A0A077ZFU2_TRITR Loading...

Replication factor C subunit 1

Subunit of the replication factor C (RFC) complex which acts during elongation of primed DNA templates by DNA polymerases delta and epsilon, and is necessary for ATP-dependent loading of proliferating cell nuclear antigen (PCNA) onto primed DNA. This subunit binds to the primer-template junction. Binds the PO-B transcription element as well as other GA rich DNA sequences. Can bind single- or double-stranded DNA.

AlphaFold DB , UniProt , Accession A0A077ZFU2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 954 aa.

						>A0A077ZFU2_TRITR|A0A077ZFU2
MPKGKTSKGKKPIPTYTSDPSDSEDPVPSKLAKHYKEKNEKTKPKKGRPLKAAKDVHSDDSDFAEEPKASKKSSIKTTKKTKSSKEAQLNPITAAAYFHGGKKPKDSDSERFSAMAKKCAKDLDSPESMKMVQTKKPARKRQKPGSDLEELLELDGESKPSVSSPAKKRAVQTVVDSPRKVATKSPSKVVPTKSPRKKVAQQTEDSLNSDKPSGGHLESTQSPAATKRRSYVDYLKREGPRALGSKEIPQGTEDCLAGLTFVISGILESITRDDAKALILKHGGRVTTAVSHKTNYLLLGRDAGESKSAKVPRLLSLILPVLNDDDLYNLIRSKSAKGPTKAEPSSPSPKKKKKASTVPAVAKESSSSKDKAPTESKGGRFDLWTEKYKPTTLKQVIGQQGPKSCLNKLLTWLRSWHQWHGDGAKKKTGAKKFGASDDGSSFKAALLSGPPGIGKTTTAQLCCKELHLPYVERNASDARNKKLLEQTCSASLTSRCLEQYYCKDFRSNDVEEGVLNHVLIMDEVDGMSGNEDRAGMQGLIELIKRTRIPIICICNDRQSPKVRSLANHCFDLRFHRPQTLQIRSALMSIVHKERLAVSPQTLDQLIEAAQHDIRQVLHNLSLMTSSKQNVTFDEARQSVKKDVNMNIFEATRSLFTDSEGSAQLSLIDRAEIFFTDYSLVPLFVQENYPHCVTGNNILDRLAALAEAAQFIAYGDVVDKQIRSFSSWSLLNLQATFSTVIPTELMKGYLKGQISFPAWFGKNSKTGRLFRQLQQLHLHTSIHSSADTASICLDYVDHMRDSIMAHLNREDVTKALDLCQSYDMSKDDVDTIMELGTWPHRKDPMSKLSSKTKAAFTRAFNTSTHMLPYDVVGATLNRRKRLPVDTLDVVENGQETADAVELLAEDDDSSDDEDTALLLKAAKVKSAPAKGKATAKKGRGGTKATSGRKKAVVSV
					

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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	29.4	Very low	33.2	Very low	243 Å²	243	167.7 Å²	167.7	100%	1.197	90%	0.904	S	S	*	*				0	-178.5	0	-61.1	-177.9	166.9	0	0	108.7
2	P	36.5	Very low	33.1	Very low	110 Å²	110	163.7 Å²	163.7	71%	0.714	89%	0.893	S	S	*	*				-122.8	173.6	-80.1	36.7	-22.4	0	0	0	114.7
3	K	33.5	Very low	32.9	Very low	208 Å²	208	163.6 Å²	163.6	90%	0.904	89%	0.889	S	S	*	*			trans	42	114.6	155.4	-65.8	174.5	-179.1	178.3	0	119.2
4	G	30.4	Very low	32.9	Very low	83 Å²	83	158.9 Å²	158.9	86%	0.856	87%	0.871	S	S	*	*			trans	-94.9	170	174.3	0	0	0	0	0	115.7
5	K	38	Very low	32.8	Very low	216 Å²	216	157.1 Å²	157.1	94%	0.939	87%	0.866	S	S	*	*			trans	-122.2	150.1	169.2	-74.1	-177	175.9	179	0	110.5
6	T	31.6	Very low	32.7	Very low	150 Å²	150	160.5 Å²	160.5	92%	0.92	86%	0.864	S	S	*	*			trans	-96.1	153.3	-173.1	48.4	0	0	0	0	113.3
7	S	36.8	Very low	32.8	Very low	124 Å²	124	157.5 Å²	157.5	87%	0.867	85%	0.853	S	S	*	*			trans	-146.3	151.2	170.6	-171.9	0	0	0	0	110.7
8	K	31.3	Very low	32.8	Very low	217 Å²	217	153.5 Å²	153.5	94%	0.943	84%	0.839	S	S	*	*			trans	-98.1	135.4	-161.1	-64.9	174.4	178.9	174.7	0	112.8
9	G	33.2	Very low	32.7	Very low	76 Å²	76	151.9 Å²	151.9	78%	0.784	83%	0.829	S	S	*	*			trans	-124.1	139.1	177.6	0	0	0	0	0	112.9
10	K	33	Very low	32.7	Very low	215 Å²	215	150.5 Å²	150.5	94%	0.935	83%	0.828	S	S	*	*			trans	-45	138.9	-172.1	-64.5	171.4	175.5	178.6	0	115.7
11	K	31.9	Very low	32.5	Very low	203 Å²	203	147.4 Å²	147.4	88%	0.883	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-68.6	145	169.8	-62.8	-174.2	177.4	-171.5	0	111.6
12	P	32	Very low	32.5	Very low	119 Å²	119	143.9 Å²	143.9	77%	0.773	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-75.7	168.9	161.3	34.2	-34.6	0	0	0	111.6
13	I	30.3	Very low	32.3	Very low	163 Å²	163	144.1 Å²	144.1	84%	0.836	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75.4	129.1	176.2	-60.7	162.4	0	0	0	109
14	P	33	Very low	32.2	Very low	98 Å²	98	143.4 Å²	143.4	64%	0.636	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78.2	122.1	174.3	31	-32	0	0	0	110.7	Y16	P14-Y16 PolarHBondContact O-N 2.86Å
15	T	31.2	Very low	32.5	Very low	132 Å²	132	146.8 Å²	146.8	81%	0.81	81%	0.806	S	S	*	*			trans	-73.2	107.6	159.1	44.9	0	0	0	0	108	T17	T15-T17 PolarHBondContact O-N 3.42Å; T15-T17 VanDerWaalsContact O-N 3.13Å
16	Y	31	Very low	32.1	Very low	211 Å²	211	142.1 Å²	142.1	83%	0.827	80%	0.797	S	S	*	*			trans	-75.4	98.6	178.2	-120	-93.4	0	0	0	110	P14	P14-Y16 PolarHBondContact O-N 2.86Å
17	T	33.9	Very low	32.2	Very low	109 Å²	109	141.3 Å²	141.3	67%	0.669	79%	0.792	S	S	*	*			trans	-87.7	120.6	148.4	45.3	0	0	0	0	106.5	T15 D19	T15-T17 PolarHBondContact O-N 3.42Å; T15-T17 VanDerWaalsContact O-N 3.13Å; T17-D19 PolarHBondContact O-N 3.39Å
18	S	33.7	Very low	32.1	Very low	86 Å²	86	140.4 Å²	140.4	60%	0.601	78%	0.783	S	S	*	*			trans	-77.5	88.9	-179.1	44.7	0	0	0	0	110.8	P20	S18-P20 WeakPolarHBondContact O-CD 3.2Å
19	D	30.6	Very low	32.2	Very low	124 Å²	124	136 Å²	136	66%	0.663	78%	0.78	S	S	*	*			trans	-66.6	120.5	165.5	-71.5	-49.4	0	0	0	109.4	T17 S21	T17-D19 PolarHBondContact O-N 3.39Å; D19-S21 PolarHBondContact O-N 2.61Å
20	P	32.6	Very low	32.2	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	78%	0.781	S	S	*	*	S	Bend	trans	-82.8	58.3	175.3	35.5	-34.9	0	0	0	110.3	S18	S18-P20 WeakPolarHBondContact O-CD 3.2Å
21	S	29.6	Very low	32.2	Very low	85 Å²	85	138.5 Å²	138.5	59%	0.594	78%	0.775	S	S	*	*			trans	-149.6	60.2	-174.6	68.2	0	0	0	0	113.2	D19	D19-S21 PolarHBondContact O-N 2.61Å
22	D	29.1	Very low	32.2	Very low	170 Å²	170	134 Å²	134	91%	0.909	78%	0.776	S	S	*	*			trans	-155.9	61	169.7	-112.5	-17.7	0	0	0	109.7
23	S	32.8	Very low	32.3	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	78%	0.779	S	S	*	*			trans	-153.9	40.2	176.3	70.9	0	0	0	0	114.4
24	E	30.4	Very low	32.6	Very low	194 Å²	194	137.7 Å²	137.7	91%	0.907	78%	0.776	S	S	*	*			trans	-115.9	77.7	164.8	-71.6	-163.3	165.3	0	0	110.3
25	D	35.8	Very low	32.4	Very low	154 Å²	154	144.1 Å²	144.1	82%	0.824	79%	0.789	S	S	*	*			trans	-73	127.7	160.6	-85.8	-50.6	0	0	0	108.7	V27	D25-V27 PolarHBondContact O-N 2.88Å
26	P	30.9	Very low	32.5	Very low	117 Å²	117	147.8 Å²	147.8	76%	0.76	79%	0.794	S	S	*	*			trans	-72.9	103.8	-175.9	28.3	-34.3	0	0	0	111.2	P28	P26-P28 WeakPolarHBondContact O-CD 3.39Å
27	V	33.1	Very low	32.4	Very low	134 Å²	134	145.7 Å²	145.7	81%	0.812	79%	0.792	S	S	*	*			trans	-61.3	121.2	177.6	-179.2	0	0	0	0	110.3	D25 S29	D25-V27 PolarHBondContact O-N 2.88Å; V27-S29 PolarHBondContact O-N 2.8Å
28	P	34.4	Very low	32.3	Very low	105 Å²	105	150 Å²	150	68%	0.682	80%	0.801	S	S	*	*			trans	-63.1	134.7	179.9	-24.2	35	0	0	0	112.6	P26 K30	P26-P28 WeakPolarHBondContact O-CD 3.39Å; P28-K30 PolarHBondContact O-N 3.11Å
29	S	33.1	Very low	32.2	Very low	125 Å²	125	154.1 Å²	154.1	87%	0.874	82%	0.816	S	S	*	*	S	Bend	trans	-73.1	35.4	-172	54.5	0	0	0	0	115.7	V27	V27-S29 PolarHBondContact O-N 2.8Å
30	K	33.9	Very low	32.2	Very low	187 Å²	187	157.1 Å²	157.1	81%	0.813	83%	0.826	S	S	*	*			trans	-136.1	44.3	-171.1	-67.6	-169.5	176.4	-178	0	115.2	P28	P28-K30 PolarHBondContact O-N 3.11Å
31	L	32.8	Very low	32.1	Very low	156 Å²	156	161 Å²	161	82%	0.817	83%	0.831	S	S	*	*			trans	-136.2	-3.1	169.2	-100.7	121.1	0	0	0	116.4	K33	L31-K33 PolarHBondContact O-N 2.99Å
32	A	31.6	Very low	32.4	Very low	108 Å²	108	163.9 Å²	163.9	89%	0.893	85%	0.845	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	28.2	-175.4	0	0	0	0	0	115.8
33	K	34.2	Very low	32.7	Very low	191 Å²	191	165.6 Å²	165.6	83%	0.83	84%	0.844	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.5	12	-173.1	-77.6	-165	173.9	-172.5	0	116.3	L31	L31-K33 PolarHBondContact O-N 2.99Å
34	H	36.2	Very low	33	Very low	169 Å²	169	165.6 Å²	165.6	78%	0.782	84%	0.841	S	S	*	*	S	Bend	trans	-133.1	13.1	-173.5	-98.4	24	0	0	0	116.7
35	Y	30.4	Very low	33.2	Very low	233 Å²	233	165.3 Å²	165.3	91%	0.914	84%	0.837	S	S	*	*	S	Bend	trans	-123.8	27.8	178.6	-93.6	-87.2	0	0	0	114
36	K	32.4	Very low	33.2	Very low	209 Å²	209	167.7 Å²	167.7	91%	0.909	84%	0.84	S	S	*	*	S	Bend	trans	-121.9	7.4	175.1	-97.3	-170.3	173.9	-174.6	0	115.1
37	E	30.2	Very low	33.3	Very low	166 Å²	166	165.9 Å²	165.9	78%	0.776	84%	0.843	S	S	*	*	S	Bend	trans	-132.5	94.7	179.6	-66.7	-177	121.2	0	0	110.8
38	K	31.2	Very low	33.3	Very low	200 Å²	200	171.2 Å²	171.2	87%	0.87	85%	0.849	S	S	*	*	S	Bend	trans	156.5	81.7	156.3	-89	159.9	-177.6	176.8	0	110.9
39	N	32	Very low	33.5	Very low	172 Å²	172	172 Å²	172	92%	0.92	85%	0.854	S	S	*	*			trans	170.9	71.6	138.8	-89.6	-9.1	0	0	0	111.3
40	E	28.6	Very low	33.7	Very low	187 Å²	187	173.7 Å²	173.7	87%	0.874	85%	0.852	S	S	*	*			trans	-151.7	106.2	166.6	-164.2	178	-137.1	0	0	109.8
41	K	32	Very low	33.9	Very low	204 Å²	204	173.6 Å²	173.6	89%	0.887	85%	0.852	S	S	*	*			trans	-177.7	76.4	169.1	-110.2	164	-171.6	174.6	0	114.7
42	T	34.8	Very low	33.9	Very low	146 Å²	146	170.7 Å²	170.7	90%	0.896	85%	0.851	S	S	*	*			trans	-151.4	40.8	160.3	4.1	0	0	0	0	117.1
43	K	36.1	Very low	34.1	Very low	207 Å²	207	170 Å²	170	90%	0.9	84%	0.844	S	S	*	*			trans	52.3	158.8	149.9	-77.3	-170.3	173.4	-179.3	0	122.1
44	P	38.4	Very low	34.1	Very low	113 Å²	113	169.1 Å²	169.1	73%	0.734	84%	0.841	S	S	*	*			trans	-132.1	-169.2	-154.6	44.4	-28.1	0	0	0	115.1
45	K	34.6	Very low	34.1	Very low	189 Å²	189	166.4 Å²	166.4	82%	0.822	83%	0.832	S	S	*	*			trans	-161.4	127.7	148	-105.5	152.9	-172.9	178.1	0	113.5
46	K	36	Very low	34.2	Very low	203 Å²	203	161.3 Å²	161.3	88%	0.883	83%	0.825	S	S	*	*			trans	35.6	129.3	147	-51.7	179.1	179	-174.1	0	119.9
47	G	32.8	Very low	34.4	Very low	80 Å²	80	159.4 Å²	159.4	83%	0.825	82%	0.819	S	S	*	*			cis	118.9	129.6	-11.5	0	0	0	0	0	116.6
48	R	33.5	Very low	34.5	Very low	246 Å²	246	155.2 Å²	155.2	93%	0.928	81%	0.808	S	S	*	*			trans	-168.1	128	152.6	-157.7	172.8	-170.8	176.8	2.5	112.3
49	P	38.8	Very low	34.8	Very low	121 Å²	121	152.3 Å²	152.3	79%	0.786	80%	0.802	S	S	*	*			trans	-123	175.7	178.9	42.4	-32.5	0	0	0	115.1
50	L	37.9	Very low	34.9	Very low	160 Å²	160	151.5 Å²	151.5	84%	0.838	80%	0.797	S	S	*	*			trans	170.3	153.1	162.3	-86.5	154.2	0	0	0	105.6
51	K	36.6	Very low	35.2	Very low	185 Å²	185	148.4 Å²	148.4	80%	0.804	80%	0.796	S	S	*	*			cis	-144.6	156.8	-27.7	-97.7	-178.9	174.9	-176.7	0	105.5
52	A	33.9	Very low	35.5	Very low	96 Å²	96	146.2 Å²	146.2	79%	0.793	79%	0.794	S	S	*	*			cis	98.9	80.8	9.2	0	0	0	0	0	118.3
53	A	36.3	Very low	35.3	Very low	92 Å²	92	148.9 Å²	148.9	76%	0.76	79%	0.794	S	S	*	*			trans	-170.6	137.6	146.5	0	0	0	0	0	107.5
54	K	34.2	Very low	35.2	Very low	173 Å²	173	142.8 Å²	142.8	75%	0.752	78%	0.782	S	S	*	*			cis	78.8	132.8	41.7	-68.9	-170.5	143.7	-68.8	0	113.2
55	D	34.7	Very low	35	Very low	113 Å²	113	146.7 Å²	146.7	60%	0.604	79%	0.79	S	S	*	*			cis	-162.8	145.5	-1.9	-95.4	-29.6	0	0	0	112.3
56	V	34.1	Very low	34.9	Very low	125 Å²	125	144.9 Å²	144.9	76%	0.758	79%	0.785	S	S	*	*			trans	65.9	143.9	135.5	-179.8	0	0	0	0	124.1
57	H	35.2	Very low	35.1	Very low	170 Å²	170	141.5 Å²	141.5	79%	0.787	78%	0.784	S	S	*	*			trans	94.2	92.1	156.6	-103.7	24.3	0	0	0	122.7
58	S	32.7	Very low	35.1	Very low	77 Å²	77	146 Å²	146	54%	0.538	78%	0.78	S	S	.	*				43.9	153.7	115.1	64.6	0	0	0	0	125.9
59	D	36.5	Very low	35.1	Very low	140 Å²	140	139 Å²	139	75%	0.749	78%	0.776	S	S	*	*			trans	88.4	111.6	155.6	-56	-18.6	0	0	0	121.2
60	D	35	Very low	34.8	Very low	155 Å²	155	137.8 Å²	137.8	83%	0.829	77%	0.77	S	S	*	*			trans	24	120.7	146.1	-56.8	-16.8	0	0	0	121.9
61	S	35.8	Very low	34.4	Very low	122 Å²	122	139.1 Å²	139.1	85%	0.853	77%	0.769	S	S	*	*			trans	-161.2	127.8	136.7	-4.4	0	0	0	0	115.3
62	D	36.6	Very low	34.3	Very low	157 Å²	157	139.7 Å²	139.7	84%	0.84	77%	0.771	S	S	*	*			trans	-2.8	140.2	148.6	-79.3	-45.9	0	0	0	125
63	F	31.8	Very low	34.2	Very low	202 Å²	202	140.4 Å²	140.4	89%	0.886	77%	0.771	S	S	*	*			trans	80.9	151.5	130.6	-143	-98.3	0	0	0	122.8
64	A	33.6	Very low	33.8	Very low	79 Å²	79	141.1 Å²	141.1	65%	0.653	77%	0.77	S	S	*	*			trans	-97.3	169.2	-160.8	0	0	0	0	0	115.9
65	E	33.9	Very low	33.7	Very low	195 Å²	195	139.8 Å²	139.8	91%	0.911	77%	0.769	S	S	*	*			trans	-152.3	149.9	146.3	-127.9	-180	-179.3	0	0	113.9
66	E	33.9	Very low	33.5	Very low	152 Å²	152	142.8 Å²	142.8	71%	0.71	78%	0.777	S	S	*	*			trans	-98.6	168	169	-71.9	-169.9	139.1	0	0	111.1
67	P	39.2	Very low	33.1	Very low	131 Å²	131	142.8 Å²	142.8	85%	0.851	78%	0.778	S	S	*	*			trans	-132.7	167.1	133.3	32.7	-19.3	0	0	0	115.3
68	K	32.9	Very low	32.8	Very low	174 Å²	174	141.7 Å²	141.7	76%	0.757	78%	0.783	S	S	*	*			trans	-122.6	155.8	-154.3	-59.2	168.6	178.2	167.1	0	115.7
69	A	33	Very low	32.5	Very low	101 Å²	101	147.7 Å²	147.7	84%	0.835	80%	0.8	S	S	*	*			trans	69.6	161	148.1	0	0	0	0	0	118.4
70	S	32.8	Very low	32	Very low	94 Å²	94	150.2 Å²	150.2	66%	0.657	80%	0.804	S	S	*	*			cis	-165.5	159.4	16	77.3	0	0	0	0	115.6
71	K	30.5	Very low	31.4	Very low	188 Å²	188	148.7 Å²	148.7	82%	0.817	80%	0.8	S	S	*	*			trans	49.9	119.7	141.1	-65.6	168.1	176.6	173.7	0	122.7
72	K	33.3	Very low	31.1	Very low	197 Å²	197	152.8 Å²	152.8	86%	0.857	80%	0.803	S	S	*	*				173.3	149.6	103.7	-99.4	172	179.4	175.3	0	115.2
73	S	33.1	Very low	30.5	Very low	112 Å²	112	150.8 Å²	150.8	78%	0.783	80%	0.801	S	S	*	*			trans	32	145.9	154.5	54.9	0	0	0	0	123
74	S	28.1	Very low	30.4	Very low	106 Å²	106	146.4 Å²	146.4	74%	0.741	80%	0.796	S	S	*	*			cis	136.4	151.1	-7.9	-179.9	0	0	0	0	111.1
75	I	31.7	Very low	30.2	Very low	145 Å²	145	151.6 Å²	151.6	74%	0.744	80%	0.803	S	S	*	*			trans	95.3	122.9	157.1	-87.6	161.2	0	0	0	122.2
76	K	30.2	Very low	29.9	Very low	177 Å²	177	151.1 Å²	151.1	77%	0.77	80%	0.801	S	S	*	*			trans	69.2	86.3	151.9	-73.1	173.7	-173.5	176.9	0	123.7
77	T	24.8	Very low	29.6	Very low	124 Å²	124	148.7 Å²	148.7	76%	0.761	81%	0.807	S	S	*	*				31	131.8	114.2	58.7	0	0	0	0	122.6
78	T	30.6	Very low	29	Very low	148 Å²	148	150.2 Å²	150.2	91%	0.908	80%	0.803	S	S	*	*				-155.5	157.1	127.2	11.1	0	0	0	0	110.8
79	K	25.5	Very low	28.9	Very low	203 Å²	203	150.1 Å²	150.1	88%	0.883	81%	0.81	S	S	*	*			trans	-91.7	132.5	-172.2	-66.4	177	177	178.3	0	113.1
80	K	25.8	Very low	28.8	Very low	193 Å²	193	151.9 Å²	151.9	84%	0.839	81%	0.805	S	S	*	*			trans	-175.9	127.5	131.4	-106.4	169	-176.6	179.4	0	114.1
81	T	23.4	Very low	28.8	Very low	123 Å²	123	152.8 Å²	152.8	76%	0.755	81%	0.809	S	S	*	*			trans	38.4	105	147.6	56.9	0	0	0	0	120.4
82	K	27.9	Very low	29.1	Very low	208 Å²	208	151 Å²	151	90%	0.904	81%	0.806	S	S	*	*				-171.6	153.2	127.8	-105.3	159.8	-174.2	176.2	0	111.6
83	S	25.2	Very low	29.2	Very low	115 Å²	115	146.5 Å²	146.5	80%	0.804	80%	0.796	S	S	*	*			trans	-77.6	128.2	175.6	51.7	0	0	0	0	111.9
84	S	29.4	Very low	29.2	Very low	110 Å²	110	144.7 Å²	144.7	77%	0.769	79%	0.788	S	S	*	*			trans	-114.3	103.8	168.2	49.8	0	0	0	0	108.2
85	K	28.6	Very low	29.6	Very low	187 Å²	187	143 Å²	143	81%	0.813	78%	0.78	S	S	*	*				54.7	86.8	79.5	-71.5	-160.2	169.4	-162.9	0	112.4
86	E	28	Very low	29.9	Very low	186 Å²	186	139.3 Å²	139.3	87%	0.869	77%	0.771	S	S	*	*			trans	-65.4	160.1	153.6	-68.8	-179.3	114.4	0	0	110.6	Q88	E86-Q88 PolarHBondContact O-N 2.96Å
87	A	27.9	Very low	30.1	Very low	100 Å²	100	140.8 Å²	140.8	83%	0.826	77%	0.773	S	S	*	*			trans	-76.2	110.8	-168.8	0	0	0	0	0	112	L89	A87-L89 PolarHBondContact O-N 2.78Å; A87-L89 VanDerWaalsContact O-N 3.13Å
88	Q	27.1	Very low	30.7	Very low	164 Å²	164	142.9 Å²	142.9	77%	0.766	77%	0.772	S	S	*	*			trans	-65.6	110.8	168.5	-70.7	178.8	-42.7	0	0	109.8	E86 N90	E86-Q88 PolarHBondContact O-N 2.96Å; Q88-N90 PolarHBondContact O-N 3.29Å
89	L	31	Very low	30.8	Very low	172 Å²	172	144.5 Å²	144.5	90%	0.901	77%	0.769	S	S	*	*			trans	-65	97.5	166.4	-91.3	157.5	0	0	0	108.9	A87 P91	A87-L89 PolarHBondContact O-N 2.78Å; A87-L89 VanDerWaalsContact O-N 3.13Å; L89-P91 WeakPolarHBondContact O-CD 3.44Å
90	N	30.2	Very low	31	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-58.3	121.6	177.5	-71.4	-38.8	0	0	0	110.1	Q88 I92	Q88-N90 PolarHBondContact O-N 3.29Å; N90-I92 PolarHBondContact O-N 3.4Å
91	P	33.5	Very low	31.3	Very low	114 Å²	114	133 Å²	133	74%	0.74	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-66.6	131.7	176.5	27.2	-33.4	0	0	0	110	L89 T93	L89-P91 WeakPolarHBondContact O-CD 3.44Å; P91-T93 PolarHBondContact O-N 3.09Å; P91-T93 VanDerWaalsContact O-N 3.12Å
92	I	36.2	Very low	31.6	Very low	149 Å²	149	137 Å²	137	76%	0.764	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-61.1	116.8	178.7	-61.5	173.4	0	0	0	108.9	N90 A96	N90-I92 PolarHBondContact O-N 3.4Å; I92-A96 HydrophobicContact CG2-CB 4.15Å
93	T	35.3	Very low	31.6	Very low	104 Å²	104	136.8 Å²	136.8	64%	0.638	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-66.8	134.8	-179.4	50.9	0	0	0	0	111.2	P91 A95 A96	P91-T93 PolarHBondContact O-N 3.09Å; P91-T93 VanDerWaalsContact O-N 3.12Å; T93-A95 PolarHBondContact O-N 3.1Å; T93-A96 WeakPolarHBondContact O-CB 3.47Å; T93-A96 PolarHBondContact O-N 3.03Å
94	A	32.9	Very low	32	Very low	74 Å²	74	137.1 Å²	137.1	61%	0.612	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-54.3	-23.5	-175.4	0	0	0	0	0	115	A96 Y97 F98	A94-A96 PolarHBondContact O-N 2.89Å; A94-Y97 PolarHBondContact O-N 3.21Å; A94-F98 WeakPolarHBondContact O-CD2 3.41Å
95	A	35.9	Very low	31.9	Very low	70 Å²	70	141 Å²	141	58%	0.579	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-55.9	-30.1	173.6	0	0	0	0	0	113.8	T93 Y97	T93-A95 PolarHBondContact O-N 3.1Å; A95-Y97 VanDerWaalsContact C-N 3.27Å; A95-Y97 PolarHBondContact O-N 3.38Å
96	A	38	Very low	32.2	Very low	68 Å²	68	139 Å²	139	56%	0.562	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-69.5	-20.6	-179.1	0	0	0	0	0	113.8	I92 T93 A94	I92-A96 HydrophobicContact CG2-CB 4.15Å; T93-A96 WeakPolarHBondContact O-CB 3.47Å; T93-A96 PolarHBondContact O-N 3.03Å; A94-A96 PolarHBondContact O-N 2.89Å
97	Y	35.7	Very low	32.5	Very low	208 Å²	208	134.7 Å²	134.7	82%	0.816	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-92.1	-11	-168.8	-137.9	-90.7	0	0	0	114.6	A94 A95	A94-Y97 PolarHBondContact O-N 3.21Å; A95-Y97 VanDerWaalsContact C-N 3.27Å; A95-Y97 PolarHBondContact O-N 3.38Å
98	F	37.2	Very low	32.9	Very low	167 Å²	167	135.3 Å²	135.3	73%	0.732	75%	0.749	S	S	*	*			trans	-105	-0.7	-170.3	-74.5	-76.1	0	0	0	115.6	A94 G100	A94-F98 WeakPolarHBondContact O-CD2 3.41Å; F98-G100 VanDerWaalsContact C-N 3.26Å; F98-G100 PolarHBondContact O-N 3.02Å
99	H	32.4	Very low	33.4	Very low	182 Å²	182	131.7 Å²	131.7	84%	0.843	74%	0.742	S	S	*	*			trans	-82.7	61.1	178.6	-76.4	-72.1	0	0	0	112.9
100	G	29.7	Very low	33.6	Very low	79 Å²	79	130.8 Å²	130.8	81%	0.814	73%	0.733	S	S	*	*			trans	-163.7	44.6	-172.6	0	0	0	0	0	117	F98	F98-G100 VanDerWaalsContact C-N 3.26Å; F98-G100 PolarHBondContact O-N 3.02Å
101	G	30.9	Very low	34	Very low	75 Å²	75	133.4 Å²	133.4	77%	0.773	73%	0.733	S	S	*	*			trans	-162	138.9	177.4	0	0	0	0	0	114.7
102	K	31.4	Very low	34.2	Very low	209 Å²	209	136 Å²	136	91%	0.909	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-84.1	132	177.5	-67.9	175.1	-179.6	172.9	0	110.3	P104	K102-P104 WeakPolarHBondContact O-CD 3.15Å
103	K	27.5	Very low	34.2	Very low	203 Å²	203	131.6 Å²	131.6	88%	0.883	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-65.2	126	174.3	-65.2	-173.1	-177.9	-174.9	0	111.4
104	P	33.8	Very low	34.5	Very low	122 Å²	122	129.5 Å²	129.5	79%	0.792	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-69	161.8	155.3	-12.2	29.5	0	0	0	110.3	K102	K102-P104 WeakPolarHBondContact O-CD 3.15Å
105	K	27.6	Very low	34.8	Very low	190 Å²	190	132.4 Å²	132.4	83%	0.826	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-96.5	148.4	161.8	-59.5	175.7	-177.9	179.2	0	107.7
106	D	34.7	Very low	35.1	Very low	147 Å²	147	132.1 Å²	132.1	79%	0.786	71%	0.709	S	S	*	*			trans	168.6	175.5	136.6	-80.2	-12.7	0	0	0	110.7	D108	D106-D108 PolarHBondContact O-N 3.05Å
107	S	33.9	Very low	35.2	Very low	94 Å²	94	136 Å²	136	66%	0.657	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-12.2	-145.4	45.5	0	0	0	0	118.3	S109	S107-S109 PolarHBondContact O-N 2.81Å
108	D	36	Very low	35.2	Very low	114 Å²	114	133.6 Å²	133.6	61%	0.61	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-15.4	-167.4	-66.1	-56.4	0	0	0	115.2	D106 E110 R111	D106-D108 PolarHBondContact O-N 3.05Å; D108-E110 PolarHBondContact O-N 2.64Å; D108-R111 PolarHBondContact O-N 2.73Å
109	S	37.1	Very low	35	Very low	88 Å²	88	129.9 Å²	129.9	62%	0.615	70%	0.7	S	S	*	*	H	α-helix	trans	-64	-25.6	180	63.1	0	0	0	0	114.2	S107 S113	S107-S109 PolarHBondContact O-N 2.81Å; S109-S113 WeakPolarHBondContact O-CB 3.34Å; S109-S113 PolarHBondContact O-N 3.2Å; S109-S113 VanDerWaalsContact O-N 3.13Å
110	E	36.7	Very low	35.3	Very low	153 Å²	153	125 Å²	125	72%	0.715	69%	0.691	S	S	*	*	H	α-helix	trans	-73.2	-31.1	179.8	-63	-163.3	144.7	0	0	112.8	D108 S113 A114	D108-E110 PolarHBondContact O-N 2.64Å; E110-S113 PolarHBondContact O-N 2.94Å; E110-A114 VanDerWaalsContact O-CB 3.28Å; E110-A114 WeakPolarHBondContact O-CB 3.29Å; E110-A114 PolarHBondContact O-N 3.49Å
111	R	37.9	Very low	35.6	Very low	192 Å²	192	129.3 Å²	129.3	73%	0.725	69%	0.688	S	S	*	*	H	α-helix	trans	-66.9	-43.5	176.8	-82.8	179.5	164.5	167.8	-5.4	112.2	D108 A114 M115	D108-R111 PolarHBondContact O-N 2.73Å; R111-A114 PolarHBondContact O-N 3.43Å; R111-M115 PolarHBondContact O-N 3.45Å
112	F	36.7	Very low	36	Very low	167 Å²	167	132.1 Å²	132.1	73%	0.732	69%	0.685	S	S	*	*	H	α-helix	trans	-66.6	-41.4	174.3	-96.4	-88.5	0	0	0	112.1	A114 M115 A116	F112-A114 VanDerWaalsContact C-N 3.32Å; F112-A114 PolarHBondContact O-N 3.24Å; F112-M115 PolarHBondContact O-N 2.95Å; F112-A116 WeakPolarHBondContact O-CB 3.39Å; F112-A116 PolarHBondContact O-N 3.41Å
113	S	36.9	Very low	36.1	Very low	57 Å²	57	129.6 Å²	129.6	40%	0.399	68%	0.681	S	S	.	*	H	α-helix	trans	-59.7	-40.9	174.2	-173	0	0	0	0	112.3	S109 E110 K117	S109-S113 WeakPolarHBondContact O-CB 3.34Å; S109-S113 PolarHBondContact O-N 3.2Å; S109-S113 VanDerWaalsContact O-N 3.13Å; E110-S113 PolarHBondContact O-N 2.94Å; S113-K117 WeakPolarHBondContact O-CB 3.49Å; S113-K117 VanDerWaalsContact O-CG 3.32Å; S113-K117 WeakPolarHBondContact O-CG 3.49Å; S113-K117 PolarHBondContact O-N 3.04Å; S113-K117 VanDerWaalsContact O-N 3.11Å
114	A	41.8	Very low	36.3	Very low	61 Å²	61	127.8 Å²	127.8	50%	0.504	68%	0.681	S	S	.	*	H	α-helix	trans	-69	-42	176.9	0	0	0	0	0	113	E110 R111 F112 K118	E110-A114 VanDerWaalsContact O-CB 3.28Å; E110-A114 WeakPolarHBondContact O-CB 3.29Å; E110-A114 PolarHBondContact O-N 3.49Å; R111-A114 PolarHBondContact O-N 3.43Å; F112-A114 VanDerWaalsContact C-N 3.32Å; F112-A114 PolarHBondContact O-N 3.24Å; A114-K118 PolarHBondContact O-N 3.24Å; A114-K118 VanDerWaalsContact O-N 3.13Å
115	M	39.7	Very low	36.3	Very low	135 Å²	135	126.5 Å²	126.5	67%	0.665	68%	0.675	S	S	*	*	H	α-helix	trans	-65.2	-46	175.7	-79.8	-175.6	163.9	0	0	112.1	R111 F112 K117 K118 C119	R111-M115 PolarHBondContact O-N 3.45Å; F112-M115 PolarHBondContact O-N 2.95Å; M115-K117 VanDerWaalsContact C-N 3.32Å; M115-K117 PolarHBondContact O-N 3.13Å; M115-K118 WeakPolarHBondContact O-CB 3.38Å; M115-K118 PolarHBondContact O-N 2.94Å; M115-C119 PolarHBondContact O-N 3.24Å; M115-C119 PolarHBondContact O-SG 3.24Å
116	A	41.1	Very low	36.4	Very low	64 Å²	64	123.6 Å²	123.6	53%	0.529	68%	0.675	S	S	.	*	H	α-helix	trans	-59	-42.3	177.1	0	0	0	0	0	112.1	F112 K118 A120	F112-A116 WeakPolarHBondContact O-CB 3.39Å; F112-A116 PolarHBondContact O-N 3.41Å; A116-K118 PolarHBondContact O-N 3.17Å; A116-A120 WeakPolarHBondContact O-CB 3.2Å; A116-A120 PolarHBondContact O-N 3.1Å; A116-A120 VanDerWaalsContact O-N 3.15Å
117	K	40.3	Very low	36.3	Very low	150 Å²	150	125.6 Å²	125.6	65%	0.652	68%	0.68	S	S	*	*	H	α-helix	trans	-70.7	-14.5	175.3	-74.3	176.2	178.9	177.3	0	114.5	S113 M115	S113-K117 WeakPolarHBondContact O-CB 3.49Å; S113-K117 VanDerWaalsContact O-CG 3.32Å; S113-K117 WeakPolarHBondContact O-CG 3.49Å; S113-K117 PolarHBondContact O-N 3.04Å; S113-K117 VanDerWaalsContact O-N 3.11Å; M115-K117 VanDerWaalsContact C-N 3.32Å; M115-K117 PolarHBondContact O-N 3.13Å
118	K	34.8	Very low	36.1	Very low	157 Å²	157	126.8 Å²	126.8	68%	0.683	69%	0.688	S	S	*	*	H	α-helix	trans	-85.9	-51.8	174.6	-149.5	173.3	-174.7	-175.4	0	110.5	A114 M115 A116 A120 K121	A114-K118 PolarHBondContact O-N 3.24Å; A114-K118 VanDerWaalsContact O-N 3.13Å; M115-K118 WeakPolarHBondContact O-CB 3.38Å; M115-K118 PolarHBondContact O-N 2.94Å; A116-K118 PolarHBondContact O-N 3.17Å; K118-A120 PolarHBondContact O-N 3.35Å; K118-A120 VanDerWaalsContact O-N 3.16Å; K118-K121 PolarHBondContact O-N 3.46Å
119	C	33.9	Very low	35.7	Very low	88 Å²	88	129.9 Å²	129.9	60%	0.595	70%	0.701	S	S	*	*	H	α-helix	trans	-59.8	-27.7	176.1	-59	0	0	0	0	113.3	M115 K121	M115-C119 PolarHBondContact O-N 3.24Å; M115-C119 PolarHBondContact O-SG 3.24Å; C119-K121 PolarHBondContact O-N 3.29Å
120	A	38.6	Very low	35.6	Very low	79 Å²	79	135.9 Å²	135.9	65%	0.653	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	1.9	176.1	0	0	0	0	0	115.3	A116 K118	A116-A120 WeakPolarHBondContact O-CB 3.2Å; A116-A120 PolarHBondContact O-N 3.1Å; A116-A120 VanDerWaalsContact O-N 3.15Å; K118-A120 PolarHBondContact O-N 3.35Å; K118-A120 VanDerWaalsContact O-N 3.16Å
121	K	37.2	Very low	35.3	Very low	171 Å²	171	135.8 Å²	135.8	74%	0.743	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-14.5	176.5	-80.5	-167.4	167.2	-166.8	0	115.2	K118 C119	K118-K121 PolarHBondContact O-N 3.46Å; C119-K121 PolarHBondContact O-N 3.29Å
122	D	37.9	Very low	34.9	Very low	134 Å²	134	133 Å²	133	72%	0.717	72%	0.721	S	S	*	*	S	Bend	trans	-101.3	16.6	-172.7	-56.3	-38.7	0	0	0	112.9
123	L	33.3	Very low	34.4	Very low	156 Å²	156	132 Å²	132	82%	0.817	72%	0.719	S	S	*	*			trans	-116.3	7.3	-176.2	-75.9	171	0	0	0	114.4
124	D	31.6	Very low	34.2	Very low	164 Å²	164	135.5 Å²	135.5	88%	0.877	74%	0.738	S	S	*	*			trans	-108.7	70.1	-174.8	-150.9	6	0	0	0	110.8
