContact CZ-CB 4.44Å; F1130-L1176 HydrophobicContact CB-CD2 4.17Å; F1130-L1176 HydrophobicContact CD1-CD2 3.95Å; F1130-L1176 HydrophobicContact CG-CD2 4.05Å; F1130-L1189 HydrophobicContact CD2-CD2 4.39Å; F1130-L1189 HydrophobicContact CE1-CD2 3.9Å; F1130-L1189 HydrophobicContact CE2-CD2 3.61Å; F1130-L1189 HydrophobicContact CZ-CD2 3.34Å; F1130-L1192 HydrophobicContact CE1-CD2 4.16Å; F1130-L1192 HydrophobicContact CZ-CD2 4.21Å
1131	I	93.9	Very high	89.7	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126	-173.8	-53.6	-168.7	0	0	0	109.8	W1087 I1095 I1119 M1122 I1129 L1133 I1138 G1139 Y1141	W1087-I1131 HydrophobicContact CZ3-CD1 4.49Å; I1095-I1131 HydrophobicContact CD1-CD1 3.51Å; I1095-I1131 HydrophobicContact CG1-CD1 4.49Å; I1119-I1131 HydrophobicContact CG2-CG2 3.77Å; M1122-I1131 HydrophobicContact CG-CD1 4.38Å; M1122-I1131 HydrophobicContact CG-CG1 4.06Å; M1122-I1131 HydrophobicContact CG-CG2 4.2Å; M1122-I1131 HydrophobicContact SD-CD1 4.13Å; M1122-I1131 HydrophobicContact SD-CG1 4.43Å; I1129-I1131 HydrophobicContact CG2-CD1 4.44Å; I1129-I1131 HydrophobicContact CG2-CG1 4.24Å; I1131-L1133 HydrophobicContact CG2-CD2 3.94Å; I1131-I1138 WeakPolarHBondContact O-CA 3.16Å; I1131-G1139 PolarHBondContact N-O 3.35Å; I1131-G1139 PolarHBondContact O-N 2.82Å; I1131-Y1141 HydrophobicContact CD1-CD2 3.79Å; I1131-Y1141 HydrophobicContact CD1-CE2 3.58Å
1132	A	94	Very high	89.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.4	172.1	0	0	0	0	0	110.7	R1120 C1121 V1166 M1169	R1120-A1132 HydrophobicContact CB-CB 4.3Å; R1120-A1132 PolarHBondContact N-O 2.85Å; C1121-A1132 HydrophobicContact CB-CB 4.14Å; C1121-A1132 PolarHBondContact O-N 2.79Å; A1132-V1166 HydrophobicContact CB-CB 3.8Å; A1132-V1166 HydrophobicContact CB-CG1 4.15Å; A1132-V1166 HydrophobicContact CB-CG2 4.45Å; A1132-M1169 HydrophobicContact CB-CE 3.92Å; A1132-M1169 HydrophobicContact CB-SD 4.08Å
1133	L	92.9	Very high	88.2	Confident	7 Å²	7	29.5 Å²	29.5	4%	0.037	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	149.5	-179.3	-60.5	178.7	0	0	0	112	L1115 P1118 I1119 I1131 N1135 G1136 T1137 M1156	L1115-L1133 HydrophobicContact CD1-CD2 4Å; P1118-L1133 CarbonylContact O-C 3.54Å; I1119-L1133 HydrophobicContact CG1-CD2 4.33Å; I1131-L1133 HydrophobicContact CG2-CD2 3.94Å; L1133-N1135 WeakPolarHBondContact CB-OD1 3.31Å; L1133-N1135 PolarHBondContact O-N 3.12Å; L1133-G1136 PolarHBondContact O-N 3.15Å; L1133-T1137 PolarHBondContact N-O 3.32Å; L1133-M1156 HydrophobicContact CD1-CE 4.14Å
1134	G	89.9	Confident	86.8	Confident	26 Å²	26	30.9 Å²	30.9	27%	0.268	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-5.5	-176.3	0	0	0	0	0	115.2	P1118 P1165	P1118-G1134 WeakPolarHBondContact O-CA 3.36Å; P1118-G1134 PolarHBondContact O-N 2.6Å; G1134-P1165 VanDerWaalsContact O-CG 3.27Å; G1134-P1165 WeakPolarHBondContact O-CG 3.49Å
1135	N	88.5	Confident	85.1	Confident	88 Å²	88	31.2 Å²	31.2	47%	0.471	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-0.9	173.9	66.1	1.9	0	0	0	113.9	T1117 L1133 T1137	T1117-N1135 HydrophobicContact CG2-CB 4.39Å; L1133-N1135 WeakPolarHBondContact CB-OD1 3.31Å; L1133-N1135 PolarHBondContact O-N 3.12Å; N1135-T1137 PolarHBondContact ND2-OG1 3.37Å; N1135-T1137 WeakPolarHBondContact OD1-CB 3.39Å; N1135-T1137 PolarHBondContact OD1-N 2.94Å; N1135-T1137 PolarHBondContact OD1-OG1 3.31Å
1136	G	86.6	Confident	83.4	Confident	11 Å²	11	35.9 Å²	35.9	11%	0.113	20%	0.197	C	C	.	.	S	Bend	trans	92.9	-1	-177.1	0	0	0	0	0	115.6	L1133 F1163	L1133-G1136 PolarHBondContact O-N 3.15Å; G1136-F1163 WeakPolarHBondContact CA-O 3.42Å
1137	T	90	Very high	81.8	Confident	50 Å²	50	35.6 Å²	35.6	31%	0.307	20%	0.195	S	C	.	.			trans	-91.8	153.5	177.1	65.2	0	0	0	0	112.2	L1133 N1135 M1156	L1133-T1137 PolarHBondContact N-O 3.32Å; N1135-T1137 PolarHBondContact ND2-OG1 3.37Å; N1135-T1137 WeakPolarHBondContact OD1-CB 3.39Å; N1135-T1137 PolarHBondContact OD1-N 2.94Å; N1135-T1137 PolarHBondContact OD1-OG1 3.31Å; T1137-M1156 VanDerWaalsContact CB-CE 3.48Å; T1137-M1156 HydrophobicContact CG2-CE 4.45Å; T1137-M1156 WeakPolarHBondContact OG1-CE 3.38Å
1138	I	92.2	Very high	80.1	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.4	174.1	-54.9	169.2	0	0	0	107.2	I1131 L1157 I1159 V1166 L1185 I1187	I1131-I1138 WeakPolarHBondContact O-CA 3.16Å; I1138-L1157 HydrophobicContact CB-CD1 4.09Å; I1138-L1157 HydrophobicContact CG2-CD1 3.77Å; I1138-L1157 WeakPolarHBondContact O-CB 3.21Å; I1138-L1157 PolarHBondContact O-N 2.98Å; I1138-I1159 HydrophobicContact CD1-CD1 4.26Å; I1138-V1166 HydrophobicContact CD1-CG2 3.95Å; I1138-V1166 HydrophobicContact CG1-CG2 4.05Å; I1138-L1185 HydrophobicContact CD1-CD2 4.34Å; I1138-I1187 HydrophobicContact CD1-CD1 3.73Å
1139	G	91.5	Very high	78.2	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	173.1	172	0	0	0	0	0	111.5	F1130 I1131 R1155	F1130-G1139 WeakPolarHBondContact CA-O 3.42Å; I1131-G1139 PolarHBondContact N-O 3.35Å; I1131-G1139 PolarHBondContact O-N 2.82Å; G1139-R1155 CarbonylContact C-O 3.6Å; G1139-R1155 VanDerWaalsContact CA-O 3.24Å; G1139-R1155 WeakPolarHBondContact CA-O 3.44Å
1140	F	91.7	Very high	76.4	Confident	10 Å²	10	39.7 Å²	39.7	4%	0.044	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	148.2	172.3	69.4	-79.3	0	0	0	112.8	K1128 I1129 F1130 E1142 R1155 L1157 L1192	K1128-F1140 HydrophobicContact CB-CD2 4.25Å; K1128-F1140 HydrophobicContact CD-CD2 3.91Å; K1128-F1140 HydrophobicContact CD-CE2 3.98Å; K1128-F1140 HydrophobicContact CG-CD2 4.03Å; K1128-F1140 HydrophobicContact CG-CE2 4.42Å; I1129-F1140 WeakPolarHBondContact O-CA 3.49Å; F1130-F1140 HydrophobicContact CD1-CB 3.71Å; F1130-F1140 HydrophobicContact CD1-CG 4.45Å; F1130-F1140 HydrophobicContact CE1-CB 3.83Å; F1130-F1140 HydrophobicContact CE1-CD1 4.32Å; F1130-F1140 HydrophobicContact CE1-CG 4.1Å; F1130-F1140 HydrophobicContact CG-CB 4.24Å; F1130-F1140 HydrophobicContact CZ-CB 4.44Å; F1140-E1142 HydrophobicContact CD2-CB 4.42Å; F1140-E1142 HydrophobicContact CE2-CB 4.28Å; F1140-R1155 HydrophobicContact CD1-CB 4.05Å; F1140-R1155 VanDerWaalsContact CD1-O 3.28Å; F1140-R1155 WeakPolarHBondContact CD1-O 3.04Å; F1140-R1155 HydrophobicContact CE1-CB 3.64Å; F1140-R1155 HydrophobicContact CE2-CB 4.23Å; F1140-R1155 HydrophobicContact CZ-CB 3.75Å; F1140-R1155 HydrophobicContact CZ-CG 4.4Å; F1140-R1155 PolarHBondContact N-O 3.18Å; F1140-R1155 PolarHBondContact O-N 2.89Å; F1140-L1157 HydrophobicContact CD1-CD2 3.8Å; F1140-L1157 HydrophobicContact CD1-CG 4.32Å; F1140-L1157 HydrophobicContact CE1-CD2 3.76Å; F1140-L1192 HydrophobicContact CE1-CD1 3.81Å; F1140-L1192 HydrophobicContact CE2-CD1 4.42Å; F1140-L1192 HydrophobicContact CZ-CD1 3.59Å
1141	Y	87.7	Confident	74.9	Confident	9 Å²	9	41.4 Å²	41.4	4%	0.035	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	149.2	162.2	-64.7	-76.4	0	0	0	109.8	W1087 I1095 K1128 I1129 I1131 L1151 G1152 L1154	W1087-Y1141 AromaticContact CH2-CD2 3.87Å; W1087-Y1141 HydrophobicContact CH2-CD2 3.87Å; W1087-Y1141 HydrophobicContact CH2-CE2 4.42Å; W1087-Y1141 HydrophobicContact CH2-CG 4.13Å; W1087-Y1141 AromaticContact CZ3-CD2 3.57Å; W1087-Y1141 HydrophobicContact CZ3-CD2 3.57Å; W1087-Y1141 AromaticContact CZ3-CE2 3.91Å; W1087-Y1141 HydrophobicContact CZ3-CE2 3.91Å; W1087-Y1141 HydrophobicContact CZ3-CG 4.3Å; I1095-Y1141 HydrophobicContact CD1-CE2 3.55Å; K1128-Y1141 CarbonylContact C-O 3.57Å; K1128-Y1141 WeakPolarHBondContact CA-O 3.3Å; I1129-Y1141 PolarHBondContact N-O 3.33Å; I1129-Y1141 PolarHBondContact O-N 2.7Å; I1131-Y1141 HydrophobicContact CD1-CD2 3.79Å; I1131-Y1141 HydrophobicContact CD1-CE2 3.58Å; Y1141-L1151 HydrophobicContact CD1-CD2 4.32Å; Y1141-L1151 HydrophobicContact CD1-CG 3.98Å; Y1141-L1151 HydrophobicContact CE1-CD2 3.57Å; Y1141-L1151 HydrophobicContact CE1-CG 3.69Å; Y1141-L1151 HydrophobicContact CE2-CD2 4.19Å; Y1141-L1151 VanDerWaalsContact CZ-CD2 3.48Å; Y1141-L1151 WeakPolarHBondContact OH-CD2 3.44Å; Y1141-G1152 WeakPolarHBondContact CD1-O 3.39Å; Y1141-G1152 WeakPolarHBondContact CE1-O 3.33Å; Y1141-L1154 HydrophobicContact CD1-CB 4.41Å; Y1141-L1154 HydrophobicContact CD1-CD1 4.5Å; Y1141-L1154 HydrophobicContact CD2-CD1 4.09Å; Y1141-L1154 HydrophobicContact CE1-CB 3.68Å; Y1141-L1154 HydrophobicContact CE1-CD1 4.22Å; Y1141-L1154 HydrophobicContact CE2-CD1 3.79Å; Y1141-L1154 HydrophobicContact CG-CD1 4.46Å
1142	E	82.4	Confident	73.7	Confident	47 Å²	47	42.2 Å²	42.2	22%	0.22	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.7	-178.2	-173.5	175.8	-92.9	0	0	110.5	K1128 F1140 N1144 R1155	K1128-E1142 WeakPolarHBondContact CE-OE1 3.48Å; K1128-E1142 HydrophobicContact CG-CB 4.46Å; K1128-E1142 HydrophobicContact CG-CG 4.29Å; F1140-E1142 HydrophobicContact CD2-CB 4.42Å; F1140-E1142 HydrophobicContact CE2-CB 4.28Å; E1142-N1144 PolarHBondContact O-N 2.84Å; E1142-N1144 VanDerWaalsContact O-N 3.1Å; E1142-N1144 PolarHBondContact OE2-ND2 3.31Å; E1142-R1155 IonicContact OE1-NH1 2.75Å; E1142-R1155 PolarHBondContact OE1-NH1 2.97Å; E1142-R1155 IonicContact OE2-CZ 3.62Å; E1142-R1155 IonicContact OE2-NH1 3.57Å; E1142-R1155 PolarHBondContact OE2-NH1 3.35Å; E1142-R1155 IonicContact OE2-NH2 2.76Å; E1142-R1155 PolarHBondContact OE2-NH2 3Å
1143	C	71	Confident	72.8	Confident	43 Å²	43	49.2 Å²	49.2	29%	0.291	28%	0.279	S	S	.	.			trans	-89.1	65.8	-167.1	-55.3	0	0	0	0	112.6	R998 E1127	R998-C1143 PolarHBondContact NH1-O 2.82Å; R998-C1143 PolarHBondContact NH2-O 3.2Å; E1127-C1143 HydrophobicContact CB-CB 4.5Å; E1127-C1143 WeakPolarHBondContact O-CB 3.49Å; E1127-C1143 PolarHBondContact O-N 3.01Å; E1127-C1143 PolarHBondContact O-SG 3.38Å
1144	N	62.7	Low	72.4	Confident	57 Å²	57	50.9 Å²	50.9	31%	0.305	29%	0.288	S	S	.	.			trans	-75.1	157.6	-175.6	-68.8	-32.8	0	0	0	114.2	E1142 D1146 N1147	E1142-N1144 PolarHBondContact O-N 2.84Å; E1142-N1144 VanDerWaalsContact O-N 3.1Å; E1142-N1144 PolarHBondContact OE2-ND2 3.31Å; N1144-D1146 PolarHBondContact O-N 3.27Å; N1144-N1147 PolarHBondContact O-N 2.91Å
1145	E	52.3	Low	72.4	Confident	73 Å²	73	55.4 Å²	55.4	34%	0.341	30%	0.297	S	S	.	.	S	Bend	trans	-66.7	-16.5	-178.6	-99.1	-134.9	-132.1	0	0	112.7	R1003 K1148	R1003-E1145 IonicContact CZ-OE1 3.92Å; R1003-E1145 IonicContact NH1-OE1 3.81Å; R1003-E1145 IonicContact NH1-OE2 3.65Å; R1003-E1145 IonicContact NH2-OE1 2.78Å; R1003-E1145 PolarHBondContact NH2-OE1 3.02Å; R1003-E1145 IonicContact NH2-OE2 3.02Å; E1145-K1148 WeakPolarHBondContact O-CG 2.92Å; E1145-K1148 PolarHBondContact O-NZ 3.27Å; E1145-K1148 WeakPolarHBondContact OE2-CE 3.39Å; E1145-K1148 IonicContact OE2-NZ 2.7Å; E1145-K1148 PolarHBondContact OE2-NZ 3.38Å
1146	D	49.7	Very low	72.3	Confident	147 Å²	147	55.1 Å²	55.1	79%	0.786	29%	0.293	S	S	*	.	S	Bend	trans	-86.3	-27.5	-178.3	-46.3	-69.1	0	0	0	112.6	N1144 K1148	N1144-D1146 PolarHBondContact O-N 3.27Å; D1146-K1148 PolarHBondContact O-N 3.49Å; D1146-K1148 VanDerWaalsContact O-N 3.07Å
1147	N	51.3	Low	72.4	Confident	65 Å²	65	55.5 Å²	55.5	35%	0.348	29%	0.293	S	S	.	.			trans	-86.1	44.9	179	-71.6	-11.7	0	0	0	112.6	N1144 G1149 G1152	N1144-N1147 PolarHBondContact O-N 2.91Å; N1147-G1149 PolarHBondContact O-N 3.48Å; N1147-G1149 VanDerWaalsContact O-N 3.08Å; N1147-G1152 WeakPolarHBondContact ND2-CA 3.5Å
1148	K	44.8	Very low	71.8	Confident	99 Å²	99	62.3 Å²	62.3	43%	0.43	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	102.1	176.3	-71.8	-176.4	-171.9	86.1	0	110.8	R1080 L1081 E1145 D1146	R1080-K1148 CarbonylContact O-C 3.38Å; L1081-K1148 HydrophobicContact CD2-CD 4.21Å; E1145-K1148 WeakPolarHBondContact O-CG 2.92Å; E1145-K1148 PolarHBondContact O-NZ 3.27Å; E1145-K1148 WeakPolarHBondContact OE2-CE 3.39Å; E1145-K1148 IonicContact OE2-NZ 2.7Å; E1145-K1148 PolarHBondContact OE2-NZ 3.38Å; D1146-K1148 PolarHBondContact O-N 3.49Å; D1146-K1148 VanDerWaalsContact O-N 3.07Å
1149	G	46.1	Very low	70.9	Confident	21 Å²	21	64.1 Å²	64.1	22%	0.216	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.1	1.1	173.3	0	0	0	0	0	115.5	R1080 F1082 N1147	R1080-G1149 PolarHBondContact O-N 2.73Å; F1082-G1149 VanDerWaalsContact CE2-C 3.43Å; F1082-G1149 VanDerWaalsContact CE2-CA 3.47Å; N1147-G1149 PolarHBondContact O-N 3.48Å; N1147-G1149 VanDerWaalsContact O-N 3.08Å
1150	T	51.7	Low	69.7	Low	74 Å²	74	71.7 Å²	71.7	45%	0.454	37%	0.365	S	S	.	.	S	Bend	trans	-128.4	148.8	176.2	41.7	0	0	0	0	111.4	G1152	T1150-G1152 PolarHBondContact O-N 3.35Å
1151	L	63	Low	68.6	Low	37 Å²	37	75.5 Å²	75.5	19%	0.194	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-64.5	127.2	162.7	-134.8	65.7	0	0	0	107.8	W1087 I1097 L1111 T1113 Y1141	W1087-L1151 HydrophobicContact CH2-CD1 3.33Å; W1087-L1151 HydrophobicContact CH2-CG 4.31Å; W1087-L1151 HydrophobicContact CZ2-CD1 3.61Å; W1087-L1151 HydrophobicContact CZ3-CD1 4.15Å; I1097-L1151 HydrophobicContact CD1-CD1 3.54Å; L1111-L1151 HydrophobicContact CD2-CB 4.02Å; L1111-L1151 HydrophobicContact CD2-CD1 4.22Å; T1113-L1151 HydrophobicContact CG2-CD2 3.85Å; Y1141-L1151 HydrophobicContact CD1-CD2 4.32Å; Y1141-L1151 HydrophobicContact CD1-CG 3.98Å; Y1141-L1151 HydrophobicContact CE1-CD2 3.57Å; Y1141-L1151 HydrophobicContact CE1-CG 3.69Å; Y1141-L1151 HydrophobicContact CE2-CD2 4.19Å; Y1141-L1151 VanDerWaalsContact CZ-CD2 3.48Å; Y1141-L1151 WeakPolarHBondContact OH-CD2 3.44Å
1152	G	67.7	Low	67.8	Low	17 Å²	17	85.2 Å²	85.2	18%	0.175	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-68.9	167.9	164.4	0	0	0	0	0	110.7	Y1141 N1147 T1150	Y1141-G1152 WeakPolarHBondContact CD1-O 3.39Å; Y1141-G1152 WeakPolarHBondContact CE1-O 3.33Å; N1147-G1152 WeakPolarHBondContact ND2-CA 3.5Å; T1150-G1152 PolarHBondContact O-N 3.35Å
1153	D	75.2	Confident	67.5	Low	148 Å²	148	84.2 Å²	84.2	79%	0.791	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-61.6	140.3	176.5	-61.8	-55.5	0	0	0	112.1	R1155	D1153-R1155 PolarHBondContact O-N 2.92Å; D1153-R1155 VanDerWaalsContact O-N 3.14Å
1154	L	84.9	Confident	68.2	Low	42 Å²	42	84 Å²	84	22%	0.22	42%	0.419	C	S	.	.			trans	-69.9	107.9	175.3	178.4	61.1	0	0	0	109.7	L1115 Y1141 M1156	L1115-L1154 HydrophobicContact CD1-CD2 3.77Å; L1115-L1154 HydrophobicContact CD2-CD2 3.74Å; L1115-L1154 HydrophobicContact CG-CD2 4.4Å; Y1141-L1154 HydrophobicContact CD1-CB 4.41Å; Y1141-L1154 HydrophobicContact CD1-CD1 4.5Å; Y1141-L1154 HydrophobicContact CD2-CD1 4.09Å; Y1141-L1154 HydrophobicContact CE1-CB 3.68Å; Y1141-L1154 HydrophobicContact CE1-CD1 4.22Å; Y1141-L1154 HydrophobicContact CE2-CD1 3.79Å; Y1141-L1154 HydrophobicContact CG-CD1 4.46Å; L1154-M1156 HydrophobicContact CD2-SD 3.73Å; L1154-M1156 HydrophobicContact CG-SD 3.79Å; L1154-M1156 PolarHBondContact O-N 2.93Å
1155	R	88.8	Confident	69.4	Low	121 Å²	121	84.1 Å²	84.1	46%	0.457	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	107.9	176.8	-65.5	-173	-174.1	153.1	7.8	109.9	G1139 F1140 E1142 D1153	G1139-R1155 CarbonylContact C-O 3.6Å; G1139-R1155 VanDerWaalsContact CA-O 3.24Å; G1139-R1155 WeakPolarHBondContact CA-O 3.44Å; F1140-R1155 HydrophobicContact CD1-CB 4.05Å; F1140-R1155 VanDerWaalsContact CD1-O 3.28Å; F1140-R1155 WeakPolarHBondContact CD1-O 3.04Å; F1140-R1155 HydrophobicContact CE1-CB 3.64Å; F1140-R1155 HydrophobicContact CE2-CB 4.23Å; F1140-R1155 HydrophobicContact CZ-CB 3.75Å; F1140-R1155 HydrophobicContact CZ-CG 4.4Å; F1140-R1155 PolarHBondContact N-O 3.18Å; F1140-R1155 PolarHBondContact O-N 2.89Å; E1142-R1155 IonicContact OE1-NH1 2.75Å; E1142-R1155 PolarHBondContact OE1-NH1 2.97Å; E1142-R1155 IonicContact OE2-CZ 3.62Å; E1142-R1155 IonicContact OE2-NH1 3.57Å; E1142-R1155 PolarHBondContact OE2-NH1 3.35Å; E1142-R1155 IonicContact OE2-NH2 2.76Å; E1142-R1155 PolarHBondContact OE2-NH2 3Å; D1153-R1155 PolarHBondContact O-N 2.92Å; D1153-R1155 VanDerWaalsContact O-N 3.14Å
1156	M	88.3	Confident	71.4	Confident	81 Å²	81	80.8 Å²	80.8	40%	0.399	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	134.2	173.6	-59.1	-50.3	-60	0	0	110.7	L1133 T1137 L1154 Q1158	L1133-M1156 HydrophobicContact CD1-CE 4.14Å; T1137-M1156 VanDerWaalsContact CB-CE 3.48Å; T1137-M1156 HydrophobicContact CG2-CE 4.45Å; T1137-M1156 WeakPolarHBondContact OG1-CE 3.38Å; L1154-M1156 HydrophobicContact CD2-SD 3.73Å; L1154-M1156 HydrophobicContact CG-SD 3.79Å; L1154-M1156 PolarHBondContact O-N 2.93Å; M1156-Q1158 PolarHBondContact O-N 3.19Å
1157	L	86.7	Confident	73.4	Confident	20 Å²	20	74.9 Å²	74.9	11%	0.105	38%	0.377	C	S	.	.			trans	-69.8	123.7	173	-66.6	179.1	0	0	0	109.5	I1138 F1140 I1159 I1187 L1192	I1138-L1157 HydrophobicContact CB-CD1 4.09Å; I1138-L1157 HydrophobicContact CG2-CD1 3.77Å; I1138-L1157 WeakPolarHBondContact O-CB 3.21Å; I1138-L1157 PolarHBondContact O-N 2.98Å; F1140-L1157 HydrophobicContact CD1-CD2 3.8Å; F1140-L1157 HydrophobicContact CD1-CG 4.32Å; F1140-L1157 HydrophobicContact CE1-CD2 3.76Å; L1157-I1159 VanDerWaalsContact C-N 3.29Å; L1157-I1159 HydrophobicContact CB-CD1 4.12Å; L1157-I1159 HydrophobicContact CB-CG1 3.92Å; L1157-I1159 PolarHBondContact O-N 3.44Å; L1157-I1187 HydrophobicContact CD1-CD1 3.98Å; L1157-I1187 HydrophobicContact CD1-CG2 4.41Å; L1157-L1192 HydrophobicContact CD2-CB 3.94Å; L1157-L1192 HydrophobicContact CD2-CD2 4.31Å; L1157-L1192 HydrophobicContact CD2-CG 4.49Å
1158	Q	78	Confident	75.4	Confident	193 Å²	193	72.3 Å²	72.3	90%	0.902	37%	0.365	S	S	*	.			trans	-76.3	84.7	173.5	-70.4	-163	-8.3	0	0	110.1	M1156	M1156-Q1158 PolarHBondContact O-N 3.19Å
1159	I	73.9	Confident	77.8	Confident	41 Å²	41	68.4 Å²	68.4	21%	0.21	35%	0.349	C	S	.	.			trans	-95.9	118.4	175.2	-57.7	179.3	0	0	0	107.5	I1138 L1157 H1161 F1163 I1187 I1194	I1138-I1159 HydrophobicContact CD1-CD1 4.26Å; L1157-I1159 VanDerWaalsContact C-N 3.29Å; L1157-I1159 HydrophobicContact CB-CD1 4.12Å; L1157-I1159 HydrophobicContact CB-CG1 3.92Å; L1157-I1159 PolarHBondContact O-N 3.44Å; I1159-H1161 WeakPolarHBondContact CG2-O 3.09Å; I1159-H1161 PolarHBondContact O-N 3.11Å; I1159-F1163 HydrophobicContact CG2-CD2 3.92Å; I1159-F1163 HydrophobicContact CG2-CE2 3.45Å; I1159-F1163 VanDerWaalsContact CG2-CE2 3.45Å; I1159-F1163 HydrophobicContact CG2-CZ 4.36Å; I1159-I1187 HydrophobicContact CD1-CD1 3.99Å; I1159-I1194 HydrophobicContact CG2-CD1 4.03Å; I1159-I1194 HydrophobicContact CG2-CG1 4.37Å
1160	E	66.3	Low	80.1	Confident	161 Å²	161	68.5 Å²	68.5	75%	0.752	35%	0.345	S	S	*	.	S	Bend	trans	-61.9	-15.6	-174	-65.6	169.6	-176.9	0	0	114.1
1161	H	68.7	Low	82	Confident	89 Å²	89	66.5 Å²	66.5	41%	0.412	33%	0.332	S	S	.	.	S	Bend	trans	-125.8	129.1	-177.8	-56.8	-26.4	0	0	0	110.2	I1159 F1163 Q1211	I1159-H1161 WeakPolarHBondContact CG2-O 3.09Å; I1159-H1161 PolarHBondContact O-N 3.11Å; H1161-F1163 HydrophobicContact CB-CD1 4.43Å; H1161-F1163 HydrophobicContact CB-CE1 3.7Å; H1161-F1163 HydrophobicContact CB-CE2 4.42Å; H1161-F1163 HydrophobicContact CB-CZ 3.71Å; H1161-F1163 PolarHBondContact O-N 3.14Å; H1161-Q1211 PolarHBondContact CD2-OE1 3.24Å; H1161-Q1211 PolarHBondContact NE2-NE2 3.39Å
1162	K	69.7	Low	83.3	Confident	214 Å²	214	65 Å²	65	93%	0.93	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-72.4	119.5	171.6	-72.1	-176.4	177.8	177.8	0	109.4
1163	F	76.6	Confident	84.1	Confident	26 Å²	26	66.3 Å²	66.3	11%	0.114	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-101.7	160.4	178.6	-62.9	-50.7	0	0	0	112.3	G1136 I1159 H1161 T1180 L1185 I1194 L1213	G1136-F1163 WeakPolarHBondContact CA-O 3.42Å; I1159-F1163 HydrophobicContact CG2-CD2 3.92Å; I1159-F1163 HydrophobicContact CG2-CE2 3.45Å; I1159-F1163 VanDerWaalsContact CG2-CE2 3.45Å; I1159-F1163 HydrophobicContact CG2-CZ 4.36Å; H1161-F1163 HydrophobicContact CB-CD1 4.43Å; H1161-F1163 HydrophobicContact CB-CE1 3.7Å; H1161-F1163 HydrophobicContact CB-CE2 4.42Å; H1161-F1163 HydrophobicContact CB-CZ 3.71Å; H1161-F1163 PolarHBondContact O-N 3.14Å; F1163-T1180 HydrophobicContact CB-CG2 4.35Å; F1163-L1185 HydrophobicContact CD2-CD1 4.27Å; F1163-L1185 HydrophobicContact CD2-CD2 3.61Å; F1163-L1185 HydrophobicContact CE2-CD1 3.63Å; F1163-L1185 HydrophobicContact CE2-CD2 3.79Å; F1163-L1185 HydrophobicContact CE2-CG 4.34Å; F1163-L1185 HydrophobicContact CZ-CD1 4.17Å; F1163-I1194 HydrophobicContact CE2-CD1 3.98Å; F1163-I1194 HydrophobicContact CZ-CD1 4.02Å; F1163-L1213 HydrophobicContact CD1-CD1 4.45Å; F1163-L1213 HydrophobicContact CD1-CD2 4.24Å; F1163-L1213 HydrophobicContact CE1-CD1 4.2Å; F1163-L1213 HydrophobicContact CE1-CD2 3.49Å; F1163-L1213 VanDerWaalsContact CE1-CD2 3.49Å; F1163-L1213 HydrophobicContact CE1-CG 4.43Å; F1163-L1213 HydrophobicContact CZ-CD1 4.43Å; F1163-L1213 HydrophobicContact CZ-CD2 4.01Å
1164	P	85.4	Confident	84.7	Confident	39 Å²	39	61 Å²	61	25%	0.253	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-57.4	153.4	168.4	-22.7	33.8	0	0	0	111.8	V1166 R1181	P1164-V1166 PolarHBondContact O-N 3.04Å; P1164-R1181 HydrophobicContact CB-CG 3.78Å; P1164-R1181 HydrophobicContact CG-CG 4.05Å
1165	P	89.3	Confident	85	Confident	59 Å²	59	60.2 Å²	60.2	38%	0.383	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-49.9	129	178	-29.3	37.1	0	0	0	113.1	G1134 S1167	G1134-P1165 VanDerWaalsContact O-CG 3.27Å; G1134-P1165 WeakPolarHBondContact O-CG 3.49Å; P1165-S1167 PolarHBondContact O-N 3.28Å