125	S	34	Very low	33.6	Very low	96 Å²	96	141.9 Å²	141.9	67%	0.671	75%	0.754	S	S	*	*			trans	-148	123.4	176.4	-172	0	0	0	0	111.8	E127	S125-E127 PolarHBondContact O-N 3.29Å
126	P	30.4	Very low	32.9	Very low	128 Å²	128	145.3 Å²	145.3	83%	0.831	77%	0.766	S	S	*	*			trans	-100.9	76.1	-161.2	38.6	-37.6	0	0	0	115.4
127	E	33.3	Very low	32.5	Very low	189 Å²	189	148.4 Å²	148.4	88%	0.883	78%	0.781	S	S	*	*			trans	-122.8	0.8	173.7	-69	-157.9	119.2	0	0	115.9	S125 M129	S125-E127 PolarHBondContact O-N 3.29Å; E127-M129 PolarHBondContact O-N 3.28Å
128	S	28.7	Very low	31.8	Very low	119 Å²	119	145.5 Å²	145.5	83%	0.832	79%	0.785	S	S	*	*			trans	-93.2	36.7	-169	54.3	0	0	0	0	116.3
129	M	28.4	Very low	31.6	Very low	180 Å²	180	149.3 Å²	149.3	89%	0.887	79%	0.794	S	S	*	*			trans	-137	101.4	175.8	-78.9	-161	169.9	0	0	115.4	E127	E127-M129 PolarHBondContact O-N 3.28Å
130	K	33.5	Very low	31.5	Very low	213 Å²	213	153.7 Å²	153.7	93%	0.926	80%	0.804	S	S	*	*			trans	-133.4	113.5	151.5	-85.2	-176.5	177.4	169	0	110.4
131	M	30.9	Very low	31	Very low	151 Å²	151	161.1 Å²	161.1	74%	0.744	82%	0.815	S	S	*	*			trans	-70.8	144.5	177.9	-61.9	177.3	-76.1	0	0	111.8	Q133	M131-Q133 HydrophobicContact CB-CG 4.17Å; M131-Q133 HydrophobicContact SD-CG 4.11Å; M131-Q133 PolarHBondContact SD-NE2 3.06Å; M131-Q133 VanDerWaalsContact SD-NE2 3.41Å
132	V	30.9	Very low	30.7	Very low	133 Å²	133	162.2 Å²	162.2	81%	0.806	82%	0.822	S	S	*	*			trans	-104.3	96.2	151.9	178.3	0	0	0	0	107.8	T134	V132-T134 HydrophobicContact CG1-CG2 4.37Å
133	Q	25.9	Very low	30.2	Very low	148 Å²	148	165.3 Å²	165.3	69%	0.692	83%	0.83	S	S	*	*			trans	-81.4	119.1	170.4	-65.1	-178.5	-3.2	0	0	109.6	M131	M131-Q133 HydrophobicContact CB-CG 4.17Å; M131-Q133 HydrophobicContact SD-CG 4.11Å; M131-Q133 PolarHBondContact SD-NE2 3.06Å; M131-Q133 VanDerWaalsContact SD-NE2 3.41Å
134	T	31.4	Very low	30.2	Very low	129 Å²	129	164 Å²	164	79%	0.791	83%	0.831	S	S	*	*			trans	-109.7	141.8	163.8	47.6	0	0	0	0	110.3	V132	V132-T134 HydrophobicContact CG1-CG2 4.37Å
135	K	30	Very low	30.1	Very low	195 Å²	195	159.9 Å²	159.9	85%	0.848	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-92.3	136.6	-153.4	-62.8	167.4	-178.9	172	0	112.4	P137	K135-P137 WeakPolarHBondContact O-CD 3.47Å
136	K	24.9	Very low	29.8	Very low	207 Å²	207	160 Å²	160	90%	0.9	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.5	155.4	-71.3	-175.7	177.6	-178	0	109.2
137	P	32.2	Very low	29.9	Very low	130 Å²	130	160.7 Å²	160.7	84%	0.844	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-82.1	133.3	160.4	32.4	-30	0	0	0	109.8	K135	K135-P137 WeakPolarHBondContact O-CD 3.47Å
138	A	26.2	Very low	29.9	Very low	89 Å²	89	157.9 Å²	157.9	74%	0.736	82%	0.815	S	S	*	*			trans	-128.1	151	168.3	0	0	0	0	0	109.1
139	R	31.2	Very low	30	Very low	236 Å²	236	160.1 Å²	160.1	89%	0.891	81%	0.812	S	S	*	*			trans	108.7	145.6	-166.9	-69.7	167.1	168.3	-172.4	-3.3	111.1
140	K	30.5	Very low	30.3	Very low	181 Å²	181	159.3 Å²	159.3	79%	0.787	81%	0.806	S	S	*	*			cis	-146.7	156.3	4.9	-132.5	172.5	-178.6	-170.1	0	110.6
141	R	28.2	Very low	30.3	Very low	234 Å²	234	155.7 Å²	155.7	88%	0.883	80%	0.796	S	S	*	*			trans	-80.6	135.4	172.8	-68.1	159.5	62	-176.1	1.2	110.2
142	Q	31.3	Very low	30.6	Very low	194 Å²	194	156 Å²	156	91%	0.907	80%	0.799	S	S	*	*			trans	-165.5	144.1	142.4	-112.3	157.7	-30.8	0	0	112.7
143	K	26.9	Very low	30.5	Very low	200 Å²	200	157.9 Å²	157.9	87%	0.87	80%	0.8	S	S	*	*			trans	-134.6	170.8	166.5	-86.1	-168.7	176	-171.5	0	105.2
144	P	33.4	Very low	31.1	Very low	129 Å²	129	159.3 Å²	159.3	84%	0.838	81%	0.811	S	S	*	*			cis	-120.3	-171	-45.9	38	-23.3	0	0	0	109.6
145	G	30.3	Very low	31	Very low	77 Å²	77	161.1 Å²	161.1	79%	0.794	82%	0.816	S	S	*	*			trans	-160.7	139.7	167.2	0	0	0	0	0	110
146	S	27.5	Very low	31.1	Very low	99 Å²	99	155.5 Å²	155.5	69%	0.692	81%	0.813	S	S	*	*			trans	-105.6	-165.4	176.4	52.9	0	0	0	0	110.4
147	D	32	Very low	31.2	Very low	142 Å²	142	154.9 Å²	154.9	76%	0.759	81%	0.814	S	S	*	*			trans	77.8	146.2	168.7	-34.9	-20.4	0	0	0	112.7
148	L	33	Very low	31	Very low	130 Å²	130	153.3 Å²	153.3	68%	0.681	81%	0.806	S	S	*	*			cis	-155.6	150.2	10	-167.9	64.5	0	0	0	110.8
149	E	32	Very low	31.1	Very low	165 Å²	165	158 Å²	158	77%	0.771	81%	0.81	S	S	*	*			trans	57.2	151.4	160.1	-77.9	144.5	-157.3	0	0	118.9
150	E	33.6	Very low	30.9	Very low	163 Å²	163	152.9 Å²	152.9	76%	0.762	81%	0.807	S	S	*	*			cis	-152.1	145.7	31.8	-143.2	-173	149.7	0	0	113
151	L	35.1	Very low	30.8	Very low	137 Å²	137	149.9 Å²	149.9	72%	0.717	81%	0.809	S	S	*	*			trans	26.9	116.8	145.2	-74.8	169.4	0	0	0	119.4
152	L	35.2	Very low	30.8	Very low	157 Å²	157	145.1 Å²	145.1	82%	0.822	81%	0.805	S	S	*	*				-173.7	159	60.9	-105.6	154.8	0	0	0	113
153	E	29.7	Very low	30.8	Very low	174 Å²	174	141.3 Å²	141.3	81%	0.813	80%	0.8	S	S	*	*			trans	-90.3	155.9	178.9	-57.3	159.6	142	0	0	112.8
154	L	38	Very low	30.8	Very low	177 Å²	177	136.7 Å²	136.7	93%	0.927	79%	0.793	S	S	*	*			trans	-172.1	121.8	141.5	-108.2	174.3	0	0	0	111.1
155	D	30	Very low	30.8	Very low	167 Å²	167	136.4 Å²	136.4	89%	0.893	79%	0.791	S	S	*	*			trans	-73	155.2	176.7	-73.3	-65	0	0	0	113.6
156	G	30.9	Very low	30.6	Very low	77 Å²	77	137.3 Å²	137.3	79%	0.794	79%	0.791	S	S	*	*			trans	-174.2	81.6	179	0	0	0	0	0	113.9
157	E	27	Very low	30.7	Very low	194 Å²	194	142 Å²	142	91%	0.907	80%	0.799	S	S	*	*			trans	-61.3	137.5	173.2	-60.3	-172.8	121.1	0	0	112.4
158	S	30	Very low	30.4	Very low	98 Å²	98	145.3 Å²	145.3	69%	0.685	81%	0.807	S	S	*	*				168.5	147.8	114.8	52.8	0	0	0	0	115.2
159	K	26.7	Very low	30.2	Very low	187 Å²	187	150.3 Å²	150.3	81%	0.813	82%	0.816	S	S	*	*			trans	64.3	107.5	155.6	-69	160.8	-176.2	165.9	0	119
160	P	27	Very low	30	Very low	129 Å²	129	147.1 Å²	147.1	84%	0.838	82%	0.818	S	S	*	*			trans	-74.4	131.1	159.2	31.6	-32.5	0	0	0	111
161	S	29.2	Very low	29.7	Very low	117 Å²	117	145 Å²	145	82%	0.818	82%	0.817	S	S	*	*			trans	-110.2	115.3	176.5	63.5	0	0	0	0	112.5
162	V	27.8	Very low	29.4	Very low	134 Å²	134	147.1 Å²	147.1	81%	0.812	82%	0.823	S	S	*	*			trans	-83.1	133.4	-178.2	176.4	0	0	0	0	112
163	S	31.1	Very low	29.1	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	81%	0.813	S	S	*	*			trans	-149.8	75.6	162.7	69	0	0	0	0	114.1	P165	S163-P165 WeakPolarHBondContact O-CD 3.49Å
164	S	27.7	Very low	29	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	81%	0.811	S	S	*	*			trans	-86.4	115.5	173.7	-65.9	0	0	0	0	112	A166	S164-A166 VanDerWaalsContact C-N 3.35Å; S164-A166 PolarHBondContact O-N 3.29Å
165	P	31.9	Very low	28.7	Very low	123 Å²	123	138.3 Å²	138.3	80%	0.799	79%	0.794	S	S	*	*			trans	-80	75	-176.6	32.6	-36.1	0	0	0	112.8	S163 K167	S163-P165 WeakPolarHBondContact O-CD 3.49Å; P165-K167 PolarHBondContact O-N 3.48Å
166	A	27.8	Very low	28.5	Very low	95 Å²	95	136.1 Å²	136.1	79%	0.785	78%	0.782	S	S	*	*			trans	-66.9	88	178.8	0	0	0	0	0	113.2	S164	S164-A166 VanDerWaalsContact C-N 3.35Å; S164-A166 PolarHBondContact O-N 3.29Å
167	K	29.3	Very low	28.5	Very low	199 Å²	199	135.1 Å²	135.1	87%	0.865	76%	0.764	S	S	*	*			trans	-99.5	91.3	174.7	-96.3	176	177.5	165.2	0	113.1	P165 R169	P165-K167 PolarHBondContact O-N 3.48Å; K167-R169 PolarHBondContact O-N 2.71Å
168	K	25.7	Very low	28.7	Very low	210 Å²	210	132.5 Å²	132.5	91%	0.913	76%	0.763	S	S	*	*			trans	-50.4	123	161.7	-63.8	174.4	-178.8	173.4	0	109.9
169	R	28.1	Very low	28.5	Very low	235 Å²	235	139.1 Å²	139.1	89%	0.887	77%	0.773	S	S	*	*			trans	-128.7	115.5	156.7	-83.1	-172	67.9	176.7	-0.1	108.7	K167	K167-R169 PolarHBondContact O-N 2.71Å
170	A	28.5	Very low	28.4	Very low	98 Å²	98	140.1 Å²	140.1	81%	0.81	78%	0.778	S	S	*	*			trans	-63.8	143.5	176.7	0	0	0	0	0	111.2
171	V	27.3	Very low	28.5	Very low	120 Å²	120	140.6 Å²	140.6	73%	0.727	78%	0.778	S	S	*	*			trans	-73.9	132	170.2	176.8	0	0	0	0	108.8	T173	V171-T173 HydrophobicContact CG1-CG2 3.89Å
172	Q	28.1	Very low	28.3	Very low	181 Å²	181	138.8 Å²	138.8	85%	0.846	77%	0.77	S	S	*	*			trans	-121.9	88.2	163.1	-79.5	-170.1	-17.7	0	0	108.8
173	T	28.6	Very low	28.2	Very low	102 Å²	102	138.1 Å²	138.1	63%	0.626	77%	0.766	S	S	*	*			trans	-79.3	112.1	166.8	32	0	0	0	0	108.9	V171	V171-T173 HydrophobicContact CG1-CG2 3.89Å
174	V	29.3	Very low	28	Very low	126 Å²	126	142.4 Å²	142.4	76%	0.764	77%	0.77	S	S	*	*			trans	-108	118.4	168.4	-179.4	0	0	0	0	107.4
175	V	29.7	Very low	27.9	Very low	94 Å²	94	142.8 Å²	142.8	57%	0.57	77%	0.773	S	S	*	*			trans	-107.8	114.9	178.8	-179.1	0	0	0	0	108.4
176	D	27.7	Very low	27.9	Very low	121 Å²	121	143.2 Å²	143.2	65%	0.647	78%	0.776	S	S	*	*			trans	-133.4	139	172.8	-111.6	-28.3	0	0	0	110.1	S849	D176-S849 WeakPolarHBondContact OD1-CB 3.36Å; D176-S849 PolarHBondContact OD1-OG 2.89Å
177	S	29.9	Very low	28	Very low	57 Å²	57	144.1 Å²	144.1	40%	0.399	78%	0.776	S	S	.	*	P	Polyproline II helix	trans	-103	139.3	-175.1	-54.4	0	0	0	0	110.7	R179	S177-R179 PolarHBondContact O-N 2.97Å
178	P	30.5	Very low	28	Very low	139 Å²	139	144 Å²	144	90%	0.903	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-77	123.6	-172.2	29.7	-34.6	0	0	0	113.1
179	R	27.6	Very low	28.5	Very low	237 Å²	237	140.6 Å²	140.6	89%	0.894	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-99.4	136.7	172	-161.8	178.1	-171.2	-157.8	3.1	111.1	S177 V181	S177-R179 PolarHBondContact O-N 2.97Å; R179-V181 PolarHBondContact O-N 3.47Å
180	K	24	Very low	28.7	Very low	208 Å²	208	135.1 Å²	135.1	90%	0.904	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-60.5	122.6	177	-65.9	-179.2	178.3	-178.2	0	111.6
181	V	29.3	Very low	28.7	Very low	139 Å²	139	136.3 Å²	136.3	84%	0.842	76%	0.764	S	S	*	*			trans	-141.1	144.7	159.1	-174.6	0	0	0	0	108.3	R179	R179-V181 PolarHBondContact O-N 3.47Å
182	A	23.8	Very low	29	Very low	79 Å²	79	137.5 Å²	137.5	65%	0.653	77%	0.772	S	S	*	*			trans	-108.2	178.3	-175.5	0	0	0	0	0	113.2
183	T	26.3	Very low	29.1	Very low	119 Å²	119	138.5 Å²	138.5	73%	0.73	77%	0.773	S	S	*	*			trans	99.9	122.2	160	74.5	0	0	0	0	120.2
184	K	26.2	Very low	29.3	Very low	205 Å²	205	139.4 Å²	139.4	89%	0.891	78%	0.784	S	S	*	*			trans	62.2	114	136.1	-63.2	168.3	-174.7	174.3	0	119.8
185	S	26.2	Very low	29.4	Very low	112 Å²	112	139 Å²	139	78%	0.783	78%	0.784	S	S	*	*			trans	-119.2	136.8	161.9	56.6	0	0	0	0	111.4
186	P	31.2	Very low	29.5	Very low	132 Å²	132	146.6 Å²	146.6	86%	0.857	80%	0.802	S	S	*	*			trans	-79.8	179.1	176.6	34.2	-35.9	0	0	0	113
187	S	30.9	Very low	29.7	Very low	113 Å²	113	150.5 Å²	150.5	79%	0.79	81%	0.814	S	S	*	*			trans	-143.4	152	-171.8	64.2	0	0	0	0	113.9
188	K	30.2	Very low	29.5	Very low	198 Å²	198	156.8 Å²	156.8	86%	0.861	83%	0.834	S	S	*	*			trans	-179.6	174.5	131.5	-111.7	179.7	174.7	178.3	0	113.6
189	V	34.5	Very low	29.7	Very low	137 Å²	137	157.2 Å²	157.2	83%	0.83	83%	0.834	S	S	*	*			trans	75.3	131.1	169	-165.5	0	0	0	0	115.7
190	V	33.1	Very low	29.7	Very low	121 Å²	121	149.8 Å²	149.8	73%	0.733	82%	0.823	S	S	*	*			cis	-164.5	144.4	-33.4	129.6	0	0	0	0	105.8
191	P	29	Very low	30.3	Very low	123 Å²	123	148.5 Å²	148.5	80%	0.799	82%	0.82	S	S	*	*			trans	-122	144.8	167.3	37.2	-26.6	0	0	0	114.2
192	T	32.5	Very low	30.2	Very low	145 Å²	145	149.7 Å²	149.7	89%	0.89	82%	0.817	S	S	*	*			trans	-92.5	166.2	176.1	41	0	0	0	0	113.3
193	K	30.1	Very low	30.5	Very low	201 Å²	201	153 Å²	153	87%	0.874	83%	0.829	S	S	*	*			trans	-106.5	161	-166.8	-59.9	173	-179.1	171	0	113.4
194	S	33	Very low	30.6	Very low	122 Å²	122	155.5 Å²	155.5	85%	0.853	83%	0.832	S	S	*	*			trans	-155.4	152.7	142.2	-84.8	0	0	0	0	112
195	P	32.6	Very low	30.6	Very low	118 Å²	118	152.8 Å²	152.8	77%	0.766	83%	0.827	S	S	*	*			trans	-138.3	165.6	-147.4	40.5	-21.9	0	0	0	118.3
196	R	31.7	Very low	31	Very low	252 Å²	252	153.4 Å²	153.4	95%	0.951	83%	0.832	S	S	*	*			trans	-172.9	154.2	155	-106.4	-179.7	-178.9	-151.3	0.4	109.5
197	K	32.3	Very low	30.9	Very low	203 Å²	203	154.3 Å²	154.3	88%	0.883	83%	0.829	S	S	*	*			cis	-153.1	145.3	-49.6	-171.7	177.3	-179.6	-175.7	0	106.2
198	K	25.6	Very low	30.9	Very low	189 Å²	189	156.2 Å²	156.2	82%	0.822	83%	0.83	S	S	*	*			trans	-77.4	153.4	-179.9	-71.3	-172.1	177.8	-174.4	0	113.2
199	V	33.3	Very low	30.9	Very low	148 Å²	148	152 Å²	152	90%	0.897	83%	0.825	S	S	*	*			trans	-136.7	149.2	138	-178.3	0	0	0	0	106.6
200	A	28.8	Very low	30.8	Very low	81 Å²	81	151.3 Å²	151.3	67%	0.669	82%	0.817	S	S	*	*			trans	-159.1	152.3	-178.3	0	0	0	0	0	112.6
201	Q	35.3	Very low	30.8	Very low	181 Å²	181	154.4 Å²	154.4	85%	0.846	82%	0.821	S	S	*	*			trans	-151.4	128.1	157.2	-94.1	158.5	-45	0	0	104.4
202	Q	28.7	Very low	31.1	Very low	165 Å²	165	153.6 Å²	153.6	77%	0.771	82%	0.815	S	S	*	*				73.1	97.1	50	-73.5	-167.7	-60	0	0	114.8
203	T	29.8	Very low	30.8	Very low	149 Å²	149	152.4 Å²	152.4	91%	0.914	81%	0.813	S	S	*	*				-152.4	160.6	116.6	24.9	0	0	0	0	108.4
204	E	26.8	Very low	30.6	Very low	170 Å²	170	146.7 Å²	146.7	79%	0.794	81%	0.811	S	S	*	*			trans	-128.6	156.9	-168.8	-68.5	175.2	145.8	0	0	112.5
205	D	27.9	Very low	30.3	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	81%	0.809	S	S	*	*			trans	39	127.6	150.5	-60.5	-1.2	0	0	0	123.7
206	S	33.1	Very low	30.1	Very low	125 Å²	125	148.1 Å²	148.1	87%	0.874	81%	0.814	S	S	*	*			trans	-166.8	160.4	132.8	-81.7	0	0	0	0	111.4
207	L	30.3	Very low	29.9	Very low	152 Å²	152	144.3 Å²	144.3	80%	0.796	81%	0.812	S	S	*	*			trans	-118.2	155.3	-169.3	-69.4	95.4	0	0	0	114.8
208	N	29.8	Very low	29.7	Very low	153 Å²	153	143.4 Å²	143.4	82%	0.818	81%	0.811	S	S	*	*			trans	58.7	140.7	155.9	-59.7	-10.9	0	0	0	117.7
209	S	31.5	Very low	30	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	80%	0.799	S	S	*	*			cis	-157	171.2	47.4	51.8	0	0	0	0	116.4
210	D	32.5	Very low	29.8	Very low	124 Å²	124	138.3 Å²	138.3	66%	0.663	80%	0.8	S	S	*	*			trans	22.6	115.2	159	-69.6	-80.2	0	0	0	125.3
211	K	32.4	Very low	30.1	Very low	185 Å²	185	139.2 Å²	139.2	80%	0.804	79%	0.79	S	S	*	*				58.7	159.6	122.2	-76.9	178.2	-177.5	166.7	0	122.7
212	P	34.3	Very low	30	Very low	106 Å²	106	134 Å²	134	69%	0.688	77%	0.773	S	S	*	*			cis	-133.5	162.1	-22.4	37.7	-20.9	0	0	0	115.7
213	S	26.6	Very low	30.7	Very low	121 Å²	121	131 Å²	131	85%	0.846	77%	0.769	S	S	*	*			trans	32.2	98.2	150.6	60.9	0	0	0	0	120.7
214	G	27.2	Very low	31.5	Very low	81 Å²	81	127.1 Å²	127.1	84%	0.835	75%	0.751	S	S	*	*			trans	-145.6	134.5	155.5	0	0	0	0	0	109
215	G	25.2	Very low	32.3	Very low	77 Å²	77	120.7 Å²	120.7	79%	0.794	73%	0.728	S	S	*	*			trans	-102.8	126.6	-162	0	0	0	0	0	116.1
216	H	29.2	Very low	33.2	Very low	192 Å²	192	117 Å²	117	89%	0.889	71%	0.71	S	S	*	*			trans	-152	126.6	144	-128.7	-83.3	0	0	0	110.4	E218	H216-E218 PolarHBondContact O-N 3.42Å
217	L	27.3	Very low	33.9	Very low	173 Å²	173	118.5 Å²	118.5	91%	0.906	70%	0.701	S	S	*	*			trans	-98.9	78.7	-173	-162	82.6	0	0	0	111.5
218	E	28.3	Very low	35	Very low	183 Å²	183	120.8 Å²	120.8	86%	0.855	70%	0.699	S	S	*	*			trans	-79.2	120.7	-179.9	-165.1	169.6	-139.5	0	0	112	H216 T220	H216-E218 PolarHBondContact O-N 3.42Å; E218-T220 PolarHBondContact O-N 2.89Å
219	S	31.4	Very low	36	Very low	82 Å²	82	120.3 Å²	120.3	57%	0.573	69%	0.686	S	S	*	*			trans	-77.4	105.4	-168	72.6	0	0	0	0	112.9	Q221	S219-Q221 PolarHBondContact O-N 2.84Å; S219-Q221 PolarHBondContact OG-NE2 3.02Å
220	T	28.4	Very low	37.3	Very low	149 Å²	149	117.8 Å²	117.8	91%	0.914	67%	0.668	S	S	*	*			trans	-72.9	93.3	175.5	-6.3	0	0	0	0	111.1	E218	E218-T220 PolarHBondContact O-N 2.89Å
221	Q	35.5	Very low	38.6	Very low	99 Å²	99	118.6 Å²	118.6	46%	0.463	66%	0.663	S	S	.	*			trans	-81.6	134.5	-176.5	-66.6	179.3	35.1	0	0	112.2	S219	S219-Q221 PolarHBondContact O-N 2.84Å; S219-Q221 PolarHBondContact OG-NE2 3.02Å
222	S	34	Very low	40.2	Very low	71 Å²	71	113 Å²	113	50%	0.497	64%	0.644	S	S	.	*			trans	-67.9	146.3	-175.5	77	0	0	0	0	113.1	A224 A225	S222-A224 PolarHBondContact O-N 3.16Å; S222-A225 WeakPolarHBondContact O-CB 3.33Å; S222-A225 PolarHBondContact O-N 3.5Å
223	P	43.6	Very low	41.5	Very low	103 Å²	103	111.8 Å²	111.8	67%	0.669	63%	0.632	S	S	*	*	H	α-helix	trans	-67.5	-2.9	-174.7	26.6	-36	0	0	0	115.1	K227	P223-K227 WeakPolarHBondContact O-CG 3.43Å
224	A	45.5	Very low	43.3	Very low	67 Å²	67	110.3 Å²	110.3	55%	0.554	61%	0.609	S	S	*	*	H	α-helix	trans	-83.5	-30.2	169	0	0	0	0	0	112.5	S222 R228	S222-A224 PolarHBondContact O-N 3.16Å; A224-R228 PolarHBondContact O-N 3.02Å
225	A	43.8	Very low	44.8	Very low	36 Å²	36	111.1 Å²	111.1	30%	0.298	59%	0.593	S	S	.	*	H	α-helix	trans	-72.4	-45.3	177.3	0	0	0	0	0	111.2	S222 K227 R228 R229	S222-A225 WeakPolarHBondContact O-CB 3.33Å; S222-A225 PolarHBondContact O-N 3.5Å; A225-K227 VanDerWaalsContact C-N 3.32Å; A225-K227 PolarHBondContact O-N 3.13Å; A225-R228 WeakPolarHBondContact O-CB 3.25Å; A225-R228 PolarHBondContact O-N 3.17Å; A225-R229 PolarHBondContact O-N 3.22Å; A225-R229 VanDerWaalsContact O-N 3.1Å
226	T	47	Very low	46.6	Very low	70 Å²	70	115.1 Å²	115.1	43%	0.429	59%	0.589	S	S	.	*	H	α-helix	trans	-55.8	-46.5	176.7	-35.8	0	0	0	0	111.5	R228 R229 S230	T226-R228 VanDerWaalsContact C-N 3.29Å; T226-R228 PolarHBondContact O-N 3.27Å; T226-R229 PolarHBondContact O-N 2.97Å; T226-S230 PolarHBondContact O-N 3.08Å; T226-S230 PolarHBondContact O-OG 2.82Å
227	K	47.7	Very low	48.3	Very low	156 Å²	156	109.9 Å²	109.9	68%	0.678	56%	0.561	S	S	*	*	H	α-helix	trans	-64.3	-27.4	177.3	-73.9	-177.7	179.3	-176.7	0	114.4	P223 A225 S230 Y231	P223-K227 WeakPolarHBondContact O-CG 3.43Å; A225-K227 VanDerWaalsContact C-N 3.32Å; A225-K227 PolarHBondContact O-N 3.13Å; K227-S230 WeakPolarHBondContact CA-OG 3.41Å; K227-S230 PolarHBondContact O-OG 3.27Å; K227-Y231 WeakPolarHBondContact O-CB 3.47Å; K227-Y231 PolarHBondContact O-N 2.8Å
228	R	52.8	Low	50	Low	201 Å²	201	107.4 Å²	107.4	76%	0.758	55%	0.545	S	S	*	.	H	α-helix	trans	-72.9	-45.5	173	-88.6	-176.4	166.9	178.7	-4.9	111	A224 A225 T226 Y231 V232	A224-R228 PolarHBondContact O-N 3.02Å; A225-R228 WeakPolarHBondContact O-CB 3.25Å; A225-R228 PolarHBondContact O-N 3.17Å; T226-R228 VanDerWaalsContact C-N 3.29Å; T226-R228 PolarHBondContact O-N 3.27Å; R228-Y231 PolarHBondContact O-N 3.11Å; R228-V232 WeakPolarHBondContact O-CG2 3.38Å; R228-V232 PolarHBondContact O-N 2.88Å; R228-V232 VanDerWaalsContact O-N 3.08Å
229	R	52.1	Low	51.9	Low	142 Å²	142	101 Å²	101	54%	0.536	53%	0.528	S	S	.	.	H	α-helix	trans	-58.9	-55.8	175.2	-69.6	-162.5	-172.6	115.6	5.4	111.1	A225 T226 Y231 V232 D233	A225-R229 PolarHBondContact O-N 3.22Å; A225-R229 VanDerWaalsContact O-N 3.1Å; T226-R229 PolarHBondContact O-N 2.97Å; R229-Y231 PolarHBondContact O-N 3.49Å; R229-V232 PolarHBondContact O-N 3.46Å; R229-D233 WeakPolarHBondContact O-CB 3.13Å; R229-D233 PolarHBondContact O-N 3.05Å
230	S	58.4	Low	53.6	Low	55 Å²	55	98.6 Å²	98.6	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-57.3	-16.8	-179.8	69.9	0	0	0	0	115.4	T226 K227	T226-S230 PolarHBondContact O-N 3.08Å; T226-S230 PolarHBondContact O-OG 2.82Å; K227-S230 WeakPolarHBondContact CA-OG 3.41Å; K227-S230 PolarHBondContact O-OG 3.27Å
231	Y	60.8	Low	55.5	Low	142 Å²	142	99.9 Å²	99.9	56%	0.557	50%	0.498	S	S	*	.	H	α-helix	trans	-92.2	-38.4	173.8	-176.2	-102	0	0	0	112.6	K227 R228 R229 D233 Y234 L235	K227-Y231 WeakPolarHBondContact O-CB 3.47Å; K227-Y231 PolarHBondContact O-N 2.8Å; R228-Y231 PolarHBondContact O-N 3.11Å; R229-Y231 PolarHBondContact O-N 3.49Å; Y231-D233 VanDerWaalsContact C-N 3.33Å; Y231-Y234 WeakPolarHBondContact O-CB 3.47Å; Y231-Y234 PolarHBondContact O-N 3.36Å; Y231-L235 HydrophobicContact CD1-CD1 4.12Å; Y231-L235 HydrophobicContact CE1-CD1 3.65Å; Y231-L235 HydrophobicContact CE1-CG 4.43Å; Y231-L235 PolarHBondContact O-N 3.35Å; Y231-L235 VanDerWaalsContact O-N 3.15Å
232	V	65.1	Low	57.1	Low	67 Å²	67	97 Å²	97	41%	0.406	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-40.6	170.1	173	0	0	0	0	110.6	R228 R229 Y234 L235 K236	R228-V232 WeakPolarHBondContact O-CG2 3.38Å; R228-V232 PolarHBondContact O-N 2.88Å; R228-V232 VanDerWaalsContact O-N 3.08Å; R229-V232 PolarHBondContact O-N 3.46Å; V232-Y234 PolarHBondContact O-N 3.37Å; V232-L235 PolarHBondContact O-N 2.99Å; V232-K236 HydrophobicContact CG1-CD 4.22Å; V232-K236 WeakPolarHBondContact O-CG 3.47Å; V232-K236 PolarHBondContact O-N 3.27Å; V232-K236 VanDerWaalsContact O-N 3.17Å
233	D	61.6	Low	58.6	Low	81 Å²	81	98.8 Å²	98.8	43%	0.433	50%	0.495	S	S	.	.	H	α-helix	trans	-76.5	-6.8	177.6	-50.4	-35.7	0	0	0	112.5	R229 Y231 R237	R229-D233 WeakPolarHBondContact O-CB 3.13Å; R229-D233 PolarHBondContact O-N 3.05Å; Y231-D233 VanDerWaalsContact C-N 3.33Å; D233-R237 WeakPolarHBondContact O-CG 3.37Å; D233-R237 PolarHBondContact O-NE 3.27Å
234	Y	63.6	Low	59.6	Low	90 Å²	90	97 Å²	97	35%	0.353	50%	0.495	S	S	.	.	H	α-helix	trans	-84.3	-43.3	164.6	176.9	-85.2	0	0	0	111.1	Y231 V232 K236 R237	Y231-Y234 WeakPolarHBondContact O-CB 3.47Å; Y231-Y234 PolarHBondContact O-N 3.36Å; V232-Y234 PolarHBondContact O-N 3.37Å; Y234-K236 VanDerWaalsContact C-N 3.3Å; Y234-K236 PolarHBondContact O-N 3.28Å; Y234-R237 WeakPolarHBondContact O-CD 3.48Å; Y234-R237 WeakPolarHBondContact O-CG 3.19Å
235	L	60.5	Low	60.9	Low	97 Å²	97	97.3 Å²	97.3	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-71.5	-19.4	-178.6	-69.6	171.1	0	0	0	114.1	Y231 V232	Y231-L235 HydrophobicContact CD1-CD1 4.12Å; Y231-L235 HydrophobicContact CE1-CD1 3.65Å; Y231-L235 HydrophobicContact CE1-CG 4.43Å; Y231-L235 PolarHBondContact O-N 3.35Å; Y231-L235 VanDerWaalsContact O-N 3.15Å; V232-L235 PolarHBondContact O-N 2.99Å
236	K	63.1	Low	62.3	Low	161 Å²	161	99 Å²	99	70%	0.7	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	10.1	-179.7	-74.7	-178.7	172.6	-173.3	0	115.1	V232 Y234	V232-K236 HydrophobicContact CG1-CD 4.22Å; V232-K236 WeakPolarHBondContact O-CG 3.47Å; V232-K236 PolarHBondContact O-N 3.27Å; V232-K236 VanDerWaalsContact O-N 3.17Å; Y234-K236 VanDerWaalsContact C-N 3.3Å; Y234-K236 PolarHBondContact O-N 3.28Å
237	R	64.1	Low	63.5	Low	82 Å²	82	103.4 Å²	103.4	31%	0.309	51%	0.51	S	S	.	.			trans	-83.4	141.3	-170.9	-66.8	175.1	177.1	-150	-14.4	111.9	D233 Y234 I266 D302	D233-R237 WeakPolarHBondContact O-CG 3.37Å; D233-R237 PolarHBondContact O-NE 3.27Å; Y234-R237 WeakPolarHBondContact O-CD 3.48Å; Y234-R237 WeakPolarHBondContact O-CG 3.19Å; R237-I266 HydrophobicContact CB-CD1 3.85Å; R237-I266 HydrophobicContact CG-CD1 4.4Å; R237-D302 VanDerWaalsContact NH1-CB 3.3Å; R237-D302 PolarHBondContact NH1-O 3.19Å
238	E	63.4	Low	64.8	Low	121 Å²	121	100.5 Å²	100.5	57%	0.565	50%	0.501	S	S	*	.			trans	-66.9	148.8	169.7	-63.3	173.8	175.1	0	0	110.7	R241	E238-R241 IonicContact OE1-NH2 3.63Å; E238-R241 IonicContact OE2-CZ 3.63Å; E238-R241 IonicContact OE2-NE 3.88Å; E238-R241 PolarHBondContact OE2-NE 3.36Å; E238-R241 IonicContact OE2-NH2 2.78Å; E238-R241 PolarHBondContact OE2-NH2 3.25Å
239	G	67.1	Low	65.6	Low	48 Å²	48	91.5 Å²	91.5	50%	0.495	47%	0.468	S	S	.	.			trans	-72.3	-176.9	171.6	0	0	0	0	0	113.4	R241	G239-R241 PolarHBondContact O-N 2.9Å; G239-R241 VanDerWaalsContact O-N 3.1Å
240	P	67.1	Low	66.5	Low	32 Å²	32	93.5 Å²	93.5	21%	0.208	48%	0.484	C	S	.	.			trans	-54	115.1	174.6	-26.4	35.9	0	0	0	111.8	A242 L243 I266 L267 I270	P240-A242 PolarHBondContact O-N 3.34Å; P240-L243 HydrophobicContact CB-CB 4.42Å; P240-L243 HydrophobicContact CB-CD1 3.86Å; P240-L243 HydrophobicContact CG-CD1 3.97Å; P240-L243 PolarHBondContact O-N 3.37Å; P240-I266 HydrophobicContact CG-CG2 4.3Å; P240-L267 VanDerWaalsContact CB-O 3.29Å; P240-L267 WeakPolarHBondContact CB-O 3.49Å; P240-I270 WeakPolarHBondContact CG-O 3.34Å
241	R	68.3	Low	67	Low	177 Å²	177	91.7 Å²	91.7	67%	0.668	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.6	-172.4	-72.2	-174.3	173.8	-176.9	-2.3	114.7	E238 G239	E238-R241 IonicContact OE1-NH2 3.63Å; E238-R241 IonicContact OE2-CZ 3.63Å; E238-R241 IonicContact OE2-NE 3.88Å; E238-R241 PolarHBondContact OE2-NE 3.36Å; E238-R241 IonicContact OE2-NH2 2.78Å; E238-R241 PolarHBondContact OE2-NH2 3.25Å; G239-R241 PolarHBondContact O-N 2.9Å; G239-R241 VanDerWaalsContact O-N 3.1Å
242	A	69.1	Low	67.6	Low	39 Å²	39	88.5 Å²	88.5	32%	0.322	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	37.9	-178.8	0	0	0	0	0	111.4	P240 G244 S245 E268 S269	P240-A242 PolarHBondContact O-N 3.34Å; A242-G244 PolarHBondContact O-N 2.82Å; A242-S245 WeakPolarHBondContact CB-OG 3.4Å; A242-S245 WeakPolarHBondContact O-CB 3.3Å; A242-S245 PolarHBondContact O-N 3.47Å; A242-S245 PolarHBondContact O-OG 3.49Å; A242-E268 CarbonylContact C-O 3.23Å; A242-E268 WeakPolarHBondContact CA-O 3.3Å; A242-E268 PolarHBondContact N-O 2.74Å; A242-S269 WeakPolarHBondContact O-CA 3.48Å
243	L	66.3	Low	67.8	Low	107 Å²	107	89.5 Å²	89.5	56%	0.56	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	122.7	-178.6	-163.4	77.2	0	0	0	111.7	P240 S245 T271	P240-L243 HydrophobicContact CB-CB 4.42Å; P240-L243 HydrophobicContact CB-CD1 3.86Å; P240-L243 HydrophobicContact CG-CD1 3.97Å; P240-L243 PolarHBondContact O-N 3.37Å; L243-S245 VanDerWaalsContact C-N 3.3Å; L243-S245 PolarHBondContact O-N 2.84Å; L243-T271 HydrophobicContact CD1-CG2 3.67Å
244	G	64.7	Low	68.4	Low	66 Å²	66	90.3 Å²	90.3	68%	0.68	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	3.6	179.3	0	0	0	0	0	115.8	A242 K246 S269	A242-G244 PolarHBondContact O-N 2.82Å; G244-K246 PolarHBondContact O-N 3.14Å; G244-K246 VanDerWaalsContact O-N 3.16Å; G244-S269 PolarHBondContact N-O 3.02Å
245	S	72.8	Confident	69.4	Low	73 Å²	73	86.7 Å²	86.7	51%	0.51	46%	0.461	S	S	.	.			trans	-69.1	-5	178.8	60.7	0	0	0	0	115.6	A242 L243	A242-S245 WeakPolarHBondContact CB-OG 3.4Å; A242-S245 WeakPolarHBondContact O-CB 3.3Å; A242-S245 PolarHBondContact O-N 3.47Å; A242-S245 PolarHBondContact O-OG 3.49Å; L243-S245 VanDerWaalsContact C-N 3.3Å; L243-S245 PolarHBondContact O-N 2.84Å
246	K	72.2	Confident	70.5	Confident	72 Å²	72	82.1 Å²	82.1	31%	0.313	44%	0.437	S	S	.	.	S	Bend	trans	-138.4	138.6	-173.3	-61	-176.3	-177.7	176.7	0	111	G244 I248 D325 Y328	G244-K246 PolarHBondContact O-N 3.14Å; G244-K246 VanDerWaalsContact O-N 3.16Å; K246-I248 PolarHBondContact O-N 2.85Å; K246-D325 VanDerWaalsContact CD-OD1 3.28Å; K246-D325 WeakPolarHBondContact CD-OD1 3.21Å; K246-D325 WeakPolarHBondContact CE-OD1 3.26Å; K246-D325 IonicContact NZ-OD1 3.69Å; K246-D325 PolarHBondContact NZ-OD1 3.25Å; K246-D325 IonicContact NZ-OD2 2.74Å; K246-D325 PolarHBondContact NZ-OD2 3.03Å; K246-Y328 HydrophobicContact CB-CE2 4.14Å; K246-Y328 HydrophobicContact CD-CE2 4.25Å
247	E	72.8	Confident	71.4	Confident	163 Å²	163	76.8 Å²	76.8	76%	0.762	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-69.1	120.5	176.6	-65.2	-174.4	159.7	0	0	111.8	P249	E247-P249 WeakPolarHBondContact O-CD 3.45Å
248	I	75.2	Confident	72.2	Confident	95 Å²	95	76.4 Å²	76.4	49%	0.487	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-71	119.2	176	-59.7	173.6	0	0	0	108.7	K246 I270 L278	K246-I248 PolarHBondContact O-N 2.85Å; I248-I270 HydrophobicContact CD1-CD1 4.37Å; I248-L278 HydrophobicContact CG2-CD1 3.64Å; I248-L278 HydrophobicContact CG2-CD2 3.94Å; I248-L278 HydrophobicContact CG2-CG 4.42Å
249	P	69.8	Low	73.4	Confident	11 Å²	11	71.6 Å²	71.6	7%	0.071	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-72	140.1	-174.9	29.5	-35.6	0	0	0	112.4	E247 Y328 I331 R332	E247-P249 WeakPolarHBondContact O-CD 3.45Å; P249-Y328 HydrophobicContact CG-CD1 3.85Å; P249-Y328 HydrophobicContact CG-CG 4.1Å; P249-I331 HydrophobicContact CB-CG2 4.38Å; P249-I331 HydrophobicContact CG-CB 4.2Å; P249-I331 HydrophobicContact CG-CD1 4.38Å; P249-I331 HydrophobicContact CG-CG2 4.09Å; P249-R332 HydrophobicContact CB-CG 3.82Å
250	Q	70.1	Confident	74.3	Confident	185 Å²	185	70.1 Å²	70.1	86%	0.864	40%	0.404	S	S	*	.			trans	-90.1	109.9	168.8	-58.4	-173	15.8	0	0	109.5
251	G	69.2	Low	75.4	Confident	17 Å²	17	68.6 Å²	68.6	18%	0.175	40%	0.395	C	S	.	.			trans	-105.6	173.7	169.4	0	0	0	0	0	113.1	H282 S335	G251-H282 PolarHBondContact N-CE1 2.79Å; G251-H282 PolarHBondContact O-CE1 3.03Å; G251-H282 PolarHBondContact O-ND1 3.03Å; G251-S335 WeakPolarHBondContact CA-OG 3.23Å
252	T	74.1	Confident	76.3	Confident	74 Å²	74	60.1 Å²	60.1	45%	0.454	36%	0.363	S	S	.	.			trans	-62.2	150.2	169.9	49.7	0	0	0	0	112	D254 C255 H282 S335	T252-D254 PolarHBondContact O-N 2.86Å; T252-D254 VanDerWaalsContact O-N 3.15Å; T252-C255 PolarHBondContact O-N 3.09Å; T252-C255 WeakPolarHBondContact OG1-CB 3.35Å; T252-H282 PolarHBondContact O-ND1 2.87Å; T252-S335 PolarHBondContact N-OG 3.34Å
253	E	68.2	Low	77.2	Confident	88 Å²	88	58.8 Å²	58.8	41%	0.411	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22	-169.5	-59.9	-167.2	171.4	0	0	114.7	H282 G283 T631	E253-H282 CarbonylContact O-C 3.6Å; E253-H282 WeakPolarHBondContact O-CA 3.38Å; E253-G283 PolarHBondContact O-N 2.69Å; E253-T631 VanDerWaalsContact OE1-CB 3.3Å; E253-T631 WeakPolarHBondContact OE1-CB 3.4Å; E253-T631 WeakPolarHBondContact OE1-CG2 3.23Å; E253-T631 PolarHBondContact OE1-OG1 3.1Å
254	D	75.5	Confident	78	Confident	99 Å²	99	54 Å²	54	53%	0.529	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	12.2	-179.8	-82.8	-51.1	0	0	0	113.9	T252 L256 A257 H282	T252-D254 PolarHBondContact O-N 2.86Å; T252-D254 VanDerWaalsContact O-N 3.15Å; D254-L256 PolarHBondContact O-N 3.2Å; D254-L256 VanDerWaalsContact O-N 3.09Å; D254-A257 HydrophobicContact CB-CB 4.2Å; D254-A257 WeakPolarHBondContact O-CB 3.33Å; D254-A257 PolarHBondContact O-N 2.68Å; D254-H282 CarbonylContact C-O 3.59Å
255	C	82.9	Confident	78.6	Confident	14 Å²	14	51.6 Å²	51.6	10%	0.095	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.2	-169.7	85.7	0	0	0	0	114.4	T252 H282 K334	T252-C255 PolarHBondContact O-N 3.09Å; T252-C255 WeakPolarHBondContact OG1-CB 3.35Å; C255-H282 PolarHBondContact N-O 3.27Å; C255-K334 HydrophobicContact CB-CB 4.02Å; C255-K334 WeakPolarHBondContact O-CB 3.28Å; C255-K334 WeakPolarHBondContact O-CD 3.47Å
256	L	85.2	Confident	78.8	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	10.4	174.1	-52.2	-178	0	0	0	113.4	D254 G258 L259 F261 H282 G284 L327 L330 I331 K334	D254-L256 PolarHBondContact O-N 3.2Å; D254-L256 VanDerWaalsContact O-N 3.09Å; L256-G258 PolarHBondContact O-N 3.42Å; L256-L259 HydrophobicContact CB-CD1 4.38Å; L256-L259 HydrophobicContact CD2-CD1 4.14Å; L256-L259 VanDerWaalsContact O-CB 3.29Å; L256-L259 WeakPolarHBondContact O-CB 3.4Å; L256-L259 PolarHBondContact O-N 3.4Å; L256-F261 HydrophobicContact CB-CE2 4.26Å; L256-F261 HydrophobicContact CD1-CE2 4.07Å; L256-F261 HydrophobicContact CD1-CZ 3.93Å; L256-F261 HydrophobicContact CD2-CZ 4.26Å; L256-F261 HydrophobicContact CG-CZ 4.48Å; L256-H282 CarbonylContact C-O 3.52Å; L256-H282 VanDerWaalsContact CA-O 3.29Å; L256-H282 WeakPolarHBondContact CA-O 3.25Å; L256-H282 HydrophobicContact CB-CB 4.29Å; L256-H282 VanDerWaalsContact CB-O 3.29Å; L256-H282 WeakPolarHBondContact CB-O 3.29Å; L256-H282 HydrophobicContact CD1-CB 4.01Å; L256-H282 HydrophobicContact CG-CB 3.84Å; L256-H282 PolarHBondContact N-O 3.05Å; L256-G284 WeakPolarHBondContact O-CA 3.46Å; L256-L327 HydrophobicContact CD1-CD1 4.38Å; L256-L330 HydrophobicContact CD2-CD2 4.06Å; L256-L330 HydrophobicContact CD2-CG 3.95Å; L256-I331 HydrophobicContact CD1-CG1 4.04Å; L256-I331 HydrophobicContact CD2-CG1 4.35Å; L256-I331 HydrophobicContact CG-CG1 4.4Å; L256-K334 HydrophobicContact CD2-CD 4.46Å
257	A	80.9	Confident	79.3	Confident	49 Å²	49	46.7 Å²	46.7	41%	0.405	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	136.4	-179.2	0	0	0	0	0	112.6	D254 L259	D254-A257 HydrophobicContact CB-CB 4.2Å; D254-A257 WeakPolarHBondContact O-CB 3.33Å; D254-A257 PolarHBondContact O-N 2.68Å; A257-L259 PolarHBondContact O-N 3.49Å
258	G	81.9	Confident	79.5	Confident	75 Å²	75	42.9 Å²	42.9	77%	0.773	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	-13.6	-177.1	0	0	0	0	0	115.7	L256	L256-G258 PolarHBondContact O-N 3.42Å
259	L	88.5	Confident	79.6	Confident	19 Å²	19	38.6 Å²	38.6	10%	0.099	23%	0.233	C	C	.	.			trans	-82.4	138.3	178.5	-60.3	179.5	0	0	0	112.2	L256 A257 F261 R285 N295 Y296 L330 K334	L256-L259 HydrophobicContact CB-CD1 4.38Å; L256-L259 HydrophobicContact CD2-CD1 4.14Å; L256-L259 VanDerWaalsContact O-CB 3.29Å; L256-L259 WeakPolarHBondContact O-CB 3.4Å; L256-L259 PolarHBondContact O-N 3.4Å; A257-L259 PolarHBondContact O-N 3.49Å; L259-F261 HydrophobicContact CB-CD2 4.4Å; L259-F261 HydrophobicContact CB-CE2 3.62Å; L259-F261 HydrophobicContact CB-CZ 4.16Å; L259-F261 HydrophobicContact CD1-CE2 4.37Å; L259-F261 HydrophobicContact CD1-CZ 4.14Å; L259-R285 PolarHBondContact O-N 2.94Å; L259-N295 HydrophobicContact CD2-CB 4.21Å; L259-Y296 HydrophobicContact CB-CE2 4.47Å; L259-Y296 HydrophobicContact CD1-CD2 4.35Å; L259-Y296 HydrophobicContact CD1-CE2 3.63Å; L259-Y296 HydrophobicContact CD2-CE2 3.9Å; L259-Y296 HydrophobicContact CG-CE2 4.21Å; L259-L330 HydrophobicContact CD1-CD2 4.44Å; L259-K334 HydrophobicContact CD1-CD 4.34Å
260	T	86.3	Confident	80.2	Confident	17 Å²	17	38.5 Å²	38.5	10%	0.104	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.9	175.5	-58.4	0	0	0	0	111.7	R285 T287 K293 N295 Y296	T260-R285 CarbonylContact C-O 3.52Å; T260-R285 VanDerWaalsContact CA-O 3.29Å; T260-R285 WeakPolarHBondContact CA-O 3.17Å; T260-T287 HydrophobicContact CG2-CG2 3.76Å; T260-T287 WeakPolarHBondContact CG2-OG1 3.45Å; T260-K293 VanDerWaalsContact CB-O 3.25Å; T260-K293 WeakPolarHBondContact CB-O 3.23Å; T260-K293 PolarHBondContact OG1-O 3.28Å; T260-N295 PolarHBondContact N-OD1 3.06Å; T260-N295 PolarHBondContact O-N 3.29Å; T260-Y296 PolarHBondContact O-N 3.44Å
261	F	90.3	Very high	80.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	153	-179	-62.2	-100.3	0	0	0	111.2	L256 L259 I279 R285 V286 T287 Y296 L298 L322 L327 L330	L256-F261 HydrophobicContact CB-CE2 4.26Å; L256-F261 HydrophobicContact CD1-CE2 4.07Å; L256-F261 HydrophobicContact CD1-CZ 3.93Å; L256-F261 HydrophobicContact CD2-CZ 4.26Å; L256-F261 HydrophobicContact CG-CZ 4.48Å; L259-F261 HydrophobicContact CB-CD2 4.4Å; L259-F261 HydrophobicContact CB-CE2 3.62Å; L259-F261 HydrophobicContact CB-CZ 4.16Å; L259-F261 HydrophobicContact CD1-CE2 4.37Å; L259-F261 HydrophobicContact CD1-CZ 4.14Å; F261-I279 HydrophobicContact CB-CD1 4.08Å; F261-I279 HydrophobicContact CB-CG2 4.36Å; F261-I279 HydrophobicContact CD1-CD1 4.29Å; F261-I279 HydrophobicContact CD2-CG2 3.41Å; F261-I279 VanDerWaalsContact CD2-CG2 3.41Å; F261-I279 HydrophobicContact CE2-CG2 3.84Å; F261-I279 HydrophobicContact CG-CD1 4.09Å; F261-I279 HydrophobicContact CG-CG1 4.44Å; F261-I279 HydrophobicContact CG-CG2 3.98Å; F261-R285 PolarHBondContact N-O 3.31Å; F261-V286 CarbonylContact O-C 3.35Å; F261-V286 WeakPolarHBondContact O-CA 3.46Å; F261-T287 PolarHBondContact O-N 3.02Å; F261-T287 PolarHBondContact O-OG1 2.91Å; F261-T287 VanDerWaalsContact O-OG1 3.13Å; F261-Y296 WeakPolarHBondContact CA-O 3.47Å; F261-Y296 HydrophobicContact CD1-CD2 4.22Å; F261-Y296 HydrophobicContact CD1-CG 4.24Å; F261-Y296 AromaticContact CE1-CD2 3.68Å; F261-Y296 HydrophobicContact CE1-CD2 3.68Å; F261-Y296 AromaticContact CE1-CG 3.91Å; F261-Y296 HydrophobicContact CE1-CG 3.91Å; F261-Y296 AromaticContact CZ-CD2 3.86Å; F261-Y296 HydrophobicContact CZ-CD2 3.86Å; F261-Y296 HydrophobicContact CZ-CE2 4.42Å; F261-L298 HydrophobicContact CB-CD1 4.45Å; F261-L298 HydrophobicContact CD1-CD1 3.95Å; F261-L322 HydrophobicContact CD1-CD1 4.49Å; F261-L322 HydrophobicContact CE1-CD1 4Å; F261-L327 HydrophobicContact CE1-CD1 4.03Å; F261-L327 HydrophobicContact CZ-CD1 4.49Å; F261-L330 HydrophobicContact CE1-CD2 3.9Å; F261-L330 HydrophobicContact CZ-CD2 3.83Å
262	V	87.5	Confident	81.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.7	166	174.6	0	0	0	0	108.3	T287 V290 T294 Y296 L297 L298	V262-T287 VanDerWaalsContact CG2-OG1 3.27Å; V262-T287 WeakPolarHBondContact CG2-OG1 3.19Å; V262-V290 HydrophobicContact CB-CG2 4.32Å; V262-V290 HydrophobicContact CG1-CG2 4.04Å; V262-V290 HydrophobicContact CG2-CG2 4.19Å; V262-T294 HydrophobicContact CB-CG2 4.37Å; V262-T294 HydrophobicContact CG2-CG2 3.71Å; V262-Y296 PolarHBondContact N-O 2.93Å; V262-Y296 VanDerWaalsContact N-O 3.08Å; V262-L297 HydrophobicContact CB-CD1 3.98Å; V262-L297 HydrophobicContact CG1-CD1 3.94Å; V262-L298 PolarHBondContact O-N 3.09Å
263	I	86.6	Confident	81.5	Confident	11 Å²	11	36.3 Å²	36.3	6%	0.056	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138.2	174.4	-50.9	173.9	0	0	0	109.5	L267 R272 A275 K276 I279 V286 L298 K307	I263-L267 HydrophobicContact CG2-CD1 4.35Å; I263-L267 HydrophobicContact CG2-CG 4.5Å; I263-R272 HydrophobicContact CG2-CG 4.12Å; I263-A275 HydrophobicContact CD1-CB 4.21Å; I263-K276 HydrophobicContact CD1-CB 4.16Å; I263-I279 HydrophobicContact CD1-CD1 4.4Å; I263-V286 HydrophobicContact CD1-CG1 4.35Å; I263-V286 HydrophobicContact CG1-CG1 4.39Å; I263-L298 HydrophobicContact CB-CB 4.46Å; I263-L298 HydrophobicContact CG1-CB 4.2Å; I263-L298 HydrophobicContact CG1-CD1 4.15Å; I263-L298 HydrophobicContact CG2-CB 4.42Å; I263-K307 PolarHBondContact O-NZ 2.94Å
264	S	82.5	Confident	82.2	Confident	5 Å²	5	35 Å²	35	4%	0.035	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	102.3	-175.1	-175.9	0	0	0	0	112.4	L298 G300 K307	S264-L298 PolarHBondContact N-O 3.2Å; S264-G300 PolarHBondContact O-N 3.49Å; S264-K307 WeakPolarHBondContact OG-CB 3.22Å; S264-K307 WeakPolarHBondContact OG-CD 3.41Å
265	G	77.8	Confident	82.7	Confident	17 Å²	17	30.3 Å²	30.3	18%	0.175	18%	0.182	C	C	.	.	S	Bend	trans	110.4	-170.9	-176.1	0	0	0	0	0	111.8	R301	G265-R301 CarbonylContact C-O 3.58Å; G265-R301 WeakPolarHBondContact CA-O 3.44Å
266	I	78.3	Confident	82.8	Confident	38 Å²	38	33.4 Å²	33.4	20%	0.195	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-102.2	119.8	176.8	-64.2	154.4	0	0	0	107.5	R237 P240 G300 R301	R237-I266 HydrophobicContact CB-CD1 3.85Å; R237-I266 HydrophobicContact CG-CD1 4.4Å; P240-I266 HydrophobicContact CG-CG2 4.3Å; I266-G300 CarbonylContact O-C 3.57Å; I266-G300 WeakPolarHBondContact O-CA 3.36Å; I266-R301 PolarHBondContact N-O 3.38Å; I266-R301 PolarHBondContact O-N 2.66Å
267	L	82	Confident	82.6	Confident	3 Å²	3	34 Å²	34	2%	0.016	20%	0.198	C	C	.	.			trans	-74.8	160.2	177.3	-59.2	-177.6	0	0	0	109.9	P240 I263 I270 A275 L298 D324	P240-L267 VanDerWaalsContact CB-O 3.29Å; P240-L267 WeakPolarHBondContact CB-O 3.49Å; I263-L267 HydrophobicContact CG2-CD1 4.35Å; I263-L267 HydrophobicContact CG2-CG 4.5Å; L267-I270 HydrophobicContact CB-CG2 4.06Å; L267-I270 WeakPolarHBondContact CB-O 3.31Å; L267-I270 HydrophobicContact CD1-CG2 3.89Å; L267-A275 HydrophobicContact CD1-CB 3.45Å; L267-A275 VanDerWaalsContact CD1-CB 3.45Å; L267-L298 HydrophobicContact CD2-CD2 4.49Å; L267-D324 WeakPolarHBondContact CB-OD1 3.4Å; L267-D324 WeakPolarHBondContact CD2-OD1 3.42Å
268	E	77.1	Confident	82.7	Confident	83 Å²	83	32.2 Å²	32.2	39%	0.388	18%	0.182	S	C	.	.	S	Bend	trans	-91	-40.1	-168.3	-59.7	-162	171	0	0	113.2	A242 R301 D324	A242-E268 CarbonylContact C-O 3.23Å; A242-E268 WeakPolarHBondContact CA-O 3.3Å; A242-E268 PolarHBondContact N-O 2.74Å; E268-R301 VanDerWaalsContact CD-NH2 3.25Å; E268-R301 IonicContact OE1-CZ 3.27Å; E268-R301 IonicContact OE1-NE 3.49Å; E268-R301 PolarHBondContact OE1-NE 3.43Å; E268-R301 IonicContact OE1-NH2 2.66Å; E268-R301 PolarHBondContact OE1-NH2 3.31Å; E268-R301 IonicContact OE2-NH2 3.54Å; E268-R301 PolarHBondContact OE2-NH2 3.5Å; E268-D324 PolarHBondContact N-OD2 3.29Å; E268-D324 VanDerWaalsContact N-OD2 3.08Å
269	S	77.3	Confident	83	Confident	6 Å²	6	28.6 Å²	28.6	4%	0.042	15%	0.145	C	C	.	.	S	Bend	trans	-104.3	-17.2	-171.5	66	0	0	0	0	114.7	A242 G244 D324 Y328	A242-S269 WeakPolarHBondContact O-CA 3.48Å; G244-S269 PolarHBondContact N-O 3.02Å; S269-D324 WeakPolarHBondContact CB-OD2 3.44Å; S269-D324 PolarHBondContact N-OD2 2.95Å; S269-D324 PolarHBondContact OG-OD2 2.95Å; S269-Y328 PolarHBondContact OG-OH 2.82Å; S269-Y328 VanDerWaalsContact OG-OH 3.11Å
270	I	81.8	Confident	82.7	Confident	8 Å²	8	29.3 Å²	29.3	4%	0.041	15%	0.149	C	C	.	.	S	Bend	trans	-141.5	149.2	-167.5	-171.4	165.4	0	0	0	110.3	P240 I248 L267 D274 A275 L278	P240-I270 WeakPolarHBondContact CG-O 3.34Å; I248-I270 HydrophobicContact CD1-CD1 4.37Å; L267-I270 HydrophobicContact CB-CG2 4.06Å; L267-I270 WeakPolarHBondContact CB-O 3.31Å; L267-I270 HydrophobicContact CD1-CG2 3.89Å; I270-D274 HydrophobicContact CD1-CB 4.02Å; I270-D274 HydrophobicContact CG1-CB 3.65Å; I270-A275 HydrophobicContact CD1-CB 4.28Å; I270-A275 HydrophobicContact CG1-CB 4.39Å; I270-A275 HydrophobicContact CG2-CB 4.08Å; I270-L278 HydrophobicContact CD1-CD2 4.33Å
271	T	81.8	Confident	82.5	Confident	22 Å²	22	31.1 Å²	31.1	14%	0.135	16%	0.155	C	C	.	.			trans	-70.7	159.5	173.7	82.2	0	0	0	0	111.1	L243 D273 D274 A275	L243-T271 HydrophobicContact CD1-CG2 3.67Å; T271-D273 VanDerWaalsContact C-N 3.26Å; T271-D273 PolarHBondContact O-N 2.94Å; T271-D273 PolarHBondContact OG1-N 3.46Å; T271-D274 WeakPolarHBondContact CB-OD2 3.49Å; T271-D274 WeakPolarHBondContact CG2-OD2 3.12Å; T271-D274 PolarHBondContact O-N 3.41Å; T271-D274 WeakPolarHBondContact OG1-CB 3.47Å; T271-D274 VanDerWaalsContact OG1-CG 3.23Å; T271-D274 PolarHBondContact OG1-N 3.01Å; T271-D274 PolarHBondContact OG1-OD2 3.17Å; T271-A275 WeakPolarHBondContact O-CB 3.43Å; T271-A275 PolarHBondContact O-N 2.98Å
272	R	80.7	Confident	82.2	Confident	116 Å²	116	31.2 Å²	31.2	44%	0.438	16%	0.156	S	C	.	.	H	α-helix	trans	-62.1	-33.2	175.6	173.8	171.3	164.4	-150	-12	112.9	I263 K276	I263-R272 HydrophobicContact CG2-CG 4.12Å; R272-K276 WeakPolarHBondContact O-CB 3.39Å; R272-K276 PolarHBondContact O-N 3.2Å; R272-K276 VanDerWaalsContact O-N 3.14Å
273	D	78.9	Confident	81.8	Confident	92 Å²	92	31.5 Å²	31.5	49%	0.492	16%	0.158	S	C	.	.	H	α-helix	trans	-84.4	-28.4	179.1	-79.3	-55.3	0	0	0	112.8	T271 K276 A277	T271-D273 VanDerWaalsContact C-N 3.26Å; T271-D273 PolarHBondContact O-N 2.94Å; T271-D273 PolarHBondContact OG1-N 3.46Å; D273-K276 WeakPolarHBondContact O-CB 3.34Å; D273-K276 PolarHBondContact O-N 3.47Å; D273-K276 WeakPolarHBondContact OD1-CD 3.22Å; D273-A277 WeakPolarHBondContact O-CB 3.09Å; D273-A277 PolarHBondContact O-N 2.75Å
274	D	83	Confident	81.7	Confident	62 Å²	62	31 Å²	31	33%	0.332	16%	0.156	S	C	.	.	H	α-helix	trans	-72.4	-38.9	170.1	-65.1	-52.3	0	0	0	111.8	I270 T271 K276 A277 L278	I270-D274 HydrophobicContact CD1-CB 4.02Å; I270-D274 HydrophobicContact CG1-CB 3.65Å; T271-D274 WeakPolarHBondContact CB-OD2 3.49Å; T271-D274 WeakPolarHBondContact CG2-OD2 3.12Å; T271-D274 PolarHBondContact O-N 3.41Å; T271-D274 WeakPolarHBondContact OG1-CB 3.47Å; T271-D274 VanDerWaalsContact OG1-CG 3.23Å; T271-D274 PolarHBondContact OG1-N 3.01Å; T271-D274 PolarHBondContact OG1-OD2 3.17Å; D274-K276 VanDerWaalsContact C-N 3.32Å; D274-K276 PolarHBondContact O-N 3.12Å; D274-A277 PolarHBondContact O-N 3.17Å; D274-L278 WeakPolarHBondContact O-CB 3.18Å; D274-L278 PolarHBondContact O-N 3.24Å
275	A	85	Confident	81.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-40.1	170.7	0	0	0	0	0	111.5	I263 L267 I270 T271 L278 I279	I263-A275 HydrophobicContact CD1-CB 4.21Å; L267-A275 HydrophobicContact CD1-CB 3.45Å; L267-A275 VanDerWaalsContact CD1-CB 3.45Å; I270-A275 HydrophobicContact CD1-CB 4.28Å; I270-A275 HydrophobicContact CG1-CB 4.39Å; I270-A275 HydrophobicContact CG2-CB 4.08Å; T271-A275 WeakPolarHBondContact O-CB 3.43Å; T271-A275 PolarHBondContact O-N 2.98Å; A275-L278 PolarHBondContact O-N 3.41Å; A275-I279 VanDerWaalsContact O-CD1 3.29Å; A275-I279 WeakPolarHBondContact O-CD1 3.33Å; A275-I279 WeakPolarHBondContact O-CG1 3.3Å; A275-I279 PolarHBondContact O-N 3.26Å
276	K	84.9	Confident	82.2	Confident	78 Å²	78	39.9 Å²	39.9	34%	0.339	19%	0.188	S	C	.	.	H	α-helix	trans	-61.3	-44.3	171.5	174.6	-158.4	166.9	-154.7	0	111.2	I263 R272 D273 D274 I279 L280 V286	I263-K276 HydrophobicContact CD1-CB 4.16Å; R272-K276 WeakPolarHBondContact O-CB 3.39Å; R272-K276 PolarHBondContact O-N 3.2Å; R272-K276 VanDerWaalsContact O-N 3.14Å; D273-K276 WeakPolarHBondContact O-CB 3.34Å; D273-K276 PolarHBondContact O-N 3.47Å; D273-K276 WeakPolarHBondContact OD1-CD 3.22Å; D274-K276 VanDerWaalsContact C-N 3.32Å; D274-K276 PolarHBondContact O-N 3.12Å; K276-I279 PolarHBondContact O-N 3.33Å; K276-L280 HydrophobicContact CG-CD1 3.99Å; K276-L280 VanDerWaalsContact O-CG 3.29Å; K276-L280 WeakPolarHBondContact O-CG 3.34Å; K276-L280 PolarHBondContact O-N 3.33Å; K276-L280 VanDerWaalsContact O-N 3.08Å; K276-V286 HydrophobicContact CB-CG2 4.45Å; K276-V286 HydrophobicContact CG-CB 4.31Å; K276-V286 HydrophobicContact CG-CG1 4.39Å; K276-V286 HydrophobicContact CG-CG2 4.1Å
277	A	80.9	Confident	82.5	Confident	12 Å²	12	39.8 Å²	39.8	10%	0.099	19%	0.189	C	C	.	.	H	α-helix	trans	-65.1	-42.4	178.5	0	0	0	0	0	112.1	D273 D274 I279 L280 K281	D273-A277 WeakPolarHBondContact O-CB 3.09Å; D273-A277 PolarHBondContact O-N 2.75Å; D274-A277 PolarHBondContact O-N 3.17Å; A277-I279 PolarHBondContact O-N 3.15Å; A277-L280 PolarHBondContact O-N 3.18Å; A277-K281 VanDerWaalsContact O-CB 3.27Å; A277-K281 WeakPolarHBondContact O-CB 3.44Å; A277-K281 PolarHBondContact O-N 2.7Å
278	L	84.8	Confident	82.5	Confident	12 Å²	12	45.5 Å²	45.5	6%	0.063	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-43.2	176.6	-175.7	64.4	0	0	0	111.8	I248 I270 D274 A275 K281 H282 L327 Y328 I331	I248-L278 HydrophobicContact CG2-CD1 3.64Å; I248-L278 HydrophobicContact CG2-CD2 3.94Å; I248-L278 HydrophobicContact CG2-CG 4.42Å; I270-L278 HydrophobicContact CD1-CD2 4.33Å; D274-L278 WeakPolarHBondContact O-CB 3.18Å; D274-L278 PolarHBondContact O-N 3.24Å; A275-L278 PolarHBondContact O-N 3.41Å; L278-K281 PolarHBondContact O-N 3.12Å; L278-H282 PolarHBondContact O-CD2 3.02Å; L278-H282 VanDerWaalsContact O-CD2 3.24Å; L278-H282 PolarHBondContact O-N 3.11Å; L278-L327 HydrophobicContact CD2-CD2 4.44Å; L278-Y328 HydrophobicContact CD2-CD1 4.06Å; L278-Y328 HydrophobicContact CD2-CE1 3.76Å; L278-I331 HydrophobicContact CD1-CD1 4.16Å; L278-I331 HydrophobicContact CD2-CD1 3.68Å; L278-I331 HydrophobicContact CG-CD1 3.69Å
279	I	86.5	Confident	82.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-43.6	175.7	-67.2	159.8	0	0	0	111.1	F261 I263 A275 K276 A277 H282 G284 V286 L298 L327	F261-I279 HydrophobicContact CB-CD1 4.08Å; F261-I279 HydrophobicContact CB-CG2 4.36Å; F261-I279 HydrophobicContact CD1-CD1 4.29Å; F261-I279 HydrophobicContact CD2-CG2 3.41Å; F261-I279 VanDerWaalsContact CD2-CG2 3.41Å; F261-I279 HydrophobicContact CE2-CG2 3.84Å; F261-I279 HydrophobicContact CG-CD1 4.09Å; F261-I279 HydrophobicContact CG-CG1 4.44Å; F261-I279 HydrophobicContact CG-CG2 3.98Å; I263-I279 HydrophobicContact CD1-CD1 4.4Å; A275-I279 VanDerWaalsContact O-CD1 3.29Å; A275-I279 WeakPolarHBondContact O-CD1 3.33Å; A275-I279 WeakPolarHBondContact O-CG1 3.3Å; A275-I279 PolarHBondContact O-N 3.26Å; K276-I279 PolarHBondContact O-N 3.33Å; A277-I279 PolarHBondContact O-N 3.15Å; I279-H282 PolarHBondContact O-N 3.11Å; I279-G284 VanDerWaalsContact O-CA 3.28Å; I279-G284 WeakPolarHBondContact O-CA 3.49Å; I279-G284 PolarHBondContact O-N 2.93Å; I279-V286 HydrophobicContact CB-CG2 3.88Å; I279-V286 HydrophobicContact CD1-CG2 4.01Å; I279-V286 HydrophobicContact CG2-CG2 3.63Å; I279-L298 HydrophobicContact CD1-CD1 3.48Å; I279-L298 VanDerWaalsContact CD1-CD1 3.48Å; I279-L327 HydrophobicContact CD1-CD2 4.27Å; I279-L327 HydrophobicContact CG1-CD1 4.02Å; I279-L327 HydrophobicContact CG1-CD2 4.1Å
280	L	83.1	Confident	82.6	Confident	33 Å²	33	46.3 Å²	46.3	17%	0.173	24%	0.241	C	C	.	.	H	α-helix	trans	-67.9	-39	178.9	-72.6	166.4	0	0	0	112.5	K276 A277 H282 G283 F632	K276-L280 HydrophobicContact CG-CD1 3.99Å; K276-L280 VanDerWaalsContact O-CG 3.29Å; K276-L280 WeakPolarHBondContact O-CG 3.34Å; K276-L280 PolarHBondContact O-N 3.33Å; K276-L280 VanDerWaalsContact O-N 3.08Å; A277-L280 PolarHBondContact O-N 3.18Å; L280-H282 PolarHBondContact O-N 3.27Å; L280-G283 PolarHBondContact O-N 2.9Å; L280-F632 HydrophobicContact CB-CE2 3.85Å; L280-F632 HydrophobicContact CB-CZ 3.73Å
281	K	81.3	Confident	82.3	Confident	56 Å²	56	49.2 Å²	49.2	24%	0.243	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-33.8	176.9	173.6	175	172.3	168.3	0	112.8	A277 L278 F632 D633	A277-K281 VanDerWaalsContact O-CB 3.27Å; A277-K281 WeakPolarHBondContact O-CB 3.44Å; A277-K281 PolarHBondContact O-N 2.7Å; L278-K281 PolarHBondContact O-N 3.12Å; K281-F632 HydrophobicContact CB-CD1 3.66Å; K281-F632 HydrophobicContact CB-CE1 3.88Å; K281-F632 HydrophobicContact CB-CG 4.15Å; K281-F632 HydrophobicContact CG-CB 4.46Å; K281-F632 HydrophobicContact CG-CD1 4.05Å; K281-F632 HydrophobicContact CG-CG 4.46Å; K281-D633 VanDerWaalsContact CE-OD2 3.31Å; K281-D633 WeakPolarHBondContact CE-OD2 3.47Å; K281-D633 IonicContact NZ-OD1 2.71Å; K281-D633 IonicContact NZ-OD2 2.75Å; K281-D633 PolarHBondContact NZ-OD2 2.75Å
282	H	84.4	Confident	82	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	22.2	176.7	-64.7	-59.6	0	0	0	113.3	G251 T252 E253 D254 C255 L256 L278 I279 L280 G284	G251-H282 PolarHBondContact N-CE1 2.79Å; G251-H282 PolarHBondContact O-CE1 3.03Å; G251-H282 PolarHBondContact O-ND1 3.03Å; T252-H282 PolarHBondContact O-ND1 2.87Å; E253-H282 CarbonylContact O-C 3.6Å; E253-H282 WeakPolarHBondContact O-CA 3.38Å; D254-H282 CarbonylContact C-O 3.59Å; C255-H282 PolarHBondContact N-O 3.27Å; L256-H282 CarbonylContact C-O 3.52Å; L256-H282 VanDerWaalsContact CA-O 3.29Å; L256-H282 WeakPolarHBondContact CA-O 3.25Å; L256-H282 HydrophobicContact CB-CB 4.29Å; L256-H282 VanDerWaalsContact CB-O 3.29Å; L256-H282 WeakPolarHBondContact CB-O 3.29Å; L256-H282 HydrophobicContact CD1-CB 4.01Å; L256-H282 HydrophobicContact CG-CB 3.84Å; L256-H282 PolarHBondContact N-O 3.05Å; L278-H282 PolarHBondContact O-CD2 3.02Å; L278-H282 VanDerWaalsContact O-CD2 3.24Å; L278-H282 PolarHBondContact O-N 3.11Å; I279-H282 PolarHBondContact O-N 3.11Å; L280-H282 PolarHBondContact O-N 3.27Å; H282-G284 VanDerWaalsContact C-N 3.27Å; H282-G284 PolarHBondContact O-N 3.46Å
283	G	79.2	Confident	81.9	Confident	6 Å²	6	59 Å²	59	6%	0.062	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	-1.2	174.2	0	0	0	0	0	115.5	E253 L280 Q600	E253-G283 PolarHBondContact O-N 2.69Å; L280-G283 PolarHBondContact O-N 2.9Å; G283-Q600 PolarHBondContact O-NE2 2.78Å
284	G	84.3	Confident	82.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.288	C	S	.	.			trans	-73.3	159.2	177.6	0	0	0	0	0	113.3	L256 I279 H282	L256-G284 WeakPolarHBondContact O-CA 3.46Å; I279-G284 VanDerWaalsContact O-CA 3.28Å; I279-G284 WeakPolarHBondContact O-CA 3.49Å; I279-G284 PolarHBondContact O-N 2.93Å; H282-G284 VanDerWaalsContact C-N 3.27Å; H282-G284 PolarHBondContact O-N 3.46Å
285	R	83.9	Confident	82.3	Confident	168 Å²	168	55.2 Å²	55.2	63%	0.634	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.9	-179.4	-176.8	-178	-173.4	160.6	6.2	111.5	L259 T260 F261	L259-R285 PolarHBondContact O-N 2.94Å; T260-R285 CarbonylContact C-O 3.52Å; T260-R285 VanDerWaalsContact CA-O 3.29Å; T260-R285 WeakPolarHBondContact CA-O 3.17Å; F261-R285 PolarHBondContact N-O 3.31Å