1166	V	92.8	Very high	85.2	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	128.7	177.5	178.5	0	0	0	0	109.2	R1120 A1132 I1138 P1164 A1168 M1169 C1178 G1179 T1180	R1120-V1166 WeakPolarHBondContact CB-O 3.34Å; A1132-V1166 HydrophobicContact CB-CB 3.8Å; A1132-V1166 HydrophobicContact CB-CG1 4.15Å; A1132-V1166 HydrophobicContact CB-CG2 4.45Å; I1138-V1166 HydrophobicContact CD1-CG2 3.95Å; I1138-V1166 HydrophobicContact CG1-CG2 4.05Å; P1164-V1166 PolarHBondContact O-N 3.04Å; V1166-A1168 VanDerWaalsContact CG1-O 3.27Å; V1166-A1168 WeakPolarHBondContact CG1-O 3.49Å; V1166-M1169 HydrophobicContact CG1-CG 3.64Å; V1166-M1169 HydrophobicContact CG1-SD 4.43Å; V1166-C1178 HydrophobicContact CG1-CB 3.85Å; V1166-C1178 HydrophobicContact CG2-CB 4.11Å; V1166-G1179 CarbonylContact C-O 3.57Å; V1166-G1179 VanDerWaalsContact CA-O 3.25Å; V1166-G1179 WeakPolarHBondContact CA-O 3.34Å; V1166-T1180 HydrophobicContact CG2-CG2 3.75Å
1167	S	92.5	Very high	85.5	Confident	24 Å²	24	50.6 Å²	50.6	17%	0.168	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-30	-177.8	49.9	0	0	0	0	113.5	P1165 G1179 V1224	P1165-S1167 PolarHBondContact O-N 3.28Å; S1167-G1179 PolarHBondContact N-O 3.38Å; S1167-G1179 PolarHBondContact OG-O 2.72Å; S1167-V1224 WeakPolarHBondContact CB-O 3.35Å; S1167-V1224 PolarHBondContact OG-O 3.45Å
1168	A	93.9	Very high	85.9	Confident	11 Å²	11	49.7 Å²	49.7	9%	0.091	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	151.3	176.5	0	0	0	0	0	110.2	V1166 G1179 L1227	V1166-A1168 VanDerWaalsContact CG1-O 3.27Å; V1166-A1168 WeakPolarHBondContact CG1-O 3.49Å; A1168-G1179 PolarHBondContact O-N 3.34Å; A1168-L1227 HydrophobicContact CB-CB 4.29Å; A1168-L1227 HydrophobicContact CB-CD1 4.06Å; A1168-L1227 HydrophobicContact CB-CG 4.11Å
1169	M	94.8	Very high	86.7	Confident	17 Å²	17	40.5 Å²	40.5	8%	0.084	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.1	170.6	-61.7	-168.2	-68	0	0	111.2	C1121 T1123 A1132 V1166 L1176 W1177	C1121-M1169 HydrophobicContact CB-CE 3.93Å; C1121-M1169 HydrophobicContact CB-CG 4.34Å; C1121-M1169 WeakPolarHBondContact O-CE 3.49Å; T1123-M1169 HydrophobicContact CG2-CB 4.36Å; T1123-M1169 HydrophobicContact CG2-CE 4.13Å; A1132-M1169 HydrophobicContact CB-CE 3.92Å; A1132-M1169 HydrophobicContact CB-SD 4.08Å; V1166-M1169 HydrophobicContact CG1-CG 3.64Å; V1166-M1169 HydrophobicContact CG1-SD 4.43Å; M1169-L1176 HydrophobicContact CB-CD1 4.15Å; M1169-L1176 HydrophobicContact SD-CD1 4.22Å; M1169-L1176 HydrophobicContact SD-CD2 4.19Å; M1169-W1177 CarbonylContact C-O 3.54Å; M1169-W1177 VanDerWaalsContact CA-O 3.28Å; M1169-W1177 WeakPolarHBondContact CA-O 3.24Å
1170	T	94.1	Very high	87.4	Confident	23 Å²	23	38.6 Å²	38.6	14%	0.141	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	164.2	165.5	-161.1	0	0	0	0	110.2	W1177 L1227 A1229 V1234	T1170-W1177 HydrophobicContact CG2-CB 4.01Å; T1170-W1177 PolarHBondContact N-O 3.49Å; T1170-W1177 PolarHBondContact O-N 2.87Å; T1170-L1227 HydrophobicContact CG2-CB 3.82Å; T1170-L1227 HydrophobicContact CG2-CD1 4.42Å; T1170-A1229 HydrophobicContact CG2-CB 4.12Å; T1170-V1234 HydrophobicContact CG2-CG1 4.28Å
1171	V	92	Very high	88.6	Confident	31 Å²	31	37.3 Å²	37.3	19%	0.188	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.8	177.4	179.5	0	0	0	0	110	T1123 Y1125 K1175 L1176 L1189	T1123-V1171 HydrophobicContact CG2-CG2 4.43Å; Y1125-V1171 HydrophobicContact CD2-CB 4.26Å; Y1125-V1171 HydrophobicContact CD2-CG1 3.6Å; Y1125-V1171 HydrophobicContact CD2-CG2 4.45Å; Y1125-V1171 HydrophobicContact CE2-CG1 3.69Å; Y1125-V1171 HydrophobicContact CG-CG1 4.05Å; Y1125-V1171 HydrophobicContact CG-CG2 4.39Å; V1171-K1175 WeakPolarHBondContact CA-O 3.46Å; V1171-L1176 HydrophobicContact CG2-CD1 3.85Å; V1171-L1189 HydrophobicContact CG1-CD1 3.64Å; V1171-L1189 HydrophobicContact CG2-CD1 4.21Å
1172	A	89.5	Confident	89.6	Confident	5 Å²	5	33.7 Å²	33.7	4%	0.041	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	131.7	178.4	0	0	0	0	0	110.4	N1174 K1175 A1229 V1234 A1249	A1172-N1174 VanDerWaalsContact C-N 3.33Å; A1172-N1174 PolarHBondContact O-N 2.73Å; A1172-K1175 PolarHBondContact N-O 3.43Å; A1172-K1175 WeakPolarHBondContact O-CB 3.49Å; A1172-K1175 PolarHBondContact O-N 3.19Å; A1172-A1229 HydrophobicContact CB-CB 3.91Å; A1172-V1234 HydrophobicContact CB-CG2 3.54Å; A1172-A1249 HydrophobicContact CB-CB 4.1Å
1173	T	85.7	Confident	90.6	Very high	45 Å²	45	26.3 Å²	26.3	28%	0.276	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	47.1	179.2	57.8	0	0	0	0	114.6	K1175 L1232 A1249	T1173-K1175 VanDerWaalsContact C-N 3.27Å; T1173-K1175 PolarHBondContact O-N 3.32Å; T1173-L1232 HydrophobicContact CG2-CD2 3.78Å; T1173-L1232 HydrophobicContact CG2-CG 4.25Å; T1173-A1249 HydrophobicContact CG2-CB 3.96Å
1174	N	86.4	Confident	91.3	Very high	37 Å²	37	25 Å²	25	20%	0.198	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	32.9	-177.1	-160.9	32.8	0	0	0	114.8	Y1125 A1172 L1189 N1190	Y1125-N1174 WeakPolarHBondContact CE1-OD1 3.26Å; Y1125-N1174 PolarHBondContact OH-OD1 2.86Å; A1172-N1174 VanDerWaalsContact C-N 3.33Å; A1172-N1174 PolarHBondContact O-N 2.73Å; N1174-L1189 WeakPolarHBondContact O-CB 3.37Å; N1174-L1189 PolarHBondContact O-N 2.95Å; N1174-N1190 VanDerWaalsContact ND2-CG 3.28Å; N1174-N1190 PolarHBondContact ND2-ND2 2.86Å; N1174-N1190 PolarHBondContact ND2-OD1 2.88Å
1175	K	90.8	Very high	91.6	Very high	26 Å²	26	23.2 Å²	23.2	11%	0.113	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.5	174.8	-54.5	175.1	-157.9	-173.7	0	109.9	V1171 A1172 T1173 V1186 I1187 E1195 F1252	V1171-K1175 WeakPolarHBondContact CA-O 3.46Å; A1172-K1175 PolarHBondContact N-O 3.43Å; A1172-K1175 WeakPolarHBondContact O-CB 3.49Å; A1172-K1175 PolarHBondContact O-N 3.19Å; T1173-K1175 VanDerWaalsContact C-N 3.27Å; T1173-K1175 PolarHBondContact O-N 3.32Å; K1175-V1186 HydrophobicContact CB-CG1 3.75Å; K1175-V1186 HydrophobicContact CD-CG1 3.95Å; K1175-V1186 HydrophobicContact CG-CG1 4.34Å; K1175-I1187 CarbonylContact C-O 3.48Å; K1175-I1187 VanDerWaalsContact CA-O 3.28Å; K1175-I1187 WeakPolarHBondContact CA-O 3.38Å; K1175-E1195 HydrophobicContact CD-CG 4.42Å; K1175-E1195 WeakPolarHBondContact CE-OE1 3.37Å; K1175-E1195 IonicContact NZ-OE1 2.7Å; K1175-E1195 PolarHBondContact NZ-OE1 3.44Å; K1175-F1252 HydrophobicContact CD-CZ 4.3Å
1176	L	94	Very high	91.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.1	173.8	-179.5	68	0	0	0	109	T1123 F1130 M1169 V1171 I1187 L1189	T1123-L1176 HydrophobicContact CG2-CD1 3.67Å; F1130-L1176 HydrophobicContact CB-CD2 4.17Å; F1130-L1176 HydrophobicContact CD1-CD2 3.95Å; F1130-L1176 HydrophobicContact CG-CD2 4.05Å; M1169-L1176 HydrophobicContact CB-CD1 4.15Å; M1169-L1176 HydrophobicContact SD-CD1 4.22Å; M1169-L1176 HydrophobicContact SD-CD2 4.19Å; V1171-L1176 HydrophobicContact CG2-CD1 3.85Å; L1176-I1187 HydrophobicContact CB-CB 4.36Å; L1176-I1187 PolarHBondContact N-O 3.18Å; L1176-I1187 PolarHBondContact O-N 3.23Å; L1176-L1189 HydrophobicContact CB-CD1 4.34Å; L1176-L1189 HydrophobicContact CB-CD2 3.88Å; L1176-L1189 HydrophobicContact CB-CG 4.18Å
1177	W	94.9	Very high	91.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	118.7	179.1	-74.2	61	0	0	0	108.9	M1169 T1170 L1184 V1186 F1214 L1227 V1234 A1249 F1252	M1169-W1177 CarbonylContact C-O 3.54Å; M1169-W1177 VanDerWaalsContact CA-O 3.28Å; M1169-W1177 WeakPolarHBondContact CA-O 3.24Å; T1170-W1177 HydrophobicContact CG2-CB 4.01Å; T1170-W1177 PolarHBondContact N-O 3.49Å; T1170-W1177 PolarHBondContact O-N 2.87Å; W1177-L1184 HydrophobicContact CE3-CD1 3.73Å; W1177-L1184 HydrophobicContact CZ3-CD1 3.67Å; W1177-V1186 HydrophobicContact CD2-CG2 3.85Å; W1177-V1186 HydrophobicContact CE3-CG2 4.14Å; W1177-V1186 HydrophobicContact CG-CG2 4.29Å; W1177-V1186 HydrophobicContact CH2-CG2 4.41Å; W1177-V1186 HydrophobicContact CZ2-CG2 4.1Å; W1177-V1186 HydrophobicContact CZ3-CG2 4.43Å; W1177-F1214 HydrophobicContact CH2-CZ 4.36Å; W1177-F1214 HydrophobicContact CZ3-CZ 4.03Å; W1177-L1227 WeakPolarHBondContact O-CD1 3.36Å; W1177-V1234 HydrophobicContact CD2-CG1 4.1Å; W1177-V1234 HydrophobicContact CD2-CG2 4.04Å; W1177-V1234 HydrophobicContact CE3-CB 4.19Å; W1177-V1234 HydrophobicContact CE3-CG1 3.7Å; W1177-V1234 HydrophobicContact CE3-CG2 4.19Å; W1177-V1234 HydrophobicContact CH2-CB 4.49Å; W1177-V1234 HydrophobicContact CH2-CG2 4.26Å; W1177-V1234 HydrophobicContact CZ2-CG2 4.13Å; W1177-V1234 HydrophobicContact CZ3-CB 4.16Å; W1177-V1234 HydrophobicContact CZ3-CG1 4.09Å; W1177-V1234 HydrophobicContact CZ3-CG2 4.28Å; W1177-A1249 HydrophobicContact CZ2-CB 4.32Å; W1177-A1249 WeakPolarHBondContact CZ2-O 3.47Å; W1177-F1252 AromaticContact CH2-CD1 3.58Å; W1177-F1252 HydrophobicContact CH2-CD1 3.58Å; W1177-F1252 HydrophobicContact CH2-CE1 4.08Å; W1177-F1252 AromaticContact CZ2-CD1 3.56Å; W1177-F1252 HydrophobicContact CZ2-CD1 3.56Å; W1177-F1252 AromaticContact CZ2-CE1 3.54Å; W1177-F1252 HydrophobicContact CZ2-CE1 3.54Å
1178	C	94.8	Very high	91.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.4	-176.7	-60.9	0	0	0	0	110.5	V1166 L1184 L1185	V1166-C1178 HydrophobicContact CG1-CB 3.85Å; V1166-C1178 HydrophobicContact CG2-CB 4.11Å; C1178-L1184 WeakPolarHBondContact O-CA 3.39Å; C1178-L1185 HydrophobicContact CB-CB 4.22Å; C1178-L1185 PolarHBondContact N-O 3.47Å; C1178-L1185 PolarHBondContact O-N 2.94Å
1179	G	93.6	Very high	91.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	121.4	170	0	0	0	0	0	111.4	V1166 S1167 A1168	V1166-G1179 CarbonylContact C-O 3.57Å; V1166-G1179 VanDerWaalsContact CA-O 3.25Å; V1166-G1179 WeakPolarHBondContact CA-O 3.34Å; S1167-G1179 PolarHBondContact N-O 3.38Å; S1167-G1179 PolarHBondContact OG-O 2.72Å; A1168-G1179 PolarHBondContact O-N 3.34Å
1180	T	90	Very high	90.9	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	97.3	-178.7	51.9	0	0	0	0	110.1	F1163 V1166 N1182 H1183 L1185	F1163-T1180 HydrophobicContact CB-CG2 4.35Å; V1166-T1180 HydrophobicContact CG2-CG2 3.75Å; T1180-N1182 PolarHBondContact O-N 3.36Å; T1180-H1183 PolarHBondContact N-O 2.96Å; T1180-H1183 WeakPolarHBondContact O-CB 3.3Å; T1180-H1183 PolarHBondContact O-N 2.98Å; T1180-H1183 VanDerWaalsContact O-N 3.08Å; T1180-L1185 HydrophobicContact CG2-CB 4.48Å
1181	R	90.7	Very high	90.5	Very high	134 Å²	134	28.4 Å²	28.4	51%	0.506	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	-133.6	-161.8	-70.8	-177.9	175.7	159.4	-5.4	110.3	P1164 H1183 S1222 Y1223 V1224	P1164-R1181 HydrophobicContact CB-CG 3.78Å; P1164-R1181 HydrophobicContact CG-CG 4.05Å; R1181-H1183 PolarHBondContact O-N 3.09Å; R1181-S1222 CarbonylContact C-O 3.54Å; R1181-Y1223 VanDerWaalsContact O-CA 3.29Å; R1181-Y1223 WeakPolarHBondContact O-CA 3.48Å; R1181-V1224 PolarHBondContact O-N 3.35Å
1182	N	90.8	Very high	90.2	Very high	12 Å²	12	29.1 Å²	29.1	6%	0.064	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	9.3	-179.5	71.2	-42.8	0	0	0	114.3	T1180 A1215 V1216 N1217 D1219 S1222	T1180-N1182 PolarHBondContact O-N 3.36Å; N1182-A1215 WeakPolarHBondContact O-CA 3.33Å; N1182-V1216 WeakPolarHBondContact O-CG2 3.33Å; N1182-V1216 PolarHBondContact O-N 3.05Å; N1182-N1217 HydrophobicContact CB-CB 4.3Å; N1182-N1217 PolarHBondContact ND2-O 3.16Å; N1182-D1219 WeakPolarHBondContact CB-O 3.28Å; N1182-D1219 PolarHBondContact ND2-O 3.45Å; N1182-S1222 PolarHBondContact N-O 3.26Å; N1182-S1222 VanDerWaalsContact N-O 3.12Å
1183	H	90.3	Very high	90	Very high	59 Å²	59	35.8 Å²	35.8	27%	0.273	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	154.2	178	-65.3	66.8	0	0	0	111.8	T1180 R1181 L1213 F1214 A1215	T1180-H1183 PolarHBondContact N-O 2.96Å; T1180-H1183 WeakPolarHBondContact O-CB 3.3Å; T1180-H1183 PolarHBondContact O-N 2.98Å; T1180-H1183 VanDerWaalsContact O-N 3.08Å; R1181-H1183 PolarHBondContact O-N 3.09Å; H1183-L1213 HydrophobicContact CB-CD1 3.98Å; H1183-F1214 CarbonylContact C-O 3.53Å; H1183-F1214 VanDerWaalsContact CA-O 3.24Å; H1183-F1214 WeakPolarHBondContact CA-O 3.38Å; H1183-A1215 PolarHBondContact CD2-N 3.2Å
1184	L	92.1	Very high	89.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	134.4	159.2	-73	177.9	0	0	0	109.9	W1177 C1178 L1213 F1214 V1216 V1224 L1227 L1236	W1177-L1184 HydrophobicContact CE3-CD1 3.73Å; W1177-L1184 HydrophobicContact CZ3-CD1 3.67Å; C1178-L1184 WeakPolarHBondContact O-CA 3.39Å; L1184-L1213 VanDerWaalsContact O-CA 3.29Å; L1184-L1213 WeakPolarHBondContact O-CA 3.49Å; L1184-F1214 HydrophobicContact CB-CE1 4.01Å; L1184-F1214 HydrophobicContact CB-CE2 4.03Å; L1184-F1214 HydrophobicContact CB-CZ 3.74Å; L1184-F1214 HydrophobicContact CD1-CE2 3.8Å; L1184-F1214 HydrophobicContact CD1-CZ 3.68Å; L1184-F1214 HydrophobicContact CG-CE2 4.41Å; L1184-F1214 HydrophobicContact CG-CZ 4.35Å; L1184-F1214 PolarHBondContact N-O 3.39Å; L1184-F1214 PolarHBondContact O-N 3.12Å; L1184-V1216 HydrophobicContact CB-CG1 4.34Å; L1184-V1216 HydrophobicContact CD1-CG1 3.72Å; L1184-V1216 HydrophobicContact CG-CG1 3.75Å; L1184-V1216 HydrophobicContact CG-CG2 4.49Å; L1184-V1224 HydrophobicContact CD2-CG1 4.45Å; L1184-V1224 HydrophobicContact CD2-CG2 4.16Å; L1184-L1227 HydrophobicContact CD2-CD1 4.37Å; L1184-L1227 HydrophobicContact CD2-CD2 4.09Å; L1184-L1236 HydrophobicContact CD1-CD2 3.65Å; L1184-L1236 HydrophobicContact CD2-CD2 4.49Å; L1184-L1236 HydrophobicContact CG-CD2 4.23Å
1185	L	91	Very high	89.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.2	168.4	172	69.3	0	0	0	108.3	I1138 F1163 C1178 T1180 I1187 I1194 L1213	I1138-L1185 HydrophobicContact CD1-CD2 4.34Å; F1163-L1185 HydrophobicContact CD2-CD1 4.27Å; F1163-L1185 HydrophobicContact CD2-CD2 3.61Å; F1163-L1185 HydrophobicContact CE2-CD1 3.63Å; F1163-L1185 HydrophobicContact CE2-CD2 3.79Å; F1163-L1185 HydrophobicContact CE2-CG 4.34Å; F1163-L1185 HydrophobicContact CZ-CD1 4.17Å; C1178-L1185 HydrophobicContact CB-CB 4.22Å; C1178-L1185 PolarHBondContact N-O 3.47Å; C1178-L1185 PolarHBondContact O-N 2.94Å; T1180-L1185 HydrophobicContact CG2-CB 4.48Å; L1185-I1187 HydrophobicContact CD2-CD1 4.11Å; L1185-I1187 HydrophobicContact CD2-CG1 4.35Å; L1185-I1187 HydrophobicContact CG-CD1 4.48Å; L1185-I1187 HydrophobicContact CG-CG1 4.19Å; L1185-I1194 HydrophobicContact CD1-CD1 4.16Å; L1185-I1194 HydrophobicContact CD1-CG1 4.16Å; L1185-I1194 HydrophobicContact CD1-CG2 3.72Å; L1185-L1213 HydrophobicContact CB-CD1 4.11Å; L1185-L1213 HydrophobicContact CD1-CD1 4.33Å
1186	V	92.3	Very high	88.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.2	175.8	-175.2	0	0	0	0	110.4	K1175 W1177 I1194 E1195 C1212 F1214 F1252	K1175-V1186 HydrophobicContact CB-CG1 3.75Å; K1175-V1186 HydrophobicContact CD-CG1 3.95Å; K1175-V1186 HydrophobicContact CG-CG1 4.34Å; W1177-V1186 HydrophobicContact CD2-CG2 3.85Å; W1177-V1186 HydrophobicContact CE3-CG2 4.14Å; W1177-V1186 HydrophobicContact CG-CG2 4.29Å; W1177-V1186 HydrophobicContact CH2-CG2 4.41Å; W1177-V1186 HydrophobicContact CZ2-CG2 4.1Å; W1177-V1186 HydrophobicContact CZ3-CG2 4.43Å; V1186-I1194 WeakPolarHBondContact O-CG2 3.33Å; V1186-E1195 HydrophobicContact CB-CB 4.26Å; V1186-E1195 HydrophobicContact CG1-CB 4.02Å; V1186-E1195 PolarHBondContact O-N 3.44Å; V1186-C1212 HydrophobicContact CB-CB 3.94Å; V1186-C1212 HydrophobicContact CG2-CB 4.4Å; V1186-C1212 PolarHBondContact N-O 3.03Å; V1186-F1214 HydrophobicContact CG2-CE1 4.09Å; V1186-F1252 HydrophobicContact CB-CE1 4.17Å; V1186-F1252 HydrophobicContact CG1-CE1 3.88Å; V1186-F1252 HydrophobicContact CG1-CZ 4.42Å; V1186-F1252 HydrophobicContact CG2-CD1 3.96Å; V1186-F1252 HydrophobicContact CG2-CE1 3.86Å
1187	I	90.9	Very high	87.5	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.7	179.3	-58.6	175.1	0	0	0	108.8	I1138 L1157 I1159 K1175 L1176 L1185 K1193	I1138-I1187 HydrophobicContact CD1-CD1 3.73Å; L1157-I1187 HydrophobicContact CD1-CD1 3.98Å; L1157-I1187 HydrophobicContact CD1-CG2 4.41Å; I1159-I1187 HydrophobicContact CD1-CD1 3.99Å; K1175-I1187 CarbonylContact C-O 3.48Å; K1175-I1187 VanDerWaalsContact CA-O 3.28Å; K1175-I1187 WeakPolarHBondContact CA-O 3.38Å; L1176-I1187 HydrophobicContact CB-CB 4.36Å; L1176-I1187 PolarHBondContact N-O 3.18Å; L1176-I1187 PolarHBondContact O-N 3.23Å; L1185-I1187 HydrophobicContact CD2-CD1 4.11Å; L1185-I1187 HydrophobicContact CD2-CG1 4.35Å; L1185-I1187 HydrophobicContact CG-CD1 4.48Å; L1185-I1187 HydrophobicContact CG-CG1 4.19Å; I1187-K1193 WeakPolarHBondContact CA-O 3.49Å
1188	N	89.3	Confident	85.7	Confident	34 Å²	34	47.6 Å²	47.6	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.1	176.8	-170.7	-67	0	0	0	110.1	N1190 S1191 L1192 K1193 E1195	N1188-N1190 PolarHBondContact O-N 3.21Å; N1188-N1190 PolarHBondContact OD1-N 3.32Å; N1188-S1191 WeakPolarHBondContact CB-OG 3.41Å; N1188-S1191 PolarHBondContact OD1-N 3.37Å; N1188-L1192 VanDerWaalsContact O-CA 3.26Å; N1188-L1192 WeakPolarHBondContact O-CA 3.25Å; N1188-L1192 PolarHBondContact O-N 3.02Å; N1188-K1193 PolarHBondContact N-O 2.93Å; N1188-E1195 WeakPolarHBondContact CB-OE2 3.5Å; N1188-E1195 PolarHBondContact ND2-OE2 2.98Å
1189	L	88.5	Confident	83.7	Confident	12 Å²	12	52.2 Å²	52.2	6%	0.063	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-15.9	-173.1	-71	169.6	0	0	0	114.1	Y1125 F1130 V1171 N1174 L1176	Y1125-L1189 HydrophobicContact CD1-CD1 3.55Å; Y1125-L1189 HydrophobicContact CE1-CB 4.35Å; Y1125-L1189 HydrophobicContact CE1-CD1 3.66Å; Y1125-L1189 HydrophobicContact CG-CD1 4.11Å; F1130-L1189 HydrophobicContact CD2-CD2 4.39Å; F1130-L1189 HydrophobicContact CE1-CD2 3.9Å; F1130-L1189 HydrophobicContact CE2-CD2 3.61Å; F1130-L1189 HydrophobicContact CZ-CD2 3.34Å; V1171-L1189 HydrophobicContact CG1-CD1 3.64Å; V1171-L1189 HydrophobicContact CG2-CD1 4.21Å; N1174-L1189 WeakPolarHBondContact O-CB 3.37Å; N1174-L1189 PolarHBondContact O-N 2.95Å; L1176-L1189 HydrophobicContact CB-CD1 4.34Å; L1176-L1189 HydrophobicContact CB-CD2 3.88Å; L1176-L1189 HydrophobicContact CB-CG 4.18Å
1190	N	86.6	Confident	81.4	Confident	128 Å²	128	57.7 Å²	57.7	68%	0.684	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-42.3	172.9	-72.8	0	0	0	0	112.2	N1174 N1188	N1174-N1190 VanDerWaalsContact ND2-CG 3.28Å; N1174-N1190 PolarHBondContact ND2-ND2 2.86Å; N1174-N1190 PolarHBondContact ND2-OD1 2.88Å; N1188-N1190 PolarHBondContact O-N 3.21Å; N1188-N1190 PolarHBondContact OD1-N 3.32Å
1191	S	87.3	Confident	79.5	Confident	69 Å²	69	66.3 Å²	66.3	48%	0.483	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-10.6	-177.2	69.7	0	0	0	0	114.3	N1188 K1193	N1188-S1191 WeakPolarHBondContact CB-OG 3.41Å; N1188-S1191 PolarHBondContact OD1-N 3.37Å; S1191-K1193 PolarHBondContact O-N 3.25Å; S1191-K1193 VanDerWaalsContact O-N 3.11Å
1192	L	85.4	Confident	77.2	Confident	47 Å²	47	65.4 Å²	65.4	25%	0.246	34%	0.339	C	S	.	.			trans	55.6	22.1	-177.3	-59.2	179.1	0	0	0	114.5	F1130 F1140 L1157 N1188	F1130-L1192 HydrophobicContact CE1-CD2 4.16Å; F1130-L1192 HydrophobicContact CZ-CD2 4.21Å; F1140-L1192 HydrophobicContact CE1-CD1 3.81Å; F1140-L1192 HydrophobicContact CE2-CD1 4.42Å; F1140-L1192 HydrophobicContact CZ-CD1 3.59Å; L1157-L1192 HydrophobicContact CD2-CB 3.94Å; L1157-L1192 HydrophobicContact CD2-CD2 4.31Å; L1157-L1192 HydrophobicContact CD2-CG 4.49Å; N1188-L1192 VanDerWaalsContact O-CA 3.26Å; N1188-L1192 WeakPolarHBondContact O-CA 3.25Å; N1188-L1192 PolarHBondContact O-N 3.02Å
1193	K	84.6	Confident	74.8	Confident	144 Å²	144	71.5 Å²	71.5	63%	0.626	37%	0.372	S	S	*	.	S	Bend	trans	-112	162.6	176.8	-67.8	-172.5	179.5	-164.1	0	111.3	I1187 N1188 S1191 E1195	I1187-K1193 WeakPolarHBondContact CA-O 3.49Å; N1188-K1193 PolarHBondContact N-O 2.93Å; S1191-K1193 PolarHBondContact O-N 3.25Å; S1191-K1193 VanDerWaalsContact O-N 3.11Å; K1193-E1195 PolarHBondContact O-N 3.02Å
1194	I	83.4	Confident	72.5	Confident	24 Å²	24	76.7 Å²	76.7	12%	0.123	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-56.5	130	169.4	-44.7	179.4	0	0	0	108.1	I1159 F1163 L1185 V1186 Q1211	I1159-I1194 HydrophobicContact CG2-CD1 4.03Å; I1159-I1194 HydrophobicContact CG2-CG1 4.37Å; F1163-I1194 HydrophobicContact CE2-CD1 3.98Å; F1163-I1194 HydrophobicContact CZ-CD1 4.02Å; L1185-I1194 HydrophobicContact CD1-CD1 4.16Å; L1185-I1194 HydrophobicContact CD1-CG1 4.16Å; L1185-I1194 HydrophobicContact CD1-CG2 3.72Å; V1186-I1194 WeakPolarHBondContact O-CG2 3.33Å; I1194-Q1211 HydrophobicContact CG2-CB 4.23Å
1195	E	82.5	Confident	70.1	Confident	37 Å²	37	80.4 Å²	80.4	17%	0.173	44%	0.438	C	S	.	.			trans	-62.1	148.2	172.6	-176.9	85.8	156.6	0	0	109.4	K1175 V1186 N1188 K1193 C1212 F1252	K1175-E1195 HydrophobicContact CD-CG 4.42Å; K1175-E1195 WeakPolarHBondContact CE-OE1 3.37Å; K1175-E1195 IonicContact NZ-OE1 2.7Å; K1175-E1195 PolarHBondContact NZ-OE1 3.44Å; V1186-E1195 HydrophobicContact CB-CB 4.26Å; V1186-E1195 HydrophobicContact CG1-CB 4.02Å; V1186-E1195 PolarHBondContact O-N 3.44Å; N1188-E1195 WeakPolarHBondContact CB-OE2 3.5Å; N1188-E1195 PolarHBondContact ND2-OE2 2.98Å; K1193-E1195 PolarHBondContact O-N 3.02Å; E1195-C1212 HydrophobicContact CB-CB 3.95Å; E1195-C1212 HydrophobicContact CG-CB 4.36Å; E1195-C1212 VanDerWaalsContact O-CB 3.25Å; E1195-C1212 WeakPolarHBondContact O-CB 3.34Å; E1195-C1212 PolarHBondContact O-N 3.34Å; E1195-C1212 PolarHBondContact O-SG 3.36Å; E1195-F1252 HydrophobicContact CG-CE2 4.21Å; E1195-F1252 HydrophobicContact CG-CZ 3.8Å