286	V	87.5	Confident	82.5	Confident	41 Å²	41	57.3 Å²	57.3	25%	0.248	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.7	173.5	-174.1	0	0	0	0	111.2	F261 I263 K276 I279	F261-V286 CarbonylContact O-C 3.35Å; F261-V286 WeakPolarHBondContact O-CA 3.46Å; I263-V286 HydrophobicContact CD1-CG1 4.35Å; I263-V286 HydrophobicContact CG1-CG1 4.39Å; K276-V286 HydrophobicContact CB-CG2 4.45Å; K276-V286 HydrophobicContact CG-CB 4.31Å; K276-V286 HydrophobicContact CG-CG1 4.39Å; K276-V286 HydrophobicContact CG-CG2 4.1Å; I279-V286 HydrophobicContact CB-CG2 3.88Å; I279-V286 HydrophobicContact CD1-CG2 4.01Å; I279-V286 HydrophobicContact CG2-CG2 3.63Å
287	T	84.5	Confident	82.5	Confident	37 Å²	37	53.9 Å²	53.9	23%	0.227	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.5	176.6	50.3	0	0	0	0	111.9	T260 F261 V262	T260-T287 HydrophobicContact CG2-CG2 3.76Å; T260-T287 WeakPolarHBondContact CG2-OG1 3.45Å; F261-T287 PolarHBondContact O-N 3.02Å; F261-T287 PolarHBondContact O-OG1 2.91Å; F261-T287 VanDerWaalsContact O-OG1 3.13Å; V262-T287 VanDerWaalsContact CG2-OG1 3.27Å; V262-T287 WeakPolarHBondContact CG2-OG1 3.19Å
288	T	81.1	Confident	82.8	Confident	122 Å²	122	53.3 Å²	53.3	75%	0.748	28%	0.277	S	S	*	.	S	Bend	trans	-79	-29.7	-174.9	50.2	0	0	0	0	113.5	K307	T288-K307 VanDerWaalsContact O-CE 3.27Å; T288-K307 WeakPolarHBondContact O-CE 3.29Å; T288-K307 PolarHBondContact O-NZ 3.08Å
289	A	77.9	Confident	82.7	Confident	63 Å²	63	55.1 Å²	55.1	52%	0.521	29%	0.287	S	S	.	.	S	Bend	trans	-124.7	146.4	-179.9	0	0	0	0	0	111
290	V	78.2	Confident	82.4	Confident	44 Å²	44	55.8 Å²	55.8	27%	0.267	29%	0.294	S	S	.	.			trans	-72.7	139.4	176.8	-162.3	0	0	0	0	110.5	V262 T294 L297 L314 L319	V262-V290 HydrophobicContact CB-CG2 4.32Å; V262-V290 HydrophobicContact CG1-CG2 4.04Å; V262-V290 HydrophobicContact CG2-CG2 4.19Å; V290-T294 HydrophobicContact CG1-CG2 4.16Å; V290-L297 HydrophobicContact CG2-CD1 4.29Å; V290-L314 HydrophobicContact CB-CD1 4.41Å; V290-L314 HydrophobicContact CB-CD2 4.25Å; V290-L314 HydrophobicContact CG1-CD1 4.32Å; V290-L314 HydrophobicContact CG1-CD2 3.76Å; V290-L314 HydrophobicContact CG2-CD1 3.97Å; V290-L319 HydrophobicContact CG1-CD1 3.69Å
291	S	76.3	Confident	82.1	Confident	69 Å²	69	60 Å²	60	48%	0.483	31%	0.307	S	S	.	.			trans	-139.5	167.2	180	-171.8	0	0	0	0	110	K293 T294	S291-K293 PolarHBondContact O-N 2.92Å; S291-T294 PolarHBondContact N-OG1 3.32Å; S291-T294 WeakPolarHBondContact O-CB 3.24Å; S291-T294 PolarHBondContact O-N 2.95Å; S291-T294 PolarHBondContact O-OG1 3.11Å
292	H	75.8	Confident	81.5	Confident	171 Å²	171	62 Å²	62	79%	0.792	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-4.9	170.1	-58.8	-76.2	0	0	0	114
293	K	79.3	Confident	80.6	Confident	171 Å²	171	62.7 Å²	62.7	74%	0.743	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	2.6	172.6	-61.3	-168.7	176.4	-168	0	113.7	T260 S291	T260-K293 VanDerWaalsContact CB-O 3.25Å; T260-K293 WeakPolarHBondContact CB-O 3.23Å; T260-K293 PolarHBondContact OG1-O 3.28Å; S291-K293 PolarHBondContact O-N 2.92Å
294	T	82.9	Confident	79.8	Confident	12 Å²	12	64 Å²	64	7%	0.074	34%	0.341	C	S	.	.			trans	-76.8	136.8	170.5	-56.2	0	0	0	0	108.4	V262 V290 S291 Y296 L319	V262-T294 HydrophobicContact CB-CG2 4.37Å; V262-T294 HydrophobicContact CG2-CG2 3.71Å; V290-T294 HydrophobicContact CG1-CG2 4.16Å; S291-T294 PolarHBondContact N-OG1 3.32Å; S291-T294 WeakPolarHBondContact O-CB 3.24Å; S291-T294 PolarHBondContact O-N 2.95Å; S291-T294 PolarHBondContact O-OG1 3.11Å; T294-Y296 VanDerWaalsContact CG2-O 3.28Å; T294-Y296 WeakPolarHBondContact CG2-O 3.45Å; T294-L319 HydrophobicContact CG2-CD2 3.85Å; T294-L319 WeakPolarHBondContact O-CD2 3.14Å
295	N	86.6	Confident	78.8	Confident	63 Å²	63	70.8 Å²	70.8	34%	0.337	37%	0.372	S	S	.	.			trans	-100.5	-35	175.5	-60.2	96.8	0	0	0	112	L259 T260 P320	L259-N295 HydrophobicContact CD2-CB 4.21Å; T260-N295 PolarHBondContact N-OD1 3.06Å; T260-N295 PolarHBondContact O-N 3.29Å; N295-P320 VanDerWaalsContact O-CD 3.31Å; N295-P320 WeakPolarHBondContact O-CD 3.38Å; N295-P320 VanDerWaalsContact O-CG 3.28Å; N295-P320 WeakPolarHBondContact O-CG 3.23Å
296	Y	88.4	Confident	77.5	Confident	45 Å²	45	67 Å²	67	18%	0.176	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	145.5	-175.1	-62.1	-81.7	0	0	0	112.2	L259 T260 F261 V262 T294 P320 L322 L330	L259-Y296 HydrophobicContact CB-CE2 4.47Å; L259-Y296 HydrophobicContact CD1-CD2 4.35Å; L259-Y296 HydrophobicContact CD1-CE2 3.63Å; L259-Y296 HydrophobicContact CD2-CE2 3.9Å; L259-Y296 HydrophobicContact CG-CE2 4.21Å; T260-Y296 PolarHBondContact O-N 3.44Å; F261-Y296 WeakPolarHBondContact CA-O 3.47Å; F261-Y296 HydrophobicContact CD1-CD2 4.22Å; F261-Y296 HydrophobicContact CD1-CG 4.24Å; F261-Y296 AromaticContact CE1-CD2 3.68Å; F261-Y296 HydrophobicContact CE1-CD2 3.68Å; F261-Y296 AromaticContact CE1-CG 3.91Å; F261-Y296 HydrophobicContact CE1-CG 3.91Å; F261-Y296 AromaticContact CZ-CD2 3.86Å; F261-Y296 HydrophobicContact CZ-CD2 3.86Å; F261-Y296 HydrophobicContact CZ-CE2 4.42Å; V262-Y296 PolarHBondContact N-O 2.93Å; V262-Y296 VanDerWaalsContact N-O 3.08Å; T294-Y296 VanDerWaalsContact CG2-O 3.28Å; T294-Y296 WeakPolarHBondContact CG2-O 3.45Å; Y296-P320 WeakPolarHBondContact CA-O 3.27Å; Y296-P320 HydrophobicContact CD1-CB 4.05Å; Y296-P320 HydrophobicContact CD1-CG 3.53Å; Y296-P320 HydrophobicContact CE1-CB 4.22Å; Y296-P320 HydrophobicContact CE1-CG 3.64Å; Y296-P320 HydrophobicContact CG-CG 4.44Å; Y296-L322 HydrophobicContact CD1-CD1 3.61Å; Y296-L322 HydrophobicContact CD1-CD2 3.87Å; Y296-L322 HydrophobicContact CD1-CG 3.77Å; Y296-L322 HydrophobicContact CE1-CD1 4.33Å; Y296-L322 HydrophobicContact CE1-CD2 4.26Å; Y296-L322 HydrophobicContact CG-CD1 3.83Å; Y296-L322 HydrophobicContact CG-CG 4.32Å; Y296-L330 HydrophobicContact CD2-CD2 4.3Å; Y296-L330 HydrophobicContact CE1-CD2 4.28Å; Y296-L330 HydrophobicContact CE2-CD2 3.96Å
297	L	86.2	Confident	76.1	Confident	5 Å²	5	67.6 Å²	67.6	3%	0.026	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	110.8	172.6	178.2	65.4	0	0	0	109.8	V262 V290 L299 V311 L314 P320 V321 L322	V262-L297 HydrophobicContact CB-CD1 3.98Å; V262-L297 HydrophobicContact CG1-CD1 3.94Å; V290-L297 HydrophobicContact CG2-CD1 4.29Å; L297-L299 PolarHBondContact O-N 3.1Å; L297-V311 HydrophobicContact CD2-CG2 4.43Å; L297-L314 HydrophobicContact CD2-CD1 4.23Å; L297-P320 PolarHBondContact N-O 2.97Å; L297-V321 HydrophobicContact CD2-CG2 4.39Å; L297-V321 CarbonylContact O-C 3.59Å; L297-V321 VanDerWaalsContact O-CA 3.31Å; L297-V321 WeakPolarHBondContact O-CA 3.44Å; L297-L322 PolarHBondContact O-N 3.43Å
298	L	86.7	Confident	74.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	116.2	168.7	-87.1	141.6	0	0	0	109.4	F261 V262 I263 S264 L267 I279 L322 L327	F261-L298 HydrophobicContact CB-CD1 4.45Å; F261-L298 HydrophobicContact CD1-CD1 3.95Å; V262-L298 PolarHBondContact O-N 3.09Å; I263-L298 HydrophobicContact CB-CB 4.46Å; I263-L298 HydrophobicContact CG1-CB 4.2Å; I263-L298 HydrophobicContact CG1-CD1 4.15Å; I263-L298 HydrophobicContact CG2-CB 4.42Å; S264-L298 PolarHBondContact N-O 3.2Å; L267-L298 HydrophobicContact CD2-CD2 4.49Å; I279-L298 HydrophobicContact CD1-CD1 3.48Å; I279-L298 VanDerWaalsContact CD1-CD1 3.48Å; L298-L322 WeakPolarHBondContact CA-O 3.33Å; L298-L322 HydrophobicContact CD2-CB 4.4Å; L298-L322 HydrophobicContact CG-CB 4.38Å; L298-L327 HydrophobicContact CD1-CD2 4.15Å; L298-L327 HydrophobicContact CD2-CB 4.13Å; L298-L327 HydrophobicContact CD2-CD2 4.1Å
299	L	83.5	Confident	73.5	Confident	50 Å²	50	65.8 Å²	65.8	26%	0.262	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123	-177	-170.9	70	0	0	0	110	L297 A303 V321 L322	L297-L299 PolarHBondContact O-N 3.1Å; L299-A303 HydrophobicContact CD1-CB 3.57Å; L299-V321 HydrophobicContact CB-CG1 3.55Å; L299-V321 HydrophobicContact CD2-CG1 3.99Å; L299-V321 HydrophobicContact CG-CG1 4.41Å; L299-L322 PolarHBondContact N-O 2.96Å
300	G	79.9	Confident	72.5	Confident	15 Å²	15	68.1 Å²	68.1	16%	0.155	37%	0.368	C	S	.	.			trans	-117.1	179.1	172.8	0	0	0	0	0	111.9	S264 I266	S264-G300 PolarHBondContact O-N 3.49Å; I266-G300 CarbonylContact O-C 3.57Å; I266-G300 WeakPolarHBondContact O-CA 3.36Å
301	R	75.5	Confident	71.5	Confident	120 Å²	120	67.6 Å²	67.6	45%	0.453	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-59.3	152.4	174.8	-58.4	-173.7	-175.2	-161	3.4	110.7	G265 I266 E268 A303	G265-R301 CarbonylContact C-O 3.58Å; G265-R301 WeakPolarHBondContact CA-O 3.44Å; I266-R301 PolarHBondContact N-O 3.38Å; I266-R301 PolarHBondContact O-N 2.66Å; E268-R301 VanDerWaalsContact CD-NH2 3.25Å; E268-R301 IonicContact OE1-CZ 3.27Å; E268-R301 IonicContact OE1-NE 3.49Å; E268-R301 PolarHBondContact OE1-NE 3.43Å; E268-R301 IonicContact OE1-NH2 2.66Å; E268-R301 PolarHBondContact OE1-NH2 3.31Å; E268-R301 IonicContact OE2-NH2 3.54Å; E268-R301 PolarHBondContact OE2-NH2 3.5Å; R301-A303 VanDerWaalsContact C-N 3.26Å; R301-A303 PolarHBondContact O-N 2.93Å; R301-A303 VanDerWaalsContact O-N 3.17Å
302	D	68.7	Low	70.4	Confident	98 Å²	98	68.9 Å²	68.9	52%	0.524	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	34.2	-178.8	-59.1	-9.6	0	0	0	116.2	R237 G304	R237-D302 VanDerWaalsContact NH1-CB 3.3Å; R237-D302 PolarHBondContact NH1-O 3.19Å; D302-G304 PolarHBondContact O-N 3.47Å
303	A	66.9	Low	69.3	Low	17 Å²	17	70 Å²	70	14%	0.14	37%	0.368	C	S	.	.			trans	-52.7	108.3	172	0	0	0	0	0	111.5	L299 R301 S308	L299-A303 HydrophobicContact CD1-CB 3.57Å; R301-A303 VanDerWaalsContact C-N 3.26Å; R301-A303 PolarHBondContact O-N 2.93Å; R301-A303 VanDerWaalsContact O-N 3.17Å; A303-S308 VanDerWaalsContact O-CB 3.25Å; A303-S308 WeakPolarHBondContact O-CB 3.15Å; A303-S308 PolarHBondContact O-OG 2.85Å
304	G	62.2	Low	68	Low	34 Å²	34	62.7 Å²	62.7	35%	0.351	34%	0.337	S	S	.	.			trans	-58.6	144	-167.8	0	0	0	0	0	114.4	D302 S306 K307 S308	D302-G304 PolarHBondContact O-N 3.47Å; G304-S306 VanDerWaalsContact C-N 3.27Å; G304-S306 PolarHBondContact O-N 3.09Å; G304-K307 WeakPolarHBondContact O-CA 2.99Å; G304-K307 PolarHBondContact O-N 3.24Å; G304-S308 PolarHBondContact O-N 3.43Å; G304-S308 VanDerWaalsContact O-N 3.09Å; G304-S308 PolarHBondContact O-OG 3.47Å
305	E	63	Low	66.5	Low	141 Å²	141	67.7 Å²	67.7	66%	0.659	36%	0.363	S	S	*	.	H	α-helix	trans	-37.7	-48.3	-170.4	-61.4	169.1	-178.6	0	0	114.9	K307 S308 A309	E305-K307 PolarHBondContact O-N 3.27Å; E305-K307 VanDerWaalsContact O-N 3.14Å; E305-S308 VanDerWaalsContact CA-OG 3.24Å; E305-S308 WeakPolarHBondContact CA-OG 3.2Å; E305-S308 PolarHBondContact N-OG 3.17Å; E305-S308 PolarHBondContact O-N 2.66Å; E305-S308 PolarHBondContact O-OG 3.33Å; E305-A309 WeakPolarHBondContact O-CB 3.3Å; E305-A309 PolarHBondContact O-N 3.05Å
306	S	57.1	Low	64.8	Low	89 Å²	89	69 Å²	69	62%	0.622	38%	0.377	S	S	*	.	H	α-helix	trans	-70.9	-5.8	-177.3	70.5	0	0	0	0	115.5	G304 K310	G304-S306 VanDerWaalsContact C-N 3.27Å; G304-S306 PolarHBondContact O-N 3.09Å; S306-K310 VanDerWaalsContact O-CD 3.23Å; S306-K310 WeakPolarHBondContact O-CD 3.36Å; S306-K310 WeakPolarHBondContact O-CE 3.38Å; S306-K310 PolarHBondContact O-NZ 3.06Å; S306-K310 VanDerWaalsContact O-NZ 3.14Å
307	K	58.3	Low	63.3	Low	54 Å²	54	70.7 Å²	70.7	24%	0.235	39%	0.389	C	S	.	.	H	α-helix	trans	-109.3	-44.9	168.3	-67.9	-170.2	176.1	-170.7	0	111.4	I263 S264 T288 G304 E305 K310 V311	I263-K307 PolarHBondContact O-NZ 2.94Å; S264-K307 WeakPolarHBondContact OG-CB 3.22Å; S264-K307 WeakPolarHBondContact OG-CD 3.41Å; T288-K307 VanDerWaalsContact O-CE 3.27Å; T288-K307 WeakPolarHBondContact O-CE 3.29Å; T288-K307 PolarHBondContact O-NZ 3.08Å; G304-K307 WeakPolarHBondContact O-CA 2.99Å; G304-K307 PolarHBondContact O-N 3.24Å; E305-K307 PolarHBondContact O-N 3.27Å; E305-K307 VanDerWaalsContact O-N 3.14Å; K307-K310 CarbonylContact O-C 3.5Å; K307-K310 WeakPolarHBondContact O-CA 3.48Å; K307-K310 WeakPolarHBondContact O-CB 3.33Å; K307-K310 PolarHBondContact O-N 3.15Å; K307-V311 PolarHBondContact O-N 3.5Å
308	S	55.1	Low	62.1	Low	48 Å²	48	78.2 Å²	78.2	34%	0.336	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-43.3	178.4	41.3	0	0	0	0	113	A303 G304 E305 K310 V311 P312	A303-S308 VanDerWaalsContact O-CB 3.25Å; A303-S308 WeakPolarHBondContact O-CB 3.15Å; A303-S308 PolarHBondContact O-OG 2.85Å; G304-S308 PolarHBondContact O-N 3.43Å; G304-S308 VanDerWaalsContact O-N 3.09Å; G304-S308 PolarHBondContact O-OG 3.47Å; E305-S308 VanDerWaalsContact CA-OG 3.24Å; E305-S308 WeakPolarHBondContact CA-OG 3.2Å; E305-S308 PolarHBondContact N-OG 3.17Å; E305-S308 PolarHBondContact O-N 2.66Å; E305-S308 PolarHBondContact O-OG 3.33Å; S308-K310 PolarHBondContact O-N 3.29Å; S308-V311 WeakPolarHBondContact O-CB 3.37Å; S308-V311 PolarHBondContact O-N 3.42Å; S308-P312 WeakPolarHBondContact O-CD 3.47Å
309	A	55.3	Low	61.1	Low	73 Å²	73	79.1 Å²	79.1	60%	0.603	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-7.2	171.4	0	0	0	0	0	113.7	E305	E305-A309 WeakPolarHBondContact O-CB 3.3Å; E305-A309 PolarHBondContact O-N 3.05Å
310	K	56.2	Low	60.8	Low	112 Å²	112	79.7 Å²	79.7	49%	0.487	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-18.7	167.9	-65.3	179	-174.8	154.3	0	113.1	S306 K307 S308 P312 R313 L314	S306-K310 VanDerWaalsContact O-CD 3.23Å; S306-K310 WeakPolarHBondContact O-CD 3.36Å; S306-K310 WeakPolarHBondContact O-CE 3.38Å; S306-K310 PolarHBondContact O-NZ 3.06Å; S306-K310 VanDerWaalsContact O-NZ 3.14Å; K307-K310 CarbonylContact O-C 3.5Å; K307-K310 WeakPolarHBondContact O-CA 3.48Å; K307-K310 WeakPolarHBondContact O-CB 3.33Å; K307-K310 PolarHBondContact O-N 3.15Å; S308-K310 PolarHBondContact O-N 3.29Å; K310-P312 VanDerWaalsContact C-N 3.34Å; K310-R313 CarbonylContact O-C 3.13Å; K310-R313 VanDerWaalsContact O-C 3.26Å; K310-R313 VanDerWaalsContact O-CA 3.27Å; K310-R313 WeakPolarHBondContact O-CA 3.37Å; K310-R313 WeakPolarHBondContact O-CB 2.99Å; K310-R313 PolarHBondContact O-N 2.98Å; K310-L314 HydrophobicContact CB-CD1 4.05Å; K310-L314 HydrophobicContact CB-CG 4.24Å; K310-L314 VanDerWaalsContact O-CG 3.26Å; K310-L314 WeakPolarHBondContact O-CG 3.46Å; K310-L314 PolarHBondContact O-N 2.73Å
311	V	56.7	Low	60.9	Low	33 Å²	33	81.7 Å²	81.7	20%	0.2	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-46.4	-179.3	172.3	0	0	0	0	112	L297 K307 S308 R313 L314 L315	L297-V311 HydrophobicContact CD2-CG2 4.43Å; K307-V311 PolarHBondContact O-N 3.5Å; S308-V311 WeakPolarHBondContact O-CB 3.37Å; S308-V311 PolarHBondContact O-N 3.42Å; V311-R313 VanDerWaalsContact C-N 3.25Å; V311-R313 PolarHBondContact O-N 2.84Å; V311-L314 WeakPolarHBondContact O-CA 3.36Å; V311-L314 PolarHBondContact O-N 3.37Å; V311-L315 HydrophobicContact CG1-CD1 3.65Å; V311-L315 WeakPolarHBondContact O-CD1 3.4Å; V311-L315 PolarHBondContact O-N 2.65Å
312	P	54.4	Low	61.3	Low	96 Å²	96	76.8 Å²	76.8	62%	0.623	43%	0.431	S	S	*	.	H	α-helix	trans	-60.4	-30.4	173.7	-24.6	35.3	0	0	0	114.4	S308 K310 L314	S308-P312 WeakPolarHBondContact O-CD 3.47Å; K310-P312 VanDerWaalsContact C-N 3.34Å; P312-L314 VanDerWaalsContact C-N 3.35Å
313	R	52.7	Low	62	Low	193 Å²	193	76.3 Å²	76.3	73%	0.728	43%	0.428	S	S	*	.	H	α-helix	trans	-88.1	2.4	174.5	-61.3	-175.4	178.8	-173.8	0.4	113.8	K310 V311 S316	K310-R313 CarbonylContact O-C 3.13Å; K310-R313 VanDerWaalsContact O-C 3.26Å; K310-R313 VanDerWaalsContact O-CA 3.27Å; K310-R313 WeakPolarHBondContact O-CA 3.37Å; K310-R313 WeakPolarHBondContact O-CB 2.99Å; K310-R313 PolarHBondContact O-N 2.98Å; V311-R313 VanDerWaalsContact C-N 3.25Å; V311-R313 PolarHBondContact O-N 2.84Å; R313-S316 PolarHBondContact O-OG 3.42Å
314	L	52.4	Low	62.8	Low	18 Å²	18	75.9 Å²	75.9	9%	0.094	42%	0.423	C	S	.	.	H	α-helix	trans	-109.9	-29.1	176.5	-68.8	173.8	0	0	0	111.2	V290 L297 K310 V311 P312 S316 L317 L319	V290-L314 HydrophobicContact CB-CD1 4.41Å; V290-L314 HydrophobicContact CB-CD2 4.25Å; V290-L314 HydrophobicContact CG1-CD1 4.32Å; V290-L314 HydrophobicContact CG1-CD2 3.76Å; V290-L314 HydrophobicContact CG2-CD1 3.97Å; L297-L314 HydrophobicContact CD2-CD1 4.23Å; K310-L314 HydrophobicContact CB-CD1 4.05Å; K310-L314 HydrophobicContact CB-CG 4.24Å; K310-L314 VanDerWaalsContact O-CG 3.26Å; K310-L314 WeakPolarHBondContact O-CG 3.46Å; K310-L314 PolarHBondContact O-N 2.73Å; V311-L314 WeakPolarHBondContact O-CA 3.36Å; V311-L314 PolarHBondContact O-N 3.37Å; P312-L314 VanDerWaalsContact C-N 3.35Å; L314-S316 PolarHBondContact O-N 3.05Å; L314-L317 HydrophobicContact CD2-CD1 4.19Å; L314-L317 WeakPolarHBondContact O-CA 3.33Å; L314-L317 WeakPolarHBondContact O-CB 3.44Å; L314-L317 PolarHBondContact O-N 2.86Å; L314-L319 HydrophobicContact CD2-CD1 3.88Å
315	L	50.9	Low	63.8	Low	117 Å²	117	77.5 Å²	77.5	61%	0.613	42%	0.424	S	S	*	.	H	α-helix	trans	-56.6	-39.4	165.9	-90	75.2	0	0	0	111.2	V311 L317 I318	V311-L315 HydrophobicContact CG1-CD1 3.65Å; V311-L315 WeakPolarHBondContact O-CD1 3.4Å; V311-L315 PolarHBondContact O-N 2.65Å; L315-L317 PolarHBondContact O-N 3.22Å; L315-L317 VanDerWaalsContact O-N 3.12Å; L315-I318 PolarHBondContact O-N 2.64Å
316	S	51.4	Low	64.9	Low	91 Å²	91	73.6 Å²	73.6	64%	0.636	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-0.5	173.9	60	0	0	0	0	115	R313 L314	R313-S316 PolarHBondContact O-OG 3.42Å; L314-S316 PolarHBondContact O-N 3.05Å
317	L	56.1	Low	66.2	Low	81 Å²	81	69.5 Å²	69.5	42%	0.424	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	18.5	176.8	-80	166.7	0	0	0	112.8	L314 L315 L319	L314-L317 HydrophobicContact CD2-CD1 4.19Å; L314-L317 WeakPolarHBondContact O-CA 3.33Å; L314-L317 WeakPolarHBondContact O-CB 3.44Å; L314-L317 PolarHBondContact O-N 2.86Å; L315-L317 PolarHBondContact O-N 3.22Å; L315-L317 VanDerWaalsContact O-N 3.12Å; L317-L319 HydrophobicContact CB-CD1 4.18Å; L317-L319 PolarHBondContact O-N 2.92Å
318	I	60.4	Low	67.5	Low	162 Å²	162	67.3 Å²	67.3	83%	0.831	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	43.3	175.2	-38	-179.8	0	0	0	111.7	L315 P320	L315-I318 PolarHBondContact O-N 2.64Å; I318-P320 VanDerWaalsContact O-CD 3.27Å; I318-P320 WeakPolarHBondContact O-CD 3.49Å
319	L	66.5	Low	68.9	Low	20 Å²	20	68.9 Å²	68.9	11%	0.105	37%	0.374	C	S	.	.			trans	-99.5	103.5	-177.8	-98.3	159.6	0	0	0	110.1	V290 T294 L314 L317 V321	V290-L319 HydrophobicContact CG1-CD1 3.69Å; T294-L319 HydrophobicContact CG2-CD2 3.85Å; T294-L319 WeakPolarHBondContact O-CD2 3.14Å; L314-L319 HydrophobicContact CD2-CD1 3.88Å; L317-L319 HydrophobicContact CB-CD1 4.18Å; L317-L319 PolarHBondContact O-N 2.92Å; L319-V321 PolarHBondContact O-N 3.25Å
320	P	78.3	Confident	70.4	Confident	62 Å²	62	66.3 Å²	66.3	40%	0.403	35%	0.35	S	S	.	.			trans	-60.7	128.9	174.9	23.2	-33.2	0	0	0	111.1	N295 Y296 L297 I318	N295-P320 VanDerWaalsContact O-CD 3.31Å; N295-P320 WeakPolarHBondContact O-CD 3.38Å; N295-P320 VanDerWaalsContact O-CG 3.28Å; N295-P320 WeakPolarHBondContact O-CG 3.23Å; Y296-P320 WeakPolarHBondContact CA-O 3.27Å; Y296-P320 HydrophobicContact CD1-CB 4.05Å; Y296-P320 HydrophobicContact CD1-CG 3.53Å; Y296-P320 HydrophobicContact CE1-CB 4.22Å; Y296-P320 HydrophobicContact CE1-CG 3.64Å; Y296-P320 HydrophobicContact CG-CG 4.44Å; L297-P320 PolarHBondContact N-O 2.97Å; I318-P320 VanDerWaalsContact O-CD 3.27Å; I318-P320 WeakPolarHBondContact O-CD 3.49Å
321	V	81.7	Confident	71.7	Confident	57 Å²	57	61 Å²	61	35%	0.345	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.2	172.3	-174.4	0	0	0	0	107.9	L297 L299 L319	L297-V321 HydrophobicContact CD2-CG2 4.39Å; L297-V321 CarbonylContact O-C 3.59Å; L297-V321 VanDerWaalsContact O-CA 3.31Å; L297-V321 WeakPolarHBondContact O-CA 3.44Å; L299-V321 HydrophobicContact CB-CG1 3.55Å; L299-V321 HydrophobicContact CD2-CG1 3.99Å; L299-V321 HydrophobicContact CG-CG1 4.41Å; L319-V321 PolarHBondContact O-N 3.25Å
322	L	83.5	Confident	73.1	Confident	17 Å²	17	65.7 Å²	65.7	9%	0.089	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.6	178.7	-56.9	-177.1	0	0	0	110	F261 Y296 L297 L298 L299 D326 L330	F261-L322 HydrophobicContact CD1-CD1 4.49Å; F261-L322 HydrophobicContact CE1-CD1 4Å; Y296-L322 HydrophobicContact CD1-CD1 3.61Å; Y296-L322 HydrophobicContact CD1-CD2 3.87Å; Y296-L322 HydrophobicContact CD1-CG 3.77Å; Y296-L322 HydrophobicContact CE1-CD1 4.33Å; Y296-L322 HydrophobicContact CE1-CD2 4.26Å; Y296-L322 HydrophobicContact CG-CD1 3.83Å; Y296-L322 HydrophobicContact CG-CG 4.32Å; L297-L322 PolarHBondContact O-N 3.43Å; L298-L322 WeakPolarHBondContact CA-O 3.33Å; L298-L322 HydrophobicContact CD2-CB 4.4Å; L298-L322 HydrophobicContact CG-CB 4.38Å; L299-L322 PolarHBondContact N-O 2.96Å; L322-D326 HydrophobicContact CB-CB 3.95Å; L322-D326 HydrophobicContact CD2-CB 3.79Å; L322-D326 HydrophobicContact CG-CB 4.38Å; L322-L330 HydrophobicContact CD1-CD2 4.01Å
323	N	83.9	Confident	74.4	Confident	87 Å²	87	64.2 Å²	64.2	47%	0.465	33%	0.333	S	S	.	.			trans	-94.6	-179.4	160.8	-48.5	-69.8	0	0	0	110	D325 D326 L327	N323-D325 VanDerWaalsContact C-N 3.33Å; N323-D325 PolarHBondContact O-N 3.14Å; N323-D326 WeakPolarHBondContact CB-OD2 3.09Å; N323-D326 PolarHBondContact N-OD2 2.84Å; N323-D326 PolarHBondContact ND2-OD2 3.1Å; N323-D326 PolarHBondContact O-N 3.27Å; N323-L327 PolarHBondContact O-N 3.43Å; N323-L327 VanDerWaalsContact O-N 3.1Å
324	D	83.1	Confident	75.7	Confident	8 Å²	8	58.3 Å²	58.3	4%	0.043	31%	0.313	C	S	.	.	H	α-helix	trans	-52.2	-49.1	177.2	-62.4	13.8	0	0	0	112.3	L267 E268 S269 D326 L327 Y328	L267-D324 WeakPolarHBondContact CB-OD1 3.4Å; L267-D324 WeakPolarHBondContact CD2-OD1 3.42Å; E268-D324 PolarHBondContact N-OD2 3.29Å; E268-D324 VanDerWaalsContact N-OD2 3.08Å; S269-D324 WeakPolarHBondContact CB-OD2 3.44Å; S269-D324 PolarHBondContact N-OD2 2.95Å; S269-D324 PolarHBondContact OG-OD2 2.95Å; D324-D326 VanDerWaalsContact C-N 3.32Å; D324-D326 PolarHBondContact O-N 3.45Å; D324-L327 WeakPolarHBondContact O-CB 3.4Å; D324-L327 PolarHBondContact O-N 3.35Å; D324-Y328 HydrophobicContact CB-CE2 4.29Å; D324-Y328 WeakPolarHBondContact O-CD2 3.48Å; D324-Y328 PolarHBondContact O-N 3.31Å
325	D	83.4	Confident	76.6	Confident	68 Å²	68	59.1 Å²	59.1	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-67.3	-33.9	-177.4	-58.4	-56.6	0	0	0	112.1	K246 N323 L327 Y328 N329	K246-D325 VanDerWaalsContact CD-OD1 3.28Å; K246-D325 WeakPolarHBondContact CD-OD1 3.21Å; K246-D325 WeakPolarHBondContact CE-OD1 3.26Å; K246-D325 IonicContact NZ-OD1 3.69Å; K246-D325 PolarHBondContact NZ-OD1 3.25Å; K246-D325 IonicContact NZ-OD2 2.74Å; K246-D325 PolarHBondContact NZ-OD2 3.03Å; N323-D325 VanDerWaalsContact C-N 3.33Å; N323-D325 PolarHBondContact O-N 3.14Å; D325-L327 VanDerWaalsContact C-N 3.34Å; D325-Y328 PolarHBondContact O-N 3.09Å; D325-N329 VanDerWaalsContact O-CB 3.31Å; D325-N329 WeakPolarHBondContact O-CB 3.43Å; D325-N329 PolarHBondContact O-N 2.82Å; D325-N329 PolarHBondContact O-ND2 2.84Å; D325-N329 VanDerWaalsContact O-ND2 3.13Å
326	D	85.4	Confident	77	Confident	60 Å²	60	57.8 Å²	57.8	32%	0.321	33%	0.325	S	S	.	.	H	α-helix	trans	-69.8	-33.8	177	-53.2	-56.8	0	0	0	111.2	L322 N323 D324 L330	L322-D326 HydrophobicContact CB-CB 3.95Å; L322-D326 HydrophobicContact CD2-CB 3.79Å; L322-D326 HydrophobicContact CG-CB 4.38Å; N323-D326 WeakPolarHBondContact CB-OD2 3.09Å; N323-D326 PolarHBondContact N-OD2 2.84Å; N323-D326 PolarHBondContact ND2-OD2 3.1Å; N323-D326 PolarHBondContact O-N 3.27Å; D324-D326 VanDerWaalsContact C-N 3.32Å; D324-D326 PolarHBondContact O-N 3.45Å; D326-L330 VanDerWaalsContact O-CB 3.23Å; D326-L330 WeakPolarHBondContact O-CB 3.02Å; D326-L330 PolarHBondContact O-N 3.4Å
327	L	84.4	Confident	77.1	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-66.8	-44.3	170.4	175.8	64.5	0	0	0	111.3	L256 F261 L278 I279 L298 N323 D324 D325 N329 L330 I331	L256-L327 HydrophobicContact CD1-CD1 4.38Å; F261-L327 HydrophobicContact CE1-CD1 4.03Å; F261-L327 HydrophobicContact CZ-CD1 4.49Å; L278-L327 HydrophobicContact CD2-CD2 4.44Å; I279-L327 HydrophobicContact CD1-CD2 4.27Å; I279-L327 HydrophobicContact CG1-CD1 4.02Å; I279-L327 HydrophobicContact CG1-CD2 4.1Å; L298-L327 HydrophobicContact CD1-CD2 4.15Å; L298-L327 HydrophobicContact CD2-CB 4.13Å; L298-L327 HydrophobicContact CD2-CD2 4.1Å; N323-L327 PolarHBondContact O-N 3.43Å; N323-L327 VanDerWaalsContact O-N 3.1Å; D324-L327 WeakPolarHBondContact O-CB 3.4Å; D324-L327 PolarHBondContact O-N 3.35Å; D325-L327 VanDerWaalsContact C-N 3.34Å; L327-N329 VanDerWaalsContact C-N 3.34Å; L327-N329 PolarHBondContact O-N 2.89Å; L327-L330 PolarHBondContact O-N 2.84Å; L327-I331 HydrophobicContact CD1-CD1 4.22Å; L327-I331 HydrophobicContact CD1-CG1 4.49Å; L327-I331 HydrophobicContact CG-CD1 4.14Å; L327-I331 WeakPolarHBondContact O-CG1 3.3Å; L327-I331 PolarHBondContact O-N 3.08Å
328	Y	86.8	Confident	76.4	Confident	8 Å²	8	59.9 Å²	59.9	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-41.5	176.7	-60.7	-28.2	0	0	0	111.8	K246 P249 S269 L278 D324 D325 I331 R332	K246-Y328 HydrophobicContact CB-CE2 4.14Å; K246-Y328 HydrophobicContact CD-CE2 4.25Å; P249-Y328 HydrophobicContact CG-CD1 3.85Å; P249-Y328 HydrophobicContact CG-CG 4.1Å; S269-Y328 PolarHBondContact OG-OH 2.82Å; S269-Y328 VanDerWaalsContact OG-OH 3.11Å; L278-Y328 HydrophobicContact CD2-CD1 4.06Å; L278-Y328 HydrophobicContact CD2-CE1 3.76Å; D324-Y328 HydrophobicContact CB-CE2 4.29Å; D324-Y328 WeakPolarHBondContact O-CD2 3.48Å; D324-Y328 PolarHBondContact O-N 3.31Å; D325-Y328 PolarHBondContact O-N 3.09Å; Y328-I331 PolarHBondContact O-N 3.39Å; Y328-R332 VanDerWaalsContact O-CG 3.3Å; Y328-R332 WeakPolarHBondContact O-CG 3.31Å; Y328-R332 PolarHBondContact O-N 2.97Å
329	N	84.6	Confident	75.5	Confident	81 Å²	81	58.6 Å²	58.6	43%	0.433	34%	0.337	S	S	.	.	H	α-helix	trans	-69	-33.6	175.3	-71.4	-31.2	0	0	0	112.4	D325 L327 S333	D325-N329 VanDerWaalsContact O-CB 3.31Å; D325-N329 WeakPolarHBondContact O-CB 3.43Å; D325-N329 PolarHBondContact O-N 2.82Å; D325-N329 PolarHBondContact O-ND2 2.84Å; D325-N329 VanDerWaalsContact O-ND2 3.13Å; L327-N329 VanDerWaalsContact C-N 3.34Å; L327-N329 PolarHBondContact O-N 2.89Å; N329-S333 VanDerWaalsContact O-CB 3.23Å; N329-S333 WeakPolarHBondContact O-CB 3.36Å; N329-S333 PolarHBondContact O-N 3.47Å; N329-S333 PolarHBondContact O-OG 2.59Å
330	L	85.7	Confident	73.9	Confident	20 Å²	20	63.6 Å²	63.6	11%	0.105	37%	0.368	C	S	.	.	H	α-helix	trans	-65.1	-41.9	172.4	-175.7	65.1	0	0	0	111.6	L256 L259 F261 Y296 L322 D326 L327 S333 K334	L256-L330 HydrophobicContact CD2-CD2 4.06Å; L256-L330 HydrophobicContact CD2-CG 3.95Å; L259-L330 HydrophobicContact CD1-CD2 4.44Å; F261-L330 HydrophobicContact CE1-CD2 3.9Å; F261-L330 HydrophobicContact CZ-CD2 3.83Å; Y296-L330 HydrophobicContact CD2-CD2 4.3Å; Y296-L330 HydrophobicContact CE1-CD2 4.28Å; Y296-L330 HydrophobicContact CE2-CD2 3.96Å; L322-L330 HydrophobicContact CD1-CD2 4.01Å; D326-L330 VanDerWaalsContact O-CB 3.23Å; D326-L330 WeakPolarHBondContact O-CB 3.02Å; D326-L330 PolarHBondContact O-N 3.4Å; L327-L330 PolarHBondContact O-N 2.84Å; L330-S333 PolarHBondContact O-OG 3.41Å; L330-K334 HydrophobicContact CD1-CD 4.4Å; L330-K334 HydrophobicContact CD1-CG 4.22Å; L330-K334 WeakPolarHBondContact O-CB 3.27Å; L330-K334 PolarHBondContact O-N 3.42Å
331	I	84.5	Confident	71.7	Confident	0 Å²	0	70 Å²	70	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-63.7	-50.1	175.3	-68.1	162.9	0	0	0	110.4	P249 L256 L278 L327 Y328 S335	P249-I331 HydrophobicContact CB-CG2 4.38Å; P249-I331 HydrophobicContact CG-CB 4.2Å; P249-I331 HydrophobicContact CG-CD1 4.38Å; P249-I331 HydrophobicContact CG-CG2 4.09Å; L256-I331 HydrophobicContact CD1-CG1 4.04Å; L256-I331 HydrophobicContact CD2-CG1 4.35Å; L256-I331 HydrophobicContact CG-CG1 4.4Å; L278-I331 HydrophobicContact CD1-CD1 4.16Å; L278-I331 HydrophobicContact CD2-CD1 3.68Å; L278-I331 HydrophobicContact CG-CD1 3.69Å; L327-I331 HydrophobicContact CD1-CD1 4.22Å; L327-I331 HydrophobicContact CD1-CG1 4.49Å; L327-I331 HydrophobicContact CG-CD1 4.14Å; L327-I331 WeakPolarHBondContact O-CG1 3.3Å; L327-I331 PolarHBondContact O-N 3.08Å; Y328-I331 PolarHBondContact O-N 3.39Å; I331-S335 WeakPolarHBondContact O-CB 3.49Å; I331-S335 PolarHBondContact O-N 2.95Å
332	R	84.5	Confident	69.2	Low	131 Å²	131	72.2 Å²	72.2	49%	0.494	41%	0.414	S	S	.	.	H	α-helix	trans	-57.9	-52.2	177.8	-71.4	170.4	177.6	-179.2	-1.5	111.9	P249 Y328 S335 A336	P249-R332 HydrophobicContact CB-CG 3.82Å; Y328-R332 VanDerWaalsContact O-CG 3.3Å; Y328-R332 WeakPolarHBondContact O-CG 3.31Å; Y328-R332 PolarHBondContact O-N 2.97Å; R332-S335 PolarHBondContact O-N 3.3Å; R332-A336 PolarHBondContact O-N 2.92Å
333	S	82.5	Confident	66.7	Low	66 Å²	66	79.9 Å²	79.9	46%	0.462	45%	0.449	S	S	.	.	H	α-helix	trans	-69.5	-33.2	-175.8	60.3	0	0	0	0	114.1	N329 L330	N329-S333 VanDerWaalsContact O-CB 3.23Å; N329-S333 WeakPolarHBondContact O-CB 3.36Å; N329-S333 PolarHBondContact O-N 3.47Å; N329-S333 PolarHBondContact O-OG 2.59Å; L330-S333 PolarHBondContact O-OG 3.41Å
334	K	80.3	Confident	64.2	Low	69 Å²	69	81.8 Å²	81.8	30%	0.3	47%	0.467	S	S	.	.	H	α-helix	trans	-77.8	-32.7	172.1	-74.2	-153.2	169.6	-160.3	0	113.1	C255 L256 L259 L330 A336 K337	C255-K334 HydrophobicContact CB-CB 4.02Å; C255-K334 WeakPolarHBondContact O-CB 3.28Å; C255-K334 WeakPolarHBondContact O-CD 3.47Å; L256-K334 HydrophobicContact CD2-CD 4.46Å; L259-K334 HydrophobicContact CD1-CD 4.34Å; L330-K334 HydrophobicContact CD1-CD 4.4Å; L330-K334 HydrophobicContact CD1-CG 4.22Å; L330-K334 WeakPolarHBondContact O-CB 3.27Å; L330-K334 PolarHBondContact O-N 3.42Å; K334-A336 PolarHBondContact O-N 3.01Å; K334-K337 PolarHBondContact O-N 2.97Å; K334-K337 VanDerWaalsContact O-O 3.11Å
335	S	70	Confident	62.1	Low	35 Å²	35	87.3 Å²	87.3	25%	0.245	51%	0.506	C	S	.	.	H	α-helix	trans	-62.4	-27.6	175.7	-168.6	0	0	0	0	113.1	G251 T252 I331 R332 K337	G251-S335 WeakPolarHBondContact CA-OG 3.23Å; T252-S335 PolarHBondContact N-OG 3.34Å; I331-S335 WeakPolarHBondContact O-CB 3.49Å; I331-S335 PolarHBondContact O-N 2.95Å; R332-S335 PolarHBondContact O-N 3.3Å; S335-K337 VanDerWaalsContact C-N 3.27Å; S335-K337 PolarHBondContact O-N 3.49Å
336	A	59.3	Low	59.6	Low	88 Å²	88	88.8 Å²	88.8	73%	0.727	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.6	174.9	0	0	0	0	0	114.1	R332 K334	R332-A336 PolarHBondContact O-N 2.92Å; K334-A336 PolarHBondContact O-N 3.01Å
337	K	54	Low	57.3	Low	165 Å²	165	92 Å²	92	72%	0.717	55%	0.546	S	S	*	.	S	Bend	trans	-110.5	103.1	177.3	-67.5	-174.9	179.1	-177.6	0	109.2	K334 S335	K334-K337 PolarHBondContact O-N 2.97Å; K334-K337 VanDerWaalsContact O-O 3.11Å; S335-K337 VanDerWaalsContact C-N 3.27Å; S335-K337 PolarHBondContact O-N 3.49Å
338	G	42.5	Very low	54.7	Low	52 Å²	52	97 Å²	97	54%	0.536	58%	0.58	S	S	.	*			trans	-53.9	159	173.8	0	0	0	0	0	112.5	T340	G338-T340 PolarHBondContact O-N 3.37Å
339	P	39.8	Very low	52.2	Low	135 Å²	135	102.9 Å²	102.9	88%	0.877	62%	0.62	S	S	*	*			trans	-63.2	93	-163.2	24.6	-35.2	0	0	0	113.3	K341	P339-K341 PolarHBondContact O-N 2.97Å
340	T	34.5	Very low	49.5	Very low	124 Å²	124	108.8 Å²	108.8	76%	0.761	64%	0.641	S	S	*	*			trans	-65.4	119.2	171.8	51.9	0	0	0	0	109.4	G338 A342	G338-T340 PolarHBondContact O-N 3.37Å; T340-A342 PolarHBondContact O-N 2.88Å
341	K	30.5	Very low	47.1	Very low	197 Å²	197	118 Å²	118	86%	0.857	68%	0.681	S	S	*	*			trans	-51.2	129.2	170.4	-72.2	178	178	173.8	0	109.3	P339 E343	P339-K341 PolarHBondContact O-N 2.97Å; K341-E343 PolarHBondContact O-N 2.71Å
342	A	30.3	Very low	44.5	Very low	104 Å²	104	127.3 Å²	127.3	86%	0.86	72%	0.721	S	S	*	*			trans	-73.2	100.3	-178.5	0	0	0	0	0	110.9	T340	T340-A342 PolarHBondContact O-N 2.88Å
343	E	30.5	Very low	42.1	Very low	177 Å²	177	130.2 Å²	130.2	83%	0.827	74%	0.738	S	S	*	*			trans	-73.2	135.3	170.2	-64.6	-165.9	146.2	0	0	111.1	K341 S345	K341-E343 PolarHBondContact O-N 2.71Å; E343-S345 PolarHBondContact O-N 3.26Å
344	P	31.4	Very low	39.8	Very low	128 Å²	128	137 Å²	137	83%	0.831	76%	0.759	S	S	*	*			trans	-87.6	93.4	-178.9	33.5	-33.5	0	0	0	111.8	S346	P344-S346 PolarHBondContact O-N 2.88Å
345	S	38.9	Very low	37.4	Very low	124 Å²	124	138.3 Å²	138.3	87%	0.867	78%	0.782	S	S	*	*			trans	-71.2	127	169.4	50.4	0	0	0	0	111.3	E343	E343-S345 PolarHBondContact O-N 3.26Å
346	S	32.4	Very low	35.8	Very low	98 Å²	98	142 Å²	142	69%	0.685	81%	0.808	S	S	*	*			trans	-96.7	174.6	179.7	68	0	0	0	0	111.7	P344	P344-S346 PolarHBondContact O-N 2.88Å
347	P	36	Very low	34.4	Very low	128 Å²	128	144.2 Å²	144.2	83%	0.831	81%	0.813	S	S	*	*				-140.4	147.1	91	35.6	-21.4	0	0	0	114.5
348	S	29	Very low	33.7	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	82%	0.818	S	S	*	*			trans	-115.5	136	173.9	-63.5	0	0	0	0	111.9
349	P	34.4	Very low	33.5	Very low	132 Å²	132	146 Å²	146	86%	0.857	83%	0.829	S	S	*	*			trans	-74.3	139.6	175.7	30	-33.5	0	0	0	112
350	K	28.8	Very low	33	Very low	205 Å²	205	144.3 Å²	144.3	89%	0.891	83%	0.826	S	S	*	*			trans	-70.6	133.6	-171.6	-59.7	161.3	-178.7	170	0	112.9
351	K	35.3	Very low	33.1	Very low	214 Å²	214	145.1 Å²	145.1	93%	0.93	83%	0.831	S	S	*	*			trans	-141.8	133.6	146.9	-97.8	-177.6	-179	177.3	0	110.7
352	K	30	Very low	33.2	Very low	195 Å²	195	140.1 Å²	140.1	85%	0.848	83%	0.826	S	S	*	*			trans	-94.2	147.4	-177.5	-57	175.7	178.8	-178.6	0	110.8
353	K	34.4	Very low	33.4	Very low	193 Å²	193	144.7 Å²	144.7	84%	0.839	83%	0.827	S	S	*	*				167.6	143.3	110.6	-94.1	178.1	179.9	-179	0	115.2
354	K	32.7	Very low	33.6	Very low	209 Å²	209	144.4 Å²	144.4	91%	0.909	83%	0.825	S	S	*	*			trans	71.9	154.6	157.6	-70.2	-171.1	171.4	-167.4	0	118.8
355	A	30.9	Very low	33.5	Very low	96 Å²	96	143.5 Å²	143.5	79%	0.793	82%	0.822	S	S	*	*			trans	-159.2	157.6	-166	0	0	0	0	0	112.2
356	S	35.5	Very low	33.3	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	82%	0.822	S	S	*	*			trans	-171	113.5	163.2	49.8	0	0	0	0	105.7
357	T	30.1	Very low	33.3	Very low	133 Å²	133	144.9 Å²	144.9	82%	0.816	83%	0.832	S	S	*	*			cis	76.6	85.6	43.8	-43.9	0	0	0	0	113.2
358	V	40.4	Very low	33.4	Very low	138 Å²	138	143.8 Å²	143.8	84%	0.836	83%	0.827	S	S	*	*			trans	-139.5	136.3	155.2	-178.1	0	0	0	0	105.8
359	P	36.9	Very low	33.5	Very low	118 Å²	118	148.7 Å²	148.7	77%	0.766	84%	0.835	S	S	*	*			trans	-92.1	170	-158.8	36	-37.6	0	0	0	115.3
360	A	29.6	Very low	33.6	Very low	98 Å²	98	149.7 Å²	149.7	81%	0.81	83%	0.833	S	S	*	*			trans	-79.5	154.2	171.7	0	0	0	0	0	112.4
361	V	38	Very low	33.9	Very low	142 Å²	142	148.9 Å²	148.9	86%	0.861	83%	0.829	S	S	*	*			trans	-119.5	121.5	162.8	175.8	0	0	0	0	107.5
362	A	31.4	Very low	33.7	Very low	92 Å²	92	142.4 Å²	142.4	76%	0.76	82%	0.816	S	S	*	*			trans	-99.2	145.5	167.2	0	0	0	0	0	109.4
363	K	34.7	Very low	33.9	Very low	200 Å²	200	138.5 Å²	138.5	87%	0.87	81%	0.811	S	S	*	*			trans	-150.8	149.8	154.2	-121.4	177	-177.8	-177.6	0	109.9
364	E	34	Very low	33.7	Very low	170 Å²	170	135.9 Å²	135.9	79%	0.794	81%	0.811	S	S	*	*			trans	-103.7	172.4	-156.5	-63.6	149.4	115.3	0	0	113.3
365	S	31.2	Very low	33.8	Very low	110 Å²	110	132 Å²	132	77%	0.769	80%	0.796	S	S	*	*			trans	48.3	114.8	147.6	63.8	0	0	0	0	119.2
366	S	34.3	Very low	33.8	Very low	123 Å²	123	133.2 Å²	133.2	86%	0.86	80%	0.799	S	S	*	*				-157.5	149	107.7	33.3	0	0	0	0	110.5
367	S	32.4	Very low	33.8	Very low	128 Å²	128	135.4 Å²	135.4	90%	0.895	79%	0.794	S	S	*	*			trans	-96.2	119.7	178.6	42.2	0	0	0	0	110.4
368	S	37	Very low	34	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	79%	0.794	S	S	*	*			trans	-125.6	137.3	163.8	53.2	0	0	0	0	109.8	D370	S368-D370 PolarHBondContact O-N 3.41Å
369	K	31.3	Very low	34	Very low	210 Å²	210	128.9 Å²	128.9	91%	0.913	78%	0.781	S	S	*	*			trans	-81.3	109.4	176.1	-64.9	169.8	-179.2	172	0	108.2
370	D	36.4	Very low	34.5	Very low	152 Å²	152	133.5 Å²	133.5	81%	0.813	78%	0.783	S	S	*	*			trans	-109.8	144.8	163.8	-103.2	-53.2	0	0	0	112.5	S368	S368-D370 PolarHBondContact O-N 3.41Å
371	K	36.7	Very low	36.3	Very low	188 Å²	188	138.8 Å²	138.8	82%	0.817	79%	0.788	S	S	*	*			trans	-84.5	140.6	-157.4	-64.4	164.1	-175.8	168.3	0	110.9
372	A	29.8	Very low	38.4	Very low	78 Å²	78	135.9 Å²	135.9	65%	0.645	77%	0.768	S	S	*	*			trans	-59.9	129.9	162	0	0	0	0	0	108.8	T374	A372-T374 VanDerWaalsContact C-N 3.28Å; A372-T374 PolarHBondContact O-N 2.96Å
373	P	34.7	Very low	41.1	Very low	114 Å²	114	136.8 Å²	136.8	74%	0.74	76%	0.759	S	S	*	*			trans	-73.5	85.8	172.9	29.8	-33.4	0	0	0	109.2	E375	P373-E375 PolarHBondContact O-N 2.81Å
374	T	29.2	Very low	43.7	Very low	137 Å²	137	128.8 Å²	128.8	84%	0.84	72%	0.724	S	S	*	*			trans	-72.1	57.4	163.4	46	0	0	0	0	110.3	A372 S376	A372-T374 VanDerWaalsContact C-N 3.28Å; A372-T374 PolarHBondContact O-N 2.96Å; T374-S376 PolarHBondContact O-N 3.05Å
375	E	36.4	Very low	46.4	Very low	128 Å²	128	122.3 Å²	122.3	60%	0.598	70%	0.696	S	S	*	*			trans	-81.8	102.6	164.3	-74.9	-166.3	143.5	0	0	108.7	P373 K377	P373-E375 PolarHBondContact O-N 2.81Å; E375-K377 HydrophobicContact CB-CG 4.48Å; E375-K377 PolarHBondContact O-N 3.09Å; E375-K377 IonicContact OE1-NZ 2.78Å; E375-K377 WeakPolarHBondContact OE2-CE 3.41Å; E375-K377 IonicContact OE2-NZ 2.85Å; E375-K377 PolarHBondContact OE2-NZ 3.09Å
376	S	31	Very low	49.2	Very low	122 Å²	122	122.1 Å²	122.1	85%	0.853	68%	0.683	S	S	*	*			trans	-69.7	63.5	168.6	56.1	0	0	0	0	111.2	T374 G378	T374-S376 PolarHBondContact O-N 3.05Å; S376-G378 PolarHBondContact O-N 3.42Å; S376-G378 VanDerWaalsContact O-N 3.11Å
377	K	35.5	Very low	51.9	Low	159 Å²	159	121.2 Å²	121.2	69%	0.691	66%	0.664	S	S	*	*			trans	-65.5	108.6	167.2	-80.6	169.2	173.3	154.5	0	107.4	E375 G379	E375-K377 HydrophobicContact CB-CG 4.48Å; E375-K377 PolarHBondContact O-N 3.09Å; E375-K377 IonicContact OE1-NZ 2.78Å; E375-K377 WeakPolarHBondContact OE2-CE 3.41Å; E375-K377 IonicContact OE2-NZ 2.85Å; E375-K377 PolarHBondContact OE2-NZ 3.09Å; K377-G379 PolarHBondContact O-N 3Å
378	G	33.6	Very low	54.8	Low	78 Å²	78	117.3 Å²	117.3	80%	0.804	63%	0.629	S	S	*	*			trans	-47.9	111.3	-175.2	0	0	0	0	0	110.8	S376 R380	S376-G378 PolarHBondContact O-N 3.42Å; S376-G378 VanDerWaalsContact O-N 3.11Å; G378-R380 PolarHBondContact O-N 2.73Å
379	G	40	Very low	57.4	Low	56 Å²	56	115.3 Å²	115.3	58%	0.577	61%	0.608	S	S	*	*			trans	-65.2	103.7	-167.6	0	0	0	0	0	110.9	K377 F381	K377-G379 PolarHBondContact O-N 3Å; G379-F381 WeakPolarHBondContact O-CD2 3.33Å; G379-F381 PolarHBondContact O-N 2.84Å
380	R	47	Very low	60.4	Low	215 Å²	215	107 Å²	107	81%	0.811	58%	0.575	S	S	*	*			trans	-66.1	108.5	169.4	-144.6	-178.5	-166.8	150.2	5	106.9	G378 D382	G378-R380 PolarHBondContact O-N 2.73Å; R380-D382 WeakPolarHBondContact CD-OD1 3.45Å; R380-D382 VanDerWaalsContact CG-OD1 3.29Å; R380-D382 WeakPolarHBondContact CG-OD1 3.48Å; R380-D382 IonicContact NE-OD1 2.61Å; R380-D382 PolarHBondContact O-N 3.43Å
381	F	68.3	Low	63	Low	208 Å²	208	104.8 Å²	104.8	91%	0.912	57%	0.568	S	S	*	*			trans	-75.2	60.7	179.3	-74	-84.8	0	0	0	110.4	G379 L383	G379-F381 WeakPolarHBondContact O-CD2 3.33Å; G379-F381 PolarHBondContact O-N 2.84Å; F381-L383 PolarHBondContact O-N 2.66Å
382	D	81.7	Confident	65.6	Low	82 Å²	82	99.1 Å²	99.1	44%	0.439	55%	0.548	S	S	.	.			trans	-68.8	127.9	179	-64.7	-25.9	0	0	0	109.5	R380	R380-D382 WeakPolarHBondContact CD-OD1 3.45Å; R380-D382 VanDerWaalsContact CG-OD1 3.29Å; R380-D382 WeakPolarHBondContact CG-OD1 3.48Å; R380-D382 IonicContact NE-OD1 2.61Å; R380-D382 PolarHBondContact O-N 3.43Å
383	L	88	Confident	68.5	Low	110 Å²	110	96.1 Å²	96.1	58%	0.576	52%	0.522	S	S	*	.			trans	-54.2	144	176.4	-66.7	173.6	0	0	0	110.5	F381 T385 E386 K387	F381-L383 PolarHBondContact O-N 2.66Å; L383-T385 PolarHBondContact O-N 2.69Å; L383-E386 PolarHBondContact O-N 3.29Å; L383-K387 PolarHBondContact O-N 2.86Å
384	W	90.6	Very high	71.1	Confident	32 Å²	32	98.8 Å²	98.8	12%	0.121	52%	0.522	C	S	.	.	H	α-helix	trans	-55.7	-28.1	-179.3	-75.1	25.2	0	0	0	113.6	E386 Y388 I589 E593 L595 L620 T624	W384-E386 VanDerWaalsContact C-N 3.28Å; W384-E386 PolarHBondContact O-N 3.02Å; W384-Y388 HydrophobicContact CB-CD2 4.21Å; W384-Y388 HydrophobicContact CD2-CE2 4.41Å; W384-Y388 HydrophobicContact CG-CD2 4.41Å; W384-Y388 HydrophobicContact CG-CE2 4.37Å; W384-Y388 WeakPolarHBondContact O-CB 3.38Å; W384-Y388 PolarHBondContact O-N 2.91Å; W384-I589 HydrophobicContact CE3-CG2 4.06Å; W384-I589 HydrophobicContact CZ3-CG2 4.09Å; W384-E593 VanDerWaalsContact CE2-OE1 3.26Å; W384-E593 HydrophobicContact CH2-CB 4.32Å; W384-E593 HydrophobicContact CH2-CG 3.94Å; W384-E593 HydrophobicContact CZ2-CB 4.29Å; W384-E593 HydrophobicContact CZ2-CG 3.78Å; W384-E593 HydrophobicContact CZ3-CG 4.45Å; W384-E593 PolarHBondContact NE1-OE1 2.99Å; W384-E593 VanDerWaalsContact NE1-OE1 3.16Å; W384-L595 HydrophobicContact CH2-CD1 3.62Å; W384-L595 HydrophobicContact CZ2-CD1 4.3Å; W384-L620 HydrophobicContact CH2-CG 4.37Å; W384-L620 HydrophobicContact CZ3-CB 4.22Å; W384-L620 HydrophobicContact CZ3-CD2 3.84Å; W384-L620 HydrophobicContact CZ3-CG 3.73Å; W384-T624 HydrophobicContact CH2-CG2 4.27Å; W384-T624 WeakPolarHBondContact CH2-OG1 3.43Å; W384-T624 WeakPolarHBondContact CZ2-OG1 3.26Å
385	T	90.3	Very high	74.1	Confident	35 Å²	35	96.6 Å²	96.6	22%	0.215	50%	0.502	C	S	.	.	H	α-helix	trans	-64.7	-27.7	174.7	48.4	0	0	0	0	113.7	L383 R614 L617	L383-T385 PolarHBondContact O-N 2.69Å; T385-R614 HydrophobicContact CG2-CG 3.81Å; T385-L617 HydrophobicContact CG2-CB 4.04Å
386	E	89.5	Confident	76.7	Confident	106 Å²	106	90.8 Å²	90.8	50%	0.495	48%	0.475	S	S	.	.	H	α-helix	trans	-96.4	-44.2	172.8	-68.4	-63.2	127.3	0	0	111.3	L383 W384 Y388 K389	L383-E386 PolarHBondContact O-N 3.29Å; W384-E386 VanDerWaalsContact C-N 3.28Å; W384-E386 PolarHBondContact O-N 3.02Å; E386-Y388 PolarHBondContact O-N 2.86Å; E386-K389 WeakPolarHBondContact O-CB 3.29Å; E386-K389 PolarHBondContact O-N 3.31Å; E386-K389 WeakPolarHBondContact OE1-CD 3.28Å; E386-K389 IonicContact OE1-NZ 3.36Å; E386-K389 PolarHBondContact OE1-NZ 3.06Å; E386-K389 WeakPolarHBondContact OE2-CD 3.16Å; E386-K389 WeakPolarHBondContact OE2-CE 3.33Å; E386-K389 IonicContact OE2-NZ 3.4Å; E386-K389 PolarHBondContact OE2-NZ 3.27Å
387	K	91.3	Very high	79.6	Confident	104 Å²	104	86.6 Å²	86.6	45%	0.452	44%	0.443	S	S	.	.	H	α-helix	trans	-55.7	-33.4	176.2	-176.5	-177.9	173.6	-174.1	0	113.4	L383 E593	L383-K387 PolarHBondContact O-N 2.86Å; K387-E593 IonicContact NZ-OE1 3.97Å; K387-E593 PolarHBondContact NZ-OE1 2.78Å; K387-E593 IonicContact NZ-OE2 3.97Å; K387-E593 PolarHBondContact NZ-OE2 3.06Å
388	Y	92.5	Very high	82	Confident	45 Å²	45	80.4 Å²	80.4	18%	0.176	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	19.3	176.6	-61.7	-65	0	0	0	113.9	W384 E386 P390 I589 K592 E593	W384-Y388 HydrophobicContact CB-CD2 4.21Å; W384-Y388 HydrophobicContact CD2-CE2 4.41Å; W384-Y388 HydrophobicContact CG-CD2 4.41Å; W384-Y388 HydrophobicContact CG-CE2 4.37Å; W384-Y388 WeakPolarHBondContact O-CB 3.38Å; W384-Y388 PolarHBondContact O-N 2.91Å; E386-Y388 PolarHBondContact O-N 2.86Å; Y388-P390 WeakPolarHBondContact O-CD 3.28Å; Y388-I589 HydrophobicContact CD1-CD1 4.32Å; Y388-I589 HydrophobicContact CD1-CG1 3.91Å; Y388-I589 HydrophobicContact CD2-CD1 4.21Å; Y388-I589 HydrophobicContact CD2-CG1 4.21Å; Y388-I589 HydrophobicContact CD2-CG2 3.7Å; Y388-I589 HydrophobicContact CE1-CG1 4.34Å; Y388-I589 HydrophobicContact CE2-CG2 3.61Å; Y388-I589 HydrophobicContact CG-CD1 3.81Å; Y388-I589 HydrophobicContact CG-CG1 3.84Å; Y388-I589 HydrophobicContact CG-CG2 4.23Å; Y388-K592 HydrophobicContact CE1-CB 4.45Å; Y388-K592 HydrophobicContact CE1-CD 3.86Å; Y388-E593 HydrophobicContact CE2-CG 4.14Å; Y388-E593 WeakPolarHBondContact CE2-OE1 3.43Å; Y388-E593 WeakPolarHBondContact OH-CG 3.29Å; Y388-E593 PolarHBondContact OH-OE1 3.44Å; Y388-E593 PolarHBondContact OH-OE2 3.17Å
389	K	92.4	Very high	84.5	Confident	62 Å²	62	77.5 Å²	77.5	27%	0.27	39%	0.389	S	S	.	.			trans	-60.1	128.1	173.4	-170.2	161.5	-179	166.9	0	110.1	E386 T391 T457	E386-K389 WeakPolarHBondContact O-CB 3.29Å; E386-K389 PolarHBondContact O-N 3.31Å; E386-K389 WeakPolarHBondContact OE1-CD 3.28Å; E386-K389 IonicContact OE1-NZ 3.36Å; E386-K389 PolarHBondContact OE1-NZ 3.06Å; E386-K389 WeakPolarHBondContact OE2-CD 3.16Å; E386-K389 WeakPolarHBondContact OE2-CE 3.33Å; E386-K389 IonicContact OE2-NZ 3.4Å; E386-K389 PolarHBondContact OE2-NZ 3.27Å; K389-T391 PolarHBondContact O-N 3.02Å; K389-T391 VanDerWaalsContact O-N 3.13Å; K389-T457 HydrophobicContact CG-CG2 4.41Å
390	P	93.3	Very high	86.7	Confident	35 Å²	35	81.5 Å²	81.5	23%	0.227	39%	0.393	C	S	.	.			trans	-51.1	119.4	175.5	-32.8	37.6	0	0	0	112.6	Y388 Q395 V396 T457 L461	Y388-P390 WeakPolarHBondContact O-CD 3.28Å; P390-Q395 HydrophobicContact CB-CB 3.98Å; P390-V396 HydrophobicContact CB-CG2 4.31Å; P390-T457 HydrophobicContact CB-CG2 3.96Å; P390-T457 HydrophobicContact CG-CG2 4.17Å; P390-L461 HydrophobicContact CB-CD1 3.85Å
391	T	90.9	Very high	88.5	Confident	107 Å²	107	72.9 Å²	72.9	66%	0.656	37%	0.371	S	S	*	.			trans	-99.2	-20.2	177.2	57.1	0	0	0	0	112.8	K389 Q395 L461	K389-T391 PolarHBondContact O-N 3.02Å; K389-T391 VanDerWaalsContact O-N 3.13Å; T391-Q395 PolarHBondContact OG1-NE2 3.09Å; T391-Q395 PolarHBondContact OG1-OE1 2.82Å; T391-L461 WeakPolarHBondContact O-CD2 3.32Å
392	T	92.3	Very high	89.2	Confident	68 Å²	68	69 Å²	69	42%	0.417	37%	0.367	S	S	.	.	S	Bend	trans	-123.5	142.5	177.2	-46.6	0	0	0	0	109.9	K394 Q395	T392-K394 HydrophobicContact CG2-CB 4.45Å; T392-K394 PolarHBondContact O-N 3.22Å; T392-Q395 WeakPolarHBondContact O-CB 3.29Å; T392-Q395 PolarHBondContact O-N 2.83Å; T392-Q395 PolarHBondContact OG1-NE2 2.86Å
393	L	90.7	Very high	89.3	Confident	16 Å²	16	72.8 Å²	72.8	8%	0.084	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-55.6	-28.5	-177.4	-156.1	-174.6	0	0	0	113.7	Q395 V396 L406 L410 L461 E465	L393-Q395 VanDerWaalsContact C-N 3.29Å; L393-Q395 PolarHBondContact O-N 3.35Å; L393-V396 PolarHBondContact O-N 3.01Å; L393-L406 HydrophobicContact CD1-CD2 3.79Å; L393-L406 HydrophobicContact CD1-CG 4.4Å; L393-L406 HydrophobicContact CD2-CD1 3.82Å; L393-L406 HydrophobicContact CD2-CD2 4.17Å; L393-L406 HydrophobicContact CD2-CG 3.89Å; L393-L406 HydrophobicContact CG-CD1 3.93Å; L393-L406 HydrophobicContact CG-CD2 3.83Å; L393-L406 HydrophobicContact CG-CG 4.07Å; L393-L410 HydrophobicContact CD1-CD1 4.18Å; L393-L410 HydrophobicContact CD1-CD2 4.02Å; L393-L461 HydrophobicContact CD2-CB 3.6Å; L393-E465 HydrophobicContact CD1-CB 4.35Å; L393-E465 HydrophobicContact CD1-CG 4.42Å; L393-E465 WeakPolarHBondContact CD1-OE1 3.31Å
394	K	89.8	Confident	89.3	Confident	170 Å²	170	68.1 Å²	68.1	74%	0.739	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-65.5	-22.8	173.5	-65.4	175.8	-177.9	171	0	114.6	T392 Q400	T392-K394 HydrophobicContact CG2-CB 4.45Å; T392-K394 PolarHBondContact O-N 3.22Å; K394-Q400 PolarHBondContact O-NE2 3.3Å
395	Q	91.3	Very high	89.4	Confident	91 Å²	91	67.3 Å²	67.3	43%	0.425	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-84	-8.6	-177.1	-61.6	167.7	3.7	0	0	112.9	P390 T391 T392 L393 I397	P390-Q395 HydrophobicContact CB-CB 3.98Å; T391-Q395 PolarHBondContact OG1-NE2 3.09Å; T391-Q395 PolarHBondContact OG1-OE1 2.82Å; T392-Q395 WeakPolarHBondContact O-CB 3.29Å; T392-Q395 PolarHBondContact O-N 2.83Å; T392-Q395 PolarHBondContact OG1-NE2 2.86Å; L393-Q395 VanDerWaalsContact C-N 3.29Å; L393-Q395 PolarHBondContact O-N 3.35Å; Q395-I397 PolarHBondContact O-N 2.9Å
396	V	91.8	Very high	89.4	Confident	5 Å²	5	66 Å²	66	3%	0.03	35%	0.347	C	S	.	.	S	Bend	trans	-70.7	111.8	179.9	-174.7	0	0	0	0	110.5	P390 L393 G398 Q399 L406 L461	P390-V396 HydrophobicContact CB-CG2 4.31Å; L393-V396 PolarHBondContact O-N 3.01Å; V396-G398 PolarHBondContact O-N 2.83Å; V396-Q399 HydrophobicContact CG1-CB 3.94Å; V396-Q399 HydrophobicContact CG1-CG 4.05Å; V396-L406 HydrophobicContact CB-CD1 3.81Å; V396-L406 HydrophobicContact CG1-CD1 4.1Å; V396-L406 HydrophobicContact CG2-CD1 3.98Å; V396-L461 HydrophobicContact CG2-CD1 3.61Å
397	I	90.6	Very high	89.6	Confident	35 Å²	35	63.1 Å²	63.1	18%	0.179	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	134	-174.9	-56.8	172.8	0	0	0	110.6	Q395 Q399 P577 Q581 I582 A585 I613	Q395-I397 PolarHBondContact O-N 2.9Å; I397-Q399 PolarHBondContact O-N 2.88Å; I397-P577 HydrophobicContact CG2-CB 4.15Å; I397-Q581 HydrophobicContact CG2-CB 3.98Å; I397-I582 HydrophobicContact CG2-CG1 4.19Å; I397-A585 HydrophobicContact CD1-CB 3.4Å; I397-A585 HydrophobicContact CG1-CB 3.97Å; I397-I613 HydrophobicContact CB-CD1 4.05Å; I397-I613 HydrophobicContact CD1-CD1 4.01Å; I397-I613 HydrophobicContact CD1-CG2 4.23Å; I397-I613 HydrophobicContact CG2-CD1 4.33Å
398	G	86	Confident	89.6	Confident	28 Å²	28	60 Å²	60	29%	0.289	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	-24	175.4	0	0	0	0	0	116.3	V396 Q400	V396-G398 PolarHBondContact O-N 2.83Å; G398-Q400 PolarHBondContact O-N 3.24Å
399	Q	86.2	Confident	89.7	Confident	17 Å²	17	57.9 Å²	57.9	8%	0.079	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	16.3	-173.6	-60	-61.7	-30.9	0	0	115	V396 I397 S404 C405 L406 F574	V396-Q399 HydrophobicContact CG1-CB 3.94Å; V396-Q399 HydrophobicContact CG1-CG 4.05Å; I397-Q399 PolarHBondContact O-N 2.88Å; Q399-S404 WeakPolarHBondContact O-CB 3.23Å; Q399-S404 PolarHBondContact O-OG 3.36Å; Q399-C405 VanDerWaalsContact OE1-N 3.16Å; Q399-L406 HydrophobicContact CB-CB 3.8Å; Q399-L406 HydrophobicContact CB-CD1 3.93Å; Q399-F574 HydrophobicContact CG-CD1 4.19Å; Q399-F574 HydrophobicContact CG-CE1 3.96Å
400	Q	85.3	Confident	89.6	Confident	140 Å²	140	55.4 Å²	55.4	65%	0.654	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.4	-177.5	-66.6	175.3	-13.8	0	0	115	K394 G398	K394-Q400 PolarHBondContact O-NE2 3.3Å; G398-Q400 PolarHBondContact O-N 3.24Å
401	G	86.7	Confident	89.5	Confident	34 Å²	34	57 Å²	57	35%	0.351	31%	0.311	S	S	.	.	S	Bend	trans	-68.8	151.7	-175.2	0	0	0	0	0	113.8	K403 S404 N407	G401-K403 PolarHBondContact O-N 2.89Å; G401-S404 WeakPolarHBondContact O-CB 3.38Å; G401-S404 PolarHBondContact O-N 3.46Å; G401-S404 PolarHBondContact O-OG 3.12Å; G401-N407 PolarHBondContact O-ND2 3.09Å
402	P	82.8	Confident	89.5	Confident	127 Å²	127	51.9 Å²	51.9	83%	0.825	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-8.2	-172.7	27.2	-36.5	0	0	0	115.1
403	K	82.3	Confident	89.4	Confident	161 Å²	161	48.8 Å²	48.8	70%	0.7	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	20.7	172.2	-59.9	-166.1	177.1	-166.9	0	113	G401 K408	G401-K403 PolarHBondContact O-N 2.89Å; K403-K408 WeakPolarHBondContact O-CE 3.39Å
404	S	89.7	Confident	89.3	Confident	13 Å²	13	55.2 Å²	55.2	9%	0.091	28%	0.284	C	S	.	.	S	Bend	trans	-65.1	164.6	175.4	67.9	0	0	0	0	112.1	Q399 G401 L406 N407 K408	Q399-S404 WeakPolarHBondContact O-CB 3.23Å; Q399-S404 PolarHBondContact O-OG 3.36Å; G401-S404 WeakPolarHBondContact O-CB 3.38Å; G401-S404 PolarHBondContact O-N 3.46Å; G401-S404 PolarHBondContact O-OG 3.12Å; S404-L406 VanDerWaalsContact C-N 3.27Å; S404-L406 PolarHBondContact O-N 3.13Å; S404-N407 PolarHBondContact O-N 2.78Å; S404-N407 PolarHBondContact OG-N 3.5Å; S404-N407 VanDerWaalsContact OG-N 3.12Å; S404-N407 PolarHBondContact OG-ND2 3.35Å; S404-N407 VanDerWaalsContact OG-ND2 3.13Å; S404-K408 WeakPolarHBondContact O-CG 3.37Å; S404-K408 PolarHBondContact O-N 2.92Å