1196	V	73	Confident	67.6	Low	61 Å²	61	86.7 Å²	86.7	37%	0.37	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	116.7	-177	-171.9	0	0	0	0	110.5	K1198 T1209 L1210	V1196-K1198 PolarHBondContact O-N 2.91Å; V1196-K1198 VanDerWaalsContact O-N 3.07Å; V1196-T1209 HydrophobicContact CG1-CG2 3.64Å; V1196-L1210 CarbonylContact C-O 3.47Å; V1196-L1210 WeakPolarHBondContact CA-O 3.41Å; V1196-L1210 WeakPolarHBondContact CG1-O 3.34Å
1197	K	66.2	Low	65.4	Low	62 Å²	62	93.5 Å²	93.5	27%	0.27	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	98.1	178.2	-169.2	172.7	-176.2	169.3	0	109.4	N1199 L1210 K1251 F1252 E1253	K1197-N1199 PolarHBondContact O-N 3.38Å; K1197-L1210 PolarHBondContact N-O 3.06Å; K1197-K1251 WeakPolarHBondContact CE-O 3.45Å; K1197-K1251 PolarHBondContact NZ-O 3.12Å; K1197-F1252 HydrophobicContact CD-CD2 4.31Å; K1197-E1253 IonicContact NZ-OE1 2.7Å; K1197-E1253 PolarHBondContact NZ-OE1 2.68Å
1198	K	57.1	Low	63.1	Low	173 Å²	173	102.7 Å²	102.7	75%	0.752	54%	0.541	S	S	*	.			trans	-66.1	119.2	168.1	-66.7	-175.6	179.6	-178.6	0	108.9	V1196 T1209	V1196-K1198 PolarHBondContact O-N 2.91Å; V1196-K1198 VanDerWaalsContact O-N 3.07Å; K1198-T1209 HydrophobicContact CG-CG2 4.47Å
1199	N	51.3	Low	61.1	Low	96 Å²	96	105 Å²	105	51%	0.513	56%	0.557	S	S	.	*			trans	-71.2	129.3	178.7	-100.2	-38.6	0	0	0	110.8	K1197 K1201	K1197-N1199 PolarHBondContact O-N 3.38Å; N1199-K1201 PolarHBondContact O-N 2.63Å; N1199-K1201 VanDerWaalsContact O-N 3.11Å
1200	P	46.8	Very low	59.4	Low	115 Å²	115	109 Å²	109	75%	0.747	58%	0.578	S	S	*	*	S	Bend	trans	-79.4	13.3	-173.9	32.8	-37.4	0	0	0	114.8	P1202	P1200-P1202 WeakPolarHBondContact O-CD 3.42Å
1201	K	48.7	Very low	58.3	Low	184 Å²	184	105.9 Å²	105.9	80%	0.8	56%	0.559	S	S	*	*			trans	-113.6	92.5	174.7	-72.5	-169.2	176.3	-174.3	0	110.1	N1199 N1203	N1199-K1201 PolarHBondContact O-N 2.63Å; N1199-K1201 VanDerWaalsContact O-N 3.11Å; K1201-N1203 PolarHBondContact O-N 3.3Å; K1201-N1203 VanDerWaalsContact O-N 3.07Å
1202	P	43.1	Very low	57.7	Low	115 Å²	115	102.8 Å²	102.8	75%	0.747	54%	0.538	S	S	*	.			trans	-83.4	38.1	-177.4	36.6	-38	0	0	0	113.2	P1200	P1200-P1202 WeakPolarHBondContact O-CD 3.42Å
1203	N	39.7	Very low	57.5	Low	140 Å²	140	103.2 Å²	103.2	75%	0.749	54%	0.54	S	S	*	.			trans	-106.9	127.6	-177.6	-78.8	-2.6	0	0	0	111.7	K1201	K1201-N1203 PolarHBondContact O-N 3.3Å; K1201-N1203 VanDerWaalsContact O-N 3.07Å
1204	I	43.1	Very low	57.5	Low	167 Å²	167	98.3 Å²	98.3	86%	0.856	52%	0.519	S	S	*	.	S	Bend	trans	70.8	91	173.3	-47.2	177.7	0	0	0	115.2	N1206	I1204-N1206 PolarHBondContact O-N 2.92Å
1205	G	41.3	Very low	57.6	Low	79 Å²	79	99.7 Å²	99.7	81%	0.814	53%	0.534	S	S	*	.	S	Bend	trans	78.8	-23.4	138.3	0	0	0	0	0	119.8
1206	N	39.4	Very low	57.9	Low	133 Å²	133	98.3 Å²	98.3	71%	0.711	53%	0.528	S	S	*	.			trans	-147.5	104.7	-177.8	-102.1	-67.9	0	0	0	113.3	I1204 R1208	I1204-N1206 PolarHBondContact O-N 2.92Å; N1206-R1208 VanDerWaalsContact C-N 3.27Å; N1206-R1208 PolarHBondContact O-N 2.63Å
1207	I	44.3	Very low	58.6	Low	143 Å²	143	97.4 Å²	97.4	73%	0.733	52%	0.521	S	S	*	.			trans	-75.7	82.1	168.9	-55.1	179	0	0	0	108.5	T1209	I1207-T1209 VanDerWaalsContact C-N 3.31Å; I1207-T1209 HydrophobicContact CG2-CG2 4.49Å; I1207-T1209 PolarHBondContact O-N 2.97Å
1208	R	43.7	Very low	59.5	Low	193 Å²	193	102 Å²	102	73%	0.728	55%	0.549	S	S	*	.			trans	-71.4	88.7	168.2	-73.9	-173.7	174.7	-179.4	-1.4	109.6	N1206 L1210	N1206-R1208 VanDerWaalsContact C-N 3.27Å; N1206-R1208 PolarHBondContact O-N 2.63Å; R1208-L1210 PolarHBondContact O-N 3.24Å; R1208-L1210 VanDerWaalsContact O-N 3.15Å
1209	T	47.5	Very low	60.9	Low	82 Å²	82	97.7 Å²	97.7	50%	0.503	53%	0.534	S	S	.	.			trans	-63.9	104.7	166.3	19.8	0	0	0	0	109.7	V1196 K1198 I1207 Q1211	V1196-T1209 HydrophobicContact CG1-CG2 3.64Å; K1198-T1209 HydrophobicContact CG-CG2 4.47Å; I1207-T1209 VanDerWaalsContact C-N 3.31Å; I1207-T1209 HydrophobicContact CG2-CG2 4.49Å; I1207-T1209 PolarHBondContact O-N 2.97Å; T1209-Q1211 PolarHBondContact O-N 3.18Å
1210	L	53.1	Low	62.4	Low	97 Å²	97	102.1 Å²	102.1	51%	0.508	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	114.7	176.1	-65.1	173.2	0	0	0	108.9	V1196 K1197 R1208	V1196-L1210 CarbonylContact C-O 3.47Å; V1196-L1210 WeakPolarHBondContact CA-O 3.41Å; V1196-L1210 WeakPolarHBondContact CG1-O 3.34Å; K1197-L1210 PolarHBondContact N-O 3.06Å; R1208-L1210 PolarHBondContact O-N 3.24Å; R1208-L1210 VanDerWaalsContact O-N 3.15Å
1211	Q	63.6	Low	64.2	Low	62 Å²	62	103.1 Å²	103.1	29%	0.29	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	142.5	164	-67.8	177.7	2.8	0	0	108.8	H1161 I1194 T1209 L1213	H1161-Q1211 PolarHBondContact CD2-OE1 3.24Å; H1161-Q1211 PolarHBondContact NE2-NE2 3.39Å; I1194-Q1211 HydrophobicContact CG2-CB 4.23Å; T1209-Q1211 PolarHBondContact O-N 3.18Å; Q1211-L1213 PolarHBondContact O-N 3.41Å
1212	C	74.2	Confident	66.2	Low	5 Å²	5	94.7 Å²	94.7	3%	0.034	50%	0.502	C	S	.	.	S	Bend	trans	-77.5	54.6	177.1	-69.2	0	0	0	0	111.7	V1186 E1195 F1252	V1186-C1212 HydrophobicContact CB-CB 3.94Å; V1186-C1212 HydrophobicContact CG2-CB 4.4Å; V1186-C1212 PolarHBondContact N-O 3.03Å; E1195-C1212 HydrophobicContact CB-CB 3.95Å; E1195-C1212 HydrophobicContact CG-CB 4.36Å; E1195-C1212 VanDerWaalsContact O-CB 3.25Å; E1195-C1212 WeakPolarHBondContact O-CB 3.34Å; E1195-C1212 PolarHBondContact O-N 3.34Å; E1195-C1212 PolarHBondContact O-SG 3.36Å; C1212-F1252 VanDerWaalsContact SG-CE2 3.55Å
1213	L	80.9	Confident	68.6	Low	56 Å²	56	93.1 Å²	93.1	29%	0.293	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	106.4	163.6	179.2	74.9	0	0	0	107.1	F1163 H1183 L1184 L1185 Q1211	F1163-L1213 HydrophobicContact CD1-CD1 4.45Å; F1163-L1213 HydrophobicContact CD1-CD2 4.24Å; F1163-L1213 HydrophobicContact CE1-CD1 4.2Å; F1163-L1213 HydrophobicContact CE1-CD2 3.49Å; F1163-L1213 VanDerWaalsContact CE1-CD2 3.49Å; F1163-L1213 HydrophobicContact CE1-CG 4.43Å; F1163-L1213 HydrophobicContact CZ-CD1 4.43Å; F1163-L1213 HydrophobicContact CZ-CD2 4.01Å; H1183-L1213 HydrophobicContact CB-CD1 3.98Å; L1184-L1213 VanDerWaalsContact O-CA 3.29Å; L1184-L1213 WeakPolarHBondContact O-CA 3.49Å; L1185-L1213 HydrophobicContact CB-CD1 4.11Å; L1185-L1213 HydrophobicContact CD1-CD1 4.33Å; Q1211-L1213 PolarHBondContact O-N 3.41Å
1214	F	85.1	Confident	71.2	Confident	40 Å²	40	86.5 Å²	86.5	18%	0.175	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.7	-174.3	58.6	-84.7	0	0	0	112.1	W1177 H1183 L1184 V1186 V1216 Y1247 F1252	W1177-F1214 HydrophobicContact CH2-CZ 4.36Å; W1177-F1214 HydrophobicContact CZ3-CZ 4.03Å; H1183-F1214 CarbonylContact C-O 3.53Å; H1183-F1214 VanDerWaalsContact CA-O 3.24Å; H1183-F1214 WeakPolarHBondContact CA-O 3.38Å; L1184-F1214 HydrophobicContact CB-CE1 4.01Å; L1184-F1214 HydrophobicContact CB-CE2 4.03Å; L1184-F1214 HydrophobicContact CB-CZ 3.74Å; L1184-F1214 HydrophobicContact CD1-CE2 3.8Å; L1184-F1214 HydrophobicContact CD1-CZ 3.68Å; L1184-F1214 HydrophobicContact CG-CE2 4.41Å; L1184-F1214 HydrophobicContact CG-CZ 4.35Å; L1184-F1214 PolarHBondContact N-O 3.39Å; L1184-F1214 PolarHBondContact O-N 3.12Å; V1186-F1214 HydrophobicContact CG2-CE1 4.09Å; F1214-V1216 HydrophobicContact CD2-CG1 3.89Å; F1214-V1216 HydrophobicContact CE2-CG1 3.71Å; F1214-Y1247 HydrophobicContact CD2-CE1 4.46Å; F1214-Y1247 AromaticContact CE2-CD1 3.97Å; F1214-Y1247 HydrophobicContact CE2-CD1 3.97Å; F1214-Y1247 AromaticContact CE2-CE1 3.73Å; F1214-Y1247 HydrophobicContact CE2-CE1 3.73Å; F1214-Y1247 HydrophobicContact CZ-CD1 4.49Å; F1214-F1252 HydrophobicContact CD1-CB 4.35Å; F1214-F1252 HydrophobicContact CE1-CB 3.78Å; F1214-F1252 HydrophobicContact CE1-CD1 4.06Å; F1214-F1252 HydrophobicContact CE1-CG 4.19Å; F1214-F1252 HydrophobicContact CZ-CB 3.92Å; F1214-F1252 HydrophobicContact CZ-CD1 4.39Å
1215	A	85.4	Confident	73.7	Confident	54 Å²	54	80 Å²	80	45%	0.446	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	135.3	175.8	0	0	0	0	0	110.8	N1182 H1183	N1182-A1215 WeakPolarHBondContact O-CA 3.33Å; H1183-A1215 PolarHBondContact CD2-N 3.2Å
1216	V	89.4	Confident	76.3	Confident	7 Å²	7	76.9 Å²	76.9	4%	0.042	38%	0.383	C	S	.	.	S	Bend	trans	-111.9	-10.6	176	-62.8	0	0	0	0	113.2	N1182 L1184 F1214 V1224 L1236 M1238 K1245 Y1247	N1182-V1216 WeakPolarHBondContact O-CG2 3.33Å; N1182-V1216 PolarHBondContact O-N 3.05Å; L1184-V1216 HydrophobicContact CB-CG1 4.34Å; L1184-V1216 HydrophobicContact CD1-CG1 3.72Å; L1184-V1216 HydrophobicContact CG-CG1 3.75Å; L1184-V1216 HydrophobicContact CG-CG2 4.49Å; F1214-V1216 HydrophobicContact CD2-CG1 3.89Å; F1214-V1216 HydrophobicContact CE2-CG1 3.71Å; V1216-V1224 HydrophobicContact CG2-CG2 3.78Å; V1216-L1236 HydrophobicContact CB-CD2 4.09Å; V1216-L1236 HydrophobicContact CG1-CD2 3.95Å; V1216-L1236 HydrophobicContact CG2-CD1 4.33Å; V1216-L1236 HydrophobicContact CG2-CD2 4.13Å; V1216-M1238 HydrophobicContact CG2-CE 4.48Å; V1216-M1238 HydrophobicContact CG2-SD 3.79Å; V1216-K1245 PolarHBondContact O-NZ 2.68Å; V1216-K1245 VanDerWaalsContact O-NZ 3.12Å; V1216-Y1247 HydrophobicContact CG1-CE1 4.12Å; V1216-Y1247 HydrophobicContact CG1-CE2 4.26Å; V1216-Y1247 WeakPolarHBondContact CG1-OH 3.17Å
1217	N	86.9	Confident	79	Confident	43 Å²	43	71.5 Å²	71.5	23%	0.23	35%	0.354	C	S	.	.			trans	-140.6	146.5	172	-168.7	7.6	0	0	0	110.2	N1182 D1219 S1222 M1238	N1182-N1217 HydrophobicContact CB-CB 4.3Å; N1182-N1217 PolarHBondContact ND2-O 3.16Å; N1217-D1219 PolarHBondContact OD1-N 3.29Å; N1217-S1222 WeakPolarHBondContact ND2-CB 3.38Å; N1217-S1222 PolarHBondContact ND2-OG 3.14Å; N1217-M1238 HydrophobicContact CB-CE 3.75Å; N1217-M1238 HydrophobicContact CB-CG 4.19Å; N1217-M1238 HydrophobicContact CB-SD 4.12Å
1218	N	85.3	Confident	81.4	Confident	159 Å²	159	65 Å²	65	85%	0.85	32%	0.322	S	S	*	.	S	Bend	trans	-77.1	-31.8	178.7	-68.7	-12.6	0	0	0	112.2	R1220	N1218-R1220 PolarHBondContact O-N 2.66Å
1219	D	86.6	Confident	83.8	Confident	82 Å²	82	57 Å²	57	44%	0.439	30%	0.297	S	S	.	.			trans	-64.9	126.8	169.2	175.2	10.6	0	0	0	109.7	N1182 N1217 E1221 S1222	N1182-D1219 WeakPolarHBondContact CB-O 3.28Å; N1182-D1219 PolarHBondContact ND2-O 3.45Å; N1217-D1219 PolarHBondContact OD1-N 3.29Å; D1219-E1221 PolarHBondContact OD1-N 3.48Å; D1219-S1222 PolarHBondContact OD1-N 3.05Å; D1219-S1222 VanDerWaalsContact OD2-CB 3.29Å; D1219-S1222 WeakPolarHBondContact OD2-CB 3.49Å; D1219-S1222 PolarHBondContact OD2-N 2.79Å
1220	R	82.2	Confident	85.5	Confident	188 Å²	188	55.6 Å²	55.6	71%	0.709	29%	0.286	S	S	*	.	S	Bend	trans	-88.6	-20.6	-176.3	-63.1	-178.9	177.4	-173.3	-1.6	113.6	N1218	N1218-R1220 PolarHBondContact O-N 2.66Å
1221	E	83.9	Confident	86.9	Confident	137 Å²	137	54.5 Å²	54.5	64%	0.64	29%	0.292	S	S	*	.	S	Bend	trans	-87.6	-25.9	177.7	-59.6	-53.2	132.3	0	0	111.4	D1219	D1219-E1221 PolarHBondContact OD1-N 3.48Å
1222	S	91.2	Very high	88	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.042	28%	0.282	C	S	.	.			trans	-59.6	147.9	167.8	-168.6	0	0	0	0	112.3	R1181 N1182 N1217 D1219 M1238	R1181-S1222 CarbonylContact C-O 3.54Å; N1182-S1222 PolarHBondContact N-O 3.26Å; N1182-S1222 VanDerWaalsContact N-O 3.12Å; N1217-S1222 WeakPolarHBondContact ND2-CB 3.38Å; N1217-S1222 PolarHBondContact ND2-OG 3.14Å; D1219-S1222 PolarHBondContact OD1-N 3.05Å; D1219-S1222 VanDerWaalsContact OD2-CB 3.29Å; D1219-S1222 WeakPolarHBondContact OD2-CB 3.49Å; D1219-S1222 PolarHBondContact OD2-N 2.79Å; S1222-M1238 WeakPolarHBondContact OG-CE 3.36Å
1223	Y	93.6	Very high	88.7	Confident	83 Å²	83	52.3 Å²	52.3	33%	0.325	28%	0.282	S	S	.	.			trans	-132.7	152.2	175.4	65.4	-92.1	0	0	0	112.9	R1181 A1225 M1238 Y1239	R1181-Y1223 VanDerWaalsContact O-CA 3.29Å; R1181-Y1223 WeakPolarHBondContact O-CA 3.48Å; Y1223-A1225 HydrophobicContact CE2-CB 4.5Å; Y1223-A1225 PolarHBondContact O-N 3.49Å; Y1223-A1225 VanDerWaalsContact O-N 3.16Å; Y1223-M1238 CarbonylContact O-C 3.33Å; Y1223-M1238 WeakPolarHBondContact O-CE 3.16Å; Y1223-Y1239 HydrophobicContact CD1-CD1 4.19Å; Y1223-Y1239 HydrophobicContact CD1-CD2 4.44Å; Y1223-Y1239 AromaticContact CD1-CG 3.85Å; Y1223-Y1239 HydrophobicContact CD1-CG 3.85Å; Y1223-Y1239 AromaticContact CE1-CD1 3.74Å; Y1223-Y1239 HydrophobicContact CE1-CD1 3.74Å; Y1223-Y1239 AromaticContact CE1-CD2 3.54Å; Y1223-Y1239 HydrophobicContact CE1-CD2 3.54Å; Y1223-Y1239 HydrophobicContact CE1-CE1 4.26Å; Y1223-Y1239 HydrophobicContact CE1-CE2 4.09Å; Y1223-Y1239 AromaticContact CE1-CG 3.33Å; Y1223-Y1239 HydrophobicContact CE1-CG 3.33Å; Y1223-Y1239 HydrophobicContact CE2-CD2 4.11Å; Y1223-Y1239 HydrophobicContact CE2-CG 4.32Å; Y1223-Y1239 AromaticContact CZ-CD2 3.34Å; Y1223-Y1239 AromaticContact CZ-CE2 3.94Å; Y1223-Y1239 AromaticContact CZ-CG 3.61Å; Y1223-Y1239 WeakPolarHBondContact O-CB 3.46Å; Y1223-Y1239 PolarHBondContact O-N 3.22Å; Y1223-Y1239 WeakPolarHBondContact OH-CD2 3.34Å; Y1223-Y1239 WeakPolarHBondContact OH-CE2 3.41Å
1224	V	95.4	Very high	89.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	114.7	174.6	176.8	0	0	0	0	109.1	S1167 R1181 L1184 V1216 L1227 L1236 M1238	S1167-V1224 WeakPolarHBondContact CB-O 3.35Å; S1167-V1224 PolarHBondContact OG-O 3.45Å; R1181-V1224 PolarHBondContact O-N 3.35Å; L1184-V1224 HydrophobicContact CD2-CG1 4.45Å; L1184-V1224 HydrophobicContact CD2-CG2 4.16Å; V1216-V1224 HydrophobicContact CG2-CG2 3.78Å; V1224-L1227 HydrophobicContact CG1-CD1 4.37Å; V1224-L1227 HydrophobicContact CG1-CD2 3.94Å; V1224-L1227 HydrophobicContact CG1-CG 3.85Å; V1224-L1236 HydrophobicContact CG1-CB 4.27Å; V1224-M1238 HydrophobicContact CG2-CE 4.25Å; V1224-M1238 HydrophobicContact CG2-SD 3.97Å
1225	A	94.3	Very high	89.9	Confident	30 Å²	30	47.8 Å²	47.8	25%	0.248	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-38.2	-170.7	0	0	0	0	0	113.2	Y1223 S1237	Y1223-A1225 HydrophobicContact CE2-CB 4.5Å; Y1223-A1225 PolarHBondContact O-N 3.49Å; Y1223-A1225 VanDerWaalsContact O-N 3.16Å; A1225-S1237 PolarHBondContact N-O 2.7Å
1226	C	96	Very high	90.5	Very high	15 Å²	15	45.2 Å²	45.2	10%	0.101	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148.2	175.5	-52.5	0	0	0	0	110.5	L1236 S1237 M1288	C1226-L1236 WeakPolarHBondContact O-CA 3.37Å; C1226-S1237 WeakPolarHBondContact CB-OG 3.5Å; C1226-S1237 PolarHBondContact N-OG 3.3Å; C1226-S1237 PolarHBondContact O-N 2.87Å; C1226-S1237 VanDerWaalsContact O-N 3.12Å; C1226-M1288 HydrophobicContact CB-CB 4.16Å; C1226-M1288 HydrophobicContact CB-CE 3.95Å; C1226-M1288 HydrophobicContact CB-CG 3.89Å
1227	L	96.5	Very high	90.8	Very high	19 Å²	19	44.9 Å²	44.9	10%	0.099	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.8	171.1	-75.4	173.3	0	0	0	109.5	A1168 T1170 W1177 L1184 V1224 V1234 W1235 L1236	A1168-L1227 HydrophobicContact CB-CB 4.29Å; A1168-L1227 HydrophobicContact CB-CD1 4.06Å; A1168-L1227 HydrophobicContact CB-CG 4.11Å; T1170-L1227 HydrophobicContact CG2-CB 3.82Å; T1170-L1227 HydrophobicContact CG2-CD1 4.42Å; W1177-L1227 WeakPolarHBondContact O-CD1 3.36Å; L1184-L1227 HydrophobicContact CD2-CD1 4.37Å; L1184-L1227 HydrophobicContact CD2-CD2 4.09Å; V1224-L1227 HydrophobicContact CG1-CD1 4.37Å; V1224-L1227 HydrophobicContact CG1-CD2 3.94Å; V1224-L1227 HydrophobicContact CG1-CG 3.85Å; L1227-V1234 HydrophobicContact CD2-CG1 4.36Å; L1227-W1235 WeakPolarHBondContact CA-O 3.5Å; L1227-L1236 HydrophobicContact CD2-CB 3.59Å
1228	A	95.1	Very high	91.2	Very high	6 Å²	6	43.1 Å²	43.1	5%	0.05	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	146.4	172.5	0	0	0	0	0	109.7	W1235 M1288 L1295	A1228-W1235 PolarHBondContact N-O 2.9Å; A1228-W1235 PolarHBondContact O-N 3.43Å; A1228-M1288 HydrophobicContact CB-CB 4.24Å; A1228-L1295 HydrophobicContact CB-CD1 4.36Å
1229	A	92.5	Very high	91.6	Very high	25 Å²	25	40.7 Å²	40.7	21%	0.207	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	148.2	-176.7	0	0	0	0	0	112.6	T1170 A1172 A1233 V1234 C1290	T1170-A1229 HydrophobicContact CG2-CB 4.12Å; A1172-A1229 HydrophobicContact CB-CB 3.91Å; A1229-A1233 CarbonylContact C-O 3.5Å; A1229-A1233 VanDerWaalsContact CA-O 3.28Å; A1229-A1233 WeakPolarHBondContact CA-O 3.27Å; A1229-V1234 HydrophobicContact CB-CG2 4.47Å; A1229-C1290 VanDerWaalsContact O-CB 3.28Å; A1229-C1290 WeakPolarHBondContact O-CB 3.4Å
1230	N	84	Confident	91.9	Very high	53 Å²	53	41.8 Å²	41.8	28%	0.283	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	115.1	165.4	-174.3	17.8	0	0	0	108.7	L1232 A1233 C1290 D1293	N1230-L1232 PolarHBondContact O-N 3.21Å; N1230-A1233 PolarHBondContact N-O 3.24Å; N1230-A1233 WeakPolarHBondContact O-CB 3.49Å; N1230-A1233 PolarHBondContact O-N 3.4Å; N1230-C1290 HydrophobicContact CB-CB 4.07Å; N1230-D1293 PolarHBondContact ND2-OD1 3.03Å
1231	A	81.7	Confident	92.6	Very high	75 Å²	75	34.3 Å²	34.3	62%	0.62	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.6	-106.4	-175.2	0	0	0	0	0	113.6
1232	L	87.3	Confident	93.1	Very high	16 Å²	16	28.4 Å²	28.4	8%	0.084	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-7.5	-179.9	-77.1	160.4	0	0	0	114.5	T1173 N1230 A1249 V1312	T1173-L1232 HydrophobicContact CG2-CD2 3.78Å; T1173-L1232 HydrophobicContact CG2-CG 4.25Å; N1230-L1232 PolarHBondContact O-N 3.21Å; L1232-A1249 WeakPolarHBondContact O-CB 3.42Å; L1232-A1249 PolarHBondContact O-N 3.12Å; L1232-V1312 HydrophobicContact CB-CB 4Å; L1232-V1312 HydrophobicContact CB-CG1 3.82Å; L1232-V1312 WeakPolarHBondContact CB-O 3.23Å; L1232-V1312 VanDerWaalsContact CD1-O 3.24Å; L1232-V1312 WeakPolarHBondContact CD1-O 3.38Å
1233	A	89.4	Confident	93.4	Very high	5 Å²	5	30.1 Å²	30.1	4%	0.041	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.9	178.8	0	0	0	0	0	111.1	A1229 N1230 L1246 V1312	A1229-A1233 CarbonylContact C-O 3.5Å; A1229-A1233 VanDerWaalsContact CA-O 3.28Å; A1229-A1233 WeakPolarHBondContact CA-O 3.27Å; N1230-A1233 PolarHBondContact N-O 3.24Å; N1230-A1233 WeakPolarHBondContact O-CB 3.49Å; N1230-A1233 PolarHBondContact O-N 3.4Å; A1233-L1246 HydrophobicContact CB-CD1 3.61Å; A1233-V1312 HydrophobicContact CB-CG2 3.9Å
1234	V	94.9	Very high	93.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116	169.2	-175.8	0	0	0	0	109.4	T1170 A1172 W1177 L1227 A1229 Y1247 A1249	T1170-V1234 HydrophobicContact CG2-CG1 4.28Å; A1172-V1234 HydrophobicContact CB-CG2 3.54Å; W1177-V1234 HydrophobicContact CD2-CG1 4.1Å; W1177-V1234 HydrophobicContact CD2-CG2 4.04Å; W1177-V1234 HydrophobicContact CE3-CB 4.19Å; W1177-V1234 HydrophobicContact CE3-CG1 3.7Å; W1177-V1234 HydrophobicContact CE3-CG2 4.19Å; W1177-V1234 HydrophobicContact CH2-CB 4.49Å; W1177-V1234 HydrophobicContact CH2-CG2 4.26Å; W1177-V1234 HydrophobicContact CZ2-CG2 4.13Å; W1177-V1234 HydrophobicContact CZ3-CB 4.16Å; W1177-V1234 HydrophobicContact CZ3-CG1 4.09Å; W1177-V1234 HydrophobicContact CZ3-CG2 4.28Å; L1227-V1234 HydrophobicContact CD2-CG1 4.36Å; A1229-V1234 HydrophobicContact CB-CG2 4.47Å; V1234-Y1247 PolarHBondContact N-O 3.34Å; V1234-Y1247 PolarHBondContact O-N 2.98Å; V1234-A1249 HydrophobicContact CG2-CB 3.97Å
1235	W	96.5	Very high	93.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	136.6	176.1	-62.5	97.4	0	0	0	110.8	L1227 A1228 V1244 K1245 L1246 I1258 M1288 L1295 L1307 T1309 P1310	L1227-W1235 WeakPolarHBondContact CA-O 3.5Å; A1228-W1235 PolarHBondContact N-O 2.9Å; A1228-W1235 PolarHBondContact O-N 3.43Å; W1235-V1244 HydrophobicContact CB-CG2 4.24Å; W1235-V1244 HydrophobicContact CE3-CG1 4.22Å; W1235-V1244 HydrophobicContact CE3-CG2 3.81Å; W1235-V1244 HydrophobicContact CZ3-CG1 4.12Å; W1235-K1245 WeakPolarHBondContact CA-O 3.31Å; W1235-L1246 HydrophobicContact CD2-CB 4.23Å; W1235-L1246 HydrophobicContact CD2-CD1 4Å; W1235-L1246 HydrophobicContact CE3-CB 3.71Å; W1235-L1246 HydrophobicContact CE3-CD1 4.37Å; W1235-L1246 HydrophobicContact CG-CD1 4.4Å; W1235-L1246 HydrophobicContact CH2-CB 4.18Å; W1235-L1246 HydrophobicContact CH2-CD2 4.11Å; W1235-L1246 HydrophobicContact CZ2-CD1 4.41Å; W1235-L1246 HydrophobicContact CZ2-CD2 4.13Å; W1235-L1246 HydrophobicContact CZ3-CB 3.7Å; W1235-L1246 HydrophobicContact CZ3-CD2 4.48Å; W1235-I1258 HydrophobicContact CH2-CD1 4.04Å; W1235-I1258 HydrophobicContact CZ3-CD1 4.08Å; W1235-M1288 HydrophobicContact CB-CE 4.1Å; W1235-L1295 HydrophobicContact CB-CD1 4.18Å; W1235-L1295 HydrophobicContact CD2-CD1 4.46Å; W1235-L1295 HydrophobicContact CD2-CD2 3.69Å; W1235-L1295 HydrophobicContact CE3-CD2 3.83Å; W1235-L1295 HydrophobicContact CG-CD1 3.98Å; W1235-L1295 HydrophobicContact CG-CD2 4.06Å; W1235-L1295 HydrophobicContact CH2-CD2 4.29Å; W1235-L1295 HydrophobicContact CZ2-CD2 4.18Å; W1235-L1295 HydrophobicContact CZ3-CD2 4.12Å; W1235-L1307 HydrophobicContact CH2-CD1 3.89Å; W1235-L1307 HydrophobicContact CH2-CD2 4.3Å; W1235-L1307 HydrophobicContact CZ2-CD1 3.8Å; W1235-T1309 HydrophobicContact CZ2-CG2 4.14Å; W1235-P1310 HydrophobicContact CZ2-CG 4.5Å
1236	L	96.8	Very high	93.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.6	173.4	77.5	84.6	0	0	0	112	L1184 V1216 V1224 C1226 L1227 M1238 V1244 K1245 Y1247	L1184-L1236 HydrophobicContact CD1-CD2 3.65Å; L1184-L1236 HydrophobicContact CD2-CD2 4.49Å; L1184-L1236 HydrophobicContact CG-CD2 4.23Å; V1216-L1236 HydrophobicContact CB-CD2 4.09Å; V1216-L1236 HydrophobicContact CG1-CD2 3.95Å; V1216-L1236 HydrophobicContact CG2-CD1 4.33Å; V1216-L1236 HydrophobicContact CG2-CD2 4.13Å; V1224-L1236 HydrophobicContact CG1-CB 4.27Å; C1226-L1236 WeakPolarHBondContact O-CA 3.37Å; L1227-L1236 HydrophobicContact CD2-CB 3.59Å; L1236-M1238 HydrophobicContact CD1-CG 4.34Å; L1236-M1238 HydrophobicContact CD1-SD 3.77Å; L1236-V1244 WeakPolarHBondContact O-CA 3.38Å; L1236-V1244 WeakPolarHBondContact O-CG2 3.44Å; L1236-K1245 HydrophobicContact CD1-CB 4.32Å; L1236-K1245 HydrophobicContact CD1-CD 4.29Å; L1236-K1245 HydrophobicContact CD1-CG 4.29Å; L1236-K1245 HydrophobicContact CG-CB 4.18Å; L1236-K1245 PolarHBondContact N-O 3.44Å; L1236-K1245 PolarHBondContact O-N 3.01Å; L1236-Y1247 HydrophobicContact CD2-CD2 3.67Å; L1236-Y1247 HydrophobicContact CD2-CE2 3.5Å; L1236-Y1247 VanDerWaalsContact CD2-CE2 3.5Å; L1236-Y1247 HydrophobicContact CG-CD2 4.3Å; L1236-Y1247 HydrophobicContact CG-CE2 4.17Å