405	C	90.8	Very high	89.1	Confident	15 Å²	15	47.7 Å²	47.7	10%	0.101	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-34	176.4	-66.1	0	0	0	0	111.6	Q399 K408 L409 L572 R573 F574	Q399-C405 VanDerWaalsContact OE1-N 3.16Å; C405-K408 PolarHBondContact O-N 3.47Å; C405-L409 WeakPolarHBondContact O-CB 3.37Å; C405-L409 PolarHBondContact O-N 3.5Å; C405-L572 HydrophobicContact CB-CB 4.32Å; C405-R573 PolarHBondContact SG-N 3.46Å; C405-R573 PolarHBondContact SG-O 3Å; C405-F574 HydrophobicContact CB-CD2 3.76Å; C405-F574 HydrophobicContact CB-CE1 4.37Å; C405-F574 HydrophobicContact CB-CE2 3.37Å; C405-F574 HydrophobicContact CB-CG 4.38Å; C405-F574 HydrophobicContact CB-CZ 3.72Å
406	L	92.1	Very high	89	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-55.4	172.4	178.6	163	0	0	0	111.9	L393 V396 Q399 S404 K408 L409 L410 T458	L393-L406 HydrophobicContact CD1-CD2 3.79Å; L393-L406 HydrophobicContact CD1-CG 4.4Å; L393-L406 HydrophobicContact CD2-CD1 3.82Å; L393-L406 HydrophobicContact CD2-CD2 4.17Å; L393-L406 HydrophobicContact CD2-CG 3.89Å; L393-L406 HydrophobicContact CG-CD1 3.93Å; L393-L406 HydrophobicContact CG-CD2 3.83Å; L393-L406 HydrophobicContact CG-CG 4.07Å; V396-L406 HydrophobicContact CB-CD1 3.81Å; V396-L406 HydrophobicContact CG1-CD1 4.1Å; V396-L406 HydrophobicContact CG2-CD1 3.98Å; Q399-L406 HydrophobicContact CB-CB 3.8Å; Q399-L406 HydrophobicContact CB-CD1 3.93Å; S404-L406 VanDerWaalsContact C-N 3.27Å; S404-L406 PolarHBondContact O-N 3.13Å; L406-K408 VanDerWaalsContact C-N 3.3Å; L406-K408 PolarHBondContact O-N 3.46Å; L406-L409 PolarHBondContact O-N 2.93Å; L406-L410 WeakPolarHBondContact O-CB 3.48Å; L406-L410 PolarHBondContact O-N 2.9Å; L406-T458 HydrophobicContact CB-CG2 3.69Å; L406-T458 HydrophobicContact CD1-CG2 4.2Å; L406-T458 HydrophobicContact CG-CG2 3.89Å
407	N	92	Very high	88.5	Confident	46 Å²	46	46.4 Å²	46.4	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-66.5	-31.9	-177.6	-78.2	-53.5	0	0	0	112.4	G401 S404 T411	G401-N407 PolarHBondContact O-ND2 3.09Å; S404-N407 PolarHBondContact O-N 2.78Å; S404-N407 PolarHBondContact OG-N 3.5Å; S404-N407 VanDerWaalsContact OG-N 3.12Å; S404-N407 PolarHBondContact OG-ND2 3.35Å; S404-N407 VanDerWaalsContact OG-ND2 3.13Å; N407-T411 WeakPolarHBondContact O-CB 3.33Å; N407-T411 PolarHBondContact O-N 2.9Å; N407-T411 PolarHBondContact O-OG1 2.91Å
408	K	92.6	Very high	88.1	Confident	39 Å²	39	50.9 Å²	50.9	17%	0.17	27%	0.267	C	S	.	.	H	α-helix	trans	-69.1	-44.5	172.9	-69.4	178.7	-174.7	-172.2	0	112.6	K403 S404 C405 L406 L410 T411 W412 D437 F570 L572	K403-K408 WeakPolarHBondContact O-CE 3.39Å; S404-K408 WeakPolarHBondContact O-CG 3.37Å; S404-K408 PolarHBondContact O-N 2.92Å; C405-K408 PolarHBondContact O-N 3.47Å; L406-K408 VanDerWaalsContact C-N 3.3Å; L406-K408 PolarHBondContact O-N 3.46Å; K408-L410 VanDerWaalsContact C-N 3.34Å; K408-L410 PolarHBondContact O-N 3.18Å; K408-T411 PolarHBondContact O-N 2.97Å; K408-W412 VanDerWaalsContact O-CB 3.28Å; K408-W412 WeakPolarHBondContact O-CB 3.4Å; K408-W412 PolarHBondContact O-N 3.28Å; K408-D437 VanDerWaalsContact CE-CG 3.48Å; K408-D437 WeakPolarHBondContact CE-OD1 3.39Å; K408-D437 WeakPolarHBondContact CE-OD2 3.5Å; K408-D437 IonicContact NZ-OD1 3.14Å; K408-D437 PolarHBondContact NZ-OD1 3.11Å; K408-D437 IonicContact NZ-OD2 3.99Å; K408-D437 PolarHBondContact NZ-OD2 3.16Å; K408-F570 HydrophobicContact CB-CE1 4.21Å; K408-F570 HydrophobicContact CB-CZ 4.17Å; K408-F570 HydrophobicContact CD-CZ 4.45Å; K408-L572 HydrophobicContact CB-CD2 3.73Å; K408-L572 HydrophobicContact CD-CD2 3.98Å
409	L	93.2	Very high	87.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-44.5	176.3	-176.3	63.6	0	0	0	111.1	C405 L406 W412 L413 A445 L447 C462 I551 L572	C405-L409 WeakPolarHBondContact O-CB 3.37Å; C405-L409 PolarHBondContact O-N 3.5Å; L406-L409 PolarHBondContact O-N 2.93Å; L409-W412 HydrophobicContact CD1-CE3 3.93Å; L409-W412 HydrophobicContact CD1-CZ3 4.25Å; L409-W412 PolarHBondContact O-N 3.4Å; L409-L413 HydrophobicContact CG-CD1 4.24Å; L409-L413 WeakPolarHBondContact O-CB 3.33Å; L409-L413 WeakPolarHBondContact O-CG 3.25Å; L409-L413 PolarHBondContact O-N 2.81Å; L409-A445 HydrophobicContact CD1-CB 3.93Å; L409-L447 HydrophobicContact CD1-CD1 4.18Å; L409-L447 HydrophobicContact CD2-CD1 4.28Å; L409-L447 HydrophobicContact CD2-CD2 4.09Å; L409-C462 HydrophobicContact CD2-CB 4.14Å; L409-C462 HydrophobicContact CG-CB 4.39Å; L409-I551 HydrophobicContact CD1-CD1 4.25Å; L409-I551 HydrophobicContact CD1-CG1 4.44Å; L409-I551 HydrophobicContact CD2-CD1 4.49Å; L409-L572 HydrophobicContact CB-CD1 3.82Å; L409-L572 HydrophobicContact CD1-CD1 4.03Å; L409-L572 HydrophobicContact CG-CD1 4.48Å
410	L	91.8	Very high	87.6	Confident	9 Å²	9	53.7 Å²	53.7	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-61.3	-44.6	177.3	-168.8	73.5	0	0	0	112.1	L393 L406 K408 R414 C462 E465 L466	L393-L410 HydrophobicContact CD1-CD1 4.18Å; L393-L410 HydrophobicContact CD1-CD2 4.02Å; L406-L410 WeakPolarHBondContact O-CB 3.48Å; L406-L410 PolarHBondContact O-N 2.9Å; K408-L410 VanDerWaalsContact C-N 3.34Å; K408-L410 PolarHBondContact O-N 3.18Å; L410-R414 WeakPolarHBondContact O-CB 3.45Å; L410-R414 WeakPolarHBondContact O-CG 3.28Å; L410-R414 PolarHBondContact O-N 2.86Å; L410-C462 HydrophobicContact CD1-CB 4.38Å; L410-E465 WeakPolarHBondContact CD1-OE2 3.25Å; L410-E465 WeakPolarHBondContact CD2-OE2 3.37Å; L410-L466 HydrophobicContact CD1-CD1 4.1Å; L410-L466 HydrophobicContact CD1-CD2 3.69Å; L410-L466 HydrophobicContact CD1-CG 3.81Å; L410-L466 HydrophobicContact CG-CD2 4.42Å
411	T	90.3	Very high	86.8	Confident	68 Å²	68	47.6 Å²	47.6	42%	0.417	25%	0.245	S	C	.	.	H	α-helix	trans	-66.7	-40.2	177.3	-55.3	0	0	0	0	111.9	N407 K408 S415	N407-T411 WeakPolarHBondContact O-CB 3.33Å; N407-T411 PolarHBondContact O-N 2.9Å; N407-T411 PolarHBondContact O-OG1 2.91Å; K408-T411 PolarHBondContact O-N 2.97Å; T411-S415 WeakPolarHBondContact O-CB 3.28Å; T411-S415 PolarHBondContact O-N 3.48Å; T411-S415 PolarHBondContact O-OG 2.97Å
412	W	91.7	Very high	85.6	Confident	1 Å²	1	52.4 Å²	52.4	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-44.7	176.2	175.8	75.7	0	0	0	111.9	K408 L409 S415 W416 G439 F442 K443 A444 A445 P549 I551 F570	K408-W412 VanDerWaalsContact O-CB 3.28Å; K408-W412 WeakPolarHBondContact O-CB 3.4Å; K408-W412 PolarHBondContact O-N 3.28Å; L409-W412 HydrophobicContact CD1-CE3 3.93Å; L409-W412 HydrophobicContact CD1-CZ3 4.25Å; L409-W412 PolarHBondContact O-N 3.4Å; W412-S415 PolarHBondContact O-N 2.73Å; W412-S415 PolarHBondContact O-OG 2.85Å; W412-W416 AromaticContact CE2-CD1 3.65Å; W412-W416 AromaticContact CH2-CD1 3.72Å; W412-W416 AromaticContact CH2-NE1 3.77Å; W412-W416 AromaticContact CZ2-CD1 3.4Å; W412-W416 AromaticContact CZ2-NE1 3.47Å; W412-W416 WeakPolarHBondContact O-CA 3.07Å; W412-W416 WeakPolarHBondContact O-CB 3.47Å; W412-W416 PolarHBondContact O-N 3.17Å; W412-G439 VanDerWaalsContact CD1-C 3.49Å; W412-G439 PolarHBondContact NE1-O 3.19Å; W412-F442 WeakPolarHBondContact CZ2-O 3.4Å; W412-F442 PolarHBondContact NE1-O 3.45Å; W412-K443 WeakPolarHBondContact CZ2-O 3.26Å; W412-A444 VanDerWaalsContact CZ2-C 3.42Å; W412-A445 HydrophobicContact CD2-CB 4.37Å; W412-A445 HydrophobicContact CE3-CB 3.95Å; W412-A445 HydrophobicContact CH2-CB 3.83Å; W412-A445 HydrophobicContact CZ2-CB 4.24Å; W412-A445 HydrophobicContact CZ3-CB 3.67Å; W412-P549 HydrophobicContact CH2-CB 4.07Å; W412-P549 HydrophobicContact CZ3-CB 4.24Å; W412-I551 HydrophobicContact CZ3-CG1 4.39Å; W412-F570 HydrophobicContact CB-CD1 4.08Å; W412-F570 HydrophobicContact CB-CE1 3.98Å; W412-F570 AromaticContact CD1-CD1 3.95Å; W412-F570 HydrophobicContact CD2-CD1 4.37Å; W412-F570 AromaticContact CG-CD1 3.85Å; W412-F570 HydrophobicContact CG-CD1 3.85Å; W412-F570 HydrophobicContact CG-CE1 4.24Å
413	L	90.3	Very high	84.5	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-48.3	174.9	-73.8	171.5	0	0	0	111.9	L409 S415 W416 C462 L466 V518 P549 I551	L409-L413 HydrophobicContact CG-CD1 4.24Å; L409-L413 WeakPolarHBondContact O-CB 3.33Å; L409-L413 WeakPolarHBondContact O-CG 3.25Å; L409-L413 PolarHBondContact O-N 2.81Å; L413-S415 VanDerWaalsContact C-N 3.26Å; L413-S415 PolarHBondContact O-N 2.63Å; L413-W416 WeakPolarHBondContact O-CB 3.17Å; L413-W416 PolarHBondContact O-N 2.86Å; L413-W416 VanDerWaalsContact O-N 3.15Å; L413-C462 HydrophobicContact CD1-CB 3.99Å; L413-L466 HydrophobicContact CB-CD1 3.38Å; L413-L466 HydrophobicContact CD1-CD1 4.02Å; L413-L466 HydrophobicContact CG-CD1 4.34Å; L413-V518 HydrophobicContact CD2-CG1 4.43Å; L413-V518 HydrophobicContact CD2-CG2 4.37Å; L413-P549 HydrophobicContact CD2-CB 3.89Å; L413-P549 HydrophobicContact CD2-CG 4.2Å; L413-I551 HydrophobicContact CD1-CD1 4.35Å; L413-I551 HydrophobicContact CD2-CD1 4.48Å
414	R	88.2	Confident	83.5	Confident	151 Å²	151	43.8 Å²	43.8	57%	0.57	24%	0.24	S	C	*	.	H	α-helix	trans	-57.1	-36.9	177.1	-76.5	179.8	-176.3	173	10.8	113.1	L410 E465 L466	L410-R414 WeakPolarHBondContact O-CB 3.45Å; L410-R414 WeakPolarHBondContact O-CG 3.28Å; L410-R414 PolarHBondContact O-N 2.86Å; R414-E465 IonicContact CZ-OE2 3.49Å; R414-E465 IonicContact NH2-OE2 2.75Å; R414-E465 PolarHBondContact NH2-OE2 2.85Å; R414-L466 HydrophobicContact CG-CD1 4.06Å; R414-L466 HydrophobicContact CG-CD2 3.42Å; R414-L466 VanDerWaalsContact CG-CD2 3.42Å; R414-L466 HydrophobicContact CG-CG 4.4Å
415	S	86.3	Confident	81.9	Confident	13 Å²	13	51.8 Å²	51.8	9%	0.091	27%	0.273	C	S	.	.	H	α-helix	trans	-93.1	-5	-179.8	63.6	0	0	0	0	114.3	T411 W412 L413 H417 Q418 W419	T411-S415 WeakPolarHBondContact O-CB 3.28Å; T411-S415 PolarHBondContact O-N 3.48Å; T411-S415 PolarHBondContact O-OG 2.97Å; W412-S415 PolarHBondContact O-N 2.73Å; W412-S415 PolarHBondContact O-OG 2.85Å; L413-S415 VanDerWaalsContact C-N 3.26Å; L413-S415 PolarHBondContact O-N 2.63Å; S415-H417 PolarHBondContact O-N 3.31Å; S415-Q418 WeakPolarHBondContact O-CB 3.31Å; S415-Q418 PolarHBondContact O-N 2.82Å; S415-W419 PolarHBondContact O-N 3.22Å
416	W	88.3	Confident	80.1	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-57.1	-46.6	-170.4	-164.2	100	0	0	0	112.6	W412 L413 Q418 W419 H420 K443 L515 R547 I548 P549	W412-W416 AromaticContact CE2-CD1 3.65Å; W412-W416 AromaticContact CH2-CD1 3.72Å; W412-W416 AromaticContact CH2-NE1 3.77Å; W412-W416 AromaticContact CZ2-CD1 3.4Å; W412-W416 AromaticContact CZ2-NE1 3.47Å; W412-W416 WeakPolarHBondContact O-CA 3.07Å; W412-W416 WeakPolarHBondContact O-CB 3.47Å; W412-W416 PolarHBondContact O-N 3.17Å; L413-W416 WeakPolarHBondContact O-CB 3.17Å; L413-W416 PolarHBondContact O-N 2.86Å; L413-W416 VanDerWaalsContact O-N 3.15Å; W416-Q418 VanDerWaalsContact C-N 3.29Å; W416-Q418 PolarHBondContact O-N 2.88Å; W416-W419 PolarHBondContact O-N 2.9Å; W416-W419 VanDerWaalsContact O-N 3.16Å; W416-H420 HydrophobicContact CD2-CB 3.96Å; W416-H420 AromaticContact CE2-CD2 3.7Å; W416-H420 HydrophobicContact CE3-CB 3.77Å; W416-H420 HydrophobicContact CH2-CB 3.6Å; W416-H420 HydrophobicContact CZ2-CB 3.81Å; W416-H420 HydrophobicContact CZ3-CB 3.59Å; W416-H420 AromaticContact NE1-CD2 3.74Å; W416-H420 PolarHBondContact O-N 3.46Å; W416-K443 HydrophobicContact CZ2-CB 4.22Å; W416-K443 HydrophobicContact CZ2-CG 4.3Å; W416-K443 PolarHBondContact NE1-O 3.43Å; W416-L515 HydrophobicContact CB-CD1 4.33Å; W416-L515 HydrophobicContact CE3-CD2 3.64Å; W416-L515 HydrophobicContact CZ3-CD2 4.12Å; W416-R547 VanDerWaalsContact CH2-C 3.46Å; W416-R547 VanDerWaalsContact CH2-O 3.28Å; W416-R547 WeakPolarHBondContact CH2-O 3.37Å; W416-R547 WeakPolarHBondContact CZ3-O 3.35Å; W416-I548 WeakPolarHBondContact CZ2-O 3.5Å; W416-P549 HydrophobicContact CD2-CB 4.08Å; W416-P549 HydrophobicContact CD2-CG 4.47Å; W416-P549 HydrophobicContact CG-CB 4.03Å; W416-P549 HydrophobicContact CZ2-CB 4.5Å
417	H	82.1	Confident	78.1	Confident	67 Å²	67	65.3 Å²	65.3	31%	0.31	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-38	179.3	-166.2	91.1	0	0	0	112.2	S415 W419 H420 G421 G513 L515	S415-H417 PolarHBondContact O-N 3.31Å; H417-W419 PolarHBondContact O-N 2.76Å; H417-W419 VanDerWaalsContact O-N 3.17Å; H417-H420 PolarHBondContact O-N 2.7Å; H417-G421 WeakPolarHBondContact O-CA 3.45Å; H417-G421 PolarHBondContact O-N 2.93Å; H417-G513 PolarHBondContact CE1-O 3.18Å; H417-G513 VanDerWaalsContact CG-O 3.31Å; H417-G513 PolarHBondContact ND1-O 3.22Å; H417-L515 HydrophobicContact CB-CD2 3.95Å; H417-L515 HydrophobicContact CB-CG 4.35Å
418	Q	82.1	Confident	75.7	Confident	128 Å²	128	69.6 Å²	69.6	60%	0.598	36%	0.358	S	S	*	.	H	α-helix	trans	-63.4	-24.7	-179.5	-52.9	178.4	1.7	0	0	113	S415 W416 A424	S415-Q418 WeakPolarHBondContact O-CB 3.31Å; S415-Q418 PolarHBondContact O-N 2.82Å; W416-Q418 VanDerWaalsContact C-N 3.29Å; W416-Q418 PolarHBondContact O-N 2.88Å; Q418-A424 WeakPolarHBondContact O-CB 3.28Å
419	W	79.2	Confident	73.2	Confident	59 Å²	59	70.9 Å²	70.9	22%	0.223	38%	0.382	C	S	.	.	H	α-helix	trans	-107.2	-22.9	-177.7	-57.3	115	0	0	0	114.4	S415 W416 H417 A424 K427 S440	S415-W419 PolarHBondContact O-N 3.22Å; W416-W419 PolarHBondContact O-N 2.9Å; W416-W419 VanDerWaalsContact O-N 3.16Å; H417-W419 PolarHBondContact O-N 2.76Å; H417-W419 VanDerWaalsContact O-N 3.17Å; W419-A424 VanDerWaalsContact C-CB 3.44Å; W419-K427 HydrophobicContact CE3-CD 4.28Å; W419-K427 HydrophobicContact CH2-CD 4.49Å; W419-K427 VanDerWaalsContact CH2-CE 3.44Å; W419-K427 VanDerWaalsContact CZ2-NZ 3.26Å; W419-K427 HydrophobicContact CZ3-CD 3.96Å; W419-K427 HydrophobicContact CZ3-CG 4.18Å; W419-K427 VanDerWaalsContact CZ3-NZ 3.32Å; W419-S440 VanDerWaalsContact NE1-CB 3.3Å
420	H	81.2	Confident	70.5	Confident	45 Å²	45	73.8 Å²	73.8	21%	0.208	41%	0.407	C	S	.	.	H	α-helix	trans	-132.1	-7.9	-172.7	-63.2	-36.3	0	0	0	116	W416 H417 F442	W416-H420 HydrophobicContact CD2-CB 3.96Å; W416-H420 AromaticContact CE2-CD2 3.7Å; W416-H420 HydrophobicContact CE3-CB 3.77Å; W416-H420 HydrophobicContact CH2-CB 3.6Å; W416-H420 HydrophobicContact CZ2-CB 3.81Å; W416-H420 HydrophobicContact CZ3-CB 3.59Å; W416-H420 AromaticContact NE1-CD2 3.74Å; W416-H420 PolarHBondContact O-N 3.46Å; H417-H420 PolarHBondContact O-N 2.7Å; H420-F442 PolarHBondContact NE2-O 3.01Å; H420-F442 VanDerWaalsContact NE2-O 3.13Å
421	G	69.6	Low	68	Low	13 Å²	13	82.5 Å²	82.5	13%	0.134	44%	0.444	C	S	.	.	S	Bend	trans	-68.9	171.6	171.8	0	0	0	0	0	113.4	H417 G423 A424	H417-G421 WeakPolarHBondContact O-CA 3.45Å; H417-G421 PolarHBondContact O-N 2.93Å; G421-G423 PolarHBondContact O-N 3.12Å; G421-A424 WeakPolarHBondContact O-CB 3.36Å; G421-A424 PolarHBondContact O-N 3.26Å; G421-A424 VanDerWaalsContact O-N 3.09Å
422	D	61.3	Low	65.8	Low	135 Å²	135	86.4 Å²	86.4	72%	0.722	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	132.3	176	-75.9	-48.2	0	0	0	110	A424 R547	D422-A424 VanDerWaalsContact C-N 3.35Å; D422-R547 IonicContact OD2-NH1 2.73Å
423	G	59.6	Low	63.2	Low	85 Å²	85	95.5 Å²	95.5	88%	0.876	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-5.9	-168	0	0	0	0	0	115.9	G421	G421-G423 PolarHBondContact O-N 3.12Å
424	A	60.5	Low	60.7	Low	22 Å²	22	97.9 Å²	97.9	18%	0.182	52%	0.52	C	S	.	.			trans	-58.2	141.1	-176	0	0	0	0	0	114.6	Q418 W419 G421 D422 K426	Q418-A424 WeakPolarHBondContact O-CB 3.28Å; W419-A424 VanDerWaalsContact C-CB 3.44Å; G421-A424 WeakPolarHBondContact O-CB 3.36Å; G421-A424 PolarHBondContact O-N 3.26Å; G421-A424 VanDerWaalsContact O-N 3.09Å; D422-A424 VanDerWaalsContact C-N 3.35Å; A424-K426 VanDerWaalsContact C-N 3.27Å; A424-K426 PolarHBondContact O-N 3.48Å
425	K	55.8	Low	58.8	Low	181 Å²	181	95.8 Å²	95.8	79%	0.787	54%	0.535	S	S	*	.			trans	-72.7	75.7	178.3	-71.5	173.9	-178.8	166.1	0	111.2	K427	K425-K427 PolarHBondContact O-N 2.64Å
426	K	54.1	Low	57.4	Low	179 Å²	179	98.2 Å²	98.2	78%	0.778	55%	0.552	S	S	*	*			trans	-48.7	106.7	174.9	-74.9	173.2	-179.2	162.9	0	110.6	A424 T428	A424-K426 VanDerWaalsContact C-N 3.27Å; A424-K426 PolarHBondContact O-N 3.48Å; K426-T428 VanDerWaalsContact C-N 3.32Å; K426-T428 PolarHBondContact O-N 3.37Å
427	K	51.1	Low	56.5	Low	126 Å²	126	102.5 Å²	102.5	55%	0.548	58%	0.575	S	S	.	*			trans	-63.8	92.8	168.5	-78.4	169	177.4	148.3	0	108.7	W419 K425 G429	W419-K427 HydrophobicContact CE3-CD 4.28Å; W419-K427 HydrophobicContact CH2-CD 4.49Å; W419-K427 VanDerWaalsContact CH2-CE 3.44Å; W419-K427 VanDerWaalsContact CZ2-NZ 3.26Å; W419-K427 HydrophobicContact CZ3-CD 3.96Å; W419-K427 HydrophobicContact CZ3-CG 4.18Å; W419-K427 VanDerWaalsContact CZ3-NZ 3.32Å; K425-K427 PolarHBondContact O-N 2.64Å; K427-G429 PolarHBondContact O-N 2.64Å
428	T	41.4	Very low	56.1	Low	137 Å²	137	101.8 Å²	101.8	84%	0.84	57%	0.574	S	S	*	*	S	Bend	trans	-59.7	105.6	-178	49.6	0	0	0	0	110.9	K426	K426-T428 VanDerWaalsContact C-N 3.32Å; K426-T428 PolarHBondContact O-N 3.37Å
429	G	38.9	Very low	56	Low	65 Å²	65	95.7 Å²	95.7	67%	0.67	55%	0.546	S	S	*	.	S	Bend	trans	77.8	99.7	-177.7	0	0	0	0	0	112.7	K427 K431	K427-G429 PolarHBondContact O-N 2.64Å; G429-K431 PolarHBondContact O-N 2.93Å
430	A	37.5	Very low	56.1	Low	62 Å²	62	93.2 Å²	93.2	51%	0.512	54%	0.537	S	S	.	.			trans	-55.9	123.8	166.6	0	0	0	0	0	109.8	K432	A430-K432 VanDerWaalsContact C-N 3.31Å; A430-K432 PolarHBondContact O-N 2.93Å
431	K	39.6	Very low	56.2	Low	192 Å²	192	94 Å²	94	84%	0.835	55%	0.547	S	S	*	.			trans	-66.5	89.4	172.2	-73.2	179.7	176.8	177	0	108.7	G429 F433 G434	G429-K431 PolarHBondContact O-N 2.93Å; K431-F433 PolarHBondContact O-N 2.87Å; K431-G434 PolarHBondContact O-N 3.29Å
432	K	42.7	Very low	57.1	Low	150 Å²	150	96.4 Å²	96.4	65%	0.652	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	17.7	-176	-67.4	-170.5	176.6	-177.1	0	116.1	A430	A430-K432 VanDerWaalsContact C-N 3.31Å; A430-K432 PolarHBondContact O-N 2.93Å
433	F	38.3	Very low	58.5	Low	191 Å²	191	92.7 Å²	92.7	84%	0.838	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	3.9	180	-94.7	-84	0	0	0	114.2	K431	K431-F433 PolarHBondContact O-N 2.87Å
434	G	37.1	Very low	60.1	Low	52 Å²	52	88.6 Å²	88.6	54%	0.536	49%	0.49	S	S	.	.			trans	-149.3	102.7	166.9	0	0	0	0	0	109.5	K431 S436	K431-G434 PolarHBondContact O-N 3.29Å; G434-S436 PolarHBondContact O-N 2.93Å; G434-S436 VanDerWaalsContact O-N 3.14Å
435	A	48.6	Very low	61.7	Low	108 Å²	108	87.6 Å²	87.6	89%	0.893	48%	0.481	S	S	*	.			trans	-65.2	112.8	169.3	0	0	0	0	0	107.9
436	S	56.8	Low	63.5	Low	64 Å²	64	79 Å²	79	45%	0.448	44%	0.444	S	S	.	.			trans	-68.9	129.5	168	38.3	0	0	0	0	107.5	G434 D438 G439	G434-S436 PolarHBondContact O-N 2.93Å; G434-S436 VanDerWaalsContact O-N 3.14Å; S436-D438 PolarHBondContact O-N 3.23Å; S436-G439 PolarHBondContact O-N 2.99Å
437	D	69.1	Low	65.5	Low	91 Å²	91	70.4 Å²	70.4	49%	0.487	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	25.9	-171	-151.9	25.3	0	0	0	113.3	K408	K408-D437 VanDerWaalsContact CE-CG 3.48Å; K408-D437 WeakPolarHBondContact CE-OD1 3.39Å; K408-D437 WeakPolarHBondContact CE-OD2 3.5Å; K408-D437 IonicContact NZ-OD1 3.14Å; K408-D437 PolarHBondContact NZ-OD1 3.11Å; K408-D437 IonicContact NZ-OD2 3.99Å; K408-D437 PolarHBondContact NZ-OD2 3.16Å
438	D	74.3	Confident	67.5	Low	52 Å²	52	64.6 Å²	64.6	28%	0.278	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	-11.5	-156.2	175.7	70.3	0	0	0	111.4	S436 S440	S436-D438 PolarHBondContact O-N 3.23Å; D438-S440 PolarHBondContact O-N 3.12Å; D438-S440 VanDerWaalsContact OD2-CB 3.26Å; D438-S440 WeakPolarHBondContact OD2-CB 3.35Å; D438-S440 PolarHBondContact OD2-OG 3.08Å
439	G	79.5	Confident	69.7	Low	1 Å²	1	58.7 Å²	58.7	1%	0.01	35%	0.348	C	S	.	.			trans	70.7	-9	171.1	0	0	0	0	0	116.9	W412 S436 S441 F442	W412-G439 VanDerWaalsContact CD1-C 3.49Å; W412-G439 PolarHBondContact NE1-O 3.19Å; S436-G439 PolarHBondContact O-N 2.99Å; G439-S441 PolarHBondContact O-N 2.85Å; G439-F442 PolarHBondContact O-N 3.36Å
440	S	81.2	Confident	71.9	Confident	7 Å²	7	57.5 Å²	57.5	5%	0.049	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	3.2	-168.9	51.2	0	0	0	0	118.2	W419 D438	W419-S440 VanDerWaalsContact NE1-CB 3.3Å; D438-S440 PolarHBondContact O-N 3.12Å; D438-S440 VanDerWaalsContact OD2-CB 3.26Å; D438-S440 WeakPolarHBondContact OD2-CB 3.35Å; D438-S440 PolarHBondContact OD2-OG 3.08Å
441	S	82.9	Confident	74.4	Confident	60 Å²	60	57.8 Å²	57.8	42%	0.42	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-9.1	168	56.3	0	0	0	0	114.8	G439	G439-S441 PolarHBondContact O-N 2.85Å
442	F	89.1	Confident	76.8	Confident	64 Å²	64	49.5 Å²	49.5	28%	0.281	30%	0.295	S	S	.	.			trans	-115.2	130.6	-172.4	-58	-77.9	0	0	0	111.8	W412 H420 G439 A444 H568 F570	W412-F442 WeakPolarHBondContact CZ2-O 3.4Å; W412-F442 PolarHBondContact NE1-O 3.45Å; H420-F442 PolarHBondContact NE2-O 3.01Å; H420-F442 VanDerWaalsContact NE2-O 3.13Å; G439-F442 PolarHBondContact O-N 3.36Å; F442-A444 VanDerWaalsContact C-N 3.31Å; F442-A444 WeakPolarHBondContact CB-O 3.29Å; F442-H568 WeakPolarHBondContact CD1-O 3.38Å; F442-F570 HydrophobicContact CB-CB 4.22Å; F442-F570 HydrophobicContact CD2-CB 3.99Å; F442-F570 HydrophobicContact CG-CB 4.38Å
443	K	89.9	Confident	79.1	Confident	57 Å²	57	42.6 Å²	42.6	25%	0.248	27%	0.265	C	S	.	.	S	Bend	trans	-71.7	-24	173.6	-74.1	-177.1	166.9	-167.8	0	113.4	W412 W416 I543 K544 T546	W412-K443 WeakPolarHBondContact CZ2-O 3.26Å; W416-K443 HydrophobicContact CZ2-CB 4.22Å; W416-K443 HydrophobicContact CZ2-CG 4.3Å; W416-K443 PolarHBondContact NE1-O 3.43Å; K443-I543 VanDerWaalsContact CD-O 3.31Å; K443-I543 WeakPolarHBondContact CD-O 3.39Å; K443-K544 PolarHBondContact NZ-O 3.26Å; K443-T546 HydrophobicContact CB-CG2 3.99Å; K443-T546 HydrophobicContact CD-CG2 3.84Å; K443-T546 WeakPolarHBondContact CE-O 3.44Å; K443-T546 HydrophobicContact CG-CG2 4.47Å; K443-T546 PolarHBondContact NZ-O 3.29Å
444	A	93.2	Very high	81.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	153.2	178.7	0	0	0	0	0	112	W412 F442 I543 I550 C569 F570	W412-A444 VanDerWaalsContact CZ2-C 3.42Å; F442-A444 VanDerWaalsContact C-N 3.31Å; F442-A444 WeakPolarHBondContact CB-O 3.29Å; A444-I543 HydrophobicContact CB-CD1 3.98Å; A444-I543 HydrophobicContact CB-CG1 3.95Å; A444-I543 HydrophobicContact CB-CG2 3.76Å; A444-I550 CarbonylContact C-O 3.57Å; A444-I550 WeakPolarHBondContact CA-O 3.31Å; A444-I550 HydrophobicContact CB-CB 3.97Å; A444-I550 HydrophobicContact CB-CG2 4.5Å; A444-I550 WeakPolarHBondContact CB-O 3.49Å; A444-C569 HydrophobicContact CB-CB 4.44Å; A444-C569 CarbonylContact O-C 3.47Å; A444-C569 VanDerWaalsContact O-CA 3.28Å; A444-C569 WeakPolarHBondContact O-CA 3.42Å; A444-F570 PolarHBondContact O-N 3.29Å
445	A	94.9	Very high	84.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	151.2	167.5	0	0	0	0	0	110.2	L409 W412 L447 I550 C552 F570	L409-A445 HydrophobicContact CD1-CB 3.93Å; W412-A445 HydrophobicContact CD2-CB 4.37Å; W412-A445 HydrophobicContact CE3-CB 3.95Å; W412-A445 HydrophobicContact CH2-CB 3.83Å; W412-A445 HydrophobicContact CZ2-CB 4.24Å; W412-A445 HydrophobicContact CZ3-CB 3.67Å; A445-L447 HydrophobicContact CB-CD1 4.28Å; A445-I550 PolarHBondContact N-O 3.19Å; A445-C552 PolarHBondContact O-N 3.22Å; A445-F570 HydrophobicContact CB-CB 4.33Å
446	L	94.5	Very high	86.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	108.7	175.5	176.3	66.2	0	0	0	109.1	V524 C552 R557 V562 A566 C569 F570 L572	L446-V524 HydrophobicContact CD1-CG2 4.33Å; L446-C552 CarbonylContact C-O 3.53Å; L446-C552 WeakPolarHBondContact CA-O 3.23Å; L446-C552 HydrophobicContact CD1-CB 3.78Å; L446-R557 HydrophobicContact CD2-CG 4.1Å; L446-V562 HydrophobicContact CD1-CG1 4.39Å; L446-V562 HydrophobicContact CD2-CG1 3.81Å; L446-A566 HydrophobicContact CD2-CB 3.72Å; L446-C569 HydrophobicContact CB-CB 3.63Å; L446-F570 PolarHBondContact N-O 3.45Å; L446-L572 PolarHBondContact O-N 2.81Å
447	L	95.2	Very high	88.3	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	111	175.7	-73.4	62.4	0	0	0	108.3	L409 A445 A459 I551 C552 I553 C554 L572 F574	L409-L447 HydrophobicContact CD1-CD1 4.18Å; L409-L447 HydrophobicContact CD2-CD1 4.28Å; L409-L447 HydrophobicContact CD2-CD2 4.09Å; A445-L447 HydrophobicContact CB-CD1 4.28Å; L447-A459 HydrophobicContact CD2-CB 4.13Å; L447-I551 HydrophobicContact CD1-CG2 3.53Å; L447-I551 HydrophobicContact CD2-CG2 4.31Å; L447-C552 PolarHBondContact N-O 2.62Å; L447-I553 HydrophobicContact CB-CG1 4.24Å; L447-I553 HydrophobicContact CB-CG2 4.28Å; L447-I553 HydrophobicContact CD2-CD1 4.45Å; L447-I553 HydrophobicContact CD2-CG1 4.42Å; L447-I553 WeakPolarHBondContact O-CA 3.26Å; L447-C554 PolarHBondContact O-N 2.96Å; L447-L572 WeakPolarHBondContact CA-O 3.2Å; L447-L572 HydrophobicContact CD1-CD1 4.35Å; L447-F574 HydrophobicContact CB-CD2 4.48Å; L447-F574 HydrophobicContact CB-CE2 4.09Å; L447-F574 HydrophobicContact CD2-CE2 3.95Å; L447-F574 HydrophobicContact CD2-CZ 4.11Å; L447-F574 HydrophobicContact CG-CE2 3.8Å; L447-F574 HydrophobicContact CG-CZ 4.45Å
448	S	92.1	Very high	89.5	Confident	4 Å²	4	22.5 Å²	22.5	3%	0.028	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	152.3	-178.8	60.9	0	0	0	0	112.2	C554 L572 R573 F574	S448-C554 WeakPolarHBondContact CA-O 3.5Å; S448-C554 VanDerWaalsContact CB-SG 3.51Å; S448-L572 PolarHBondContact N-O 2.82Å; S448-L572 PolarHBondContact OG-O 3.09Å; S448-R573 CarbonylContact O-C 3.59Å; S448-R573 WeakPolarHBondContact O-CA 3.42Å; S448-F574 PolarHBondContact O-N 3.19Å