1237	S	96.6	Very high	93.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.7	165.8	68	0	0	0	0	110.5	A1225 C1226	A1225-S1237 PolarHBondContact N-O 2.7Å; C1226-S1237 WeakPolarHBondContact CB-OG 3.5Å; C1226-S1237 PolarHBondContact N-OG 3.3Å; C1226-S1237 PolarHBondContact O-N 2.87Å; C1226-S1237 VanDerWaalsContact O-N 3.12Å
1238	M	95.7	Very high	93	Very high	7 Å²	7	25.3 Å²	25.3	3%	0.034	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	153.8	174.2	-62.5	-51.5	-58	0	0	111.3	V1216 N1217 S1222 Y1223 V1224 L1236 N1240 S1241	V1216-M1238 HydrophobicContact CG2-CE 4.48Å; V1216-M1238 HydrophobicContact CG2-SD 3.79Å; N1217-M1238 HydrophobicContact CB-CE 3.75Å; N1217-M1238 HydrophobicContact CB-CG 4.19Å; N1217-M1238 HydrophobicContact CB-SD 4.12Å; S1222-M1238 WeakPolarHBondContact OG-CE 3.36Å; Y1223-M1238 CarbonylContact O-C 3.33Å; Y1223-M1238 WeakPolarHBondContact O-CE 3.16Å; V1224-M1238 HydrophobicContact CG2-CE 4.25Å; V1224-M1238 HydrophobicContact CG2-SD 3.97Å; L1236-M1238 HydrophobicContact CD1-CG 4.34Å; L1236-M1238 HydrophobicContact CD1-SD 3.77Å; M1238-N1240 PolarHBondContact O-N 3.02Å; M1238-S1241 VanDerWaalsContact O-CB 3.27Å; M1238-S1241 WeakPolarHBondContact O-CB 3.43Å; M1238-S1241 PolarHBondContact O-N 2.87Å; M1238-S1241 VanDerWaalsContact O-N 3.16Å
1239	Y	93.9	Very high	92.7	Very high	108 Å²	108	25 Å²	25	42%	0.424	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	137.6	173.5	178	-110.7	0	0	0	111	Y1223 S1241	Y1223-Y1239 HydrophobicContact CD1-CD1 4.19Å; Y1223-Y1239 HydrophobicContact CD1-CD2 4.44Å; Y1223-Y1239 AromaticContact CD1-CG 3.85Å; Y1223-Y1239 HydrophobicContact CD1-CG 3.85Å; Y1223-Y1239 AromaticContact CE1-CD1 3.74Å; Y1223-Y1239 HydrophobicContact CE1-CD1 3.74Å; Y1223-Y1239 AromaticContact CE1-CD2 3.54Å; Y1223-Y1239 HydrophobicContact CE1-CD2 3.54Å; Y1223-Y1239 HydrophobicContact CE1-CE1 4.26Å; Y1223-Y1239 HydrophobicContact CE1-CE2 4.09Å; Y1223-Y1239 AromaticContact CE1-CG 3.33Å; Y1223-Y1239 HydrophobicContact CE1-CG 3.33Å; Y1223-Y1239 HydrophobicContact CE2-CD2 4.11Å; Y1223-Y1239 HydrophobicContact CE2-CG 4.32Å; Y1223-Y1239 AromaticContact CZ-CD2 3.34Å; Y1223-Y1239 AromaticContact CZ-CE2 3.94Å; Y1223-Y1239 AromaticContact CZ-CG 3.61Å; Y1223-Y1239 WeakPolarHBondContact O-CB 3.46Å; Y1223-Y1239 PolarHBondContact O-N 3.22Å; Y1223-Y1239 WeakPolarHBondContact OH-CD2 3.34Å; Y1223-Y1239 WeakPolarHBondContact OH-CE2 3.41Å; Y1239-S1241 PolarHBondContact O-N 3.36Å
1240	N	93.2	Very high	92.3	Very high	105 Å²	105	25.4 Å²	25.4	56%	0.561	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	28.3	-175.6	-152.4	49.5	0	0	0	115	M1238	M1238-N1240 PolarHBondContact O-N 3.02Å
1241	S	95.3	Very high	92.2	Very high	30 Å²	30	25 Å²	25	21%	0.21	15%	0.146	C	C	.	.			trans	-112.9	144	179.9	-172.3	0	0	0	0	113.3	M1238 Y1239 V1243 R1284 I1285	M1238-S1241 VanDerWaalsContact O-CB 3.27Å; M1238-S1241 WeakPolarHBondContact O-CB 3.43Å; M1238-S1241 PolarHBondContact O-N 2.87Å; M1238-S1241 VanDerWaalsContact O-N 3.16Å; Y1239-S1241 PolarHBondContact O-N 3.36Å; S1241-V1243 PolarHBondContact OG-N 3.02Å; S1241-V1243 VanDerWaalsContact OG-N 3.09Å; S1241-R1284 CarbonylContact O-C 3.59Å; S1241-R1284 WeakPolarHBondContact O-CA 3.48Å; S1241-I1285 PolarHBondContact O-N 3.07Å
1242	A	95.6	Very high	92.5	Very high	14 Å²	14	22.5 Å²	22.5	12%	0.116	12%	0.121	C	C	.	.	S	Bend	trans	-97.1	16.8	168.6	0	0	0	0	0	112.6	I1260 S1261 L1283	A1242-I1260 HydrophobicContact CB-CG1 4.11Å; A1242-I1260 WeakPolarHBondContact O-CG1 3.48Å; A1242-I1260 PolarHBondContact O-N 3.01Å; A1242-S1261 WeakPolarHBondContact CB-OG 3.41Å; A1242-L1283 HydrophobicContact CB-CD2 4.27Å; A1242-L1283 HydrophobicContact CB-CG 4.08Å
1243	V	96.1	Very high	92.5	Very high	42 Å²	42	25.4 Å²	25.4	26%	0.255	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.1	178.3	-177.9	0	0	0	0	110.3	S1241 E1257 I1258	S1241-V1243 PolarHBondContact OG-N 3.02Å; S1241-V1243 VanDerWaalsContact OG-N 3.09Å; V1243-E1257 HydrophobicContact CG1-CB 4.06Å; V1243-I1258 WeakPolarHBondContact CA-O 3.48Å
1244	V	95.7	Very high	92.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.3	167.4	70.3	0	0	0	0	109.9	W1235 L1236 E1257 I1258 I1285 M1288 L1295 I1297	W1235-V1244 HydrophobicContact CB-CG2 4.24Å; W1235-V1244 HydrophobicContact CE3-CG1 4.22Å; W1235-V1244 HydrophobicContact CE3-CG2 3.81Å; W1235-V1244 HydrophobicContact CZ3-CG1 4.12Å; L1236-V1244 WeakPolarHBondContact O-CA 3.38Å; L1236-V1244 WeakPolarHBondContact O-CG2 3.44Å; V1244-E1257 CarbonylContact O-C 3.55Å; V1244-E1257 WeakPolarHBondContact O-CA 3.43Å; V1244-I1258 HydrophobicContact CG1-CB 4Å; V1244-I1258 PolarHBondContact N-O 3.42Å; V1244-I1258 PolarHBondContact O-N 2.94Å; V1244-I1285 HydrophobicContact CB-CD1 3.92Å; V1244-M1288 HydrophobicContact CB-SD 4.28Å; V1244-M1288 HydrophobicContact CG2-CE 3.9Å; V1244-M1288 HydrophobicContact CG2-SD 3.45Å; V1244-M1288 WeakPolarHBondContact CG2-SD 3.32Å; V1244-L1295 HydrophobicContact CG1-CD2 4.39Å; V1244-L1295 HydrophobicContact CG2-CD2 4.27Å; V1244-I1297 HydrophobicContact CG1-CD1 4.26Å
1245	K	95.5	Very high	92.3	Very high	29 Å²	29	27.7 Å²	27.7	13%	0.126	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	141.6	177.3	-48.1	-169	174.8	-149.2	0	110.5	V1216 W1235 L1236 Y1247 E1257	V1216-K1245 PolarHBondContact O-NZ 2.68Å; V1216-K1245 VanDerWaalsContact O-NZ 3.12Å; W1235-K1245 WeakPolarHBondContact CA-O 3.31Å; L1236-K1245 HydrophobicContact CD1-CB 4.32Å; L1236-K1245 HydrophobicContact CD1-CD 4.29Å; L1236-K1245 HydrophobicContact CD1-CG 4.29Å; L1236-K1245 HydrophobicContact CG-CB 4.18Å; L1236-K1245 PolarHBondContact N-O 3.44Å; L1236-K1245 PolarHBondContact O-N 3.01Å; K1245-Y1247 HydrophobicContact CB-CD2 4.25Å; K1245-Y1247 HydrophobicContact CB-CE2 3.82Å; K1245-Y1247 HydrophobicContact CD-CE2 4.18Å; K1245-E1257 HydrophobicContact CB-CG 4.2Å; K1245-E1257 HydrophobicContact CD-CG 4.1Å; K1245-E1257 VanDerWaalsContact CD-OE1 3.3Å; K1245-E1257 WeakPolarHBondContact CD-OE1 3.47Å; K1245-E1257 WeakPolarHBondContact CE-OE1 3.43Å; K1245-E1257 WeakPolarHBondContact CE-OE2 3.4Å; K1245-E1257 HydrophobicContact CG-CB 4.41Å; K1245-E1257 HydrophobicContact CG-CG 3.82Å; K1245-E1257 VanDerWaalsContact NZ-CD 3.3Å; K1245-E1257 IonicContact NZ-OE1 2.99Å; K1245-E1257 PolarHBondContact NZ-OE1 3.44Å; K1245-E1257 IonicContact NZ-OE2 3.29Å; K1245-E1257 PolarHBondContact NZ-OE2 3.28Å
1246	L	94.7	Very high	91.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	121.9	174.5	174.9	54.5	0	0	0	110.4	A1233 W1235 C1254 L1255 M1256 P1310 V1312 I1319	A1233-L1246 HydrophobicContact CB-CD1 3.61Å; W1235-L1246 HydrophobicContact CD2-CB 4.23Å; W1235-L1246 HydrophobicContact CD2-CD1 4Å; W1235-L1246 HydrophobicContact CE3-CB 3.71Å; W1235-L1246 HydrophobicContact CE3-CD1 4.37Å; W1235-L1246 HydrophobicContact CG-CD1 4.4Å; W1235-L1246 HydrophobicContact CH2-CB 4.18Å; W1235-L1246 HydrophobicContact CH2-CD2 4.11Å; W1235-L1246 HydrophobicContact CZ2-CD1 4.41Å; W1235-L1246 HydrophobicContact CZ2-CD2 4.13Å; W1235-L1246 HydrophobicContact CZ3-CB 3.7Å; W1235-L1246 HydrophobicContact CZ3-CD2 4.48Å; L1246-C1254 CarbonylContact O-C 3.4Å; L1246-C1254 WeakPolarHBondContact O-CA 3.29Å; L1246-L1255 HydrophobicContact CD2-CD1 4.46Å; L1246-L1255 HydrophobicContact CG-CB 4.3Å; L1246-L1255 HydrophobicContact CG-CD1 4.32Å; L1246-L1255 PolarHBondContact O-N 3.03Å; L1246-M1256 HydrophobicContact CB-CG 3.77Å; L1246-M1256 HydrophobicContact CD2-CG 3.97Å; L1246-M1256 HydrophobicContact CD2-SD 4.14Å; L1246-M1256 HydrophobicContact CG-CG 4.4Å; L1246-M1256 PolarHBondContact N-O 3.4Å; L1246-P1310 HydrophobicContact CD2-CG 3.7Å; L1246-V1312 HydrophobicContact CD1-CG2 4.45Å; L1246-V1312 HydrophobicContact CD2-CG2 4.15Å; L1246-I1319 HydrophobicContact CD2-CD1 3.81Å
1247	Y	93.2	Very high	91.7	Very high	17 Å²	17	33 Å²	33	7%	0.067	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	146.6	174.1	-77.8	-103.5	0	0	0	111.7	F1214 V1216 V1234 L1236 K1245 E1253 C1254	F1214-Y1247 HydrophobicContact CD2-CE1 4.46Å; F1214-Y1247 AromaticContact CE2-CD1 3.97Å; F1214-Y1247 HydrophobicContact CE2-CD1 3.97Å; F1214-Y1247 AromaticContact CE2-CE1 3.73Å; F1214-Y1247 HydrophobicContact CE2-CE1 3.73Å; F1214-Y1247 HydrophobicContact CZ-CD1 4.49Å; V1216-Y1247 HydrophobicContact CG1-CE1 4.12Å; V1216-Y1247 HydrophobicContact CG1-CE2 4.26Å; V1216-Y1247 WeakPolarHBondContact CG1-OH 3.17Å; V1234-Y1247 PolarHBondContact N-O 3.34Å; V1234-Y1247 PolarHBondContact O-N 2.98Å; L1236-Y1247 HydrophobicContact CD2-CD2 3.67Å; L1236-Y1247 HydrophobicContact CD2-CE2 3.5Å; L1236-Y1247 VanDerWaalsContact CD2-CE2 3.5Å; L1236-Y1247 HydrophobicContact CG-CD2 4.3Å; L1236-Y1247 HydrophobicContact CG-CE2 4.17Å; K1245-Y1247 HydrophobicContact CB-CD2 4.25Å; K1245-Y1247 HydrophobicContact CB-CE2 3.82Å; K1245-Y1247 HydrophobicContact CD-CE2 4.18Å; Y1247-E1253 WeakPolarHBondContact CA-O 3.26Å; Y1247-C1254 HydrophobicContact CD1-CB 4.25Å; Y1247-C1254 HydrophobicContact CD2-CB 4.49Å; Y1247-C1254 HydrophobicContact CE1-CB 3.79Å; Y1247-C1254 HydrophobicContact CE2-CB 4.05Å
1248	H	90.2	Very high	91.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	118.2	173.2	-175.3	-49.5	0	0	0	111.1	G1250 K1251 F1252 E1253 L1255 V1312 A1313 H1314 T1316	H1248-G1250 VanDerWaalsContact C-N 3.34Å; H1248-G1250 PolarHBondContact ND1-N 2.65Å; H1248-G1250 PolarHBondContact O-N 2.86Å; H1248-K1251 HydrophobicContact CB-CB 4.16Å; H1248-K1251 PolarHBondContact ND1-N 2.75Å; H1248-K1251 PolarHBondContact O-N 3.27Å; H1248-K1251 VanDerWaalsContact O-N 3.11Å; H1248-F1252 PolarHBondContact O-N 2.69Å; H1248-E1253 PolarHBondContact N-O 3.13Å; H1248-L1255 HydrophobicContact CB-CD1 3.98Å; H1248-L1255 HydrophobicContact CB-CD2 4.12Å; H1248-L1255 HydrophobicContact CB-CG 4.07Å; H1248-V1312 HydrophobicContact CB-CG1 4.34Å; H1248-A1313 PolarHBondContact NE2-O 3.33Å; H1248-H1314 WeakPolarHBondContact NE2-CA 3.38Å; H1248-H1314 PolarHBondContact NE2-O 3.22Å; H1248-T1316 PolarHBondContact CD2-O 2.81Å; H1248-T1316 VanDerWaalsContact CD2-O 3.25Å
1249	A	87.9	Confident	91.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-38.2	-174.1	0	0	0	0	0	114.5	A1172 T1173 W1177 L1232 V1234 F1252	A1172-A1249 HydrophobicContact CB-CB 4.1Å; T1173-A1249 HydrophobicContact CG2-CB 3.96Å; W1177-A1249 HydrophobicContact CZ2-CB 4.32Å; W1177-A1249 WeakPolarHBondContact CZ2-O 3.47Å; L1232-A1249 WeakPolarHBondContact O-CB 3.42Å; L1232-A1249 PolarHBondContact O-N 3.12Å; V1234-A1249 HydrophobicContact CG2-CB 3.97Å; A1249-F1252 VanDerWaalsContact O-CE1 3.32Å; A1249-F1252 WeakPolarHBondContact O-CE1 3.38Å
1250	G	84.5	Confident	91.4	Very high	33 Å²	33	31 Å²	31	34%	0.34	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-32.3	174.1	0	0	0	0	0	116.5	H1248	H1248-G1250 VanDerWaalsContact C-N 3.34Å; H1248-G1250 PolarHBondContact ND1-N 2.65Å; H1248-G1250 PolarHBondContact O-N 2.86Å
1251	K	82.3	Confident	91.3	Very high	45 Å²	45	27.9 Å²	27.9	20%	0.196	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-20.9	-169.2	-63.4	-175.9	-175.5	-179	0	114.8	K1197 H1248 E1253 H1314 Q1315 T1316	K1197-K1251 WeakPolarHBondContact CE-O 3.45Å; K1197-K1251 PolarHBondContact NZ-O 3.12Å; H1248-K1251 HydrophobicContact CB-CB 4.16Å; H1248-K1251 PolarHBondContact ND1-N 2.75Å; H1248-K1251 PolarHBondContact O-N 3.27Å; H1248-K1251 VanDerWaalsContact O-N 3.11Å; K1251-E1253 VanDerWaalsContact C-N 3.29Å; K1251-E1253 HydrophobicContact CB-CB 4.25Å; K1251-E1253 HydrophobicContact CB-CG 4.33Å; K1251-E1253 WeakPolarHBondContact CD-OE2 3.46Å; K1251-E1253 PolarHBondContact O-N 2.95Å; K1251-H1314 WeakPolarHBondContact CE-O 3.45Å; K1251-Q1315 VanDerWaalsContact NZ-C 3.27Å; K1251-Q1315 PolarHBondContact NZ-O 3.44Å; K1251-T1316 WeakPolarHBondContact CE-O 3.49Å; K1251-T1316 VanDerWaalsContact NZ-C 3.31Å; K1251-T1316 PolarHBondContact NZ-O 3.23Å
1252	F	86.9	Confident	91	Very high	22 Å²	22	30.6 Å²	30.6	10%	0.096	18%	0.178	C	C	.	.			trans	63.5	32.5	-173.8	-42.1	-67.7	0	0	0	113.4	K1175 W1177 V1186 E1195 K1197 C1212 F1214 H1248 A1249	K1175-F1252 HydrophobicContact CD-CZ 4.3Å; W1177-F1252 AromaticContact CH2-CD1 3.58Å; W1177-F1252 HydrophobicContact CH2-CD1 3.58Å; W1177-F1252 HydrophobicContact CH2-CE1 4.08Å; W1177-F1252 AromaticContact CZ2-CD1 3.56Å; W1177-F1252 HydrophobicContact CZ2-CD1 3.56Å; W1177-F1252 AromaticContact CZ2-CE1 3.54Å; W1177-F1252 HydrophobicContact CZ2-CE1 3.54Å; V1186-F1252 HydrophobicContact CB-CE1 4.17Å; V1186-F1252 HydrophobicContact CG1-CE1 3.88Å; V1186-F1252 HydrophobicContact CG1-CZ 4.42Å; V1186-F1252 HydrophobicContact CG2-CD1 3.96Å; V1186-F1252 HydrophobicContact CG2-CE1 3.86Å; E1195-F1252 HydrophobicContact CG-CE2 4.21Å; E1195-F1252 HydrophobicContact CG-CZ 3.8Å; K1197-F1252 HydrophobicContact CD-CD2 4.31Å; C1212-F1252 VanDerWaalsContact SG-CE2 3.55Å; F1214-F1252 HydrophobicContact CD1-CB 4.35Å; F1214-F1252 HydrophobicContact CE1-CB 3.78Å; F1214-F1252 HydrophobicContact CE1-CD1 4.06Å; F1214-F1252 HydrophobicContact CE1-CG 4.19Å; F1214-F1252 HydrophobicContact CZ-CB 3.92Å; F1214-F1252 HydrophobicContact CZ-CD1 4.39Å; H1248-F1252 PolarHBondContact O-N 2.69Å; A1249-F1252 VanDerWaalsContact O-CE1 3.32Å; A1249-F1252 WeakPolarHBondContact O-CE1 3.38Å
1253	E	87.3	Confident	90.6	Very high	77 Å²	77	31.2 Å²	31.2	36%	0.36	18%	0.181	S	C	.	.			trans	-116.6	140.7	-177.3	-77.2	152.9	-153.9	0	0	110.3	K1197 Y1247 H1248 K1251	K1197-E1253 IonicContact NZ-OE1 2.7Å; K1197-E1253 PolarHBondContact NZ-OE1 2.68Å; Y1247-E1253 WeakPolarHBondContact CA-O 3.26Å; H1248-E1253 PolarHBondContact N-O 3.13Å; K1251-E1253 VanDerWaalsContact C-N 3.29Å; K1251-E1253 HydrophobicContact CB-CB 4.25Å; K1251-E1253 HydrophobicContact CB-CG 4.33Å; K1251-E1253 WeakPolarHBondContact CD-OE2 3.46Å; K1251-E1253 PolarHBondContact O-N 2.95Å
1254	C	90.5	Very high	90.3	Very high	49 Å²	49	29.2 Å²	29.2	33%	0.331	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	121.3	176.8	-169.8	0	0	0	0	109.8	L1246 Y1247	L1246-C1254 CarbonylContact O-C 3.4Å; L1246-C1254 WeakPolarHBondContact O-CA 3.29Å; Y1247-C1254 HydrophobicContact CD1-CB 4.25Å; Y1247-C1254 HydrophobicContact CD2-CB 4.49Å; Y1247-C1254 HydrophobicContact CE1-CB 3.79Å; Y1247-C1254 HydrophobicContact CE2-CB 4.05Å
1255	L	89.2	Confident	90	Very high	4 Å²	4	32 Å²	32	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-32.7	-176.9	-61	-178.4	0	0	0	113	L1246 H1248 V1312 T1316 S1317 I1319	L1246-L1255 HydrophobicContact CD2-CD1 4.46Å; L1246-L1255 HydrophobicContact CG-CB 4.3Å; L1246-L1255 HydrophobicContact CG-CD1 4.32Å; L1246-L1255 PolarHBondContact O-N 3.03Å; H1248-L1255 HydrophobicContact CB-CD1 3.98Å; H1248-L1255 HydrophobicContact CB-CD2 4.12Å; H1248-L1255 HydrophobicContact CB-CG 4.07Å; L1255-V1312 HydrophobicContact CD1-CB 4.34Å; L1255-V1312 HydrophobicContact CD1-CG1 3.71Å; L1255-V1312 HydrophobicContact CD1-CG2 3.67Å; L1255-T1316 HydrophobicContact CD1-CG2 3.96Å; L1255-T1316 HydrophobicContact CD2-CG2 4.13Å; L1255-S1317 WeakPolarHBondContact CD2-O 3.49Å; L1255-I1319 HydrophobicContact CB-CD1 4.1Å; L1255-I1319 HydrophobicContact CB-CG1 4.27Å; L1255-I1319 HydrophobicContact CD1-CD1 3.92Å; L1255-I1319 HydrophobicContact CD1-CG1 4.44Å; L1255-I1319 PolarHBondContact O-N 2.96Å
1256	M	89.8	Confident	89.5	Confident	17 Å²	17	39 Å²	39	8%	0.084	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	160.5	177.9	53.5	169.4	29.8	0	0	111.9	L1246 I1258 P1310 I1319 A1321 P1323	L1246-M1256 HydrophobicContact CB-CG 3.77Å; L1246-M1256 HydrophobicContact CD2-CG 3.97Å; L1246-M1256 HydrophobicContact CD2-SD 4.14Å; L1246-M1256 HydrophobicContact CG-CG 4.4Å; L1246-M1256 PolarHBondContact N-O 3.4Å; M1256-I1258 HydrophobicContact SD-CD1 3.99Å; M1256-I1258 HydrophobicContact SD-CG1 4.36Å; M1256-P1310 HydrophobicContact SD-CG 4Å; M1256-I1319 HydrophobicContact CE-CB 3.83Å; M1256-I1319 HydrophobicContact CE-CG2 3.5Å; M1256-I1319 VanDerWaalsContact CE-CG2 3.5Å; M1256-A1321 WeakPolarHBondContact CE-O 3.4Å; M1256-P1323 HydrophobicContact SD-CG 4.41Å
1257	E	92.3	Very high	89.1	Confident	95 Å²	95	39.8 Å²	39.8	44%	0.444	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143	169.7	-51.7	-165.3	-175.1	0	0	109.2	V1243 V1244 K1245	V1243-E1257 HydrophobicContact CG1-CB 4.06Å; V1244-E1257 CarbonylContact O-C 3.55Å; V1244-E1257 WeakPolarHBondContact O-CA 3.43Å; K1245-E1257 HydrophobicContact CB-CG 4.2Å; K1245-E1257 HydrophobicContact CD-CG 4.1Å; K1245-E1257 VanDerWaalsContact CD-OE1 3.3Å; K1245-E1257 WeakPolarHBondContact CD-OE1 3.47Å; K1245-E1257 WeakPolarHBondContact CE-OE1 3.43Å; K1245-E1257 WeakPolarHBondContact CE-OE2 3.4Å; K1245-E1257 HydrophobicContact CG-CB 4.41Å; K1245-E1257 HydrophobicContact CG-CG 3.82Å; K1245-E1257 VanDerWaalsContact NZ-CD 3.3Å; K1245-E1257 IonicContact NZ-OE1 2.99Å; K1245-E1257 PolarHBondContact NZ-OE1 3.44Å; K1245-E1257 IonicContact NZ-OE2 3.29Å; K1245-E1257 PolarHBondContact NZ-OE2 3.28Å
1258	I	91.7	Very high	88.8	Confident	16 Å²	16	39 Å²	39	8%	0.082	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.3	-176.4	-54.7	176.1	0	0	0	109	W1235 V1243 V1244 M1256 L1307 P1323	W1235-I1258 HydrophobicContact CH2-CD1 4.04Å; W1235-I1258 HydrophobicContact CZ3-CD1 4.08Å; V1243-I1258 WeakPolarHBondContact CA-O 3.48Å; V1244-I1258 HydrophobicContact CG1-CB 4Å; V1244-I1258 PolarHBondContact N-O 3.42Å; V1244-I1258 PolarHBondContact O-N 2.94Å; M1256-I1258 HydrophobicContact SD-CD1 3.99Å; M1256-I1258 HydrophobicContact SD-CG1 4.36Å; I1258-L1307 HydrophobicContact CD1-CD2 3.74Å; I1258-P1323 HydrophobicContact CD1-CG 3.7Å
1259	S	93.3	Very high	88.2	Confident	57 Å²	57	42.1 Å²	42.1	40%	0.399	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	130	172.2	-179.8	0	0	0	0	110.6
1260	I	93.4	Very high	87.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	28%	0.282	C	S	.	.			trans	-85.4	-15	178.4	75.8	177.6	0	0	0	113.2	A1242 P1262 T1263 V1264 I1285 I1297 T1299 L1325	A1242-I1260 HydrophobicContact CB-CG1 4.11Å; A1242-I1260 WeakPolarHBondContact O-CG1 3.48Å; A1242-I1260 PolarHBondContact O-N 3.01Å; I1260-P1262 VanDerWaalsContact C-CD 3.43Å; I1260-T1263 PolarHBondContact O-N 3.44Å; I1260-V1264 HydrophobicContact CD1-CG2 4.35Å; I1260-V1264 HydrophobicContact CG1-CG2 4.21Å; I1260-V1264 PolarHBondContact O-N 3Å; I1260-V1264 VanDerWaalsContact O-N 3.09Å; I1260-I1285 HydrophobicContact CD1-CG1 3.85Å; I1260-I1297 HydrophobicContact CD1-CG2 4.26Å; I1260-I1297 HydrophobicContact CG2-CD1 3.93Å; I1260-T1299 HydrophobicContact CD1-CG2 3.43Å; I1260-T1299 VanDerWaalsContact CD1-CG2 3.43Å; I1260-L1325 HydrophobicContact CB-CD2 3.76Å; I1260-L1325 HydrophobicContact CG2-CD2 3.76Å
1261	S	92.1	Very high	87.5	Confident	38 Å²	38	45.4 Å²	45.4	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-55	-38.6	-173.3	-52.9	0	0	0	0	114.7	A1242 T1265	A1242-S1261 WeakPolarHBondContact CB-OG 3.41Å; S1261-T1265 VanDerWaalsContact O-CB 3.23Å; S1261-T1265 WeakPolarHBondContact O-CB 3.44Å; S1261-T1265 PolarHBondContact O-N 2.91Å; S1261-T1265 PolarHBondContact O-OG1 3.45Å
1262	P	88.2	Confident	87.8	Confident	87 Å²	87	49 Å²	49	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-63	-45.3	177.6	-23.3	35.2	0	0	0	112.9	I1260 T1265 K1266	I1260-P1262 VanDerWaalsContact C-CD 3.43Å; P1262-T1265 PolarHBondContact O-N 2.72Å; P1262-K1266 WeakPolarHBondContact O-CB 3.5Å; P1262-K1266 PolarHBondContact O-N 3.13Å
1263	T	88.1	Confident	87.5	Confident	27 Å²	27	52.3 Å²	52.3	17%	0.166	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-41.4	179.3	-59.1	0	0	0	0	111.3	I1260 K1266 T1267 L1325	I1260-T1263 PolarHBondContact O-N 3.44Å; T1263-K1266 PolarHBondContact O-N 3.07Å; T1263-T1267 PolarHBondContact O-N 2.9Å; T1263-T1267 PolarHBondContact O-OG1 2.91Å; T1263-L1325 HydrophobicContact CG2-CG 4.36Å; T1263-L1325 WeakPolarHBondContact CG2-O 3.27Å; T1263-L1325 PolarHBondContact OG1-O 2.96Å
1264	V	89.4	Confident	87.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-43.7	175.5	177.4	0	0	0	0	111.4	I1260 K1266 T1267 L1268 L1280 L1283 T1299 A1301 V1303	I1260-V1264 HydrophobicContact CD1-CG2 4.35Å; I1260-V1264 HydrophobicContact CG1-CG2 4.21Å; I1260-V1264 PolarHBondContact O-N 3Å; I1260-V1264 VanDerWaalsContact O-N 3.09Å; V1264-K1266 VanDerWaalsContact C-N 3.32Å; V1264-K1266 PolarHBondContact O-N 3.12Å; V1264-T1267 WeakPolarHBondContact O-CB 3.12Å; V1264-T1267 PolarHBondContact O-N 3.35Å; V1264-T1267 VanDerWaalsContact O-N 3.1Å; V1264-L1268 HydrophobicContact CG1-CD1 3.83Å; V1264-L1268 HydrophobicContact CG1-CG 4.26Å; V1264-L1268 WeakPolarHBondContact O-CG 3.34Å; V1264-L1268 PolarHBondContact O-N 3.08Å; V1264-L1280 HydrophobicContact CG1-CD2 4.11Å; V1264-L1283 HydrophobicContact CB-CD2 3.87Å; V1264-L1283 HydrophobicContact CG1-CD1 3.98Å; V1264-L1283 HydrophobicContact CG1-CD2 3.86Å; V1264-L1283 HydrophobicContact CG2-CD1 4.3Å; V1264-L1283 HydrophobicContact CG2-CD2 4.2Å; V1264-T1299 HydrophobicContact CG2-CG2 4.27Å; V1264-A1301 HydrophobicContact CG1-CB 4.28Å; V1264-V1303 HydrophobicContact CG1-CG2 4.23Å; V1264-V1303 HydrophobicContact CG2-CG1 4.38Å