449	G	87.8	Confident	90.5	Very high	13 Å²	13	20 Å²	20	13%	0.134	13%	0.126	C	C	.	.	S	Bend	trans	141.3	174.9	176.3	0	0	0	0	0	112.3	K455 N555	G449-K455 PolarHBondContact O-NZ 3.48Å; G449-N555 CarbonylContact C-O 3.56Å; G449-N555 VanDerWaalsContact C-O 3.23Å; G449-N555 PolarHBondContact N-O 3.4Å; G449-N555 CarbonylContact O-C 3.41Å; G449-N555 WeakPolarHBondContact O-CA 3.46Å
450	P	86.8	Confident	91.2	Very high	40 Å²	40	21 Å²	21	26%	0.26	13%	0.131	S	C	.	.			trans	-48.1	160.2	-174.3	-31.2	35.5	0	0	0	116.3	I453 K455 R576	P450-I453 HydrophobicContact CB-CD1 4.06Å; P450-I453 HydrophobicContact CG-CD1 4.3Å; P450-I453 VanDerWaalsContact O-CD1 3.32Å; P450-I453 WeakPolarHBondContact O-CD1 3.43Å; P450-I453 WeakPolarHBondContact O-CG1 2.97Å; P450-K455 PolarHBondContact O-NZ 2.83Å; P450-R576 HydrophobicContact CG-CG 4.23Å
451	P	88.9	Confident	91.8	Very high	68 Å²	68	21.2 Å²	21.2	44%	0.442	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	164.4	170.2	26.9	-35.9	0	0	0	112.1	I453 D612	P451-I453 WeakPolarHBondContact O-CG2 3.31Å; P451-I453 PolarHBondContact O-N 2.8Å; P451-D612 WeakPolarHBondContact CB-OD2 3.36Å
452	G	89.3	Confident	92.3	Very high	18 Å²	18	18.3 Å²	18.3	19%	0.186	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	-17.7	170	0	0	0	0	0	118.8	G454 D612	G452-G454 PolarHBondContact O-N 3.49Å; G452-D612 WeakPolarHBondContact CA-OD1 3.3Å; G452-D612 WeakPolarHBondContact CA-OD2 3.47Å; G452-D612 PolarHBondContact N-OD2 3.24Å
453	I	91.3	Very high	92.4	Very high	5 Å²	5	15.3 Å²	15.3	3%	0.026	10%	0.097	C	C	.	.	S	Bend	trans	-74.9	14.6	-176.1	68.1	-166.9	0	0	0	115.2	P450 P451 K455 F574	P450-I453 HydrophobicContact CB-CD1 4.06Å; P450-I453 HydrophobicContact CG-CD1 4.3Å; P450-I453 VanDerWaalsContact O-CD1 3.32Å; P450-I453 WeakPolarHBondContact O-CD1 3.43Å; P450-I453 WeakPolarHBondContact O-CG1 2.97Å; P451-I453 WeakPolarHBondContact O-CG2 3.31Å; P451-I453 PolarHBondContact O-N 2.8Å; I453-K455 HydrophobicContact CG1-CG 4.21Å; I453-F574 HydrophobicContact CD1-CB 3.45Å; I453-F574 VanDerWaalsContact CD1-CB 3.45Å; I453-F574 HydrophobicContact CG1-CB 4.01Å
454	G	92.3	Very high	92.5	Very high	18 Å²	18	18 Å²	18	19%	0.186	11%	0.109	C	C	.	.	S	Bend	trans	80.5	29.8	172.3	0	0	0	0	0	116.4	G452 T458	G452-G454 PolarHBondContact O-N 3.49Å; G454-T458 WeakPolarHBondContact O-CB 3.48Å; G454-T458 PolarHBondContact O-N 2.89Å; G454-T458 PolarHBondContact O-OG1 3.26Å
455	K	93.9	Very high	92.3	Very high	12 Å²	12	22.1 Å²	22.1	5%	0.052	13%	0.129	C	C	.	.	H	α-helix	trans	-56.5	-62	177.3	-59.9	-171.2	-64.2	-94.2	0	112.1	G449 P450 I453 T457 T458 A459 I553 C554 N555 F574	G449-K455 PolarHBondContact O-NZ 3.48Å; P450-K455 PolarHBondContact O-NZ 2.83Å; I453-K455 HydrophobicContact CG1-CG 4.21Å; K455-T457 VanDerWaalsContact C-N 3.35Å; K455-T457 PolarHBondContact O-N 2.85Å; K455-T458 WeakPolarHBondContact O-CB 3.19Å; K455-T458 PolarHBondContact O-N 3.46Å; K455-T458 VanDerWaalsContact O-N 3.08Å; K455-A459 PolarHBondContact O-N 3.49Å; K455-A459 VanDerWaalsContact O-N 3.09Å; K455-I553 HydrophobicContact CB-CG2 3.65Å; K455-I553 HydrophobicContact CD-CG2 3.85Å; K455-I553 HydrophobicContact CG-CG2 4.39Å; K455-C554 WeakPolarHBondContact CD-O 3.32Å; K455-C554 WeakPolarHBondContact CE-O 3.43Å; K455-C554 PolarHBondContact NZ-O 3.02Å; K455-N555 PolarHBondContact NZ-OD1 2.66Å; K455-F574 HydrophobicContact CG-CD1 4.49Å; K455-F574 HydrophobicContact CG-CD2 4.49Å; K455-F574 HydrophobicContact CG-CG 4.26Å
456	T	93.6	Very high	92	Very high	26 Å²	26	23.6 Å²	23.6	16%	0.16	14%	0.136	C	C	.	.	H	α-helix	trans	-55.5	-47.4	177.7	-34.3	0	0	0	0	111.7	T458 A459 Q460 E472 D522 I553	T456-T458 VanDerWaalsContact C-N 3.27Å; T456-T458 PolarHBondContact O-N 2.73Å; T456-A459 WeakPolarHBondContact O-CB 3.36Å; T456-A459 PolarHBondContact O-N 3.3Å; T456-A459 VanDerWaalsContact O-N 3.09Å; T456-Q460 WeakPolarHBondContact O-CG 3.41Å; T456-Q460 PolarHBondContact O-N 2.8Å; T456-E472 WeakPolarHBondContact CG2-OE1 3.35Å; T456-D522 VanDerWaalsContact CB-OD2 3.3Å; T456-D522 WeakPolarHBondContact CB-OD2 3.33Å; T456-D522 WeakPolarHBondContact CG2-OD2 3.29Å; T456-D522 PolarHBondContact OG1-OD2 3.13Å; T456-I553 HydrophobicContact CG2-CD1 4.44Å
457	T	93.7	Very high	91.5	Very high	28 Å²	28	29.8 Å²	29.8	17%	0.172	17%	0.165	C	C	.	.	H	α-helix	trans	-58	-38.4	176.9	-38.9	0	0	0	0	112.2	K389 P390 K455 L461	K389-T457 HydrophobicContact CG-CG2 4.41Å; P390-T457 HydrophobicContact CB-CG2 3.96Å; P390-T457 HydrophobicContact CG-CG2 4.17Å; K455-T457 VanDerWaalsContact C-N 3.35Å; K455-T457 PolarHBondContact O-N 2.85Å; T457-L461 HydrophobicContact CG2-CD1 4.08Å; T457-L461 HydrophobicContact CG2-CG 4.45Å; T457-L461 VanDerWaalsContact O-CB 3.27Å; T457-L461 WeakPolarHBondContact O-CB 3.34Å; T457-L461 VanDerWaalsContact O-CG 3.23Å; T457-L461 WeakPolarHBondContact O-CG 3.46Å; T457-L461 PolarHBondContact O-N 2.84Å
458	T	94.9	Very high	91	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-69.6	-39.9	176.9	-55.9	0	0	0	0	111.4	L406 G454 K455 T456 C462 F574	L406-T458 HydrophobicContact CB-CG2 3.69Å; L406-T458 HydrophobicContact CD1-CG2 4.2Å; L406-T458 HydrophobicContact CG-CG2 3.89Å; G454-T458 WeakPolarHBondContact O-CB 3.48Å; G454-T458 PolarHBondContact O-N 2.89Å; G454-T458 PolarHBondContact O-OG1 3.26Å; K455-T458 WeakPolarHBondContact O-CB 3.19Å; K455-T458 PolarHBondContact O-N 3.46Å; K455-T458 VanDerWaalsContact O-N 3.08Å; T456-T458 VanDerWaalsContact C-N 3.27Å; T456-T458 PolarHBondContact O-N 2.73Å; T458-C462 VanDerWaalsContact O-CB 3.3Å; T458-C462 WeakPolarHBondContact O-CB 3.18Å; T458-C462 PolarHBondContact O-N 3.48Å; T458-C462 PolarHBondContact O-SG 2.9Å; T458-F574 HydrophobicContact CG2-CE1 4.22Å; T458-F574 HydrophobicContact CG2-CZ 3.87Å; T458-F574 WeakPolarHBondContact OG1-CE1 3.33Å
459	A	95	Very high	90.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-50.6	175	0	0	0	0	0	111.9	L447 K455 T456 L461 C462 C463 I520 I551 I553	L447-A459 HydrophobicContact CD2-CB 4.13Å; K455-A459 PolarHBondContact O-N 3.49Å; K455-A459 VanDerWaalsContact O-N 3.09Å; T456-A459 WeakPolarHBondContact O-CB 3.36Å; T456-A459 PolarHBondContact O-N 3.3Å; T456-A459 VanDerWaalsContact O-N 3.09Å; A459-L461 PolarHBondContact O-N 3.08Å; A459-C462 PolarHBondContact O-N 3.07Å; A459-C463 PolarHBondContact O-N 2.86Å; A459-C463 VanDerWaalsContact O-N 3.1Å; A459-C463 PolarHBondContact O-SG 3.1Å; A459-I520 HydrophobicContact CB-CD1 4.03Å; A459-I520 HydrophobicContact CB-CG2 4.48Å; A459-I551 HydrophobicContact CB-CD1 4.22Å; A459-I551 HydrophobicContact CB-CG2 3.85Å; A459-I553 HydrophobicContact CB-CD1 4Å
460	Q	94.5	Very high	90.9	Very high	22 Å²	22	32.6 Å²	32.6	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-56.1	-48.8	175.7	-69.5	171.9	-10.2	0	0	111.8	T456 C463 K464 Y470 E472	T456-Q460 WeakPolarHBondContact O-CG 3.41Å; T456-Q460 PolarHBondContact O-N 2.8Å; Q460-C463 PolarHBondContact O-N 3.24Å; Q460-K464 WeakPolarHBondContact O-CG 3.36Å; Q460-K464 PolarHBondContact O-N 2.95Å; Q460-Y470 HydrophobicContact CG-CE2 3.97Å; Q460-E472 WeakPolarHBondContact CG-OE2 3.49Å; Q460-E472 VanDerWaalsContact NE2-CD 3.29Å; Q460-E472 PolarHBondContact NE2-OE1 3Å; Q460-E472 PolarHBondContact NE2-OE2 2.89Å
461	L	94	Very high	90.9	Very high	10 Å²	10	32.6 Å²	32.6	5%	0.052	17%	0.172	C	C	.	.	H	α-helix	trans	-70.2	-34.8	-178.7	-72.4	176.5	0	0	0	113.4	P390 T391 L393 V396 T457 A459 C463 K464 E465	P390-L461 HydrophobicContact CB-CD1 3.85Å; T391-L461 WeakPolarHBondContact O-CD2 3.32Å; L393-L461 HydrophobicContact CD2-CB 3.6Å; V396-L461 HydrophobicContact CG2-CD1 3.61Å; T457-L461 HydrophobicContact CG2-CD1 4.08Å; T457-L461 HydrophobicContact CG2-CG 4.45Å; T457-L461 VanDerWaalsContact O-CB 3.27Å; T457-L461 WeakPolarHBondContact O-CB 3.34Å; T457-L461 VanDerWaalsContact O-CG 3.23Å; T457-L461 WeakPolarHBondContact O-CG 3.46Å; T457-L461 PolarHBondContact O-N 2.84Å; A459-L461 PolarHBondContact O-N 3.08Å; L461-C463 VanDerWaalsContact C-N 3.31Å; L461-K464 PolarHBondContact O-N 2.8Å; L461-E465 PolarHBondContact O-N 3.32Å
462	C	93.2	Very high	90.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-34.1	173	-76.9	0	0	0	0	111.8	L409 L410 L413 T458 A459 L466	L409-C462 HydrophobicContact CD2-CB 4.14Å; L409-C462 HydrophobicContact CG-CB 4.39Å; L410-C462 HydrophobicContact CD1-CB 4.38Å; L413-C462 HydrophobicContact CD1-CB 3.99Å; T458-C462 VanDerWaalsContact O-CB 3.3Å; T458-C462 WeakPolarHBondContact O-CB 3.18Å; T458-C462 PolarHBondContact O-N 3.48Å; T458-C462 PolarHBondContact O-SG 2.9Å; A459-C462 PolarHBondContact O-N 3.07Å; C462-L466 WeakPolarHBondContact O-CG 3.27Å; C462-L466 PolarHBondContact O-N 3.26Å
463	C	92.1	Very high	90.8	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69.4	-42.8	173.2	-58.4	0	0	0	0	111.1	A459 Q460 L461 L466 H467 L468 Y470	A459-C463 PolarHBondContact O-N 2.86Å; A459-C463 VanDerWaalsContact O-N 3.1Å; A459-C463 PolarHBondContact O-SG 3.1Å; Q460-C463 PolarHBondContact O-N 3.24Å; L461-C463 VanDerWaalsContact C-N 3.31Å; C463-L466 PolarHBondContact O-N 3.23Å; C463-H467 PolarHBondContact O-N 2.86Å; C463-L468 PolarHBondContact O-N 2.87Å; C463-Y470 HydrophobicContact CB-CD1 3.61Å; C463-Y470 HydrophobicContact CB-CE1 4.38Å; C463-Y470 HydrophobicContact CB-CG 4.09Å
464	K	90.7	Very high	90.5	Very high	115 Å²	115	38.9 Å²	38.9	50%	0.5	19%	0.187	S	C	.	.	H	α-helix	trans	-64.3	-41.1	178.4	-71.9	175	178.5	178.5	0	113.9	Q460 L461 L466 H467 Y470	Q460-K464 WeakPolarHBondContact O-CG 3.36Å; Q460-K464 PolarHBondContact O-N 2.95Å; L461-K464 PolarHBondContact O-N 2.8Å; K464-L466 PolarHBondContact O-N 3.12Å; K464-H467 PolarHBondContact O-N 2.85Å; K464-Y470 HydrophobicContact CD-CE1 4.49Å; K464-Y470 VanDerWaalsContact CE-OH 3.25Å; K464-Y470 WeakPolarHBondContact CE-OH 3.45Å; K464-Y470 HydrophobicContact CG-CE1 4.09Å; K464-Y470 PolarHBondContact NZ-OH 2.76Å
465	E	90	Very high	89.7	Confident	86 Å²	86	38 Å²	38	40%	0.402	18%	0.179	S	C	.	.	H	α-helix	trans	-68.5	-23.1	176.9	-157.2	-158.7	-113.5	0	0	112.7	L393 L410 R414 L461	L393-E465 HydrophobicContact CD1-CB 4.35Å; L393-E465 HydrophobicContact CD1-CG 4.42Å; L393-E465 WeakPolarHBondContact CD1-OE1 3.31Å; L410-E465 WeakPolarHBondContact CD1-OE2 3.25Å; L410-E465 WeakPolarHBondContact CD2-OE2 3.37Å; R414-E465 IonicContact CZ-OE2 3.49Å; R414-E465 IonicContact NH2-OE2 2.75Å; R414-E465 PolarHBondContact NH2-OE2 2.85Å; L461-E465 PolarHBondContact O-N 3.32Å
466	L	88	Confident	88.6	Confident	31 Å²	31	40.1 Å²	40.1	16%	0.162	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	3.1	177.9	-60.6	-176.4	0	0	0	113.5	L410 L413 R414 C462 C463 K464 L468	L410-L466 HydrophobicContact CD1-CD1 4.1Å; L410-L466 HydrophobicContact CD1-CD2 3.69Å; L410-L466 HydrophobicContact CD1-CG 3.81Å; L410-L466 HydrophobicContact CG-CD2 4.42Å; L413-L466 HydrophobicContact CB-CD1 3.38Å; L413-L466 HydrophobicContact CD1-CD1 4.02Å; L413-L466 HydrophobicContact CG-CD1 4.34Å; R414-L466 HydrophobicContact CG-CD1 4.06Å; R414-L466 HydrophobicContact CG-CD2 3.42Å; R414-L466 VanDerWaalsContact CG-CD2 3.42Å; R414-L466 HydrophobicContact CG-CG 4.4Å; C462-L466 WeakPolarHBondContact O-CG 3.27Å; C462-L466 PolarHBondContact O-N 3.26Å; C463-L466 PolarHBondContact O-N 3.23Å; K464-L466 PolarHBondContact O-N 3.12Å; L466-L468 HydrophobicContact CB-CD1 4.02Å; L466-L468 HydrophobicContact CB-CG 3.83Å; L466-L468 HydrophobicContact CD1-CD1 4.22Å; L466-L468 PolarHBondContact O-N 2.8Å
467	H	84.9	Confident	87.4	Confident	129 Å²	129	43.7 Å²	43.7	60%	0.597	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	43.6	-171.7	-58.4	-92.7	0	0	0	112	C463 K464 F505	C463-H467 PolarHBondContact O-N 2.86Å; K464-H467 PolarHBondContact O-N 2.85Å; H467-F505 HydrophobicContact CB-CE1 4.46Å; H467-F505 WeakPolarHBondContact O-CD1 3.02Å; H467-F505 VanDerWaalsContact O-CE1 3.25Å; H467-F505 WeakPolarHBondContact O-CE1 3.02Å
468	L	84.6	Confident	86	Confident	12 Å²	12	42.6 Å²	42.6	6%	0.063	21%	0.207	C	C	.	.			trans	-104.4	121.5	173.8	-61.6	-178.6	0	0	0	109.5	C463 L466 V514 L515 V518	C463-L468 PolarHBondContact O-N 2.87Å; L466-L468 HydrophobicContact CB-CD1 4.02Å; L466-L468 HydrophobicContact CB-CG 3.83Å; L466-L468 HydrophobicContact CD1-CD1 4.22Å; L466-L468 PolarHBondContact O-N 2.8Å; L468-V514 HydrophobicContact CD2-CG1 4.33Å; L468-L515 HydrophobicContact CD1-CD1 3.97Å; L468-L515 HydrophobicContact CD2-CB 3.95Å; L468-V518 HydrophobicContact CB-CG2 4.02Å; L468-V518 HydrophobicContact CD1-CG2 3.96Å
469	P	87.3	Confident	84.5	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.032	23%	0.229	C	C	.	.			trans	-63.6	149.1	169.8	28.5	-33.1	0	0	0	109.3	C496 E498 Q499 N516 H517 V518	P469-C496 HydrophobicContact CB-CB 4.46Å; P469-C496 HydrophobicContact CG-CB 4.14Å; P469-E498 WeakPolarHBondContact CB-OE2 3.35Å; P469-Q499 HydrophobicContact CG-CG 3.98Å; P469-N516 WeakPolarHBondContact CG-O 3.09Å; P469-H517 HydrophobicContact CG-CB 4.06Å; P469-H517 CarbonylContact O-C 2.96Å; P469-H517 WeakPolarHBondContact O-CA 3.38Å; P469-H517 VanDerWaalsContact O-CB 3.24Å; P469-H517 WeakPolarHBondContact O-CB 2.96Å; P469-V518 PolarHBondContact O-N 3.05Å
470	Y	89.2	Confident	83.3	Confident	60 Å²	60	52.1 Å²	52.1	24%	0.235	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.5	-177.3	66	-88.7	0	0	0	111.9	Q460 C463 K464 E472 V518 I520	Q460-Y470 HydrophobicContact CG-CE2 3.97Å; C463-Y470 HydrophobicContact CB-CD1 3.61Å; C463-Y470 HydrophobicContact CB-CE1 4.38Å; C463-Y470 HydrophobicContact CB-CG 4.09Å; K464-Y470 HydrophobicContact CD-CE1 4.49Å; K464-Y470 VanDerWaalsContact CE-OH 3.25Å; K464-Y470 WeakPolarHBondContact CE-OH 3.45Å; K464-Y470 HydrophobicContact CG-CE1 4.09Å; K464-Y470 PolarHBondContact NZ-OH 2.76Å; Y470-E472 HydrophobicContact CD2-CB 4.36Å; Y470-E472 HydrophobicContact CE2-CB 4.39Å; Y470-E472 WeakPolarHBondContact CE2-OE2 3.32Å; Y470-V518 CarbonylContact C-O 3.43Å; Y470-V518 VanDerWaalsContact CA-O 3.23Å; Y470-V518 WeakPolarHBondContact CA-O 3.37Å; Y470-I520 HydrophobicContact CD2-CD1 3.57Å; Y470-I520 HydrophobicContact CD2-CG1 4.37Å; Y470-I520 HydrophobicContact CE2-CD1 4.19Å; Y470-I520 HydrophobicContact CG-CD1 4.04Å
471	V	88	Confident	82.3	Confident	40 Å²	40	53.5 Å²	53.5	24%	0.242	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	116.1	174.4	-179.5	0	0	0	0	107.3	R473 V518 L519 I520	V471-R473 HydrophobicContact CG1-CG 4.44Å; V471-V518 PolarHBondContact N-O 2.88Å; V471-L519 HydrophobicContact CB-CD1 4.38Å; V471-L519 HydrophobicContact CG1-CD1 4.39Å; V471-I520 PolarHBondContact O-N 2.73Å
472	E	89.3	Confident	81.3	Confident	73 Å²	73	60.4 Å²	60.4	34%	0.341	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133	178.4	-166.2	166.8	146.2	0	0	109.8	T456 Q460 Y470 I520	T456-E472 WeakPolarHBondContact CG2-OE1 3.35Å; Q460-E472 WeakPolarHBondContact CG-OE2 3.49Å; Q460-E472 VanDerWaalsContact NE2-CD 3.29Å; Q460-E472 PolarHBondContact NE2-OE1 3Å; Q460-E472 PolarHBondContact NE2-OE2 2.89Å; Y470-E472 HydrophobicContact CD2-CB 4.36Å; Y470-E472 HydrophobicContact CE2-CB 4.39Å; Y470-E472 WeakPolarHBondContact CE2-OE2 3.32Å; E472-I520 WeakPolarHBondContact CA-O 3.37Å; E472-I520 HydrophobicContact CB-CB 4.46Å; E472-I520 HydrophobicContact CG-CB 4.29Å; E472-I520 HydrophobicContact CG-CG2 4.3Å
473	R	86	Confident	80.5	Confident	105 Å²	105	63.9 Å²	63.9	40%	0.396	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	136.4	176.8	-68.3	-63.8	-174	159.6	-0.3	109.1	V471 I520 M521 D522	V471-R473 HydrophobicContact CG1-CG 4.44Å; R473-I520 PolarHBondContact N-O 2.94Å; R473-M521 HydrophobicContact CB-CE 4.28Å; R473-M521 HydrophobicContact CB-SD 3.96Å; R473-M521 WeakPolarHBondContact O-CA 3.38Å; R473-D522 PolarHBondContact O-N 2.89Å
474	N	85.8	Confident	79.6	Confident	45 Å²	45	63.9 Å²	63.9	24%	0.241	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	135	165.1	-168.1	-45.2	0	0	0	108.1	S476 D477 E523	N474-S476 PolarHBondContact O-N 3.13Å; N474-S476 WeakPolarHBondContact OD1-CB 3.29Å; N474-S476 PolarHBondContact OD1-N 3.03Å; N474-S476 PolarHBondContact OD1-OG 2.82Å; N474-D477 WeakPolarHBondContact O-CB 3.29Å; N474-D477 PolarHBondContact O-N 3.4Å; N474-E523 PolarHBondContact ND2-OE2 3.37Å
475	A	75	Confident	78.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-66	-23.7	179.6	0	0	0	0	0	113	D477 A478 M521 D522 V524 M527	A475-D477 VanDerWaalsContact C-N 3.28Å; A475-D477 PolarHBondContact O-N 3.14Å; A475-A478 CarbonylContact O-C 3.44Å; A475-A478 PolarHBondContact O-N 3.45Å; A475-M521 HydrophobicContact CB-CE 4.32Å; A475-D522 VanDerWaalsContact CB-O 3.32Å; A475-D522 WeakPolarHBondContact CB-O 3.35Å; A475-D522 PolarHBondContact N-O 2.84Å; A475-V524 HydrophobicContact CB-CB 4.35Å; A475-V524 HydrophobicContact CB-CG1 3.92Å; A475-M527 HydrophobicContact CB-CG 3.6Å; A475-M527 HydrophobicContact CB-SD 3.97Å
476	S	71.6	Confident	78.2	Confident	55 Å²	55	64.3 Å²	64.3	39%	0.385	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-68.7	-20.8	173.6	62.7	0	0	0	0	114	N474 A478	N474-S476 PolarHBondContact O-N 3.13Å; N474-S476 WeakPolarHBondContact OD1-CB 3.29Å; N474-S476 PolarHBondContact OD1-N 3.03Å; N474-S476 PolarHBondContact OD1-OG 2.82Å; S476-A478 VanDerWaalsContact C-N 3.3Å
477	D	68.6	Low	77.3	Confident	101 Å²	101	64.6 Å²	64.6	54%	0.54	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-71.8	-27.5	168.8	-60.9	-42.1	0	0	0	111.6	N474 A475 L483	N474-D477 WeakPolarHBondContact O-CB 3.29Å; N474-D477 PolarHBondContact O-N 3.4Å; A475-D477 VanDerWaalsContact C-N 3.28Å; A475-D477 PolarHBondContact O-N 3.14Å; D477-L483 VanDerWaalsContact O-CD2 3.29Å; D477-L483 WeakPolarHBondContact O-CD2 3.49Å
478	A	62.9	Low	76.6	Confident	6 Å²	6	58.6 Å²	58.6	5%	0.05	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-111.9	33	-165.6	0	0	0	0	0	113.6	A475 S476 N480 L484 M521 M527	A475-A478 CarbonylContact O-C 3.44Å; A475-A478 PolarHBondContact O-N 3.45Å; S476-A478 VanDerWaalsContact C-N 3.3Å; A478-N480 PolarHBondContact O-N 3.17Å; A478-L484 HydrophobicContact CB-CD1 3.83Å; A478-M521 HydrophobicContact CB-CE 4.47Å; A478-M527 WeakPolarHBondContact O-CE 3.21Å
479	R	64.9	Low	75.8	Confident	125 Å²	125	60.7 Å²	60.7	47%	0.472	30%	0.297	S	S	.	.			trans	-37.9	-61.5	-177.3	-79.7	-166.4	-91.8	151.6	-7.1	115.4	E531 D532 G535	R479-E531 IonicContact CZ-OE2 2.79Å; R479-E531 IonicContact NH1-OE2 3.32Å; R479-E531 PolarHBondContact NH1-OE2 2.87Å; R479-D532 WeakPolarHBondContact CA-OD1 3.46Å; R479-D532 WeakPolarHBondContact CB-OD1 3.46Å; R479-D532 WeakPolarHBondContact CD-OD1 3.34Å; R479-D532 WeakPolarHBondContact CG-OD1 3.15Å; R479-G535 WeakPolarHBondContact O-CA 3.5Å
480	N	67.7	Low	74.8	Confident	75 Å²	75	63.2 Å²	63.2	40%	0.401	32%	0.318	S	S	.	.	S	Bend	trans	-84.8	139.4	-172.9	-169.7	-45.1	0	0	0	112.2	A478 K482 L483 L484	A478-N480 PolarHBondContact O-N 3.17Å; N480-K482 PolarHBondContact O-N 3.3Å; N480-K482 VanDerWaalsContact O-N 3.15Å; N480-K482 PolarHBondContact OD1-N 2.82Å; N480-L483 HydrophobicContact CB-CB 4.47Å; N480-L483 PolarHBondContact O-N 2.84Å; N480-L484 PolarHBondContact O-N 3.19Å
481	K	73.6	Confident	73.9	Confident	50 Å²	50	61.7 Å²	61.7	22%	0.217	32%	0.316	C	S	.	.	H	α-helix	trans	-48	-41.8	172.9	178.6	172.8	175.8	178.7	0	113	L483 L484 E485 A534 E541	K481-L483 PolarHBondContact O-N 3.08Å; K481-L484 PolarHBondContact O-N 3.33Å; K481-E485 VanDerWaalsContact CE-CD 3.43Å; K481-E485 WeakPolarHBondContact CE-OE1 3.29Å; K481-E485 HydrophobicContact CG-CG 4.28Å; K481-E485 IonicContact NZ-OE1 2.74Å; K481-E485 WeakPolarHBondContact O-CB 3.41Å; K481-E485 WeakPolarHBondContact O-CG 3.5Å; K481-E485 PolarHBondContact O-N 3.05Å; K481-A534 HydrophobicContact CB-CB 4.22Å; K481-E541 VanDerWaalsContact NZ-CD 3.31Å; K481-E541 IonicContact NZ-OE1 3.09Å; K481-E541 PolarHBondContact NZ-OE1 3.49Å; K481-E541 IonicContact NZ-OE2 3.57Å; K481-E541 PolarHBondContact NZ-OE2 3.11Å
482	K	74.8	Confident	73	Confident	155 Å²	155	60.6 Å²	60.6	67%	0.674	31%	0.309	S	S	*	.	H	α-helix	trans	-61	-44.1	177.9	-72.5	-176.5	177.6	178.5	0	112.1	N480 E485 Q486	N480-K482 PolarHBondContact O-N 3.3Å; N480-K482 VanDerWaalsContact O-N 3.15Å; N480-K482 PolarHBondContact OD1-N 2.82Å; K482-E485 PolarHBondContact O-N 3.13Å; K482-Q486 WeakPolarHBondContact O-CB 3.4Å; K482-Q486 VanDerWaalsContact O-CG 3.29Å; K482-Q486 WeakPolarHBondContact O-CG 3.42Å; K482-Q486 PolarHBondContact O-N 2.89Å
483	L	74.5	Confident	71.9	Confident	73 Å²	73	62.3 Å²	62.3	38%	0.382	32%	0.324	S	S	.	.	H	α-helix	trans	-70.5	-38.8	-179.9	-178.4	60.2	0	0	0	111.5	D477 N480 K481 Q486 T487	D477-L483 VanDerWaalsContact O-CD2 3.29Å; D477-L483 WeakPolarHBondContact O-CD2 3.49Å; N480-L483 HydrophobicContact CB-CB 4.47Å; N480-L483 PolarHBondContact O-N 2.84Å; K481-L483 PolarHBondContact O-N 3.08Å; L483-Q486 PolarHBondContact O-N 2.77Å; L483-T487 WeakPolarHBondContact O-CB 3.42Å; L483-T487 PolarHBondContact O-N 2.95Å; L483-T487 PolarHBondContact O-OG1 3.5Å
484	L	73.5	Confident	71.1	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-43.3	172.3	-172.9	72.5	0	0	0	111.3	A478 N480 K481 C488 M521 L539 L542	A478-L484 HydrophobicContact CB-CD1 3.83Å; N480-L484 PolarHBondContact O-N 3.19Å; K481-L484 PolarHBondContact O-N 3.33Å; L484-C488 WeakPolarHBondContact O-CB 3.36Å; L484-C488 PolarHBondContact O-N 2.64Å; L484-M521 HydrophobicContact CD1-CE 3.9Å; L484-L539 HydrophobicContact CD2-CB 3.93Å; L484-L542 HydrophobicContact CD1-CD1 4.29Å; L484-L542 HydrophobicContact CD2-CD1 3.95Å; L484-L542 HydrophobicContact CG-CD1 3.82Å
485	E	75.3	Confident	70.2	Confident	65 Å²	65	65.5 Å²	65.5	30%	0.304	34%	0.341	S	S	.	.	H	α-helix	trans	-65.4	-43.1	175.7	-76.6	-177.5	156.1	0	0	111.6	K481 K482 S489	K481-E485 VanDerWaalsContact CE-CD 3.43Å; K481-E485 WeakPolarHBondContact CE-OE1 3.29Å; K481-E485 HydrophobicContact CG-CG 4.28Å; K481-E485 IonicContact NZ-OE1 2.74Å; K481-E485 WeakPolarHBondContact O-CB 3.41Å; K481-E485 WeakPolarHBondContact O-CG 3.5Å; K481-E485 PolarHBondContact O-N 3.05Å; K482-E485 PolarHBondContact O-N 3.13Å; E485-S489 WeakPolarHBondContact O-CA 3.28Å; E485-S489 WeakPolarHBondContact O-CB 3.47Å; E485-S489 PolarHBondContact O-N 3.03Å; E485-S489 PolarHBondContact O-OG 3.31Å
486	Q	76	Confident	69.9	Low	145 Å²	145	66.8 Å²	66.8	68%	0.678	35%	0.35	S	S	*	.	H	α-helix	trans	-64	-52.6	175.6	-74.4	168.5	-31.9	0	0	112.2	K482 L483	K482-Q486 WeakPolarHBondContact O-CB 3.4Å; K482-Q486 VanDerWaalsContact O-CG 3.29Å; K482-Q486 WeakPolarHBondContact O-CG 3.42Å; K482-Q486 PolarHBondContact O-N 2.89Å; L483-Q486 PolarHBondContact O-N 2.77Å
487	T	69.8	Low	70	Confident	38 Å²	38	69.9 Å²	69.9	23%	0.233	36%	0.362	C	S	.	.	H	α-helix	trans	-68.2	-39.9	-174.7	-51.8	0	0	0	0	112.1	L483	L483-T487 WeakPolarHBondContact O-CB 3.42Å; L483-T487 PolarHBondContact O-N 2.95Å; L483-T487 PolarHBondContact O-OG1 3.5Å
488	C	69.7	Low	69.9	Low	2 Å²	2	69.6 Å²	69.6	1%	0.014	36%	0.357	C	S	.	.	H	α-helix	trans	-96.3	-30	-174.4	-61.7	0	0	0	0	113.8	L484 A490 S491 L492 L519 L542	L484-C488 WeakPolarHBondContact O-CB 3.36Å; L484-C488 PolarHBondContact O-N 2.64Å; C488-A490 VanDerWaalsContact C-N 3.28Å; C488-A490 PolarHBondContact O-N 2.95Å; C488-S491 PolarHBondContact O-N 3.38Å; C488-S491 VanDerWaalsContact O-N 3.09Å; C488-L492 HydrophobicContact CB-CD1 3.86Å; C488-L492 HydrophobicContact CB-CG 4.41Å; C488-L492 WeakPolarHBondContact O-CB 3.28Å; C488-L492 VanDerWaalsContact O-CD1 3.26Å; C488-L492 WeakPolarHBondContact O-CD1 3.27Å; C488-L492 WeakPolarHBondContact O-CG 3.46Å; C488-L492 PolarHBondContact O-N 2.82Å; C488-L519 HydrophobicContact CB-CD2 4.49Å; C488-L542 HydrophobicContact CB-CD1 3.87Å
489	S	68.5	Low	70	Confident	57 Å²	57	71.3 Å²	71.3	40%	0.399	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-33	-176.8	-57.1	0	0	0	0	113.1	E485 T493	E485-S489 WeakPolarHBondContact O-CA 3.28Å; E485-S489 WeakPolarHBondContact O-CB 3.47Å; E485-S489 PolarHBondContact O-N 3.03Å; E485-S489 PolarHBondContact O-OG 3.31Å; S489-T493 PolarHBondContact O-N 2.95Å; S489-T493 PolarHBondContact O-OG1 2.81Å
490	A	66.8	Low	70.2	Confident	57 Å²	57	71 Å²	71	47%	0.471	36%	0.364	S	S	.	.	H	α-helix	trans	-58.2	-51.6	170.4	0	0	0	0	0	110.7	C488 T493 S494	C488-A490 VanDerWaalsContact C-N 3.28Å; C488-A490 PolarHBondContact O-N 2.95Å; A490-T493 PolarHBondContact O-OG1 3.12Å; A490-S494 WeakPolarHBondContact O-CB 3.4Å; A490-S494 PolarHBondContact O-N 3.3Å; A490-S494 VanDerWaalsContact O-N 3.11Å; A490-S494 PolarHBondContact O-OG 2.95Å
491	S	69.2	Low	70.4	Confident	28 Å²	28	75.9 Å²	75.9	20%	0.196	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-49.7	177	-50.4	0	0	0	0	112.6	C488 T493 S494 H517	C488-S491 PolarHBondContact O-N 3.38Å; C488-S491 VanDerWaalsContact O-N 3.09Å; S491-T493 PolarHBondContact O-N 2.85Å; S491-S494 PolarHBondContact O-N 3.44Å; S491-S494 VanDerWaalsContact O-N 3.11Å; S491-H517 PolarHBondContact O-CE1 3.16Å; S491-H517 PolarHBondContact O-NE2 3.34Å
492	L	68.8	Low	69.9	Low	17 Å²	17	75.8 Å²	75.8	9%	0.089	38%	0.383	C	S	.	.	H	α-helix	trans	-60.6	-16.2	-174.3	-67.7	158.9	0	0	0	114.8	C488 L519 L542 T546 I548 I550	C488-L492 HydrophobicContact CB-CD1 3.86Å; C488-L492 HydrophobicContact CB-CG 4.41Å; C488-L492 WeakPolarHBondContact O-CB 3.28Å; C488-L492 VanDerWaalsContact O-CD1 3.26Å; C488-L492 WeakPolarHBondContact O-CD1 3.27Å; C488-L492 WeakPolarHBondContact O-CG 3.46Å; C488-L492 PolarHBondContact O-N 2.82Å; L492-L519 HydrophobicContact CD2-CD2 4.32Å; L492-L542 HydrophobicContact CD1-CD1 3.9Å; L492-L542 HydrophobicContact CD1-CD2 3.54Å; L492-L542 HydrophobicContact CD1-CG 3.42Å; L492-L542 VanDerWaalsContact CD1-CG 3.42Å; L492-L542 HydrophobicContact CD2-CD2 3.73Å; L492-L542 HydrophobicContact CG-CD2 4.3Å; L492-T546 VanDerWaalsContact CD2-OG1 3.25Å; L492-T546 WeakPolarHBondContact CD2-OG1 3.27Å; L492-I548 HydrophobicContact CD2-CD1 3.89Å; L492-I548 HydrophobicContact CD2-CG1 3.8Å; L492-I550 HydrophobicContact CD2-CD1 4.05Å