1265	T	88.8	Confident	87.4	Confident	59 Å²	59	56.9 Å²	56.9	36%	0.362	34%	0.335	S	S	.	.	H	α-helix	trans	-61	-40.5	177.2	-57.4	0	0	0	0	111.8	S1261 P1262 T1267 A1269 L1280	S1261-T1265 VanDerWaalsContact O-CB 3.23Å; S1261-T1265 WeakPolarHBondContact O-CB 3.44Å; S1261-T1265 PolarHBondContact O-N 2.91Å; S1261-T1265 PolarHBondContact O-OG1 3.45Å; P1262-T1265 PolarHBondContact O-N 2.72Å; T1265-T1267 VanDerWaalsContact C-N 3.34Å; T1265-A1269 PolarHBondContact O-N 3.19Å; T1265-L1280 HydrophobicContact CG2-CD1 4Å; T1265-L1280 WeakPolarHBondContact OG1-CD2 3.34Å
1266	K	85.6	Confident	87.4	Confident	175 Å²	175	59.2 Å²	59.2	76%	0.761	34%	0.344	S	S	*	.	H	α-helix	trans	-64.9	-36.7	174.4	-176.1	-177.6	178	-174.6	0	112.4	P1262 T1263 V1264 A1269	P1262-K1266 WeakPolarHBondContact O-CB 3.5Å; P1262-K1266 PolarHBondContact O-N 3.13Å; T1263-K1266 PolarHBondContact O-N 3.07Å; V1264-K1266 VanDerWaalsContact C-N 3.32Å; V1264-K1266 PolarHBondContact O-N 3.12Å; K1266-A1269 VanDerWaalsContact O-CB 3.28Å; K1266-A1269 WeakPolarHBondContact O-CB 3.26Å
1267	T	86.2	Confident	87.4	Confident	18 Å²	18	64.5 Å²	64.5	11%	0.11	37%	0.368	C	S	.	.	H	α-helix	trans	-70.9	-45.6	-179.7	-53.7	0	0	0	0	111.2	T1263 V1264 T1265 A1269 V1303 S1327 Y1392	T1263-T1267 PolarHBondContact O-N 2.9Å; T1263-T1267 PolarHBondContact O-OG1 2.91Å; V1264-T1267 WeakPolarHBondContact O-CB 3.12Å; V1264-T1267 PolarHBondContact O-N 3.35Å; V1264-T1267 VanDerWaalsContact O-N 3.1Å; T1265-T1267 VanDerWaalsContact C-N 3.34Å; T1267-A1269 PolarHBondContact O-N 2.88Å; T1267-A1269 VanDerWaalsContact O-N 3.16Å; T1267-V1303 HydrophobicContact CG2-CG1 4.01Å; T1267-V1303 HydrophobicContact CG2-CG2 4.03Å; T1267-S1327 VanDerWaalsContact OG1-CB 3.29Å; T1267-S1327 WeakPolarHBondContact OG1-CB 3.48Å; T1267-S1327 PolarHBondContact OG1-OG 2.9Å; T1267-Y1392 HydrophobicContact CG2-CD1 4.03Å; T1267-Y1392 HydrophobicContact CG2-CD2 3.38Å; T1267-Y1392 HydrophobicContact CG2-CE2 3.97Å; T1267-Y1392 HydrophobicContact CG2-CG 3.45Å; T1267-Y1392 VanDerWaalsContact CG2-CG 3.45Å
1268	L	86.2	Confident	87.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-75.9	6	178.1	-60.7	176	0	0	0	113.7	V1264 G1270 C1271 R1276 K1279 L1280 A1301 V1303 Y1392	V1264-L1268 HydrophobicContact CG1-CD1 3.83Å; V1264-L1268 HydrophobicContact CG1-CG 4.26Å; V1264-L1268 WeakPolarHBondContact O-CG 3.34Å; V1264-L1268 PolarHBondContact O-N 3.08Å; L1268-G1270 PolarHBondContact O-N 2.77Å; L1268-C1271 WeakPolarHBondContact O-CB 3.43Å; L1268-C1271 PolarHBondContact O-N 2.89Å; L1268-R1276 HydrophobicContact CB-CG 3.97Å; L1268-R1276 WeakPolarHBondContact O-CD 3.45Å; L1268-K1279 HydrophobicContact CD1-CB 3.77Å; L1268-K1279 HydrophobicContact CD1-CD 4.21Å; L1268-K1279 HydrophobicContact CD2-CD 4.03Å; L1268-L1280 HydrophobicContact CD1-CD2 4.2Å; L1268-L1280 HydrophobicContact CD1-CG 4.33Å; L1268-A1301 HydrophobicContact CD1-CB 4.24Å; L1268-V1303 HydrophobicContact CD2-CG2 3.89Å; L1268-V1303 HydrophobicContact CG-CG2 4.19Å; L1268-Y1392 HydrophobicContact CD2-CD1 4.28Å; L1268-Y1392 HydrophobicContact CD2-CE1 3.69Å
1269	A	79.6	Confident	87.5	Confident	66 Å²	66	66.6 Å²	66.6	55%	0.545	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-64.6	-23.1	-172.5	0	0	0	0	0	114.2	T1265 K1266 T1267	T1265-A1269 PolarHBondContact O-N 3.19Å; K1266-A1269 VanDerWaalsContact O-CB 3.28Å; K1266-A1269 WeakPolarHBondContact O-CB 3.26Å; T1267-A1269 PolarHBondContact O-N 2.88Å; T1267-A1269 VanDerWaalsContact O-N 3.16Å
1270	G	75.8	Confident	87.5	Confident	77 Å²	77	66.2 Å²	66.2	79%	0.794	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-84.4	-12.3	172.3	0	0	0	0	0	114.7	L1268	L1268-G1270 PolarHBondContact O-N 2.77Å
1271	C	81.7	Confident	87.4	Confident	25 Å²	25	70.3 Å²	70.3	17%	0.169	40%	0.404	C	S	.	.	S	Bend	trans	-79.6	147.5	-179.6	-52.7	0	0	0	0	111.4	L1268 R1276	L1268-C1271 WeakPolarHBondContact O-CB 3.43Å; L1268-C1271 PolarHBondContact O-N 2.89Å; C1271-R1276 HydrophobicContact CB-CB 4.42Å; C1271-R1276 PolarHBondContact O-NH1 2.8Å
1272	D	87	Confident	87.6	Confident	120 Å²	120	71.5 Å²	71.5	64%	0.642	41%	0.412	S	S	*	.			trans	-39.6	136.9	173.2	-100.5	-41.2	0	0	0	113.7	I1274 I1275 R1276	D1272-I1274 PolarHBondContact O-N 3.35Å; D1272-I1274 VanDerWaalsContact O-N 3.09Å; D1272-I1275 HydrophobicContact CB-CB 4.11Å; D1272-I1275 HydrophobicContact CB-CD1 3.99Å; D1272-I1275 HydrophobicContact CB-CG1 3.89Å; D1272-I1275 PolarHBondContact O-N 2.95Å; D1272-R1276 VanDerWaalsContact O-CB 3.24Å; D1272-R1276 WeakPolarHBondContact O-CB 3.46Å; D1272-R1276 PolarHBondContact O-N 3Å
1273	D	80.4	Confident	88	Confident	92 Å²	92	68.1 Å²	68.1	49%	0.492	39%	0.389	S	S	.	.	H	α-helix	trans	-50.2	-40.3	-179.8	-88.3	24.1	0	0	0	113.3	R1276 Q1277	D1273-R1276 IonicContact OD1-CZ 3.22Å; D1273-R1276 IonicContact OD1-NH1 3.43Å; D1273-R1276 PolarHBondContact OD1-NH1 3.47Å; D1273-R1276 IonicContact OD1-NH2 2.84Å; D1273-R1276 PolarHBondContact OD1-NH2 2.97Å; D1273-R1276 IonicContact OD2-NH2 4Å; D1273-Q1277 VanDerWaalsContact O-CB 3.24Å; D1273-Q1277 WeakPolarHBondContact O-CB 3.32Å; D1273-Q1277 WeakPolarHBondContact O-CG 3.42Å; D1273-Q1277 PolarHBondContact O-N 2.94Å
1274	I	90.9	Very high	88.4	Confident	142 Å²	142	70.6 Å²	70.6	73%	0.728	40%	0.395	S	S	*	.	H	α-helix	trans	-71.8	-45	-179.4	-58.5	176.2	0	0	0	110.9	D1272 H1278	D1272-I1274 PolarHBondContact O-N 3.35Å; D1272-I1274 VanDerWaalsContact O-N 3.09Å; I1274-H1278 WeakPolarHBondContact O-CB 3.47Å; I1274-H1278 PolarHBondContact O-N 3.43Å
1275	I	86.6	Confident	88.8	Confident	80 Å²	80	70.7 Å²	70.7	41%	0.41	40%	0.396	S	S	.	.	H	α-helix	trans	-66.8	-45.4	179.4	-58.7	-178.4	0	0	0	109.8	D1272 H1278 K1279	D1272-I1275 HydrophobicContact CB-CB 4.11Å; D1272-I1275 HydrophobicContact CB-CD1 3.99Å; D1272-I1275 HydrophobicContact CB-CG1 3.89Å; D1272-I1275 PolarHBondContact O-N 2.95Å; I1275-H1278 PolarHBondContact O-N 3.45Å; I1275-K1279 HydrophobicContact CG2-CD 4.19Å; I1275-K1279 HydrophobicContact CG2-CG 4.4Å; I1275-K1279 WeakPolarHBondContact O-CB 3.13Å; I1275-K1279 WeakPolarHBondContact O-CG 3.37Å; I1275-K1279 PolarHBondContact O-N 3.43Å
1276	R	87.5	Confident	89.1	Confident	53 Å²	53	69.3 Å²	69.3	20%	0.2	39%	0.387	C	S	.	.	H	α-helix	trans	-60.2	-48	176.9	-170.9	172.2	77.7	-106.6	0.8	111.4	L1268 C1271 D1272 D1273 H1278 K1279 L1280	L1268-R1276 HydrophobicContact CB-CG 3.97Å; L1268-R1276 WeakPolarHBondContact O-CD 3.45Å; C1271-R1276 HydrophobicContact CB-CB 4.42Å; C1271-R1276 PolarHBondContact O-NH1 2.8Å; D1272-R1276 VanDerWaalsContact O-CB 3.24Å; D1272-R1276 WeakPolarHBondContact O-CB 3.46Å; D1272-R1276 PolarHBondContact O-N 3Å; D1273-R1276 IonicContact OD1-CZ 3.22Å; D1273-R1276 IonicContact OD1-NH1 3.43Å; D1273-R1276 PolarHBondContact OD1-NH1 3.47Å; D1273-R1276 IonicContact OD1-NH2 2.84Å; D1273-R1276 PolarHBondContact OD1-NH2 2.97Å; D1273-R1276 IonicContact OD2-NH2 4Å; R1276-H1278 PolarHBondContact O-N 3.07Å; R1276-K1279 PolarHBondContact O-N 2.88Å; R1276-L1280 HydrophobicContact CG-CD1 3.96Å; R1276-L1280 VanDerWaalsContact O-CB 3.31Å; R1276-L1280 WeakPolarHBondContact O-CB 3.3Å; R1276-L1280 WeakPolarHBondContact O-CG 3.38Å; R1276-L1280 PolarHBondContact O-N 3.45Å
1277	Q	90.6	Very high	89.6	Confident	127 Å²	127	62 Å²	62	59%	0.593	36%	0.357	S	S	*	.	H	α-helix	trans	-62.4	-40.1	175.4	-75.8	174.8	22.9	0	0	112.1	D1273 A1281	D1273-Q1277 VanDerWaalsContact O-CB 3.24Å; D1273-Q1277 WeakPolarHBondContact O-CB 3.32Å; D1273-Q1277 WeakPolarHBondContact O-CG 3.42Å; D1273-Q1277 PolarHBondContact O-N 2.94Å; Q1277-A1281 WeakPolarHBondContact O-CB 3.5Å; Q1277-A1281 PolarHBondContact O-N 2.83Å
1278	H	92.2	Very high	90.1	Very high	131 Å²	131	61.8 Å²	61.8	61%	0.606	36%	0.355	S	S	*	.	H	α-helix	trans	-66	-49.2	177.1	-177.8	51.8	0	0	0	112.5	I1274 I1275 R1276 L1280 A1281 C1282	I1274-H1278 WeakPolarHBondContact O-CB 3.47Å; I1274-H1278 PolarHBondContact O-N 3.43Å; I1275-H1278 PolarHBondContact O-N 3.45Å; R1276-H1278 PolarHBondContact O-N 3.07Å; H1278-L1280 VanDerWaalsContact C-N 3.3Å; H1278-L1280 PolarHBondContact O-N 3.13Å; H1278-A1281 PolarHBondContact O-N 2.66Å; H1278-C1282 PolarHBondContact O-N 3.26Å; H1278-C1282 VanDerWaalsContact O-N 3.07Å
1279	K	93.7	Very high	90.5	Very high	25 Å²	25	62.8 Å²	62.8	11%	0.109	36%	0.36	C	S	.	.	H	α-helix	trans	-59.2	-38.8	176.7	-77.7	-171.7	173.7	-168.1	0	112.1	L1268 I1275 R1276 L1283 A1301 M1333 E1390	L1268-K1279 HydrophobicContact CD1-CB 3.77Å; L1268-K1279 HydrophobicContact CD1-CD 4.21Å; L1268-K1279 HydrophobicContact CD2-CD 4.03Å; I1275-K1279 HydrophobicContact CG2-CD 4.19Å; I1275-K1279 HydrophobicContact CG2-CG 4.4Å; I1275-K1279 WeakPolarHBondContact O-CB 3.13Å; I1275-K1279 WeakPolarHBondContact O-CG 3.37Å; I1275-K1279 PolarHBondContact O-N 3.43Å; R1276-K1279 PolarHBondContact O-N 2.88Å; K1279-L1283 PolarHBondContact O-N 3.43Å; K1279-A1301 HydrophobicContact CB-CB 3.96Å; K1279-A1301 HydrophobicContact CD-CB 4.34Å; K1279-A1301 HydrophobicContact CG-CB 4.35Å; K1279-M1333 WeakPolarHBondContact CE-O 3.37Å; K1279-M1333 PolarHBondContact NZ-O 3.09Å; K1279-E1390 IonicContact NZ-OE1 2.92Å; K1279-E1390 PolarHBondContact NZ-OE1 3.47Å; K1279-E1390 IonicContact NZ-OE2 3.88Å; K1279-E1390 PolarHBondContact NZ-OE2 2.95Å
1280	L	92.6	Very high	91.1	Very high	48 Å²	48	60.8 Å²	60.8	25%	0.251	34%	0.342	S	S	.	.	H	α-helix	trans	-74.9	-39.8	177	-68.3	174.6	0	0	0	113.3	V1264 T1265 L1268 R1276 H1278 C1282 L1283	V1264-L1280 HydrophobicContact CG1-CD2 4.11Å; T1265-L1280 HydrophobicContact CG2-CD1 4Å; T1265-L1280 WeakPolarHBondContact OG1-CD2 3.34Å; L1268-L1280 HydrophobicContact CD1-CD2 4.2Å; L1268-L1280 HydrophobicContact CD1-CG 4.33Å; R1276-L1280 HydrophobicContact CG-CD1 3.96Å; R1276-L1280 VanDerWaalsContact O-CB 3.31Å; R1276-L1280 WeakPolarHBondContact O-CB 3.3Å; R1276-L1280 WeakPolarHBondContact O-CG 3.38Å; R1276-L1280 PolarHBondContact O-N 3.45Å; H1278-L1280 VanDerWaalsContact C-N 3.3Å; H1278-L1280 PolarHBondContact O-N 3.13Å; L1280-C1282 PolarHBondContact O-N 3.33Å; L1280-L1283 HydrophobicContact CD2-CD2 4.1Å; L1280-L1283 VanDerWaalsContact O-CB 3.24Å; L1280-L1283 WeakPolarHBondContact O-CB 3.37Å; L1280-L1283 PolarHBondContact O-N 2.99Å; L1280-L1283 VanDerWaalsContact O-N 3.11Å
1281	A	93.1	Very high	91.7	Very high	87 Å²	87	57.7 Å²	57.7	72%	0.719	31%	0.308	S	S	*	.	H	α-helix	trans	-65.6	-25.9	176.5	0	0	0	0	0	112.9	Q1277 H1278	Q1277-A1281 WeakPolarHBondContact O-CB 3.5Å; Q1277-A1281 PolarHBondContact O-N 2.83Å; H1278-A1281 PolarHBondContact O-N 2.66Å
1282	C	94.3	Very high	91.5	Very high	63 Å²	63	60.2 Å²	60.2	43%	0.426	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	14.4	174.4	-61.7	0	0	0	0	113.1	H1278 L1280 R1284 S1300	H1278-C1282 PolarHBondContact O-N 3.26Å; H1278-C1282 VanDerWaalsContact O-N 3.07Å; L1280-C1282 PolarHBondContact O-N 3.33Å; C1282-R1284 PolarHBondContact O-N 2.93Å; C1282-S1300 WeakPolarHBondContact O-CB 3.35Å; C1282-S1300 PolarHBondContact O-OG 2.67Å
1283	L	96.7	Very high	91.1	Very high	15 Å²	15	57.1 Å²	57.1	8%	0.079	30%	0.299	C	S	.	.			trans	-71.9	119.3	-173.7	-178	59.7	0	0	0	112.2	A1242 V1264 K1279 L1280 T1299 S1300 A1301	A1242-L1283 HydrophobicContact CB-CD2 4.27Å; A1242-L1283 HydrophobicContact CB-CG 4.08Å; V1264-L1283 HydrophobicContact CB-CD2 3.87Å; V1264-L1283 HydrophobicContact CG1-CD1 3.98Å; V1264-L1283 HydrophobicContact CG1-CD2 3.86Å; V1264-L1283 HydrophobicContact CG2-CD1 4.3Å; V1264-L1283 HydrophobicContact CG2-CD2 4.2Å; K1279-L1283 PolarHBondContact O-N 3.43Å; L1280-L1283 HydrophobicContact CD2-CD2 4.1Å; L1280-L1283 VanDerWaalsContact O-CB 3.24Å; L1280-L1283 WeakPolarHBondContact O-CB 3.37Å; L1280-L1283 PolarHBondContact O-N 2.99Å; L1280-L1283 VanDerWaalsContact O-N 3.11Å; L1283-T1299 HydrophobicContact CD1-CG2 4.32Å; L1283-S1300 WeakPolarHBondContact CA-OG 3.43Å; L1283-A1301 HydrophobicContact CD1-CB 4.03Å
1284	R	96.5	Very high	91.4	Very high	79 Å²	79	53.3 Å²	53.3	30%	0.298	28%	0.278	S	S	.	.			trans	-149.2	157.7	173.1	60.2	-177.6	179.4	84.5	-1	110.5	S1241 C1282 T1299 S1300	S1241-R1284 CarbonylContact O-C 3.59Å; S1241-R1284 WeakPolarHBondContact O-CA 3.48Å; C1282-R1284 PolarHBondContact O-N 2.93Å; R1284-T1299 WeakPolarHBondContact O-CA 3.45Å; R1284-S1300 PolarHBondContact N-OG 3.29Å; R1284-S1300 PolarHBondContact O-N 2.79Å; R1284-S1300 PolarHBondContact O-OG 3.25Å
1285	I	97.9	Very high	91.5	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.015	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	136.7	167.1	-64.5	171.2	0	0	0	108.6	S1241 V1244 I1260 M1288 I1297	S1241-I1285 PolarHBondContact O-N 3.07Å; V1244-I1285 HydrophobicContact CB-CD1 3.92Å; I1260-I1285 HydrophobicContact CD1-CG1 3.85Å; I1285-M1288 HydrophobicContact CD1-SD 4.31Å; I1285-M1288 HydrophobicContact CG2-CG 3.53Å; I1285-M1288 HydrophobicContact CG2-SD 4.01Å; I1285-I1297 HydrophobicContact CB-CG2 4.45Å; I1285-I1297 HydrophobicContact CD1-CG2 4.2Å; I1285-I1297 HydrophobicContact CG1-CG2 3.81Å; I1285-I1297 HydrophobicContact CG2-CG2 4.03Å
1286	T	96.4	Very high	91.9	Very high	30 Å²	30	42.7 Å²	42.7	18%	0.184	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-29.7	179.7	51.9	0	0	0	0	113.1	G1298 T1299 P1335 C1336	T1286-G1298 PolarHBondContact N-O 3.45Å; T1286-G1298 PolarHBondContact OG1-O 3.47Å; T1286-G1298 VanDerWaalsContact OG1-O 3.1Å; T1286-T1299 PolarHBondContact OG1-N 2.92Å; T1286-P1335 HydrophobicContact CG2-CB 4.31Å; T1286-C1336 WeakPolarHBondContact CB-O 3.47Å; T1286-C1336 PolarHBondContact OG1-O 2.95Å
1287	T	96.4	Very high	92.4	Very high	20 Å²	20	40.2 Å²	40.2	12%	0.123	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	150.8	177.5	179	0	0	0	0	109.5	G1298 C1336 L1339	T1287-G1298 PolarHBondContact O-N 2.91Å; T1287-C1336 HydrophobicContact CG2-CB 4.46Å; T1287-L1339 HydrophobicContact CG2-CB 4.46Å; T1287-L1339 HydrophobicContact CG2-CD1 3.91Å; T1287-L1339 HydrophobicContact CG2-CG 3.86Å; T1287-L1339 PolarHBondContact OG1-N 2.77Å
1288	M	96.7	Very high	92.7	Very high	15 Å²	15	34.1 Å²	34.1	7%	0.074	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	149.5	176.1	-59.7	-161.7	-50.2	0	0	110.6	C1226 A1228 W1235 V1244 I1285 L1295 W1296	C1226-M1288 HydrophobicContact CB-CB 4.16Å; C1226-M1288 HydrophobicContact CB-CE 3.95Å; C1226-M1288 HydrophobicContact CB-CG 3.89Å; A1228-M1288 HydrophobicContact CB-CB 4.24Å; W1235-M1288 HydrophobicContact CB-CE 4.1Å; V1244-M1288 HydrophobicContact CB-SD 4.28Å; V1244-M1288 HydrophobicContact CG2-CE 3.9Å; V1244-M1288 HydrophobicContact CG2-SD 3.45Å; V1244-M1288 WeakPolarHBondContact CG2-SD 3.32Å; I1285-M1288 HydrophobicContact CD1-SD 4.31Å; I1285-M1288 HydrophobicContact CG2-CG 3.53Å; I1285-M1288 HydrophobicContact CG2-SD 4.01Å; M1288-L1295 HydrophobicContact CB-CD1 4.41Å; M1288-W1296 VanDerWaalsContact CA-O 3.31Å; M1288-W1296 WeakPolarHBondContact CA-O 3.39Å
1289	M	94.7	Very high	93	Very high	21 Å²	21	27.9 Å²	27.9	10%	0.103	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	143	178.6	-177.3	179.2	70.4	0	0	111.5	C1291 W1296 L1339 V1340 S1341 V1382	M1289-C1291 HydrophobicContact CE-CB 4.19Å; M1289-W1296 PolarHBondContact N-O 3.05Å; M1289-W1296 PolarHBondContact O-N 3.12Å; M1289-L1339 HydrophobicContact CB-CB 3.91Å; M1289-L1339 HydrophobicContact CB-CD1 4.38Å; M1289-L1339 HydrophobicContact CE-CB 4.17Å; M1289-L1339 HydrophobicContact SD-CB 4.22Å; M1289-V1340 WeakPolarHBondContact SD-CA 3.3Å; M1289-S1341 PolarHBondContact SD-N 3.07Å; M1289-V1382 HydrophobicContact CE-CB 4.26Å; M1289-V1382 HydrophobicContact CE-CG1 3.66Å; M1289-V1382 HydrophobicContact CE-CG2 3.74Å
1290	C	92.1	Very high	93.1	Very high	24 Å²	24	27.6 Å²	27.6	16%	0.162	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.9	168.6	-67.7	0	0	0	0	110.6	A1229 N1230 M1294	A1229-C1290 VanDerWaalsContact O-CB 3.28Å; A1229-C1290 WeakPolarHBondContact O-CB 3.4Å; N1230-C1290 HydrophobicContact CB-CB 4.07Å; C1290-M1294 CarbonylContact C-O 3.57Å; C1290-M1294 WeakPolarHBondContact CA-O 3.39Å
1291	C	86.7	Confident	93.2	Very high	11 Å²	11	25.3 Å²	25.3	7%	0.074	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	128.9	-179.5	175.7	0	0	0	0	110.1	M1289 D1293 M1294 V1380 V1382	M1289-C1291 HydrophobicContact CE-CB 4.19Å; C1291-D1293 VanDerWaalsContact C-N 3.35Å; C1291-D1293 PolarHBondContact O-N 3.3Å; C1291-M1294 PolarHBondContact N-O 3.16Å; C1291-M1294 WeakPolarHBondContact O-CA 3.48Å; C1291-M1294 WeakPolarHBondContact O-CB 3.22Å; C1291-M1294 PolarHBondContact O-N 2.92Å; C1291-V1380 WeakPolarHBondContact SG-CG1 3.32Å; C1291-V1382 HydrophobicContact CB-CG2 4.28Å
1292	K	78.6	Confident	93.2	Very high	79 Å²	79	21.2 Å²	21.2	34%	0.343	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	46.8	178.9	-83.4	-173.2	162.6	173.6	0	115	R902 M1294 R1378 V1380 V1418	R902-K1292 PolarHBondContact NH1-O 3.02Å; R902-K1292 VanDerWaalsContact NH1-O 3.13Å; K1292-M1294 PolarHBondContact O-N 3.22Å; K1292-R1378 PolarHBondContact NZ-O 2.98Å; K1292-V1380 HydrophobicContact CD-CB 3.92Å; K1292-V1380 HydrophobicContact CD-CG2 3.99Å; K1292-V1380 HydrophobicContact CG-CB 4.44Å; K1292-V1380 HydrophobicContact CG-CG2 4.31Å; K1292-V1418 HydrophobicContact CB-CG1 4.07Å; K1292-V1418 HydrophobicContact CD-CB 4.25Å; K1292-V1418 HydrophobicContact CD-CG1 3.96Å; K1292-V1418 WeakPolarHBondContact CD-OXT 3.45Å; K1292-V1418 PolarHBondContact NZ-O 3.11Å; K1292-V1418 PolarHBondContact NZ-OXT 3.08Å
1293	D	77.8	Confident	93.3	Very high	54 Å²	54	18.2 Å²	18.2	29%	0.289	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	25.8	-173	-36.3	-52.2	0	0	0	114.4	R902 N1230 C1291 S1308 T1309	R902-D1293 IonicContact CZ-OD2 3.18Å; R902-D1293 IonicContact NH1-OD2 3.51Å; R902-D1293 PolarHBondContact NH1-OD2 2.88Å; R902-D1293 IonicContact NH2-OD2 3.06Å; R902-D1293 PolarHBondContact NH2-OD2 3.39Å; R902-D1293 VanDerWaalsContact NH2-OD2 3.09Å; N1230-D1293 PolarHBondContact ND2-OD1 3.03Å; C1291-D1293 VanDerWaalsContact C-N 3.35Å; C1291-D1293 PolarHBondContact O-N 3.3Å; D1293-S1308 CarbonylContact O-C 3.49Å; D1293-S1308 WeakPolarHBondContact O-CA 3.42Å; D1293-T1309 PolarHBondContact O-N 3.26Å; D1293-T1309 PolarHBondContact O-OG1 3.47Å; D1293-T1309 VanDerWaalsContact O-OG1 3.06Å
1294	M	86.7	Confident	93.2	Very high	12 Å²	12	17.5 Å²	17.5	6%	0.059	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.6	173.1	-57.4	179.6	70.5	0	0	109.9	P905 C1290 C1291 K1292 Y1306 L1307 V1418	P905-M1294 HydrophobicContact CG-CE 3.81Å; C1290-M1294 CarbonylContact C-O 3.57Å; C1290-M1294 WeakPolarHBondContact CA-O 3.39Å; C1291-M1294 PolarHBondContact N-O 3.16Å; C1291-M1294 WeakPolarHBondContact O-CA 3.48Å; C1291-M1294 WeakPolarHBondContact O-CB 3.22Å; C1291-M1294 PolarHBondContact O-N 2.92Å; K1292-M1294 PolarHBondContact O-N 3.22Å; M1294-Y1306 HydrophobicContact CE-CD2 3.29Å; M1294-Y1306 HydrophobicContact CE-CE2 3.9Å; M1294-Y1306 HydrophobicContact CE-CG 3.98Å; M1294-L1307 CarbonylContact C-O 3.41Å; M1294-L1307 VanDerWaalsContact CA-O 3.23Å; M1294-L1307 WeakPolarHBondContact CA-O 3.4Å; M1294-V1418 HydrophobicContact SD-CG1 3.65Å
1295	L	93.4	Very high	93.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.8	165.6	174.8	73.2	0	0	0	107.5	A1228 W1235 V1244 M1288 I1297 Y1306 L1307 T1309	A1228-L1295 HydrophobicContact CB-CD1 4.36Å; W1235-L1295 HydrophobicContact CB-CD1 4.18Å; W1235-L1295 HydrophobicContact CD2-CD1 4.46Å; W1235-L1295 HydrophobicContact CD2-CD2 3.69Å; W1235-L1295 HydrophobicContact CE3-CD2 3.83Å; W1235-L1295 HydrophobicContact CG-CD1 3.98Å; W1235-L1295 HydrophobicContact CG-CD2 4.06Å; W1235-L1295 HydrophobicContact CH2-CD2 4.29Å; W1235-L1295 HydrophobicContact CZ2-CD2 4.18Å; W1235-L1295 HydrophobicContact CZ3-CD2 4.12Å; V1244-L1295 HydrophobicContact CG1-CD2 4.39Å; V1244-L1295 HydrophobicContact CG2-CD2 4.27Å; M1288-L1295 HydrophobicContact CB-CD1 4.41Å; L1295-I1297 HydrophobicContact CD2-CD1 3.88Å; L1295-I1297 HydrophobicContact CD2-CG1 4.01Å; L1295-I1297 HydrophobicContact CG-CD1 4.39Å; L1295-I1297 HydrophobicContact CG-CG1 3.99Å; L1295-Y1306 VanDerWaalsContact O-CA 3.23Å; L1295-Y1306 WeakPolarHBondContact O-CA 3.36Å; L1295-L1307 HydrophobicContact CB-CD1 3.93Å; L1295-L1307 HydrophobicContact CB-CG 4.12Å; L1295-L1307 HydrophobicContact CD2-CD1 4.49Å; L1295-L1307 HydrophobicContact CD2-CD2 4.33Å; L1295-L1307 HydrophobicContact CD2-CG 4.39Å; L1295-L1307 PolarHBondContact N-O 2.9Å; L1295-L1307 PolarHBondContact O-N 3.28Å; L1295-T1309 HydrophobicContact CB-CG2 3.92Å
1296	W	95.9	Very high	92.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	139.8	170	-75.4	75	0	0	0	110	P905 M1288 M1289 T1328 L1339 V1382 W1416 V1418	P905-W1296 HydrophobicContact CB-CH2 3.51Å; P905-W1296 HydrophobicContact CB-CZ2 3.51Å; P905-W1296 HydrophobicContact CG-CH2 3.73Å; P905-W1296 HydrophobicContact CG-CZ2 3.37Å; M1288-W1296 VanDerWaalsContact CA-O 3.31Å; M1288-W1296 WeakPolarHBondContact CA-O 3.39Å; M1289-W1296 PolarHBondContact N-O 3.05Å; M1289-W1296 PolarHBondContact O-N 3.12Å; W1296-T1328 HydrophobicContact CZ3-CG2 4.17Å; W1296-L1339 HydrophobicContact CB-CD1 3.82Å; W1296-L1339 HydrophobicContact CB-CD2 4.39Å; W1296-L1339 HydrophobicContact CE3-CD2 4.38Å; W1296-V1382 HydrophobicContact CD2-CB 4.41Å; W1296-V1382 HydrophobicContact CD2-CG1 3.8Å; W1296-V1382 HydrophobicContact CD2-CG2 4.4Å; W1296-V1382 HydrophobicContact CE3-CG1 3.85Å; W1296-V1382 HydrophobicContact CG-CG1 4.28Å; W1296-V1382 HydrophobicContact CH2-CB 4.34Å; W1296-V1382 HydrophobicContact CH2-CG1 4.31Å; W1296-V1382 HydrophobicContact CZ2-CB 4.07Å; W1296-V1382 HydrophobicContact CZ2-CG1 4.26Å; W1296-V1382 HydrophobicContact CZ2-CG2 4.15Å; W1296-V1382 HydrophobicContact CZ3-CG1 4.11Å; W1296-W1416 HydrophobicContact CH2-CB 3.67Å; W1296-W1416 HydrophobicContact CH2-CD2 4.09Å; W1296-W1416 AromaticContact CH2-CG 3.62Å; W1296-W1416 HydrophobicContact CH2-CG 3.62Å; W1296-W1416 HydrophobicContact CZ2-CB 4.34Å; W1296-W1416 HydrophobicContact CZ3-CB 4.45Å; W1296-W1416 AromaticContact CZ3-CD1 3.99Å; W1296-W1416 HydrophobicContact CZ3-CD2 4.42Å; W1296-W1416 HydrophobicContact CZ3-CG 4.01Å; W1296-V1418 HydrophobicContact CZ2-CG2 3.73Å
1297	I	97.9	Very high	92.6	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	119.7	-175.4	-52.8	178.7	0	0	0	108.7	V1244 I1260 I1285 L1295 C1305 L1325	V1244-I1297 HydrophobicContact CG1-CD1 4.26Å; I1260-I1297 HydrophobicContact CD1-CG2 4.26Å; I1260-I1297 HydrophobicContact CG2-CD1 3.93Å; I1285-I1297 HydrophobicContact CB-CG2 4.45Å; I1285-I1297 HydrophobicContact CD1-CG2 4.2Å; I1285-I1297 HydrophobicContact CG1-CG2 3.81Å; I1285-I1297 HydrophobicContact CG2-CG2 4.03Å; L1295-I1297 HydrophobicContact CD2-CD1 3.88Å; L1295-I1297 HydrophobicContact CD2-CG1 4.01Å; L1295-I1297 HydrophobicContact CG-CD1 4.39Å; L1295-I1297 HydrophobicContact CG-CG1 3.99Å; I1297-C1305 HydrophobicContact CB-CB 4.35Å; I1297-C1305 PolarHBondContact N-O 3.25Å; I1297-C1305 PolarHBondContact O-N 3.22Å; I1297-L1325 HydrophobicContact CD1-CD1 4.3Å
1298	G	97	Very high	92	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	144.3	166.7	0	0	0	0	0	110.9	T1286 T1287	T1286-G1298 PolarHBondContact N-O 3.45Å; T1286-G1298 PolarHBondContact OG1-O 3.47Å; T1286-G1298 VanDerWaalsContact OG1-O 3.1Å; T1287-G1298 PolarHBondContact O-N 2.91Å
1299	T	97.4	Very high	91.3	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	160.2	-178.2	73.8	0	0	0	0	112.9	I1260 V1264 L1283 R1284 T1286 A1301 G1302 V1303 C1336	I1260-T1299 HydrophobicContact CD1-CG2 3.43Å; I1260-T1299 VanDerWaalsContact CD1-CG2 3.43Å; V1264-T1299 HydrophobicContact CG2-CG2 4.27Å; L1283-T1299 HydrophobicContact CD1-CG2 4.32Å; R1284-T1299 WeakPolarHBondContact O-CA 3.45Å; T1286-T1299 PolarHBondContact OG1-N 2.92Å; T1299-A1301 PolarHBondContact O-N 3.13Å; T1299-A1301 PolarHBondContact OG1-N 3.05Å; T1299-G1302 PolarHBondContact O-N 2.92Å; T1299-G1302 PolarHBondContact OG1-N 3.41Å; T1299-V1303 WeakPolarHBondContact CB-O 3.46Å; T1299-V1303 WeakPolarHBondContact CG2-O 3.27Å; T1299-V1303 PolarHBondContact N-O 3.23Å; T1299-V1303 PolarHBondContact OG1-N 3.43Å; T1299-V1303 PolarHBondContact OG1-O 3.28Å; T1299-C1336 PolarHBondContact O-N 3.11Å
1300	S	96.4	Very high	90.4	Very high	18 Å²	18	13.9 Å²	13.9	13%	0.126	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.4	170.4	52.7	0	0	0	0	113.9	C1282 L1283 R1284 G1302	C1282-S1300 WeakPolarHBondContact O-CB 3.35Å; C1282-S1300 PolarHBondContact O-OG 2.67Å; L1283-S1300 WeakPolarHBondContact CA-OG 3.43Å; R1284-S1300 PolarHBondContact N-OG 3.29Å; R1284-S1300 PolarHBondContact O-N 2.79Å; R1284-S1300 PolarHBondContact O-OG 3.25Å; S1300-G1302 VanDerWaalsContact C-N 3.28Å
1301	A	94.7	Very high	89.4	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.008	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-1.8	174.1	0	0	0	0	0	113.4	V1264 L1268 K1279 L1283 T1299 V1303	V1264-A1301 HydrophobicContact CG1-CB 4.28Å; L1268-A1301 HydrophobicContact CD1-CB 4.24Å; K1279-A1301 HydrophobicContact CB-CB 3.96Å; K1279-A1301 HydrophobicContact CD-CB 4.34Å; K1279-A1301 HydrophobicContact CG-CB 4.35Å; L1283-A1301 HydrophobicContact CD1-CB 4.03Å; T1299-A1301 PolarHBondContact O-N 3.13Å; T1299-A1301 PolarHBondContact OG1-N 3.05Å; A1301-V1303 PolarHBondContact O-N 3.48Å
1302	G	93.5	Very high	88.8	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	S	Bend	trans	82.9	-22.1	176.5	0	0	0	0	0	115.9	T1299 S1300 L1304 H1332 G1334	T1299-G1302 PolarHBondContact O-N 2.92Å; T1299-G1302 PolarHBondContact OG1-N 3.41Å; S1300-G1302 VanDerWaalsContact C-N 3.28Å; G1302-L1304 PolarHBondContact O-N 2.94Å; G1302-H1332 CarbonylContact C-O 3.49Å; G1302-H1332 VanDerWaalsContact CA-O 3.23Å; G1302-H1332 WeakPolarHBondContact CA-O 3.5Å; G1302-H1332 PolarHBondContact O-N 3.44Å; G1302-G1334 WeakPolarHBondContact CA-O 3.4Å; G1302-G1334 PolarHBondContact N-O 3.04Å
1303	V	95.2	Very high	88.6	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.078	C	C	.	.			trans	-51.4	133.3	165.6	-178.1	0	0	0	0	110	V1264 T1267 L1268 T1299 A1301 Y1392	V1264-V1303 HydrophobicContact CG1-CG2 4.23Å; V1264-V1303 HydrophobicContact CG2-CG1 4.38Å; T1267-V1303 HydrophobicContact CG2-CG1 4.01Å; T1267-V1303 HydrophobicContact CG2-CG2 4.03Å; L1268-V1303 HydrophobicContact CD2-CG2 3.89Å; L1268-V1303 HydrophobicContact CG-CG2 4.19Å; T1299-V1303 WeakPolarHBondContact CB-O 3.46Å; T1299-V1303 WeakPolarHBondContact CG2-O 3.27Å; T1299-V1303 PolarHBondContact N-O 3.23Å; T1299-V1303 PolarHBondContact OG1-N 3.43Å; T1299-V1303 PolarHBondContact OG1-O 3.28Å; A1301-V1303 PolarHBondContact O-N 3.48Å; V1303-Y1392 HydrophobicContact CB-CE2 4.45Å; V1303-Y1392 HydrophobicContact CG2-CE1 4.17Å; V1303-Y1392 HydrophobicContact CG2-CE2 3.86Å; V1303-Y1392 PolarHBondContact N-OH 3.46Å
1304	L	96	Very high	88.3	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.3	169.6	-46.2	168.5	0	0	0	108.5	G1302 S1327 T1328 C1336 S1384 W1416	G1302-L1304 PolarHBondContact O-N 2.94Å; L1304-S1327 WeakPolarHBondContact O-CA 3.49Å; L1304-T1328 HydrophobicContact CB-CG2 3.98Å; L1304-T1328 WeakPolarHBondContact CB-OG1 3.49Å; L1304-T1328 HydrophobicContact CD1-CG2 4.4Å; L1304-T1328 PolarHBondContact O-N 3.4Å; L1304-T1328 PolarHBondContact O-OG1 3.35Å; L1304-C1336 HydrophobicContact CD2-CB 3.94Å; L1304-C1336 VanDerWaalsContact CD2-SG 3.54Å; L1304-S1384 VanDerWaalsContact CD1-OG 3.24Å; L1304-S1384 WeakPolarHBondContact CD1-OG 3.42Å; L1304-W1416 HydrophobicContact CD1-CZ2 4.47Å
1305	C	94.8	Very high	87.5	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	152.1	176.8	-59.2	0	0	0	0	111.1	I1297 L1325 F1326	I1297-C1305 HydrophobicContact CB-CB 4.35Å; I1297-C1305 PolarHBondContact N-O 3.25Å; I1297-C1305 PolarHBondContact O-N 3.22Å; C1305-L1325 HydrophobicContact CB-CD1 3.95Å; C1305-L1325 HydrophobicContact CB-CG 4.37Å; C1305-F1326 CarbonylContact C-O 3.54Å; C1305-F1326 WeakPolarHBondContact CA-O 3.34Å; C1305-F1326 WeakPolarHBondContact CB-O 3.4Å
1306	Y	93.2	Very high	86.4	Confident	23 Å²	23	20.1 Å²	20.1	9%	0.09	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	152.6	176.7	63.7	-92.8	0	0	0	112.6	P904 P905 M1294 L1295 F1326 T1328	P904-Y1306 WeakPolarHBondContact CB-OH 3.45Å; P905-Y1306 HydrophobicContact CG-CD1 4.22Å; P905-Y1306 HydrophobicContact CG-CD2 4.29Å; P905-Y1306 HydrophobicContact CG-CE1 4.17Å; P905-Y1306 HydrophobicContact CG-CE2 4.22Å; P905-Y1306 HydrophobicContact CG-CG 4.29Å; M1294-Y1306 HydrophobicContact CE-CD2 3.29Å; M1294-Y1306 HydrophobicContact CE-CE2 3.9Å; M1294-Y1306 HydrophobicContact CE-CG 3.98Å; L1295-Y1306 VanDerWaalsContact O-CA 3.23Å; L1295-Y1306 WeakPolarHBondContact O-CA 3.36Å; Y1306-F1326 HydrophobicContact CD1-CB 4.39Å; Y1306-F1326 HydrophobicContact CD2-CB 4.02Å; Y1306-F1326 HydrophobicContact CD2-CD2 4.25Å; Y1306-F1326 HydrophobicContact CE1-CB 3.9Å; Y1306-F1326 HydrophobicContact CE2-CB 3.5Å; Y1306-F1326 AromaticContact CE2-CD2 3.82Å; Y1306-F1326 HydrophobicContact CE2-CD2 3.82Å; Y1306-F1326 AromaticContact CE2-CG 3.88Å; Y1306-F1326 HydrophobicContact CE2-CG 3.88Å; Y1306-F1326 HydrophobicContact CG-CB 4.44Å; Y1306-F1326 VanDerWaalsContact CZ-CB 3.42Å; Y1306-F1326 PolarHBondContact N-O 3.42Å; Y1306-F1326 PolarHBondContact O-N 3.24Å; Y1306-T1328 HydrophobicContact CD1-CG2 4.25Å; Y1306-T1328 HydrophobicContact CE1-CG2 4.24Å
1307	L	89.2	Confident	85.3	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	150.6	171	62.3	83.9	0	0	0	110.6	W1235 I1258 M1294 L1295 T1309 P1323 N1324 L1325	W1235-L1307 HydrophobicContact CH2-CD1 3.89Å; W1235-L1307 HydrophobicContact CH2-CD2 4.3Å; W1235-L1307 HydrophobicContact CZ2-CD1 3.8Å; I1258-L1307 HydrophobicContact CD1-CD2 3.74Å; M1294-L1307 CarbonylContact C-O 3.41Å; M1294-L1307 VanDerWaalsContact CA-O 3.23Å; M1294-L1307 WeakPolarHBondContact CA-O 3.4Å; L1295-L1307 HydrophobicContact CB-CD1 3.93Å; L1295-L1307 HydrophobicContact CB-CG 4.12Å; L1295-L1307 HydrophobicContact CD2-CD1 4.49Å; L1295-L1307 HydrophobicContact CD2-CD2 4.33Å; L1295-L1307 HydrophobicContact CD2-CG 4.39Å; L1295-L1307 PolarHBondContact N-O 2.9Å; L1295-L1307 PolarHBondContact O-N 3.28Å; L1307-T1309 PolarHBondContact O-N 2.86Å; L1307-P1323 HydrophobicContact CD1-CG 4.17Å; L1307-P1323 HydrophobicContact CD2-CG 4.28Å; L1307-N1324 WeakPolarHBondContact CB-O 3.35Å; L1307-L1325 HydrophobicContact CB-CD1 4.28Å; L1307-L1325 HydrophobicContact CD2-CD1 4Å; L1307-L1325 HydrophobicContact CG-CD1 4.49Å
1308	S	84.1	Confident	84.2	Confident	31 Å²	31	32 Å²	32	22%	0.217	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	122.6	165.9	-55.2	0	0	0	0	108.9	D1293	D1293-S1308 CarbonylContact O-C 3.49Å; D1293-S1308 WeakPolarHBondContact O-CA 3.42Å
1309	T	82.3	Confident	83.1	Confident	14 Å²	14	33.4 Å²	33.4	9%	0.086	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-65.3	127.7	-178.1	56	0	0	0	0	110.1	W1235 D1293 L1295 L1307	W1235-T1309 HydrophobicContact CZ2-CG2 4.14Å; D1293-T1309 PolarHBondContact O-N 3.26Å; D1293-T1309 PolarHBondContact O-OG1 3.47Å; D1293-T1309 VanDerWaalsContact O-OG1 3.06Å; L1295-T1309 HydrophobicContact CB-CG2 3.92Å; L1307-T1309 PolarHBondContact O-N 2.86Å
1310	P	75.7	Confident	81.5	Confident	24 Å²	24	39.4 Å²	39.4	16%	0.156	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-71	150.4	178.6	32.9	-33.5	0	0	0	109.7	W1235 L1246 M1256 V1312 I1319 P1323	W1235-P1310 HydrophobicContact CZ2-CG 4.5Å; L1246-P1310 HydrophobicContact CD2-CG 3.7Å; M1256-P1310 HydrophobicContact SD-CG 4Å; P1310-V1312 PolarHBondContact O-N 3.4Å; P1310-I1319 HydrophobicContact CB-CD1 4.12Å; P1310-I1319 HydrophobicContact CB-CG2 4.36Å; P1310-I1319 HydrophobicContact CG-CD1 3.92Å; P1310-P1323 HydrophobicContact CG-CG 4.45Å
1311	Q	71.6	Confident	80.1	Confident	87 Å²	87	42 Å²	42	41%	0.407	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-66.2	126.6	-179.2	-87.7	-84.4	-50.1	0	0	112.3	Q781	Q781-Q1311 HydrophobicContact CG-CG 3.65Å; Q781-Q1311 VanDerWaalsContact NE2-CG 3.33Å
1312	V	74.2	Confident	78.9	Confident	13 Å²	13	46.8 Å²	46.8	8%	0.079	27%	0.27	C	S	.	.			trans	-115	113	171.8	-175.2	0	0	0	0	107.8	L1232 A1233 L1246 H1248 L1255 P1310 I1319	L1232-V1312 HydrophobicContact CB-CB 4Å; L1232-V1312 HydrophobicContact CB-CG1 3.82Å; L1232-V1312 WeakPolarHBondContact CB-O 3.23Å; L1232-V1312 VanDerWaalsContact CD1-O 3.24Å; L1232-V1312 WeakPolarHBondContact CD1-O 3.38Å; A1233-V1312 HydrophobicContact CB-CG2 3.9Å; L1246-V1312 HydrophobicContact CD1-CG2 4.45Å; L1246-V1312 HydrophobicContact CD2-CG2 4.15Å; H1248-V1312 HydrophobicContact CB-CG1 4.34Å; L1255-V1312 HydrophobicContact CD1-CB 4.34Å; L1255-V1312 HydrophobicContact CD1-CG1 3.71Å; L1255-V1312 HydrophobicContact CD1-CG2 3.67Å; P1310-V1312 PolarHBondContact O-N 3.4Å; V1312-I1319 HydrophobicContact CG2-CD1 4.26Å
1313	A	72.8	Confident	78	Confident	14 Å²	14	48.1 Å²	48.1	12%	0.116	28%	0.278	C	S	.	.			trans	-107.5	161.8	172.5	0	0	0	0	0	109.6	T863 H1248 Q1315 T1316	T863-A1313 HydrophobicContact CG2-CB 3.76Å; T863-A1313 VanDerWaalsContact OG1-CB 3.3Å; T863-A1313 WeakPolarHBondContact OG1-CB 3.49Å; H1248-A1313 PolarHBondContact NE2-O 3.33Å; A1313-Q1315 PolarHBondContact O-N 2.9Å; A1313-T1316 PolarHBondContact N-OG1 2.99Å; A1313-T1316 WeakPolarHBondContact O-CB 3.42Å; A1313-T1316 PolarHBondContact O-N 2.94Å; A1313-T1316 PolarHBondContact O-OG1 2.93Å
1314	H	71.6	Confident	77	Confident	66 Å²	66	53.1 Å²	53.1	31%	0.306	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.3	-171.7	-64.3	-103.4	0	0	0	114.9	N868 H1248 K1251	N868-H1314 WeakPolarHBondContact OD1-CB 3.42Å; N868-H1314 PolarHBondContact OD1-CD2 3.32Å; N868-H1314 VanDerWaalsContact OD1-CD2 3.23Å; N868-H1314 PolarHBondContact OD1-N 3.39Å; H1248-H1314 WeakPolarHBondContact NE2-CA 3.38Å; H1248-H1314 PolarHBondContact NE2-O 3.22Å; K1251-H1314 WeakPolarHBondContact CE-O 3.45Å
1315	Q	70	Confident	76.4	Confident	102 Å²	102	54.3 Å²	54.3	48%	0.477	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-12.7	174.3	-70.4	-168.2	13.2	0	0	114.9	L861 N868 K1251 A1313 S1317	L861-Q1315 HydrophobicContact CD2-CB 4.13Å; L861-Q1315 HydrophobicContact CD2-CG 3.9Å; N868-Q1315 PolarHBondContact ND2-N 3Å; K1251-Q1315 VanDerWaalsContact NZ-C 3.27Å; K1251-Q1315 PolarHBondContact NZ-O 3.44Å; A1313-Q1315 PolarHBondContact O-N 2.9Å; Q1315-S1317 PolarHBondContact O-N 3.31Å; Q1315-S1317 VanDerWaalsContact O-N 3.15Å
1316	T	72.1	Confident	76.1	Confident	30 Å²	30	58.1 Å²	58.1	18%	0.184	33%	0.328	C	S	.	.			trans	-54.2	120	179.7	-56.8	0	0	0	0	110.9	H1248 K1251 L1255 A1313 I1319	H1248-T1316 PolarHBondContact CD2-O 2.81Å; H1248-T1316 VanDerWaalsContact CD2-O 3.25Å; K1251-T1316 WeakPolarHBondContact CE-O 3.49Å; K1251-T1316 VanDerWaalsContact NZ-C 3.31Å; K1251-T1316 PolarHBondContact NZ-O 3.23Å; L1255-T1316 HydrophobicContact CD1-CG2 3.96Å; L1255-T1316 HydrophobicContact CD2-CG2 4.13Å; A1313-T1316 PolarHBondContact N-OG1 2.99Å; A1313-T1316 WeakPolarHBondContact O-CB 3.42Å; A1313-T1316 PolarHBondContact O-N 2.94Å; A1313-T1316 PolarHBondContact O-OG1 2.93Å; T1316-I1319 HydrophobicContact CG2-CD1 4.24Å; T1316-I1319 HydrophobicContact CG2-CG1 3.71Å
1317	S	72.1	Confident	75.8	Confident	82 Å²	82	58.8 Å²	58.8	57%	0.573	34%	0.336	S	S	*	.			trans	-109.7	-30.7	-178.7	52.1	0	0	0	0	112.8	L1255 Q1315	L1255-S1317 WeakPolarHBondContact CD2-O 3.49Å; Q1315-S1317 PolarHBondContact O-N 3.31Å; Q1315-S1317 VanDerWaalsContact O-N 3.15Å
1318	K	73.7	Confident	75.8	Confident	167 Å²	167	59 Å²	59	73%	0.726	34%	0.338	S	S	*	.			trans	-151.5	151	172.6	-170	173.8	-177.3	179.4	0	108.1
1319	I	73.8	Confident	75.8	Confident	29 Å²	29	62.5 Å²	62.5	15%	0.149	35%	0.346	C	S	.	.			trans	-110.7	118.6	171.8	-63	169	0	0	0	107.2	L1246 L1255 M1256 P1310 V1312 T1316 A1321	L1246-I1319 HydrophobicContact CD2-CD1 3.81Å; L1255-I1319 HydrophobicContact CB-CD1 4.1Å; L1255-I1319 HydrophobicContact CB-CG1 4.27Å; L1255-I1319 HydrophobicContact CD1-CD1 3.92Å; L1255-I1319 HydrophobicContact CD1-CG1 4.44Å; L1255-I1319 PolarHBondContact O-N 2.96Å; M1256-I1319 HydrophobicContact CE-CB 3.83Å; M1256-I1319 HydrophobicContact CE-CG2 3.5Å; M1256-I1319 VanDerWaalsContact CE-CG2 3.5Å; P1310-I1319 HydrophobicContact CB-CD1 4.12Å; P1310-I1319 HydrophobicContact CB-CG2 4.36Å; P1310-I1319 HydrophobicContact CG-CD1 3.92Å; V1312-I1319 HydrophobicContact CG2-CD1 4.26Å; T1316-I1319 HydrophobicContact CG2-CD1 4.24Å; T1316-I1319 HydrophobicContact CG2-CG1 3.71Å; I1319-A1321 WeakPolarHBondContact CG2-O 3.46Å
1320	S	65.6	Low	76.1	Confident	126 Å²	126	62.6 Å²	62.6	88%	0.881	35%	0.346	S	S	*	.			trans	-83.9	-31	-172.2	46.1	0	0	0	0	113.9
1321	A	66.2	Low	76.8	Confident	72 Å²	72	61.5 Å²	61.5	60%	0.595	34%	0.339	S	S	*	.	S	Bend	trans	-94.9	119.5	175.6	0	0	0	0	0	110.9	M1256 I1319	M1256-A1321 WeakPolarHBondContact CE-O 3.4Å; I1319-A1321 WeakPolarHBondContact CG2-O 3.46Å
1322	T	70	Confident	77.8	Confident	102 Å²	102	57.3 Å²	57.3	63%	0.626	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-69.8	125.8	170	48.6	0	0	0	0	110.4
1323	P	73.9	Confident	78.5	Confident	28 Å²	28	59.3 Å²	59.3	18%	0.182	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-67.7	147	175.5	29.3	-35.7	0	0	0	111.1	M1256 I1258 L1307 P1310 L1325	M1256-P1323 HydrophobicContact SD-CG 4.41Å; I1258-P1323 HydrophobicContact CD1-CG 3.7Å; L1307-P1323 HydrophobicContact CD1-CG 4.17Å; L1307-P1323 HydrophobicContact CD2-CG 4.28Å; P1310-P1323 HydrophobicContact CG-CG 4.45Å; P1323-L1325 PolarHBondContact O-N 3.49Å
1324	N	74.9	Confident	79.3	Confident	106 Å²	106	59.4 Å²	59.4	57%	0.567	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-66	126.9	176.7	-70.9	-36.2	0	0	0	110.8	L1307 F1326	L1307-N1324 WeakPolarHBondContact CB-O 3.35Å; N1324-F1326 HydrophobicContact CB-CD2 4.49Å; N1324-F1326 HydrophobicContact CB-CE2 3.68Å; N1324-F1326 HydrophobicContact CB-CZ 3.71Å; N1324-F1326 WeakPolarHBondContact O-CD2 3.31Å; N1324-F1326 WeakPolarHBondContact O-CE2 3.34Å
1325	L	83.7	Confident	80.3	Confident	24 Å²	24	58 Å²	58	13%	0.126	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-99.1	116.9	175.8	-179.9	75.6	0	0	0	110.4	I1260 T1263 I1297 C1305 L1307 P1323	I1260-L1325 HydrophobicContact CB-CD2 3.76Å; I1260-L1325 HydrophobicContact CG2-CD2 3.76Å; T1263-L1325 HydrophobicContact CG2-CG 4.36Å; T1263-L1325 WeakPolarHBondContact CG2-O 3.27Å; T1263-L1325 PolarHBondContact OG1-O 2.96Å; I1297-L1325 HydrophobicContact CD1-CD1 4.3Å; C1305-L1325 HydrophobicContact CB-CD1 3.95Å; C1305-L1325 HydrophobicContact CB-CG 4.37Å; L1307-L1325 HydrophobicContact CB-CD1 4.28Å; L1307-L1325 HydrophobicContact CD2-CD1 4Å; L1307-L1325 HydrophobicContact CG-CD1 4.49Å; P1323-L1325 PolarHBondContact O-N 3.49Å
1326	F	86.8	Confident	81.5	Confident	81 Å²	81	53.1 Å²	53.1	36%	0.355	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	163.6	178.9	-56.6	-86.3	0	0	0	111.2	C1305 Y1306 N1324	C1305-F1326 CarbonylContact C-O 3.54Å; C1305-F1326 WeakPolarHBondContact CA-O 3.34Å; C1305-F1326 WeakPolarHBondContact CB-O 3.4Å; Y1306-F1326 HydrophobicContact CD1-CB 4.39Å; Y1306-F1326 HydrophobicContact CD2-CB 4.02Å; Y1306-F1326 HydrophobicContact CD2-CD2 4.25Å; Y1306-F1326 HydrophobicContact CE1-CB 3.9Å; Y1306-F1326 HydrophobicContact CE2-CB 3.5Å; Y1306-F1326 AromaticContact CE2-CD2 3.82Å; Y1306-F1326 HydrophobicContact CE2-CD2 3.82Å; Y1306-F1326 AromaticContact CE2-CG 3.88Å; Y1306-F1326 HydrophobicContact CE2-CG 3.88Å; Y1306-F1326 HydrophobicContact CG-CB 4.44Å; Y1306-F1326 VanDerWaalsContact CZ-CB 3.42Å; Y1306-F1326 PolarHBondContact N-O 3.42Å; Y1306-F1326 PolarHBondContact O-N 3.24Å; N1324-F1326 HydrophobicContact CB-CD2 4.49Å; N1324-F1326 HydrophobicContact CB-CE2 3.68Å; N1324-F1326 HydrophobicContact CB-CZ 3.71Å; N1324-F1326 WeakPolarHBondContact O-CD2 3.31Å; N1324-F1326 WeakPolarHBondContact O-CE2 3.34Å
1327	S	87.8	Confident	82.5	Confident	36 Å²	36	54.4 Å²	54.4	25%	0.252	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	155.1	171.5	42.4	0	0	0	0	110.9	T1267 L1304	T1267-S1327 VanDerWaalsContact OG1-CB 3.29Å; T1267-S1327 WeakPolarHBondContact OG1-CB 3.48Å; T1267-S1327 PolarHBondContact OG1-OG 2.9Å; L1304-S1327 WeakPolarHBondContact O-CA 3.49Å
1328	T	89.3	Confident	83.6	Confident	6 Å²	6	50.9 Å²	50.9	4%	0.037	28%	0.28	C	S	.	.			trans	-77	150.9	172.5	54.9	0	0	0	0	111.6	W1296 L1304 Y1306 I1330 W1416	W1296-T1328 HydrophobicContact CZ3-CG2 4.17Å; L1304-T1328 HydrophobicContact CB-CG2 3.98Å; L1304-T1328 WeakPolarHBondContact CB-OG1 3.49Å; L1304-T1328 HydrophobicContact CD1-CG2 4.4Å; L1304-T1328 PolarHBondContact O-N 3.4Å; L1304-T1328 PolarHBondContact O-OG1 3.35Å; Y1306-T1328 HydrophobicContact CD1-CG2 4.25Å; Y1306-T1328 HydrophobicContact CE1-CG2 4.24Å; T1328-I1330 VanDerWaalsContact C-N 3.33Å; T1328-I1330 VanDerWaalsContact CB-O 3.32Å; T1328-I1330 WeakPolarHBondContact CB-O 3.28Å; T1328-I1330 PolarHBondContact OG1-O 2.99Å; T1328-W1416 VanDerWaalsContact CB-CH2 3.49Å; T1328-W1416 HydrophobicContact CG2-CD2 4.17Å; T1328-W1416 HydrophobicContact CG2-CE3 4.19Å; T1328-W1416 HydrophobicContact CG2-CH2 3.72Å; T1328-W1416 HydrophobicContact CG2-CZ2 3.63Å; T1328-W1416 HydrophobicContact CG2-CZ3 3.96Å
1329	R	84.5	Confident	84.7	Confident	103 Å²	103	43.7 Å²	43.7	39%	0.389	25%	0.25	S	C	.	.	S	Bend	trans	-62.5	-41.2	171.1	172.4	178.9	163.2	149	-6.2	111.9	D1391 Y1392 Q1393 E1394	R1329-D1391 VanDerWaalsContact CG-OD1 3.24Å; R1329-D1391 WeakPolarHBondContact CG-OD1 3.45Å; R1329-D1391 IonicContact CZ-OD1 2.72Å; R1329-D1391 IonicContact CZ-OD2 3.53Å; R1329-D1391 IonicContact NE-OD1 3.84Å; R1329-D1391 PolarHBondContact NE-OD1 2.73Å; R1329-D1391 IonicContact NE-OD2 3.8Å; R1329-D1391 PolarHBondContact NE-OD2 3.02Å; R1329-D1391 IonicContact NH2-OD1 3.18Å; R1329-D1391 PolarHBondContact NH2-OD1 3Å; R1329-D1391 IonicContact NH2-OD2 3.26Å; R1329-D1391 PolarHBondContact NH2-OD2 3.12Å; R1329-Y1392 WeakPolarHBondContact O-CD2 3.44Å; R1329-Y1392 PolarHBondContact O-N 3.41Å; R1329-Q1393 HydrophobicContact CG-CB 4.09Å; R1329-E1394 IonicContact NH2-OE1 2.66Å; R1329-E1394 PolarHBondContact NH2-OE1 2.85Å
1330	I	88.6	Confident	85.6	Confident	17 Å²	17	42.7 Å²	42.7	9%	0.087	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	136.1	-177.3	-58.2	173.9	0	0	0	108.4	F907 T1328 L1389 E1390 D1391 I1414 W1416	F907-I1330 HydrophobicContact CD1-CD1 3.9Å; F907-I1330 HydrophobicContact CD2-CD1 3.89Å; F907-I1330 HydrophobicContact CE1-CD1 3.85Å; F907-I1330 HydrophobicContact CE2-CD1 3.83Å; F907-I1330 HydrophobicContact CG-CD1 3.91Å; F907-I1330 HydrophobicContact CZ-CD1 3.81Å; T1328-I1330 VanDerWaalsContact C-N 3.33Å; T1328-I1330 VanDerWaalsContact CB-O 3.32Å; T1328-I1330 WeakPolarHBondContact CB-O 3.28Å; T1328-I1330 PolarHBondContact OG1-O 2.99Å; I1330-L1389 HydrophobicContact CG2-CD1 3.71Å; I1330-L1389 HydrophobicContact CG2-CG 4.28Å; I1330-E1390 CarbonylContact C-O 3.57Å; I1330-E1390 WeakPolarHBondContact CA-O 3.41Å; I1330-D1391 HydrophobicContact CG1-CB 4.42Å; I1330-I1414 HydrophobicContact CG2-CD1 4.29Å; I1330-I1414 HydrophobicContact CG2-CG2 4.45Å; I1330-W1416 HydrophobicContact CB-CH2 4.32Å; I1330-W1416 HydrophobicContact CB-CZ2 4.26Å; I1330-W1416 WeakPolarHBondContact O-CZ2 3.34Å
1331	G	90.4	Very high	86.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	-171.9	175.3	0	0	0	0	0	111.7	E1390 I1414	G1331-E1390 PolarHBondContact N-O 3Å; G1331-E1390 PolarHBondContact O-N 3.4Å; G1331-I1414 VanDerWaalsContact C-CD1 3.43Å; G1331-I1414 WeakPolarHBondContact O-CD1 3.32Å
1332	H	92.5	Very high	87.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.			trans	-88.3	158.5	167.7	-58	-84.8	0	0	0	108.8	G1302 G1334 S1384 G1386 G1388 Y1392 Y1412 I1414	G1302-H1332 CarbonylContact C-O 3.49Å; G1302-H1332 VanDerWaalsContact CA-O 3.23Å; G1302-H1332 WeakPolarHBondContact CA-O 3.5Å; G1302-H1332 PolarHBondContact O-N 3.44Å; H1332-G1334 WeakPolarHBondContact CB-O 3.49Å; H1332-S1384 PolarHBondContact CE1-O 3.34Å; H1332-S1384 PolarHBondContact NE2-OG 2.81Å; H1332-G1386 PolarHBondContact CE1-N 3.06Å; H1332-G1386 WeakPolarHBondContact ND1-CA 3.26Å; H1332-G1386 PolarHBondContact ND1-N 3.21Å; H1332-G1388 WeakPolarHBondContact CA-O 3.36Å; H1332-Y1392 PolarHBondContact O-OH 2.67Å; H1332-Y1412 PolarHBondContact CE1-O 3.08Å; H1332-I1414 VanDerWaalsContact CE1-CD1 3.49Å; H1332-I1414 WeakPolarHBondContact CE1-CD1 3.41Å; H1332-I1414 WeakPolarHBondContact NE2-CD1 3.2Å
1333	M	89.2	Confident	88.2	Confident	54 Å²	54	32.8 Å²	32.8	27%	0.266	17%	0.171	S	C	.	.	S	Bend	trans	-76.9	-32.9	173.3	-66	166.2	78.4	0	0	111.6	K1279 E1387 L1389 E1390 D1408	K1279-M1333 WeakPolarHBondContact CE-O 3.37Å; K1279-M1333 PolarHBondContact NZ-O 3.09Å; M1333-E1387 PolarHBondContact N-O 3.17Å; M1333-L1389 WeakPolarHBondContact CG-O 3.37Å; M1333-E1390 HydrophobicContact CG-CB 3.92Å; M1333-E1390 HydrophobicContact CG-CG 4.43Å; M1333-D1408 HydrophobicContact CE-CB 4.4Å
1334	G	89.4	Confident	88.2	Confident	16 Å²	16	32.3 Å²	32.3	17%	0.165	17%	0.167	C	C	.	.	S	Bend	trans	-117.2	-167.8	177.1	0	0	0	0	0	113.1	G1302 H1332 C1336 E1387	G1302-G1334 WeakPolarHBondContact CA-O 3.4Å; G1302-G1334 PolarHBondContact N-O 3.04Å; H1332-G1334 WeakPolarHBondContact CB-O 3.49Å; G1334-C1336 PolarHBondContact O-N 3.2Å; G1334-E1387 PolarHBondContact N-O 3.43Å
1335	P	92.6	Very high	87.8	Confident	36 Å²	36	29.2 Å²	29.2	23%	0.234	15%	0.153	C	C	.	.			trans	-58.3	126.1	-170.9	-27	35.6	0	0	0	114.6	T1286 R1337	T1286-P1335 HydrophobicContact CG2-CB 4.31Å; P1335-R1337 WeakPolarHBondContact O-CD 3.48Å; P1335-R1337 WeakPolarHBondContact O-CG 3.47Å; P1335-R1337 PolarHBondContact O-N 3.39Å
1336	C	95.2	Very high	86.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.			trans	-64	121.5	166.8	179.1	0	0	0	0	109.3	T1286 T1287 T1299 L1304 G1334	T1286-C1336 WeakPolarHBondContact CB-O 3.47Å; T1286-C1336 PolarHBondContact OG1-O 2.95Å; T1287-C1336 HydrophobicContact CG2-CB 4.46Å; T1299-C1336 PolarHBondContact O-N 3.11Å; L1304-C1336 HydrophobicContact CD2-CB 3.94Å; L1304-C1336 VanDerWaalsContact CD2-SG 3.54Å; G1334-C1336 PolarHBondContact O-N 3.2Å
1337	R	93.2	Very high	84.4	Confident	57 Å²	57	33.3 Å²	33.3	22%	0.215	18%	0.175	C	C	.	.			trans	-92.6	-38.6	-170.2	-59.7	-56.3	-168.3	110.6	-17.9	113.3	Q939 F940 P1335 G1385 E1387	Q939-R1337 VanDerWaalsContact NE2-NH2 3.15Å; F940-R1337 HydrophobicContact CB-CB 3.9Å; F940-R1337 HydrophobicContact CB-CG 4.05Å; F940-R1337 WeakPolarHBondContact O-CB 3.3Å; F940-R1337 VanDerWaalsContact O-CG 3.25Å; F940-R1337 WeakPolarHBondContact O-CG 3.49Å; F940-R1337 PolarHBondContact O-NH1 3.36Å; F940-R1337 VanDerWaalsContact O-NH1 3.15Å; P1335-R1337 WeakPolarHBondContact O-CD 3.48Å; P1335-R1337 WeakPolarHBondContact O-CG 3.47Å; P1335-R1337 PolarHBondContact O-N 3.39Å; R1337-G1385 WeakPolarHBondContact CB-O 3.48Å; R1337-G1385 PolarHBondContact N-O 2.65Å; R1337-E1387 IonicContact CZ-OE1 2.79Å; R1337-E1387 IonicContact NE-OE1 3.94Å; R1337-E1387 PolarHBondContact NE-OE1 3.48Å; R1337-E1387 IonicContact NH2-OE1 3.64Å; R1337-E1387 PolarHBondContact NH2-OE1 2.88Å
1338	F	94.7	Very high	81.6	Confident	8 Å²	8	37 Å²	37	4%	0.035	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.4	176.4	65.6	-105	0	0	0	111.9	F940 A943 M957 V1340 S1384 G1385 L1413	F940-F1338 HydrophobicContact CB-CD1 4.11Å; F940-F1338 HydrophobicContact CB-CE1 3.87Å; F940-F1338 HydrophobicContact CD1-CE1 4.19Å; F940-F1338 HydrophobicContact CD2-CE1 4.15Å; F940-F1338 AromaticContact CG-CE1 3.83Å; F940-F1338 HydrophobicContact CG-CE1 3.83Å; A943-F1338 HydrophobicContact CB-CB 4.36Å; A943-F1338 HydrophobicContact CB-CD1 4Å; A943-F1338 HydrophobicContact CB-CD2 3.44Å; A943-F1338 VanDerWaalsContact CB-CD2 3.44Å; A943-F1338 HydrophobicContact CB-CE1 4.08Å; A943-F1338 HydrophobicContact CB-CE2 3.55Å; A943-F1338 HydrophobicContact CB-CG 3.68Å; A943-F1338 HydrophobicContact CB-CZ 3.86Å; M957-F1338 HydrophobicContact CE-CZ 4.18Å; M957-F1338 HydrophobicContact CG-CE1 4.47Å; M957-F1338 HydrophobicContact CG-CZ 3.91Å; M957-F1338 HydrophobicContact SD-CZ 4.04Å; F1338-V1340 HydrophobicContact CD2-CG1 4.18Å; F1338-V1340 HydrophobicContact CE2-CG1 4.06Å; F1338-S1384 VanDerWaalsContact O-CA 3.31Å; F1338-S1384 WeakPolarHBondContact O-CA 3.49Å; F1338-G1385 PolarHBondContact N-O 3.08Å; F1338-G1385 PolarHBondContact O-N 3Å; F1338-L1413 HydrophobicContact CE2-CD2 4.33Å; F1338-L1413 HydrophobicContact CZ-CD2 3.65Å
1339	L	95.8	Very high	78.8	Confident	17 Å²	17	42.7 Å²	42.7	9%	0.089	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.5	164.6	-77.1	164.2	0	0	0	107.8	T1287 M1289 W1296 V1382 I1383	T1287-L1339 HydrophobicContact CG2-CB 4.46Å; T1287-L1339 HydrophobicContact CG2-CD1 3.91Å; T1287-L1339 HydrophobicContact CG2-CG 3.86Å; T1287-L1339 PolarHBondContact OG1-N 2.77Å; M1289-L1339 HydrophobicContact CB-CB 3.91Å; M1289-L1339 HydrophobicContact CB-CD1 4.38Å; M1289-L1339 HydrophobicContact CE-CB 4.17Å; M1289-L1339 HydrophobicContact SD-CB 4.22Å; W1296-L1339 HydrophobicContact CB-CD1 3.82Å; W1296-L1339 HydrophobicContact CB-CD2 4.39Å; W1296-L1339 HydrophobicContact CE3-CD2 4.38Å; L1339-V1382 HydrophobicContact CD2-CG1 3.93Å; L1339-I1383 WeakPolarHBondContact CA-O 3.45Å
1340	V	93.9	Very high	76.2	Confident	8 Å²	8	43.8 Å²	43.8	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	136.2	175	60.3	0	0	0	0	110.3	A943 V955 M1289 F1338 V1382 I1383	A943-V1340 HydrophobicContact CB-CB 4.36Å; A943-V1340 HydrophobicContact CB-CG1 4.18Å; V955-V1340 HydrophobicContact CG1-CG1 3.66Å; V955-V1340 HydrophobicContact CG1-CG2 4.28Å; V955-V1340 HydrophobicContact CG2-CG1 4.37Å; M1289-V1340 WeakPolarHBondContact SD-CA 3.3Å; F1338-V1340 HydrophobicContact CD2-CG1 4.18Å; F1338-V1340 HydrophobicContact CE2-CG1 4.06Å; V1340-V1382 WeakPolarHBondContact O-CA 3.28Å; V1340-I1383 HydrophobicContact CG1-CB 3.97Å; V1340-I1383 PolarHBondContact N-O 3.02Å; V1340-I1383 PolarHBondContact O-N 2.91Å
1341	S	91	Very high	73.5	Confident	32 Å²	32	49.8 Å²	49.8	22%	0.224	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	147.7	178	52.1	0	0	0	0	110.7	S945 M1289 Y1381	S945-S1341 VanDerWaalsContact CB-O 3.26Å; S945-S1341 WeakPolarHBondContact CB-O 3.38Å; S945-S1341 PolarHBondContact OG-O 3.1Å; M1289-S1341 PolarHBondContact SD-N 3.07Å; S1341-Y1381 CarbonylContact C-O 3.59Å; S1341-Y1381 WeakPolarHBondContact CA-O 3.42Å
1342	I	85.6	Confident	70.7	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.041	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	121	-177.2	-169.7	156.5	0	0	0	111.8	C953 V955 L972 V1380 Y1381	C953-I1342 HydrophobicContact CB-CD1 3.78Å; C953-I1342 HydrophobicContact CB-CG1 3.86Å; V955-I1342 HydrophobicContact CG2-CD1 3.63Å; V955-I1342 HydrophobicContact CG2-CG2 4.4Å; L972-I1342 HydrophobicContact CD1-CB 4.38Å; L972-I1342 HydrophobicContact CD1-CD1 3.83Å; L972-I1342 HydrophobicContact CD1-CG1 4.14Å; L972-I1342 HydrophobicContact CD1-CG2 3.41Å; L972-I1342 VanDerWaalsContact CD1-CG2 3.41Å; I1342-V1380 WeakPolarHBondContact O-CA 3.2Å; I1342-Y1381 PolarHBondContact N-O 3.22Å; I1342-Y1381 PolarHBondContact O-N 3.26Å
1343	D	80.2	Confident	67.6	Low	52 Å²	52	66.1 Å²	66.1	28%	0.278	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118.4	176.1	-77.4	29.3	0	0	0	109.6	C953 R1378 V1380	C953-D1343 PolarHBondContact SG-O 3.16Å; D1343-R1378 IonicContact OD2-NH1 3.81Å; D1343-V1380 HydrophobicContact CB-CG2 4.43Å; D1343-V1380 VanDerWaalsContact OD1-CG2 3.3Å; D1343-V1380 WeakPolarHBondContact OD1-CG2 3.33Å
1344	V	73.9	Confident	64.7	Low	18 Å²	18	68.3 Å²	68.3	11%	0.109	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.7	174.2	179.8	0	0	0	0	109	C953 L972 N1379 Y1381	C953-V1344 HydrophobicContact CB-CG2 4.46Å; L972-V1344 HydrophobicContact CD1-CG2 4.18Å; V1344-N1379 PolarHBondContact N-O 3.3Å; V1344-N1379 PolarHBondContact O-N 3Å; V1344-Y1381 HydrophobicContact CB-CD2 4.18Å; V1344-Y1381 HydrophobicContact CB-CE2 3.94Å; V1344-Y1381 HydrophobicContact CG2-CD2 3.65Å; V1344-Y1381 HydrophobicContact CG2-CE2 3.8Å
1345	P	65.1	Low	61.8	Low	40 Å²	40	71.9 Å²	71.9	26%	0.26	41%	0.41	S	S	.	.			trans	-61.8	140.5	173.6	-21.5	32.9	0	0	0	112.1	H1347	P1345-H1347 PolarHBondContact O-CD2 3.33Å; P1345-H1347 PolarHBondContact O-N 2.85Å; P1345-H1347 VanDerWaalsContact O-N 3.1Å
1346	D	53.2	Low	58.8	Low	88 Å²	88	79.1 Å²	79.1	47%	0.471	44%	0.438	S	S	.	.			trans	-71.4	102	166.5	-77.5	-54.4	0	0	0	109.9	T1348 N1379	D1346-T1348 PolarHBondContact O-N 2.97Å; D1346-N1379 PolarHBondContact OD1-ND2 2.91Å
1347	H	46.2	Very low	55.6	Low	103 Å²	103	91.5 Å²	91.5	48%	0.477	49%	0.485	S	S	.	.			trans	-79.6	95.3	173.5	-74.4	-85.2	0	0	0	110.8	H973 P1345 V1349	H973-H1347 AromaticContact CE1-CD2 3.78Å; P1345-H1347 PolarHBondContact O-CD2 3.33Å; P1345-H1347 PolarHBondContact O-N 2.85Å; P1345-H1347 VanDerWaalsContact O-N 3.1Å; H1347-V1349 PolarHBondContact O-N 3.4Å
1348	T	30.4	Very low	52.5	Low	113 Å²	113	94.2 Å²	94.2	69%	0.693	51%	0.513	S	S	*	.			trans	-65.8	117.8	166	50	0	0	0	0	110.3	D1346 D1350	D1346-T1348 PolarHBondContact O-N 2.97Å; T1348-D1350 VanDerWaalsContact C-N 3.27Å; T1348-D1350 PolarHBondContact O-N 2.94Å
1349	V	30.4	Very low	49.4	Very low	127 Å²	127	103.5 Å²	103.5	77%	0.77	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-77	-10.8	-173.9	-178	0	0	0	0	113.1	H1347 D1351	H1347-V1349 PolarHBondContact O-N 3.4Å; V1349-D1351 PolarHBondContact O-N 3.39Å
1350	D	30.1	Very low	46.2	Very low	125 Å²	125	108.1 Å²	108.1	67%	0.668	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-82.6	-8.2	-165.9	-67.2	-44.8	0	0	0	116.7	T1348 Y1352 T1353	T1348-D1350 VanDerWaalsContact C-N 3.27Å; T1348-D1350 PolarHBondContact O-N 2.94Å; D1350-Y1352 PolarHBondContact O-N 2.8Å; D1350-T1353 PolarHBondContact O-N 2.84Å; D1350-T1353 VanDerWaalsContact O-N 3.14Å; D1350-T1353 PolarHBondContact O-OG1 2.89Å
1351	D	30.3	Very low	43.1	Very low	143 Å²	143	115 Å²	115	77%	0.765	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-73	-0.4	-169.1	-135.4	21	0	0	0	114.5	V1349	V1349-D1351 PolarHBondContact O-N 3.39Å
1352	Y	31.7	Very low	40.2	Very low	226 Å²	226	117.9 Å²	117.9	89%	0.886	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-89	-6.7	171.8	-81.9	-80.4	0	0	0	114.6	D1350	D1350-Y1352 PolarHBondContact O-N 2.8Å
1353	T	28.4	Very low	37.7	Very low	118 Å²	118	125.3 Å²	125.3	72%	0.724	68%	0.675	S	S	*	*	S	Bend	trans	-132.8	30	-169.7	48.1	0	0	0	0	117.8	D1350	D1350-T1353 PolarHBondContact O-N 2.84Å; D1350-T1353 VanDerWaalsContact O-N 3.14Å; D1350-T1353 PolarHBondContact O-OG1 2.89Å
1354	S	28.3	Very low	35.5	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	70%	0.695	S	S	*	*			trans	-146.1	98.8	159.2	76.3	0	0	0	0	116.4	K1356	S1354-K1356 PolarHBondContact O-N 3.5Å
1355	G	26.9	Very low	33.7	Very low	91 Å²	91	135.6 Å²	135.6	94%	0.938	72%	0.724	S	S	*	*			trans	-75.7	76.3	174.8	0	0	0	0	0	114
1356	K	31.1	Very low	32.2	Very low	189 Å²	189	143.7 Å²	143.7	82%	0.822	75%	0.749	S	S	*	*			trans	-131.7	107.8	170	-80.8	-173.4	177.3	174.6	0	113	S1354 S1358	S1354-K1356 PolarHBondContact O-N 3.5Å; K1356-S1358 PolarHBondContact O-N 2.94Å; K1356-S1358 VanDerWaalsContact O-N 3.09Å
1357	R	26.8	Very low	31.3	Very low	259 Å²	259	149.3 Å²	149.3	98%	0.977	76%	0.763	S	S	*	*			trans	-63.6	102.6	172.2	-68.9	175.2	172.1	170.2	-4.1	111.6
1358	S	28.9	Very low	30.8	Very low	115 Å²	115	146.7 Å²	146.7	80%	0.804	75%	0.752	S	S	*	*			trans	-83.9	146.3	157.1	52.2	0	0	0	0	109.8	K1356	K1356-S1358 PolarHBondContact O-N 2.94Å; K1356-S1358 VanDerWaalsContact O-N 3.09Å
1359	K	30.2	Very low	31	Very low	202 Å²	202	144.3 Å²	144.3	88%	0.878	74%	0.74	S	S	*	*			trans	-86.5	118.2	-174.3	-66.3	-179.9	179.7	179.3	0	110.8	N1361	K1359-N1361 PolarHBondContact O-N 3.29Å
1360	S	27.9	Very low	31.5	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	72%	0.724	S	S	*	*			trans	-73.9	103.1	171.7	55.3	0	0	0	0	110.9
1361	N	28.1	Very low	31.9	Very low	152 Å²	152	138.6 Å²	138.6	81%	0.813	71%	0.705	S	S	*	*			trans	-151.6	29.2	-178.1	-132.8	35.1	0	0	0	115.3	K1359	K1359-N1361 PolarHBondContact O-N 3.29Å
1362	D	31.4	Very low	32.1	Very low	94 Å²	94	137.4 Å²	137.4	50%	0.503	70%	0.702	S	S	.	*			trans	-136.7	29.3	-176.4	-115.8	-38.4	0	0	0	114.3	S1364 R1365	D1362-S1364 PolarHBondContact O-N 3.35Å; D1362-R1365 VanDerWaalsContact OD1-CD 3.29Å; D1362-R1365 WeakPolarHBondContact OD1-CD 3.29Å; D1362-R1365 WeakPolarHBondContact OD1-CG 3.43Å; D1362-R1365 IonicContact OD1-CZ 3.28Å; D1362-R1365 IonicContact OD1-NE 2.73Å; D1362-R1365 PolarHBondContact OD1-NE 3.07Å; D1362-R1365 IonicContact OD1-NH2 2.9Å; D1362-R1365 IonicContact OD2-NE 2.66Å
1363	L	32.9	Very low	32.2	Very low	163 Å²	163	130.1 Å²	130.1	85%	0.853	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-12.6	177	-90.3	160.5	0	0	0	114.2
1364	S	34.3	Very low	32.4	Very low	100 Å²	100	129.8 Å²	129.8	70%	0.699	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-17.1	-175.3	48.6	0	0	0	0	114.9	D1362	D1362-S1364 PolarHBondContact O-N 3.35Å
1365	R	35.3	Very low	32.7	Very low	187 Å²	187	129 Å²	129	71%	0.706	67%	0.67	S	S	*	*	S	Bend	trans	-81.4	-26.2	-176	-64.3	-171.9	-167.2	-125.2	-0.9	114.9	D1362 R1367	D1362-R1365 VanDerWaalsContact OD1-CD 3.29Å; D1362-R1365 WeakPolarHBondContact OD1-CD 3.29Å; D1362-R1365 WeakPolarHBondContact OD1-CG 3.43Å; D1362-R1365 IonicContact OD1-CZ 3.28Å; D1362-R1365 IonicContact OD1-NE 2.73Å; D1362-R1365 PolarHBondContact OD1-NE 3.07Å; D1362-R1365 IonicContact OD1-NH2 2.9Å; D1362-R1365 IonicContact OD2-NE 2.66Å; R1365-R1367 PolarHBondContact O-N 3.48Å
1366	R	33.5	Very low	33.4	Very low	210 Å²	210	131.9 Å²	131.9	79%	0.792	66%	0.659	S	S	*	*			trans	-73.6	18.7	-169.7	-74.3	-173.4	165.7	-172.7	-5.8	116
1367	R	33.9	Very low	34.2	Very low	205 Å²	205	131.7 Å²	131.7	77%	0.774	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	14.8	-166.6	-121.3	-179.4	-172.9	-169.5	0.6	116.2	M715 R1365	M715-R1367 VanDerWaalsContact CE-O 3.23Å; M715-R1367 WeakPolarHBondContact CE-O 3.45Å; R1365-R1367 PolarHBondContact O-N 3.48Å
1368	M	35.5	Very low	35.6	Very low	48 Å²	48	121.6 Å²	121.6	24%	0.236	62%	0.623	C	S	.	*	T	Hydrogen-bonded Turn	trans	-126.4	6.2	-172.8	-67.9	-65.6	-72.5	0	0	115.1	I719 L774 L775	I719-M1368 HydrophobicContact CD1-SD 3.54Å; I719-M1368 VanDerWaalsContact CD1-SD 3.54Å; L774-M1368 WeakPolarHBondContact O-CE 3.32Å; L775-M1368 WeakPolarHBondContact O-CE 3.45Å
1369	S	35.3	Very low	37.7	Very low	64 Å²	64	117.5 Å²	117.5	45%	0.448	59%	0.592	S	S	.	*			trans	-104.7	112	179.3	57.3	0	0	0	0	111.9	N1371	S1369-N1371 PolarHBondContact O-N 2.78Å
1370	L	40.2	Very low	40.2	Very low	83 Å²	83	108 Å²	108	44%	0.435	55%	0.551	S	S	.	*			trans	-69	-8	165.6	-68.9	172.2	0	0	0	112.8	L776 L778	L776-L1370 HydrophobicContact CD2-CD1 3.92Å; L778-L1370 HydrophobicContact CD2-CD1 4.11Å
1371	N	38.4	Very low	43.1	Very low	49 Å²	49	105 Å²	105	26%	0.262	52%	0.523	S	S	.	.			trans	-100.3	87.8	-173.5	-100.7	-73.3	0	0	0	112.4	K777 S1369 A1373	K777-N1371 PolarHBondContact O-ND2 2.89Å; S1369-N1371 PolarHBondContact O-N 2.78Å; N1371-A1373 PolarHBondContact O-N 2.68Å; N1371-A1373 VanDerWaalsContact O-N 3.12Å
1372	V	35.7	Very low	46.2	Very low	117 Å²	117	97.8 Å²	97.8	71%	0.709	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	44.9	172.7	-164.3	0	0	0	0	110.9	L1375	V1372-L1375 HydrophobicContact CG1-CD1 4.48Å
1373	A	34.3	Very low	49.2	Very low	73 Å²	73	93.3 Å²	93.3	60%	0.603	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-20.5	-173.5	0	0	0	0	0	114.3	N1371 L1375	N1371-A1373 PolarHBondContact O-N 2.68Å; N1371-A1373 VanDerWaalsContact O-N 3.12Å; A1373-L1375 VanDerWaalsContact C-N 3.31Å; A1373-L1375 PolarHBondContact O-N 2.83Å
1374	N	32.7	Very low	52.1	Low	112 Å²	112	85.6 Å²	85.6	60%	0.599	42%	0.42	S	S	*	.			trans	-87.9	17.3	-179.9	-93.9	14.8	0	0	0	114.2	D686 H1376	D686-N1374 WeakPolarHBondContact CB-ND2 3.43Å; D686-N1374 PolarHBondContact OD2-ND2 2.85Å; N1374-H1376 PolarHBondContact O-N 3.48Å; N1374-H1376 VanDerWaalsContact O-N 3.11Å
1375	L	34.7	Very low	54.9	Low	82 Å²	82	80.8 Å²	80.8	43%	0.429	39%	0.386	S	S	.	.	S	Bend	trans	-73.1	104.6	169.3	-113.6	75.7	0	0	0	108.8	V1372 A1373	V1372-L1375 HydrophobicContact CG1-CD1 4.48Å; A1373-L1375 VanDerWaalsContact C-N 3.31Å; A1373-L1375 PolarHBondContact O-N 2.83Å
1376	H	40.9	Very low	57.5	Low	152 Å²	152	71.9 Å²	71.9	70%	0.704	35%	0.353	S	S	*	.			trans	23.1	110.9	163.5	-53.6	81.3	0	0	0	115.5	N1374 R1378	N1374-H1376 PolarHBondContact O-N 3.48Å; N1374-H1376 VanDerWaalsContact O-N 3.11Å; H1376-R1378 VanDerWaalsContact C-N 3.27Å; H1376-R1378 PolarHBondContact O-N 2.79Å
1377	Q	47.8	Very low	59.9	Low	184 Å²	184	63.4 Å²	63.4	86%	0.86	32%	0.322	S	S	*	.			trans	-56.2	75.6	-175.1	-68.8	-177.5	-47.2	0	0	114.5	N1379	Q1377-N1379 PolarHBondContact O-N 3.2Å
1378	R	56.9	Low	62.3	Low	47 Å²	47	53.6 Å²	53.6	18%	0.177	29%	0.285	C	S	.	.			trans	-55.3	134.8	-178.8	-64.5	-174.2	-173.5	141.4	5.4	110	S1027 K1292 D1343 H1376 V1380	S1027-R1378 PolarHBondContact O-NH1 3.1Å; S1027-R1378 PolarHBondContact OG-NH2 2.92Å; K1292-R1378 PolarHBondContact NZ-O 2.98Å; D1343-R1378 IonicContact OD2-NH1 3.81Å; H1376-R1378 VanDerWaalsContact C-N 3.27Å; H1376-R1378 PolarHBondContact O-N 2.79Å; R1378-V1380 PolarHBondContact O-N 3.41Å
1379	N	72.2	Confident	64.7	Low	30 Å²	30	52.8 Å²	52.8	16%	0.16	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	113.6	170	-61.7	-44.1	0	0	0	107.7	V1344 D1346 Q1377 Y1381 K1417	V1344-N1379 PolarHBondContact N-O 3.3Å; V1344-N1379 PolarHBondContact O-N 3Å; D1346-N1379 PolarHBondContact OD1-ND2 2.91Å; Q1377-N1379 PolarHBondContact O-N 3.2Å; N1379-Y1381 HydrophobicContact CB-CE2 3.63Å; N1379-K1417 WeakPolarHBondContact OD1-CE 3.29Å; N1379-K1417 PolarHBondContact OD1-NZ 2.83Å
1380	V	83.5	Confident	67.1	Low	3 Å²	3	51.4 Å²	51.4	2%	0.018	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.2	175.9	179.2	0	0	0	0	107.4	C1291 K1292 I1342 D1343 R1378 V1418	C1291-V1380 WeakPolarHBondContact SG-CG1 3.32Å; K1292-V1380 HydrophobicContact CD-CB 3.92Å; K1292-V1380 HydrophobicContact CD-CG2 3.99Å; K1292-V1380 HydrophobicContact CG-CB 4.44Å; K1292-V1380 HydrophobicContact CG-CG2 4.31Å; I1342-V1380 WeakPolarHBondContact O-CA 3.2Å; D1343-V1380 HydrophobicContact CB-CG2 4.43Å; D1343-V1380 VanDerWaalsContact OD1-CG2 3.3Å; D1343-V1380 WeakPolarHBondContact OD1-CG2 3.33Å; R1378-V1380 PolarHBondContact O-N 3.41Å; V1380-V1418 PolarHBondContact N-O 2.95Å; V1380-V1418 PolarHBondContact O-N 3.3Å
1381	Y	88.7	Confident	69.3	Low	51 Å²	51	50.1 Å²	50.1	20%	0.2	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.4	179.6	-62.8	-93.5	0	0	0	109.8	V908 S1341 I1342 V1344 N1379 I1415 W1416 K1417	V908-Y1381 HydrophobicContact CG1-CE1 4.49Å; V908-Y1381 HydrophobicContact CG2-CD1 4.14Å; V908-Y1381 HydrophobicContact CG2-CE1 3.97Å; S1341-Y1381 CarbonylContact C-O 3.59Å; S1341-Y1381 WeakPolarHBondContact CA-O 3.42Å; I1342-Y1381 PolarHBondContact N-O 3.22Å; I1342-Y1381 PolarHBondContact O-N 3.26Å; V1344-Y1381 HydrophobicContact CB-CD2 4.18Å; V1344-Y1381 HydrophobicContact CB-CE2 3.94Å; V1344-Y1381 HydrophobicContact CG2-CD2 3.65Å; V1344-Y1381 HydrophobicContact CG2-CE2 3.8Å; N1379-Y1381 HydrophobicContact CB-CE2 3.63Å; Y1381-I1415 HydrophobicContact CD1-CG2 3.91Å; Y1381-W1416 CarbonylContact C-O 3.58Å; Y1381-W1416 WeakPolarHBondContact CA-O 3.41Å; Y1381-K1417 HydrophobicContact CD1-CB 4.17Å; Y1381-K1417 HydrophobicContact CE1-CB 4.01Å; Y1381-K1417 HydrophobicContact CE1-CD 4.48Å; Y1381-K1417 HydrophobicContact CE1-CG 4.27Å
1382	V	92.2	Very high	71.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.7	169.3	171.4	0	0	0	0	107.7	M1289 C1291 W1296 L1339 V1340 W1416 V1418	M1289-V1382 HydrophobicContact CE-CB 4.26Å; M1289-V1382 HydrophobicContact CE-CG1 3.66Å; M1289-V1382 HydrophobicContact CE-CG2 3.74Å; C1291-V1382 HydrophobicContact CB-CG2 4.28Å; W1296-V1382 HydrophobicContact CD2-CB 4.41Å; W1296-V1382 HydrophobicContact CD2-CG1 3.8Å; W1296-V1382 HydrophobicContact CD2-CG2 4.4Å; W1296-V1382 HydrophobicContact CE3-CG1 3.85Å; W1296-V1382 HydrophobicContact CG-CG1 4.28Å; W1296-V1382 HydrophobicContact CH2-CB 4.34Å; W1296-V1382 HydrophobicContact CH2-CG1 4.31Å; W1296-V1382 HydrophobicContact CZ2-CB 4.07Å; W1296-V1382 HydrophobicContact CZ2-CG1 4.26Å; W1296-V1382 HydrophobicContact CZ2-CG2 4.15Å; W1296-V1382 HydrophobicContact CZ3-CG1 4.11Å; L1339-V1382 HydrophobicContact CD2-CG1 3.93Å; V1340-V1382 WeakPolarHBondContact O-CA 3.28Å; V1382-W1416 HydrophobicContact CB-CB 4.43Å; V1382-W1416 PolarHBondContact N-O 3.14Å; V1382-W1416 PolarHBondContact O-N 3.12Å; V1382-V1418 HydrophobicContact CB-CG2 4.43Å; V1382-V1418 HydrophobicContact CG2-CG2 3.86Å
1383	I	93.6	Very high	72.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.8	178.8	-49.9	-171	0	0	0	108.2	V955 L970 L972 L1339 V1340 L1413 I1414 I1415	V955-I1383 HydrophobicContact CG2-CD1 4.12Å; L970-I1383 HydrophobicContact CD2-CD1 3.55Å; L972-I1383 HydrophobicContact CD1-CD1 4.49Å; L972-I1383 HydrophobicContact CD2-CD1 4.11Å; L1339-I1383 WeakPolarHBondContact CA-O 3.45Å; V1340-I1383 HydrophobicContact CG1-CB 3.97Å; V1340-I1383 PolarHBondContact N-O 3.02Å; V1340-I1383 PolarHBondContact O-N 2.91Å; I1383-L1413 HydrophobicContact CG2-CB 4.27Å; I1383-L1413 HydrophobicContact CG2-CD2 4.22Å; I1383-I1414 WeakPolarHBondContact CA-O 3.48Å; I1383-I1415 HydrophobicContact CD1-CD1 4.25Å; I1383-I1415 HydrophobicContact CD1-CG1 4.19Å; I1383-I1415 HydrophobicContact CG1-CG1 4.12Å; I1383-I1415 HydrophobicContact CG1-CG2 4.35Å; I1383-I1415 HydrophobicContact CG2-CG1 4.23Å
1384	S	94.8	Very high	73.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138	170.4	69.3	0	0	0	0	111	L1304 H1332 F1338 L1413 I1414	L1304-S1384 VanDerWaalsContact CD1-OG 3.24Å; L1304-S1384 WeakPolarHBondContact CD1-OG 3.42Å; H1332-S1384 PolarHBondContact CE1-O 3.34Å; H1332-S1384 PolarHBondContact NE2-OG 2.81Å; F1338-S1384 VanDerWaalsContact O-CA 3.31Å; F1338-S1384 WeakPolarHBondContact O-CA 3.49Å; S1384-L1413 CarbonylContact O-C 3.55Å; S1384-L1413 WeakPolarHBondContact O-CA 3.47Å; S1384-I1414 PolarHBondContact N-O 3.19Å; S1384-I1414 PolarHBondContact O-N 2.98Å
1385	G	92.1	Very high	73.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.9	175.9	0	0	0	0	0	111.6	R1337 F1338 Y1412	R1337-G1385 WeakPolarHBondContact CB-O 3.48Å; R1337-G1385 PolarHBondContact N-O 2.65Å; F1338-G1385 PolarHBondContact N-O 3.08Å; F1338-G1385 PolarHBondContact O-N 3Å; G1385-Y1412 WeakPolarHBondContact CA-O 3.41Å
1386	G	90.8	Very high	73.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	-171	-177	0	0	0	0	0	113.7	H1332 N1411 Y1412	H1332-G1386 PolarHBondContact CE1-N 3.06Å; H1332-G1386 WeakPolarHBondContact ND1-CA 3.26Å; H1332-G1386 PolarHBondContact ND1-N 3.21Å; G1386-N1411 CarbonylContact O-C 3.53Å; G1386-N1411 WeakPolarHBondContact O-CA 3.3Å; G1386-Y1412 PolarHBondContact N-O 2.87Å; G1386-Y1412 PolarHBondContact O-N 3.15Å
1387	E	84.1	Confident	73.4	Confident	31 Å²	31	51.8 Å²	51.8	15%	0.145	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.9	-176.2	-71.8	162.9	-93.8	0	0	110.7	Q939 M1333 G1334 R1337	Q939-E1387 PolarHBondContact NE2-OE1 3.02Å; Q939-E1387 PolarHBondContact NE2-OE2 3.48Å; M1333-E1387 PolarHBondContact N-O 3.17Å; G1334-E1387 PolarHBondContact N-O 3.43Å; R1337-E1387 IonicContact CZ-OE1 2.79Å; R1337-E1387 IonicContact NE-OE1 3.94Å; R1337-E1387 PolarHBondContact NE-OE1 3.48Å; R1337-E1387 IonicContact NH2-OE1 3.64Å; R1337-E1387 PolarHBondContact NH2-OE1 2.88Å
1388	G	85	Confident	72.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	65.8	178.2	-175.2	0	0	0	0	0	114.5	H1332 T1410 Y1412	H1332-G1388 WeakPolarHBondContact CA-O 3.36Å; G1388-T1410 PolarHBondContact N-O 3.11Å; G1388-Y1412 WeakPolarHBondContact O-CD2 3.41Å
1389	L	85.8	Confident	72	Confident	31 Å²	31	55.8 Å²	55.8	16%	0.162	30%	0.297	C	S	.	.			trans	-135.3	133.5	177.7	-173.8	79.2	0	0	0	109.6	F910 I1330 M1333 Y1412 I1414	F910-L1389 HydrophobicContact CB-CD1 4Å; F910-L1389 HydrophobicContact CB-CD2 4.48Å; F910-L1389 HydrophobicContact CD1-CD1 4.14Å; F910-L1389 HydrophobicContact CD1-CD2 3.4Å; F910-L1389 HydrophobicContact CD1-CG 4.41Å; F910-L1389 HydrophobicContact CD2-CD2 3.95Å; F910-L1389 HydrophobicContact CE1-CD2 3.43Å; F910-L1389 VanDerWaalsContact CE1-CD2 3.43Å; F910-L1389 HydrophobicContact CE2-CD2 3.96Å; F910-L1389 HydrophobicContact CG-CD1 4.09Å; F910-L1389 HydrophobicContact CG-CD2 3.69Å; F910-L1389 HydrophobicContact CZ-CD2 3.72Å; I1330-L1389 HydrophobicContact CG2-CD1 3.71Å; I1330-L1389 HydrophobicContact CG2-CG 4.28Å; M1333-L1389 WeakPolarHBondContact CG-O 3.37Å; L1389-Y1412 HydrophobicContact CB-CD1 4.11Å; L1389-Y1412 HydrophobicContact CB-CD2 4.05Å; L1389-Y1412 HydrophobicContact CB-CE1 4.28Å; L1389-Y1412 HydrophobicContact CB-CE2 4.22Å; L1389-Y1412 HydrophobicContact CB-CG 4Å; L1389-Y1412 HydrophobicContact CD1-CD1 4.43Å; L1389-I1414 HydrophobicContact CD1-CD1 3.88Å; L1389-I1414 HydrophobicContact CD1-CG1 3.93Å
1390	E	85.5	Confident	70.2	Confident	34 Å²	34	61.4 Å²	61.4	16%	0.159	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.5	-173.2	-159.5	173.1	-148.1	0	0	110.1	K1279 I1330 G1331 M1333 Y1392	K1279-E1390 IonicContact NZ-OE1 2.92Å; K1279-E1390 PolarHBondContact NZ-OE1 3.47Å; K1279-E1390 IonicContact NZ-OE2 3.88Å; K1279-E1390 PolarHBondContact NZ-OE2 2.95Å; I1330-E1390 CarbonylContact C-O 3.57Å; I1330-E1390 WeakPolarHBondContact CA-O 3.41Å; G1331-E1390 PolarHBondContact N-O 3Å; G1331-E1390 PolarHBondContact O-N 3.4Å; M1333-E1390 HydrophobicContact CG-CB 3.92Å; M1333-E1390 HydrophobicContact CG-CG 4.43Å; E1390-Y1392 HydrophobicContact CB-CE1 4.17Å; E1390-Y1392 HydrophobicContact CG-CD1 4.23Å; E1390-Y1392 HydrophobicContact CG-CE1 3.57Å; E1390-Y1392 WeakPolarHBondContact OE2-CE1 3.49Å; E1390-Y1392 PolarHBondContact OE2-OH 2.85Å
1391	D	85	Confident	67.9	Low	56 Å²	56	66.1 Å²	66.1	30%	0.299	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.4	173.6	-169.4	-36.1	0	0	0	109.7	R1329 I1330 Q1393	R1329-D1391 VanDerWaalsContact CG-OD1 3.24Å; R1329-D1391 WeakPolarHBondContact CG-OD1 3.45Å; R1329-D1391 IonicContact CZ-OD1 2.72Å; R1329-D1391 IonicContact CZ-OD2 3.53Å; R1329-D1391 IonicContact NE-OD1 3.84Å; R1329-D1391 PolarHBondContact NE-OD1 2.73Å; R1329-D1391 IonicContact NE-OD2 3.8Å; R1329-D1391 PolarHBondContact NE-OD2 3.02Å; R1329-D1391 IonicContact NH2-OD1 3.18Å; R1329-D1391 PolarHBondContact NH2-OD1 3Å; R1329-D1391 IonicContact NH2-OD2 3.26Å; R1329-D1391 PolarHBondContact NH2-OD2 3.12Å; I1330-D1391 HydrophobicContact CG1-CB 4.42Å; D1391-Q1393 VanDerWaalsContact C-N 3.35Å; D1391-Q1393 PolarHBondContact O-N 3.34Å; D1391-Q1393 PolarHBondContact OD1-N 3.22Å
1392	Y	76.8	Confident	65.4	Low	40 Å²	40	71.6 Å²	71.6	16%	0.157	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	6.4	-172.7	-54.5	-66.7	0	0	0	114.2	T1267 L1268 V1303 R1329 H1332 E1390	T1267-Y1392 HydrophobicContact CG2-CD1 4.03Å; T1267-Y1392 HydrophobicContact CG2-CD2 3.38Å; T1267-Y1392 HydrophobicContact CG2-CE2 3.97Å; T1267-Y1392 HydrophobicContact CG2-CG 3.45Å; T1267-Y1392 VanDerWaalsContact CG2-CG 3.45Å; L1268-Y1392 HydrophobicContact CD2-CD1 4.28Å; L1268-Y1392 HydrophobicContact CD2-CE1 3.69Å; V1303-Y1392 HydrophobicContact CB-CE2 4.45Å; V1303-Y1392 HydrophobicContact CG2-CE1 4.17Å; V1303-Y1392 HydrophobicContact CG2-CE2 3.86Å; V1303-Y1392 PolarHBondContact N-OH 3.46Å; R1329-Y1392 WeakPolarHBondContact O-CD2 3.44Å; R1329-Y1392 PolarHBondContact O-N 3.41Å; H1332-Y1392 PolarHBondContact O-OH 2.67Å; E1390-Y1392 HydrophobicContact CB-CE1 4.17Å; E1390-Y1392 HydrophobicContact CG-CD1 4.23Å; E1390-Y1392 HydrophobicContact CG-CE1 3.57Å; E1390-Y1392 WeakPolarHBondContact OE2-CE1 3.49Å; E1390-Y1392 PolarHBondContact OE2-OH 2.85Å
1393	Q	63.5	Low	62.8	Low	135 Å²	135	75.6 Å²	75.6	63%	0.631	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-13.4	-177.2	-119.6	-177.5	9.6	0	0	116.2	R1329 D1391 G1395	R1329-Q1393 HydrophobicContact CG-CB 4.09Å; D1391-Q1393 VanDerWaalsContact C-N 3.35Å; D1391-Q1393 PolarHBondContact O-N 3.34Å; D1391-Q1393 PolarHBondContact OD1-N 3.22Å; Q1393-G1395 PolarHBondContact O-N 3.29Å
1394	E	50.2	Low	60.1	Low	110 Å²	110	83.1 Å²	83.1	51%	0.514	45%	0.446	S	S	.	.			trans	-97.5	86.4	-175.6	-74.8	175.5	-162.4	0	0	111.9	R1329 T1396	R1329-E1394 IonicContact NH2-OE1 2.66Å; R1329-E1394 PolarHBondContact NH2-OE1 2.85Å; E1394-T1396 VanDerWaalsContact C-N 3.29Å; E1394-T1396 PolarHBondContact O-N 2.96Å; E1394-T1396 VanDerWaalsContact O-N 3.14Å
1395	G	41.2	Very low	57.5	Low	75 Å²	75	86.2 Å²	86.2	77%	0.773	48%	0.478	S	S	*	.			trans	-81	68.9	169.5	0	0	0	0	0	112.1	Q1393	Q1393-G1395 PolarHBondContact O-N 3.29Å
1396	T	36.8	Very low	55.6	Low	95 Å²	95	88.6 Å²	88.6	58%	0.583	49%	0.49	S	S	*	.			trans	-105.6	105.1	-177.4	33.2	0	0	0	0	112.1	E1394 D1398	E1394-T1396 VanDerWaalsContact C-N 3.29Å; E1394-T1396 PolarHBondContact O-N 2.96Å; E1394-T1396 VanDerWaalsContact O-N 3.14Å; T1396-D1398 PolarHBondContact O-N 3.37Å
1397	N	35	Very low	53.9	Low	165 Å²	165	94.2 Å²	94.2	88%	0.882	52%	0.516	S	S	*	.			trans	-79.1	47.6	170.8	-66.9	-60.2	0	0	0	111.8
1398	D	35.6	Very low	52.8	Low	121 Å²	121	98.3 Å²	98.3	65%	0.647	54%	0.539	S	S	*	.			trans	-105.8	96.7	179.7	-81.2	-57.5	0	0	0	110.1	T1396 N1400	T1396-D1398 PolarHBondContact O-N 3.37Å; D1398-N1400 PolarHBondContact O-N 3.33Å
1399	E	38.8	Very low	51.9	Low	195 Å²	195	100.7 Å²	100.7	91%	0.911	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	31.1	-177	-56.5	-177.8	127.2	0	0	114.4
1400	N	35.3	Very low	51.3	Low	147 Å²	147	99.3 Å²	99.3	79%	0.786	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.2	-1.2	-171.1	-74.5	-89.1	0	0	0	115.9	D1398	D1398-N1400 PolarHBondContact O-N 3.33Å
1401	D	35.2	Very low	51.2	Low	102 Å²	102	97.9 Å²	97.9	55%	0.545	54%	0.541	S	S	.	.			trans	-108.1	74.6	-179.6	-143.3	69.8	0	0	0	112.3	S1403	D1401-S1403 PolarHBondContact O-N 3.35Å; D1401-S1403 PolarHBondContact OD1-OG 2.75Å; D1401-S1403 VanDerWaalsContact OD2-CB 3.32Å; D1401-S1403 WeakPolarHBondContact OD2-CB 3.41Å; D1401-S1403 PolarHBondContact OD2-OG 3.2Å
1402	D	36.1	Very low	51.3	Low	167 Å²	167	95.5 Å²	95.5	89%	0.893	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-58.2	-2.1	173.8	-80.3	-35.7	0	0	0	113.7
1403	S	37.5	Very low	51.9	Low	84 Å²	84	93.8 Å²	93.8	59%	0.587	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-71.5	-23.9	-176.2	-23.3	0	0	0	0	115	D1401	D1401-S1403 PolarHBondContact O-N 3.35Å; D1401-S1403 PolarHBondContact OD1-OG 2.75Å; D1401-S1403 VanDerWaalsContact OD2-CB 3.32Å; D1401-S1403 WeakPolarHBondContact OD2-CB 3.41Å; D1401-S1403 PolarHBondContact OD2-OG 3.2Å
1404	F	37.4	Very low	53.2	Low	158 Å²	158	87.3 Å²	87.3	69%	0.693	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-95.9	6.2	-173.8	-90.2	-82.3	0	0	0	114.9	M1406	F1404-M1406 PolarHBondContact O-N 3.06Å
1405	G	39.6	Very low	55.2	Low	64 Å²	64	82.3 Å²	82.3	66%	0.66	47%	0.468	S	S	*	.			trans	-71.4	57.3	167.2	0	0	0	0	0	113.6	E1407	G1405-E1407 PolarHBondContact O-N 3.33Å; G1405-E1407 VanDerWaalsContact O-N 3.12Å
1406	M	51.7	Low	57.5	Low	51 Å²	51	79.1 Å²	79.1	25%	0.251	43%	0.433	S	S	.	.			trans	-67.3	105.3	175.8	-75.6	-73.6	-98	0	0	110.2	F910 F1404 D1408 Y1412	F910-M1406 HydrophobicContact CE2-CE 4.24Å; F1404-M1406 PolarHBondContact O-N 3.06Å; M1406-D1408 PolarHBondContact O-N 3.36Å; M1406-Y1412 HydrophobicContact CE-CE1 4.21Å; M1406-Y1412 WeakPolarHBondContact CE-OH 3.29Å
1407	E	55.1	Low	59.9	Low	117 Å²	117	78.4 Å²	78.4	55%	0.547	42%	0.422	S	S	.	.			trans	-28.1	111.6	-167.2	-62.6	-177.2	147.2	0	0	116.2	G1405 S1409 T1410	G1405-E1407 PolarHBondContact O-N 3.33Å; G1405-E1407 VanDerWaalsContact O-N 3.12Å; E1407-S1409 PolarHBondContact O-N 3.41Å; E1407-T1410 PolarHBondContact O-N 3.48Å; E1407-T1410 PolarHBondContact OE2-OG1 3.48Å; E1407-T1410 VanDerWaalsContact OE2-OG1 3.06Å
1408	D	61.5	Low	62	Low	118 Å²	118	72.8 Å²	72.8	63%	0.631	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-26.3	177.7	-59.8	30.8	0	0	0	114.8	M1333 M1406	M1333-D1408 HydrophobicContact CE-CB 4.4Å; M1406-D1408 PolarHBondContact O-N 3.36Å
1409	S	65.7	Low	63.3	Low	49 Å²	49	70.4 Å²	70.4	34%	0.343	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-5.8	-177.3	49.2	0	0	0	0	115.4	E1407	E1407-S1409 PolarHBondContact O-N 3.41Å
1410	T	74.9	Confident	64.6	Low	2 Å²	2	63.8 Å²	63.8	1%	0.012	35%	0.352	C	S	.	.	S	Bend	trans	-88	136.1	-178.1	-77	0	0	0	0	110.3	A912 N914 G1388 E1407 Y1412	A912-T1410 HydrophobicContact CB-CG2 4.3Å; N914-T1410 WeakPolarHBondContact OD1-CG2 3.39Å; G1388-T1410 PolarHBondContact N-O 3.11Å; E1407-T1410 PolarHBondContact O-N 3.48Å; E1407-T1410 PolarHBondContact OE2-OG1 3.48Å; E1407-T1410 VanDerWaalsContact OE2-OG1 3.06Å; T1410-Y1412 HydrophobicContact CG2-CD2 4.32Å; T1410-Y1412 HydrophobicContact CG2-CE2 3.71Å; T1410-Y1412 WeakPolarHBondContact O-CD2 3.39Å
1411	N	82.9	Confident	66.2	Low	4 Å²	4	59.2 Å²	59.2	2%	0.021	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	140	179.2	-61.1	-96.6	0	0	0	109.7	A913 F938 F940 G1386	A913-N1411 HydrophobicContact CB-CB 4.39Å; A913-N1411 PolarHBondContact N-O 3.46Å; F938-N1411 PolarHBondContact O-ND2 3.21Å; F940-N1411 HydrophobicContact CD2-CB 3.75Å; F940-N1411 HydrophobicContact CE2-CB 3.5Å; F940-N1411 HydrophobicContact CG-CB 4.48Å; F940-N1411 HydrophobicContact CZ-CB 4.01Å; F940-N1411 PolarHBondContact N-OD1 3.07Å; G1386-N1411 CarbonylContact O-C 3.53Å; G1386-N1411 WeakPolarHBondContact O-CA 3.3Å
1412	Y	86.5	Confident	68	Low	7 Å²	7	56.6 Å²	56.6	3%	0.027	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.1	177.9	-74.9	-94.8	0	0	0	112	F910 I911 A912 H1332 G1385 G1386 G1388 L1389 M1406 T1410	F910-Y1412 AromaticContact CD2-CD1 3.99Å; F910-Y1412 HydrophobicContact CD2-CD1 3.99Å; F910-Y1412 HydrophobicContact CD2-CE1 4.06Å; F910-Y1412 HydrophobicContact CE2-CE1 4.34Å; I911-Y1412 WeakPolarHBondContact O-CA 3.22Å; A912-Y1412 HydrophobicContact CB-CD1 4.15Å; A912-Y1412 HydrophobicContact CB-CE1 3.61Å; H1332-Y1412 PolarHBondContact CE1-O 3.08Å; G1385-Y1412 WeakPolarHBondContact CA-O 3.41Å; G1386-Y1412 PolarHBondContact N-O 2.87Å; G1386-Y1412 PolarHBondContact O-N 3.15Å; G1388-Y1412 WeakPolarHBondContact O-CD2 3.41Å; L1389-Y1412 HydrophobicContact CB-CD1 4.11Å; L1389-Y1412 HydrophobicContact CB-CD2 4.05Å; L1389-Y1412 HydrophobicContact CB-CE1 4.28Å; L1389-Y1412 HydrophobicContact CB-CE2 4.22Å; L1389-Y1412 HydrophobicContact CB-CG 4Å; L1389-Y1412 HydrophobicContact CD1-CD1 4.43Å; M1406-Y1412 HydrophobicContact CE-CE1 4.21Å; M1406-Y1412 WeakPolarHBondContact CE-OH 3.29Å; T1410-Y1412 HydrophobicContact CG2-CD2 4.32Å; T1410-Y1412 HydrophobicContact CG2-CE2 3.71Å; T1410-Y1412 WeakPolarHBondContact O-CD2 3.39Å
1413	L	89.5	Confident	70	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132	161.9	-60.5	173.8	0	0	0	108.8	F910 I911 F940 M957 L970 F1338 I1383 S1384	F910-L1413 CarbonylContact C-O 3.44Å; F910-L1413 WeakPolarHBondContact CA-O 3.46Å; F910-L1413 WeakPolarHBondContact CB-O 3.35Å; I911-L1413 HydrophobicContact CB-CB 4.24Å; I911-L1413 PolarHBondContact N-O 2.89Å; I911-L1413 PolarHBondContact O-N 3.03Å; F940-L1413 HydrophobicContact CE2-CD2 3.82Å; F940-L1413 HydrophobicContact CE2-CG 4.29Å; F940-L1413 HydrophobicContact CZ-CD2 4.05Å; F940-L1413 HydrophobicContact CZ-CG 4.36Å; M957-L1413 HydrophobicContact CE-CD1 3.86Å; M957-L1413 HydrophobicContact CE-CD2 3.62Å; M957-L1413 HydrophobicContact CE-CG 4.16Å; M957-L1413 HydrophobicContact SD-CD1 3.71Å; M957-L1413 HydrophobicContact SD-CD2 3.75Å; M957-L1413 HydrophobicContact SD-CG 4.36Å; L970-L1413 HydrophobicContact CD1-CD1 4.45Å; L970-L1413 HydrophobicContact CD2-CD1 4.27Å; F1338-L1413 HydrophobicContact CE2-CD2 4.33Å; F1338-L1413 HydrophobicContact CZ-CD2 3.65Å; I1383-L1413 HydrophobicContact CG2-CB 4.27Å; I1383-L1413 HydrophobicContact CG2-CD2 4.22Å; S1384-L1413 CarbonylContact O-C 3.55Å; S1384-L1413 WeakPolarHBondContact O-CA 3.47Å
1414	I	91.5	Very high	72.2	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	121.9	176.6	-48.7	174.2	0	0	0	108	F907 I1330 G1331 H1332 I1383 S1384 L1389 W1416	F907-I1414 HydrophobicContact CD2-CG2 4.07Å; F907-I1414 HydrophobicContact CE2-CG2 3.93Å; I1330-I1414 HydrophobicContact CG2-CD1 4.29Å; I1330-I1414 HydrophobicContact CG2-CG2 4.45Å; G1331-I1414 VanDerWaalsContact C-CD1 3.43Å; G1331-I1414 WeakPolarHBondContact O-CD1 3.32Å; H1332-I1414 VanDerWaalsContact CE1-CD1 3.49Å; H1332-I1414 WeakPolarHBondContact CE1-CD1 3.41Å; H1332-I1414 WeakPolarHBondContact NE2-CD1 3.2Å; I1383-I1414 WeakPolarHBondContact CA-O 3.48Å; S1384-I1414 PolarHBondContact N-O 3.19Å; S1384-I1414 PolarHBondContact O-N 2.98Å; L1389-I1414 HydrophobicContact CD1-CD1 3.88Å; L1389-I1414 HydrophobicContact CD1-CG1 3.93Å; I1414-W1416 HydrophobicContact CG2-CZ2 3.77Å; I1414-W1416 VanDerWaalsContact CG2-NE1 3.31Å
1415	I	91	Very high	74.7	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.8	-173.8	-54.9	-178.5	0	0	0	109.9	V908 K909 I911 V976 Y1381 I1383	V908-I1415 HydrophobicContact CB-CB 4.37Å; V908-I1415 HydrophobicContact CB-CG2 4.1Å; V908-I1415 WeakPolarHBondContact CB-O 3.34Å; V908-I1415 HydrophobicContact CG2-CG2 4.32Å; V908-I1415 PolarHBondContact N-O 3.48Å; K909-I1415 HydrophobicContact CG-CD1 4.29Å; K909-I1415 WeakPolarHBondContact O-CB 3.48Å; K909-I1415 PolarHBondContact O-N 3.09Å; I911-I1415 HydrophobicContact CD1-CD1 3.95Å; I911-I1415 HydrophobicContact CG1-CD1 4.45Å; V976-I1415 HydrophobicContact CG1-CD1 3.8Å; Y1381-I1415 HydrophobicContact CD1-CG2 3.91Å; I1383-I1415 HydrophobicContact CD1-CD1 4.25Å; I1383-I1415 HydrophobicContact CD1-CG1 4.19Å; I1383-I1415 HydrophobicContact CG1-CG1 4.12Å; I1383-I1415 HydrophobicContact CG1-CG2 4.35Å; I1383-I1415 HydrophobicContact CG2-CG1 4.23Å
1416	W	89.3	Confident	77.4	Confident	8 Å²	8	37.7 Å²	37.7	3%	0.03	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.5	178.1	-58.5	86.7	0	0	0	110.1	P905 V906 F907 W1296 L1304 T1328 I1330 Y1381 V1382 I1414	P905-W1416 HydrophobicContact CB-CB 4.36Å; P905-W1416 HydrophobicContact CB-CE3 4.14Å; V906-W1416 CarbonylContact O-C 3.55Å; V906-W1416 WeakPolarHBondContact O-CA 3.47Å; F907-W1416 HydrophobicContact CB-CE3 4.06Å; F907-W1416 HydrophobicContact CB-CH2 3.87Å; F907-W1416 HydrophobicContact CB-CZ3 3.58Å; F907-W1416 HydrophobicContact CD2-CH2 4.21Å; F907-W1416 HydrophobicContact CD2-CZ2 4.22Å; F907-W1416 HydrophobicContact CG-CH2 4.45Å; W1296-W1416 HydrophobicContact CH2-CB 3.67Å; W1296-W1416 HydrophobicContact CH2-CD2 4.09Å; W1296-W1416 AromaticContact CH2-CG 3.62Å; W1296-W1416 HydrophobicContact CH2-CG 3.62Å; W1296-W1416 HydrophobicContact CZ2-CB 4.34Å; W1296-W1416 HydrophobicContact CZ3-CB 4.45Å; W1296-W1416 AromaticContact CZ3-CD1 3.99Å; W1296-W1416 HydrophobicContact CZ3-CD2 4.42Å; W1296-W1416 HydrophobicContact CZ3-CG 4.01Å; L1304-W1416 HydrophobicContact CD1-CZ2 4.47Å; T1328-W1416 VanDerWaalsContact CB-CH2 3.49Å; T1328-W1416 HydrophobicContact CG2-CD2 4.17Å; T1328-W1416 HydrophobicContact CG2-CE3 4.19Å; T1328-W1416 HydrophobicContact CG2-CH2 3.72Å; T1328-W1416 HydrophobicContact CG2-CZ2 3.63Å; T1328-W1416 HydrophobicContact CG2-CZ3 3.96Å; I1330-W1416 HydrophobicContact CB-CH2 4.32Å; I1330-W1416 HydrophobicContact CB-CZ2 4.26Å; I1330-W1416 WeakPolarHBondContact O-CZ2 3.34Å; Y1381-W1416 CarbonylContact C-O 3.58Å; Y1381-W1416 WeakPolarHBondContact CA-O 3.41Å; V1382-W1416 HydrophobicContact CB-CB 4.43Å; V1382-W1416 PolarHBondContact N-O 3.14Å; V1382-W1416 PolarHBondContact O-N 3.12Å; I1414-W1416 HydrophobicContact CG2-CZ2 3.77Å; I1414-W1416 VanDerWaalsContact CG2-NE1 3.31Å
1417	K	87.1	Confident	79.5	Confident	81 Å²	81	36.6 Å²	36.6	35%	0.352	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	137.2	169.3	-179.2	176.7	178.2	173.9	0	110.1	P905 V906 V908 N1379 Y1381	P905-K1417 CarbonylContact C-O 3.54Å; P905-K1417 WeakPolarHBondContact CA-O 3.15Å; V906-K1417 HydrophobicContact CB-CB 4.48Å; V906-K1417 PolarHBondContact N-O 3.17Å; V906-K1417 PolarHBondContact O-N 3.21Å; V908-K1417 HydrophobicContact CG2-CB 3.74Å; N1379-K1417 WeakPolarHBondContact OD1-CE 3.29Å; N1379-K1417 PolarHBondContact OD1-NZ 2.83Å; Y1381-K1417 HydrophobicContact CD1-CB 4.17Å; Y1381-K1417 HydrophobicContact CE1-CB 4.01Å; Y1381-K1417 HydrophobicContact CE1-CD 4.48Å; Y1381-K1417 HydrophobicContact CE1-CG 4.27Å
1418	V	79.1	Confident	81.7	Confident	46 Å²	46	29.3 Å²	29.3	28%	0.279	16%	0.157	S	C	.	.			trans	-133.7	0	-178	-164.6	0	0	0	0	109	P905 K1292 M1294 W1296 V1380 V1382	P905-V1418 HydrophobicContact CB-CG2 4.36Å; K1292-V1418 HydrophobicContact CB-CG1 4.07Å; K1292-V1418 HydrophobicContact CD-CB 4.25Å; K1292-V1418 HydrophobicContact CD-CG1 3.96Å; K1292-V1418 WeakPolarHBondContact CD-OXT 3.45Å; K1292-V1418 PolarHBondContact NZ-O 3.11Å; K1292-V1418 PolarHBondContact NZ-OXT 3.08Å; M1294-V1418 HydrophobicContact SD-CG1 3.65Å; W1296-V1418 HydrophobicContact CZ2-CG2 3.73Å; V1380-V1418 PolarHBondContact N-O 2.95Å; V1380-V1418 PolarHBondContact O-N 3.3Å; V1382-V1418 HydrophobicContact CB-CG2 4.43Å; V1382-V1418 HydrophobicContact CG2-CG2 3.86Å

Retrieved 1,418 of 1,418 residues in 849.7 ms (Link to these results)

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