493	T	67.6	Low	69	Low	109 Å²	109	76.8 Å²	76.8	67%	0.669	39%	0.388	S	S	*	.	H	α-helix	trans	-111.1	-24.7	177.8	54.3	0	0	0	0	113.5	S489 A490 S491	S489-T493 PolarHBondContact O-N 2.95Å; S489-T493 PolarHBondContact O-OG1 2.81Å; A490-T493 PolarHBondContact O-OG1 3.12Å; S491-T493 PolarHBondContact O-N 2.85Å
494	S	67.6	Low	68.2	Low	56 Å²	56	79.7 Å²	79.7	39%	0.392	40%	0.403	S	S	.	.	S	Bend	trans	-83.9	167.2	-175.5	-60.9	0	0	0	0	113.9	A490 S491 N516	A490-S494 WeakPolarHBondContact O-CB 3.4Å; A490-S494 PolarHBondContact O-N 3.3Å; A490-S494 VanDerWaalsContact O-N 3.11Å; A490-S494 PolarHBondContact O-OG 2.95Å; S491-S494 PolarHBondContact O-N 3.44Å; S491-S494 VanDerWaalsContact O-N 3.11Å; S494-N516 PolarHBondContact O-ND2 3.02Å; S494-N516 VanDerWaalsContact O-ND2 3.12Å
495	R	68.1	Low	67.3	Low	161 Å²	161	82.1 Å²	82.1	61%	0.608	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-89.5	150.6	159	-81.3	176.7	169.6	154.2	-4.3	109.8	L497 Y500 N516	R495-L497 PolarHBondContact O-N 2.97Å; R495-Y500 HydrophobicContact CB-CE2 3.98Å; R495-Y500 VanDerWaalsContact CD-OH 3.3Å; R495-Y500 WeakPolarHBondContact CD-OH 3.47Å; R495-N516 HydrophobicContact CG-CB 4.25Å; R495-N516 VanDerWaalsContact CG-CG 3.47Å; R495-N516 WeakPolarHBondContact CG-ND2 3.19Å; R495-N516 PolarHBondContact NE-OD1 3.39Å
496	C	68.9	Low	66.2	Low	28 Å²	28	86.8 Å²	86.8	19%	0.189	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-75.7	128.3	175.1	-172.5	0	0	0	0	109.1	P469 E498 Q499 H517	P469-C496 HydrophobicContact CB-CB 4.46Å; P469-C496 HydrophobicContact CG-CB 4.14Å; C496-E498 PolarHBondContact O-N 3.49Å; C496-E498 VanDerWaalsContact O-N 3.17Å; C496-Q499 HydrophobicContact CB-CG 4.29Å; C496-Q499 WeakPolarHBondContact O-CB 3.49Å; C496-Q499 PolarHBondContact O-N 3.15Å; C496-Q499 VanDerWaalsContact O-N 3.1Å; C496-H517 HydrophobicContact CB-CB 4.2Å
497	L	72.8	Confident	64.7	Low	120 Å²	120	83 Å²	83	63%	0.628	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.7	-178.7	-167.9	65	0	0	0	112.2	R495 Q499 Y500 Y501	R495-L497 PolarHBondContact O-N 2.97Å; L497-Q499 PolarHBondContact O-N 3.42Å; L497-Y500 WeakPolarHBondContact O-CB 3.35Å; L497-Y500 PolarHBondContact O-N 2.98Å; L497-Y501 HydrophobicContact CD1-CD2 4.4Å; L497-Y501 HydrophobicContact CD1-CE2 3.8Å; L497-Y501 HydrophobicContact CD2-CE2 4.15Å; L497-Y501 HydrophobicContact CG-CD2 3.98Å; L497-Y501 HydrophobicContact CG-CE2 3.72Å; L497-Y501 WeakPolarHBondContact O-CD2 3.29Å
498	E	67.8	Low	63.5	Low	94 Å²	94	89 Å²	89	44%	0.439	45%	0.449	S	S	.	.	H	α-helix	trans	-56.4	-32.6	177.2	-161.7	169.2	-134.5	0	0	113.2	P469 C496 Y500 Y501 C502 F505	P469-E498 WeakPolarHBondContact CB-OE2 3.35Å; C496-E498 PolarHBondContact O-N 3.49Å; C496-E498 VanDerWaalsContact O-N 3.17Å; E498-Y500 PolarHBondContact O-N 3.31Å; E498-Y501 PolarHBondContact O-N 3.07Å; E498-C502 HydrophobicContact CG-CB 4.42Å; E498-C502 WeakPolarHBondContact O-CB 3.33Å; E498-C502 PolarHBondContact O-N 3.36Å; E498-F505 HydrophobicContact CG-CE2 4.36Å
499	Q	64.2	Low	62.5	Low	42 Å²	42	96 Å²	96	20%	0.196	49%	0.486	C	S	.	.	H	α-helix	trans	-63.6	-24.6	177	-60.4	-172.6	-70.5	0	0	113.1	P469 C496 L497 L515 N516	P469-Q499 HydrophobicContact CG-CG 3.98Å; C496-Q499 HydrophobicContact CB-CG 4.29Å; C496-Q499 WeakPolarHBondContact O-CB 3.49Å; C496-Q499 PolarHBondContact O-N 3.15Å; C496-Q499 VanDerWaalsContact O-N 3.1Å; L497-Q499 PolarHBondContact O-N 3.42Å; Q499-L515 PolarHBondContact NE2-O 2.93Å; Q499-N516 PolarHBondContact NE2-O 2.84Å; Q499-N516 PolarHBondContact OE1-O 3.44Å; Q499-N516 VanDerWaalsContact OE1-O 3.05Å
500	Y	69.2	Low	61.7	Low	120 Å²	120	96.7 Å²	96.7	47%	0.471	49%	0.488	S	S	.	.	H	α-helix	trans	-87.6	-34.3	-178.2	-66	-91.2	0	0	0	112.5	R495 L497 E498 R506	R495-Y500 HydrophobicContact CB-CE2 3.98Å; R495-Y500 VanDerWaalsContact CD-OH 3.3Å; R495-Y500 WeakPolarHBondContact CD-OH 3.47Å; L497-Y500 WeakPolarHBondContact O-CB 3.35Å; L497-Y500 PolarHBondContact O-N 2.98Å; E498-Y500 PolarHBondContact O-N 3.31Å; Y500-R506 PolarHBondContact O-NH1 2.82Å
501	Y	72.1	Confident	60.6	Low	176 Å²	176	101.7 Å²	101.7	69%	0.69	50%	0.502	S	S	*	.	H	α-helix	trans	-95.6	-39.4	-174.4	-69.7	-76.1	0	0	0	114	L497 E498 K503	L497-Y501 HydrophobicContact CD1-CD2 4.4Å; L497-Y501 HydrophobicContact CD1-CE2 3.8Å; L497-Y501 HydrophobicContact CD2-CE2 4.15Å; L497-Y501 HydrophobicContact CG-CD2 3.98Å; L497-Y501 HydrophobicContact CG-CE2 3.72Å; L497-Y501 WeakPolarHBondContact O-CD2 3.29Å; E498-Y501 PolarHBondContact O-N 3.07Å; Y501-K503 PolarHBondContact O-N 3.32Å
502	C	61.8	Low	59.4	Low	48 Å²	48	110.6 Å²	110.6	32%	0.324	54%	0.54	S	S	.	.			trans	-78.2	114	-174.1	-72.5	0	0	0	0	111.2	E498 D504 F505	E498-C502 HydrophobicContact CG-CB 4.42Å; E498-C502 WeakPolarHBondContact O-CB 3.33Å; E498-C502 PolarHBondContact O-N 3.36Å; C502-D504 PolarHBondContact O-N 3.21Å; C502-D504 VanDerWaalsContact O-N 3.09Å; C502-F505 HydrophobicContact CB-CD2 3.6Å; C502-F505 HydrophobicContact CB-CE2 3.81Å; C502-F505 PolarHBondContact O-N 2.83Å; C502-F505 VanDerWaalsContact O-N 3.1Å
503	K	56.8	Low	58.6	Low	177 Å²	177	111.1 Å²	111.1	77%	0.77	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-55.4	-28.1	-178.7	-71.4	-176.1	178.1	179.4	0	113.6	Y501 F505 R506	Y501-K503 PolarHBondContact O-N 3.32Å; K503-F505 PolarHBondContact O-N 3.11Å; K503-R506 WeakPolarHBondContact O-CA 3.39Å; K503-R506 WeakPolarHBondContact O-CB 3.42Å; K503-R506 PolarHBondContact O-N 3.01Å
504	D	57.8	Low	58.1	Low	133 Å²	133	109.1 Å²	109.1	71%	0.711	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-64.6	-20	-179.5	-56.2	-15.7	0	0	0	113.5	C502	C502-D504 PolarHBondContact O-N 3.21Å; C502-D504 VanDerWaalsContact O-N 3.09Å
505	F	55.3	Low	57.8	Low	51 Å²	51	107.2 Å²	107.2	22%	0.224	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-99.9	4.7	172.1	-51.8	-89.9	0	0	0	112.8	H467 E498 C502 K503	H467-F505 HydrophobicContact CB-CE1 4.46Å; H467-F505 WeakPolarHBondContact O-CD1 3.02Å; H467-F505 VanDerWaalsContact O-CE1 3.25Å; H467-F505 WeakPolarHBondContact O-CE1 3.02Å; E498-F505 HydrophobicContact CG-CE2 4.36Å; C502-F505 HydrophobicContact CB-CD2 3.6Å; C502-F505 HydrophobicContact CB-CE2 3.81Å; C502-F505 PolarHBondContact O-N 2.83Å; C502-F505 VanDerWaalsContact O-N 3.1Å; K503-F505 PolarHBondContact O-N 3.11Å
506	R	50.6	Low	57.8	Low	163 Å²	163	101.5 Å²	101.5	62%	0.615	50%	0.504	S	S	*	.			trans	-104.6	24.6	179.4	-56.9	-180	70.7	145.5	-3	111.9	Y500 K503	Y500-R506 PolarHBondContact O-NH1 2.82Å; K503-R506 WeakPolarHBondContact O-CA 3.39Å; K503-R506 WeakPolarHBondContact O-CB 3.42Å; K503-R506 PolarHBondContact O-N 3.01Å
507	S	45.9	Very low	58.5	Low	65 Å²	65	100.4 Å²	100.4	46%	0.455	50%	0.496	S	S	.	.			trans	-62.5	136.5	164.6	43.8	0	0	0	0	109.6	D509 V510	S507-D509 PolarHBondContact O-N 2.74Å; S507-V510 WeakPolarHBondContact O-CG2 3.19Å; S507-V510 PolarHBondContact O-N 2.92Å
508	N	44.8	Very low	59.3	Low	166 Å²	166	94.7 Å²	94.7	89%	0.888	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-2	-169.3	-66.1	-31.7	0	0	0	114.3
509	D	48.7	Very low	60.4	Low	147 Å²	147	90.3 Å²	90.3	79%	0.786	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	10.4	-179.8	-51.6	-60.5	0	0	0	113.5	S507 E511	S507-D509 PolarHBondContact O-N 2.74Å; D509-E511 PolarHBondContact O-N 2.79Å
510	V	50	Low	61.8	Low	72 Å²	72	88.3 Å²	88.3	44%	0.436	44%	0.436	S	S	.	.			trans	-72.7	90.1	174.9	175.1	0	0	0	0	109.4	S507 V514	S507-V510 WeakPolarHBondContact O-CG2 3.19Å; S507-V510 PolarHBondContact O-N 2.92Å; V510-V514 HydrophobicContact CG1-CB 3.88Å; V510-V514 HydrophobicContact CG1-CG1 4.44Å; V510-V514 HydrophobicContact CG1-CG2 3.84Å
511	E	44.7	Very low	62.8	Low	163 Å²	163	82.6 Å²	82.6	76%	0.762	41%	0.414	S	S	*	.			trans	-50.6	144.9	173.7	-66.5	-174.1	143.8	0	0	111.8	D509 G513 V514	D509-E511 PolarHBondContact O-N 2.79Å; E511-G513 PolarHBondContact O-N 3.1Å; E511-V514 PolarHBondContact O-N 3.46Å; E511-V514 VanDerWaalsContact O-N 3.14Å
512	E	44.2	Very low	63.7	Low	214 Å²	214	75.2 Å²	75.2	100%	1	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	76.8	175.7	-66.3	-166.6	119.6	0	0	111.7
513	G	51.2	Low	65	Low	28 Å²	28	76.6 Å²	76.6	29%	0.289	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	167.4	-11.8	-170.6	0	0	0	0	0	114.3	H417 E511 L515	H417-G513 PolarHBondContact CE1-O 3.18Å; H417-G513 VanDerWaalsContact CG-O 3.31Å; H417-G513 PolarHBondContact ND1-O 3.22Å; E511-G513 PolarHBondContact O-N 3.1Å; G513-L515 PolarHBondContact O-N 3.11Å
514	V	57.3	Low	66.4	Low	67 Å²	67	68.1 Å²	68.1	41%	0.406	35%	0.351	S	S	.	.			trans	-58	140.1	176.4	176.6	0	0	0	0	111.6	L468 V510 E511	L468-V514 HydrophobicContact CD2-CG1 4.33Å; V510-V514 HydrophobicContact CG1-CB 3.88Å; V510-V514 HydrophobicContact CG1-CG1 4.44Å; V510-V514 HydrophobicContact CG1-CG2 3.84Å; E511-V514 PolarHBondContact O-N 3.46Å; E511-V514 VanDerWaalsContact O-N 3.14Å
515	L	61	Low	67.6	Low	17 Å²	17	63.4 Å²	63.4	9%	0.089	33%	0.326	C	S	.	.			trans	-67.1	132.6	-170.1	-64.5	164.6	0	0	0	112.3	W416 H417 L468 Q499 G513 H517 P549	W416-L515 HydrophobicContact CB-CD1 4.33Å; W416-L515 HydrophobicContact CE3-CD2 3.64Å; W416-L515 HydrophobicContact CZ3-CD2 4.12Å; H417-L515 HydrophobicContact CB-CD2 3.95Å; H417-L515 HydrophobicContact CB-CG 4.35Å; L468-L515 HydrophobicContact CD1-CD1 3.97Å; L468-L515 HydrophobicContact CD2-CB 3.95Å; Q499-L515 PolarHBondContact NE2-O 2.93Å; G513-L515 PolarHBondContact O-N 3.11Å; L515-H517 PolarHBondContact O-N 2.78Å; L515-P549 HydrophobicContact CD1-CG 4.34Å
516	N	68.2	Low	68.7	Low	41 Å²	41	62.5 Å²	62.5	22%	0.219	33%	0.331	C	S	.	.	S	Bend	trans	-56	-44.4	-178.3	-67.4	1	0	0	0	113.9	P469 S494 R495 Q499 I548	P469-N516 WeakPolarHBondContact CG-O 3.09Å; S494-N516 PolarHBondContact O-ND2 3.02Å; S494-N516 VanDerWaalsContact O-ND2 3.12Å; R495-N516 HydrophobicContact CG-CB 4.25Å; R495-N516 VanDerWaalsContact CG-CG 3.47Å; R495-N516 WeakPolarHBondContact CG-ND2 3.19Å; R495-N516 PolarHBondContact NE-OD1 3.39Å; Q499-N516 PolarHBondContact NE2-O 2.84Å; Q499-N516 PolarHBondContact OE1-O 3.44Å; Q499-N516 VanDerWaalsContact OE1-O 3.05Å; N516-I548 HydrophobicContact CB-CG2 4.44Å
517	H	84.2	Confident	69.8	Low	5 Å²	5	54.9 Å²	54.9	2%	0.023	30%	0.303	C	S	.	.			trans	-176.7	176.4	175.7	54.8	-77.4	0	0	0	110	P469 S491 C496 L515 I548	P469-H517 HydrophobicContact CG-CB 4.06Å; P469-H517 CarbonylContact O-C 2.96Å; P469-H517 WeakPolarHBondContact O-CA 3.38Å; P469-H517 VanDerWaalsContact O-CB 3.24Å; P469-H517 WeakPolarHBondContact O-CB 2.96Å; S491-H517 PolarHBondContact O-CE1 3.16Å; S491-H517 PolarHBondContact O-NE2 3.34Å; C496-H517 HydrophobicContact CB-CB 4.2Å; L515-H517 PolarHBondContact O-N 2.78Å; H517-I548 VanDerWaalsContact NE2-CD1 3.29Å; H517-I548 WeakPolarHBondContact NE2-CD1 3.4Å
518	V	89.5	Confident	70.5	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	139.7	170.9	-169.3	0	0	0	0	110	L413 L468 P469 Y470 V471 P549 I551	L413-V518 HydrophobicContact CD2-CG1 4.43Å; L413-V518 HydrophobicContact CD2-CG2 4.37Å; L468-V518 HydrophobicContact CB-CG2 4.02Å; L468-V518 HydrophobicContact CD1-CG2 3.96Å; P469-V518 PolarHBondContact O-N 3.05Å; Y470-V518 CarbonylContact C-O 3.43Å; Y470-V518 VanDerWaalsContact CA-O 3.23Å; Y470-V518 WeakPolarHBondContact CA-O 3.37Å; V471-V518 PolarHBondContact N-O 2.88Å; V518-P549 HydrophobicContact CB-CG 4.27Å; V518-P549 HydrophobicContact CG1-CB 4.3Å; V518-P549 HydrophobicContact CG1-CG 4.12Å; V518-P549 HydrophobicContact CG2-CG 3.91Å; V518-I551 HydrophobicContact CG1-CD1 3.71Å; V518-I551 HydrophobicContact CG1-CG1 3.86Å
519	L	90.6	Very high	71.4	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.6	168.8	176.9	67.3	0	0	0	109.6	V471 C488 L492 M521 I548 P549 I550 I551	V471-L519 HydrophobicContact CB-CD1 4.38Å; V471-L519 HydrophobicContact CG1-CD1 4.39Å; C488-L519 HydrophobicContact CB-CD2 4.49Å; L492-L519 HydrophobicContact CD2-CD2 4.32Å; L519-M521 HydrophobicContact CD1-SD 4.1Å; L519-M521 HydrophobicContact CD2-CG 4.29Å; L519-M521 HydrophobicContact CD2-SD 4.14Å; L519-M521 HydrophobicContact CG-CG 4.23Å; L519-M521 HydrophobicContact CG-SD 4.14Å; L519-I548 HydrophobicContact CB-CD1 4Å; L519-P549 PolarHBondContact N-O 3.47Å; L519-I550 HydrophobicContact CB-CG1 4.31Å; L519-I550 HydrophobicContact CD2-CD1 4.34Å; L519-I550 HydrophobicContact CD2-CG1 4.32Å; L519-I550 HydrophobicContact CD2-CG2 4.41Å; L519-I550 CarbonylContact O-C 3.54Å; L519-I550 WeakPolarHBondContact O-CA 3.35Å; L519-I551 PolarHBondContact O-N 3.18Å
520	I	93.3	Very high	72	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.7	173.1	-53.3	-179.9	0	0	0	108.2	A459 Y470 V471 E472 R473 I551 I553	A459-I520 HydrophobicContact CB-CD1 4.03Å; A459-I520 HydrophobicContact CB-CG2 4.48Å; Y470-I520 HydrophobicContact CD2-CD1 3.57Å; Y470-I520 HydrophobicContact CD2-CG1 4.37Å; Y470-I520 HydrophobicContact CE2-CD1 4.19Å; Y470-I520 HydrophobicContact CG-CD1 4.04Å; V471-I520 PolarHBondContact O-N 2.73Å; E472-I520 WeakPolarHBondContact CA-O 3.37Å; E472-I520 HydrophobicContact CB-CB 4.46Å; E472-I520 HydrophobicContact CG-CB 4.29Å; E472-I520 HydrophobicContact CG-CG2 4.3Å; R473-I520 PolarHBondContact N-O 2.94Å; I520-I551 WeakPolarHBondContact CA-O 3.24Å; I520-I551 HydrophobicContact CG1-CB 4.33Å; I520-I551 HydrophobicContact CG1-CD1 4.4Å; I520-I553 HydrophobicContact CG2-CD1 3.94Å; I520-I553 HydrophobicContact CG2-CG1 4.47Å
521	M	90.2	Very high	72.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	101.1	172	-62	-61.9	-55.8	0	0	107.9	R473 A475 A478 L484 L519 V524 L539 I550 I551 C552 I553	R473-M521 HydrophobicContact CB-CE 4.28Å; R473-M521 HydrophobicContact CB-SD 3.96Å; R473-M521 WeakPolarHBondContact O-CA 3.38Å; A475-M521 HydrophobicContact CB-CE 4.32Å; A478-M521 HydrophobicContact CB-CE 4.47Å; L484-M521 HydrophobicContact CD1-CE 3.9Å; L519-M521 HydrophobicContact CD1-SD 4.1Å; L519-M521 HydrophobicContact CD2-CG 4.29Å; L519-M521 HydrophobicContact CD2-SD 4.14Å; L519-M521 HydrophobicContact CG-CG 4.23Å; L519-M521 HydrophobicContact CG-SD 4.14Å; M521-V524 HydrophobicContact CB-CG1 3.75Å; M521-L539 HydrophobicContact CG-CD1 4.29Å; M521-I550 HydrophobicContact CG-CG2 4.47Å; M521-I551 PolarHBondContact N-O 2.86Å; M521-C552 CarbonylContact O-C 3.48Å; M521-C552 WeakPolarHBondContact O-CA 3.19Å; M521-I553 PolarHBondContact O-N 3.45Å
522	D	91.9	Very high	73.3	Confident	20 Å²	20	42.5 Å²	42.5	11%	0.107	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	158.5	175	-147.7	-21	0	0	0	111.5	T456 R473 A475 V524 I553	T456-D522 VanDerWaalsContact CB-OD2 3.3Å; T456-D522 WeakPolarHBondContact CB-OD2 3.33Å; T456-D522 WeakPolarHBondContact CG2-OD2 3.29Å; T456-D522 PolarHBondContact OG1-OD2 3.13Å; R473-D522 PolarHBondContact O-N 2.89Å; A475-D522 VanDerWaalsContact CB-O 3.32Å; A475-D522 WeakPolarHBondContact CB-O 3.35Å; A475-D522 PolarHBondContact N-O 2.84Å; D522-V524 VanDerWaalsContact C-N 3.34Å; D522-V524 PolarHBondContact O-N 3.44Å; D522-I553 VanDerWaalsContact OD1-CB 3.29Å; D522-I553 WeakPolarHBondContact OD1-CB 3.35Å; D522-I553 WeakPolarHBondContact OD1-CG2 3.36Å
523	E	88.1	Confident	74.1	Confident	77 Å²	77	36.6 Å²	36.6	36%	0.36	21%	0.213	S	C	.	.			trans	53.5	40.2	176.9	-52.8	-169.2	146.8	0	0	114.6	N474 D525 G526 I553	N474-E523 PolarHBondContact ND2-OE2 3.37Å; E523-D525 PolarHBondContact O-N 3.22Å; E523-D525 VanDerWaalsContact O-N 3.11Å; E523-G526 WeakPolarHBondContact O-CA 3.14Å; E523-G526 PolarHBondContact O-N 2.91Å; E523-I553 PolarHBondContact N-O 3.14Å; E523-I553 VanDerWaalsContact N-O 3.11Å
524	V	86.1	Confident	75	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-8.9	179.1	-61.1	0	0	0	0	114.4	L446 A475 M521 D522 L539 C552 I553 C554 L565	L446-V524 HydrophobicContact CD1-CG2 4.33Å; A475-V524 HydrophobicContact CB-CB 4.35Å; A475-V524 HydrophobicContact CB-CG1 3.92Å; M521-V524 HydrophobicContact CB-CG1 3.75Å; D522-V524 VanDerWaalsContact C-N 3.34Å; D522-V524 PolarHBondContact O-N 3.44Å; V524-L539 HydrophobicContact CB-CD2 4.48Å; V524-L539 HydrophobicContact CG1-CD2 3.97Å; V524-C552 HydrophobicContact CG1-CB 4.28Å; V524-C552 HydrophobicContact CG2-CB 4.07Å; V524-I553 WeakPolarHBondContact CG2-O 3.43Å; V524-I553 PolarHBondContact N-O 3.43Å; V524-C554 HydrophobicContact CG2-CB 4.09Å; V524-L565 HydrophobicContact CB-CD2 4.38Å; V524-L565 HydrophobicContact CG2-CD2 3.83Å
525	D	83.3	Confident	75.9	Confident	33 Å²	33	34.4 Å²	34.4	18%	0.176	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-17.4	165	42.9	-17.7	0	0	0	113.9	E523 M527 C554 N555 D556 V562	E523-D525 PolarHBondContact O-N 3.22Å; E523-D525 VanDerWaalsContact O-N 3.11Å; D525-M527 VanDerWaalsContact C-N 3.31Å; D525-C554 HydrophobicContact CB-CB 4.08Å; D525-C554 VanDerWaalsContact OD1-CA 3.24Å; D525-C554 WeakPolarHBondContact OD1-CA 3.42Å; D525-C554 WeakPolarHBondContact OD1-CB 3.28Å; D525-N555 PolarHBondContact OD1-N 2.97Å; D525-N555 WeakPolarHBondContact OD2-CA 3.41Å; D525-N555 WeakPolarHBondContact OD2-CB 3.27Å; D525-N555 PolarHBondContact OD2-N 3.09Å; D525-D556 PolarHBondContact OD2-N 3.3Å; D525-V562 HydrophobicContact CB-CG2 3.77Å
526	G	78.2	Confident	77	Confident	32 Å²	32	34.1 Å²	34.1	33%	0.33	20%	0.197	S	C	.	.			trans	-81.4	1.6	173.8	0	0	0	0	0	115.2	E523 S528	E523-G526 WeakPolarHBondContact O-CA 3.14Å; E523-G526 PolarHBondContact O-N 2.91Å; G526-S528 PolarHBondContact O-N 2.86Å; G526-S528 PolarHBondContact O-OG 3.32Å
527	M	74.5	Confident	77.6	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.02	20%	0.201	C	C	.	.			trans	-75.5	79.2	166.8	-59	-165.9	85.8	0	0	108.8	A475 A478 D525 D532 M536	A475-M527 HydrophobicContact CB-CG 3.6Å; A475-M527 HydrophobicContact CB-SD 3.97Å; A478-M527 WeakPolarHBondContact O-CE 3.21Å; D525-M527 VanDerWaalsContact C-N 3.31Å; M527-D532 VanDerWaalsContact C-CB 3.49Å; M527-D532 HydrophobicContact CB-CB 4.22Å; M527-M536 HydrophobicContact CB-CG 3.93Å; M527-M536 HydrophobicContact CB-SD 4.24Å; M527-M536 HydrophobicContact CG-SD 4.41Å; M527-M536 HydrophobicContact SD-CG 4.18Å; M527-M536 HydrophobicContact SD-SD 3.85Å
528	S	61.4	Low	77.5	Confident	68 Å²	68	35 Å²	35	48%	0.476	20%	0.2	S	C	.	.			trans	-137.9	86.8	-166	61.2	0	0	0	0	114.7	G526 D532 K561	G526-S528 PolarHBondContact O-N 2.86Å; G526-S528 PolarHBondContact O-OG 3.32Å; S528-D532 PolarHBondContact N-OD2 2.85Å; S528-K561 VanDerWaalsContact CB-NZ 3.31Å
529	G	63	Low	77.4	Confident	36 Å²	36	35 Å²	35	37%	0.371	20%	0.2	S	C	.	.	S	Bend	trans	-174	179.2	168	0	0	0	0	0	110.9	E531 D532 R533	G529-E531 PolarHBondContact O-N 3.42Å; G529-D532 PolarHBondContact N-OD2 3.46Å; G529-D532 PolarHBondContact O-N 2.81Å; G529-D532 VanDerWaalsContact O-N 3.11Å; G529-R533 PolarHBondContact O-N 2.88Å
530	N	61.1	Low	77.3	Confident	122 Å²	122	35.2 Å²	35.2	65%	0.652	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-31	173.3	-74.8	-14.8	0	0	0	111.4	D532	N530-D532 VanDerWaalsContact C-N 3.34Å; N530-D532 PolarHBondContact O-N 2.84Å
531	E	59.3	Low	76.9	Confident	117 Å²	117	37.9 Å²	37.9	55%	0.547	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-35.4	170.2	-58.4	-175.7	151.5	0	0	113.2	R479 G529	R479-E531 IonicContact CZ-OE2 2.79Å; R479-E531 IonicContact NH1-OE2 3.32Å; R479-E531 PolarHBondContact NH1-OE2 2.87Å; G529-E531 PolarHBondContact O-N 3.42Å
532	D	63.4	Low	76.7	Confident	9 Å²	9	38.4 Å²	38.4	5%	0.048	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-15.9	-164.7	-59.4	-19.8	0	0	0	113.9	R479 M527 S528 G529 N530 A534 G535 M536	R479-D532 WeakPolarHBondContact CA-OD1 3.46Å; R479-D532 WeakPolarHBondContact CB-OD1 3.46Å; R479-D532 WeakPolarHBondContact CD-OD1 3.34Å; R479-D532 WeakPolarHBondContact CG-OD1 3.15Å; M527-D532 VanDerWaalsContact C-CB 3.49Å; M527-D532 HydrophobicContact CB-CB 4.22Å; S528-D532 PolarHBondContact N-OD2 2.85Å; G529-D532 PolarHBondContact N-OD2 3.46Å; G529-D532 PolarHBondContact O-N 2.81Å; G529-D532 VanDerWaalsContact O-N 3.11Å; N530-D532 VanDerWaalsContact C-N 3.34Å; N530-D532 PolarHBondContact O-N 2.84Å; D532-A534 PolarHBondContact O-N 3.06Å; D532-G535 WeakPolarHBondContact O-CA 3.46Å; D532-G535 PolarHBondContact O-N 2.89Å; D532-M536 PolarHBondContact O-N 3.14Å
533	R	59.6	Low	76.5	Confident	90 Å²	90	37.7 Å²	37.7	34%	0.34	21%	0.213	S	C	.	.	H	α-helix	trans	-60.1	-33.5	-179.2	-154.5	179.3	-158.4	129.2	2	111.4	G529 S909 D913	G529-R533 PolarHBondContact O-N 2.88Å; R533-S909 VanDerWaalsContact CZ-O 3.29Å; R533-S909 PolarHBondContact NH1-O 3.3Å; R533-S909 PolarHBondContact NH1-OG 3.01Å; R533-S909 PolarHBondContact NH2-O 2.7Å; R533-S909 VanDerWaalsContact NH2-O 3.11Å; R533-D913 IonicContact CZ-OD2 3.64Å; R533-D913 IonicContact NE-OD2 4Å; R533-D913 IonicContact NH2-OD2 2.69Å; R533-D913 PolarHBondContact NH2-OD2 3.19Å
534	A	70.3	Confident	76.5	Confident	49 Å²	49	39.3 Å²	39.3	41%	0.405	22%	0.218	S	C	.	.	H	α-helix	trans	-69.2	-34.4	171.1	0	0	0	0	0	112.9	K481 D532 Q537 G538	K481-A534 HydrophobicContact CB-CB 4.22Å; D532-A534 PolarHBondContact O-N 3.06Å; A534-Q537 PolarHBondContact O-N 3.43Å; A534-G538 PolarHBondContact O-N 2.81Å
535	G	78	Confident	76.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-43.9	179.5	0	0	0	0	0	112.9	R479 D532 Q537 G538 L539	R479-G535 WeakPolarHBondContact O-CA 3.5Å; D532-G535 WeakPolarHBondContact O-CA 3.46Å; D532-G535 PolarHBondContact O-N 2.89Å; G535-Q537 PolarHBondContact O-N 2.86Å; G535-G538 CarbonylContact O-C 3.5Å; G535-G538 WeakPolarHBondContact O-CA 3.44Å; G535-G538 PolarHBondContact O-N 3.01Å; G535-L539 PolarHBondContact O-N 3.14Å
536	M	82.6	Confident	76.6	Confident	11 Å²	11	45.9 Å²	45.9	5%	0.054	24%	0.241	C	C	.	.	H	α-helix	trans	-65.6	-37.9	177.2	-77.5	-68.2	-82.8	0	0	113.3	M527 D532 L539 I540 K561 L565	M527-M536 HydrophobicContact CB-CG 3.93Å; M527-M536 HydrophobicContact CB-SD 4.24Å; M527-M536 HydrophobicContact CG-SD 4.41Å; M527-M536 HydrophobicContact SD-CG 4.18Å; M527-M536 HydrophobicContact SD-SD 3.85Å; D532-M536 PolarHBondContact O-N 3.14Å; M536-L539 PolarHBondContact O-N 3.22Å; M536-L539 HydrophobicContact SD-CD2 4.42Å; M536-I540 WeakPolarHBondContact O-CB 3.22Å; M536-I540 WeakPolarHBondContact O-CG1 3.41Å; M536-I540 PolarHBondContact O-N 3.2Å; M536-K561 WeakPolarHBondContact CE-O 3.42Å; M536-L565 HydrophobicContact CE-CB 3.92Å; M536-L565 HydrophobicContact CE-CD2 3.95Å; M536-L565 HydrophobicContact SD-CD2 4.5Å
537	Q	81.3	Confident	76.8	Confident	65 Å²	65	52.5 Å²	52.5	30%	0.304	26%	0.256	S	S	.	.	H	α-helix	trans	-69.6	-37.2	172.1	-65.8	-66	-1.7	0	0	111.6	A534 G535 I540 E541	A534-Q537 PolarHBondContact O-N 3.43Å; G535-Q537 PolarHBondContact O-N 2.86Å; Q537-I540 PolarHBondContact O-N 2.99Å; Q537-E541 PolarHBondContact O-N 2.66Å
538	G	82.4	Confident	77.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-55	-50.8	169.9	0	0	0	0	0	112	A534 G535 I540 E541 L542	A534-G538 PolarHBondContact O-N 2.81Å; G535-G538 CarbonylContact O-C 3.5Å; G535-G538 WeakPolarHBondContact O-CA 3.44Å; G535-G538 PolarHBondContact O-N 3.01Å; G538-I540 VanDerWaalsContact C-N 3.28Å; G538-I540 PolarHBondContact O-N 2.93Å; G538-E541 PolarHBondContact O-N 2.91Å; G538-E541 VanDerWaalsContact O-N 3.16Å; G538-L542 WeakPolarHBondContact O-CB 3.38Å; G538-L542 PolarHBondContact O-N 2.79Å
539	L	86.6	Confident	78.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-37.7	176.1	-176.7	59.6	0	0	0	112	L484 M521 V524 G535 M536 L542 I543 L565	L484-L539 HydrophobicContact CD2-CB 3.93Å; M521-L539 HydrophobicContact CG-CD1 4.29Å; V524-L539 HydrophobicContact CB-CD2 4.48Å; V524-L539 HydrophobicContact CG1-CD2 3.97Å; G535-L539 PolarHBondContact O-N 3.14Å; M536-L539 PolarHBondContact O-N 3.22Å; M536-L539 HydrophobicContact SD-CD2 4.42Å; L539-L542 HydrophobicContact CD1-CD1 4.49Å; L539-L542 WeakPolarHBondContact O-CB 3.41Å; L539-L542 PolarHBondContact O-N 3.24Å; L539-I543 HydrophobicContact CD1-CD1 4.19Å; L539-I543 HydrophobicContact CD1-CG1 4.44Å; L539-I543 HydrophobicContact CG-CD1 4Å; L539-I543 WeakPolarHBondContact O-CB 3.43Å; L539-I543 WeakPolarHBondContact O-CD1 3.34Å; L539-I543 WeakPolarHBondContact O-CG1 3.5Å; L539-I543 PolarHBondContact O-N 2.82Å; L539-L565 HydrophobicContact CD2-CD1 4.2Å; L539-L565 HydrophobicContact CD2-CD2 4.07Å; L539-L565 HydrophobicContact CG-CD1 4.27Å
540	I	88	Confident	80.2	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-69.9	-36.3	176.1	-75.5	169.5	0	0	0	112.4	M536 Q537 G538 K544 L565	M536-I540 WeakPolarHBondContact O-CB 3.22Å; M536-I540 WeakPolarHBondContact O-CG1 3.41Å; M536-I540 PolarHBondContact O-N 3.2Å; Q537-I540 PolarHBondContact O-N 2.99Å; G538-I540 VanDerWaalsContact C-N 3.28Å; G538-I540 PolarHBondContact O-N 2.93Å; I540-K544 HydrophobicContact CG2-CD 4.47Å; I540-K544 VanDerWaalsContact CG2-CE 3.49Å; I540-K544 VanDerWaalsContact O-CD 3.27Å; I540-K544 WeakPolarHBondContact O-CD 3.47Å; I540-K544 WeakPolarHBondContact O-CE 3.37Å; I540-K544 VanDerWaalsContact O-CG 3.25Å; I540-K544 WeakPolarHBondContact O-CG 3.48Å; I540-K544 PolarHBondContact O-N 2.97Å; I540-L565 HydrophobicContact CD1-CB 4.33Å; I540-L565 HydrophobicContact CG1-CB 4.41Å; I540-L565 HydrophobicContact CG1-CD1 3.86Å
541	E	86	Confident	81.8	Confident	57 Å²	57	41.8 Å²	41.8	27%	0.266	19%	0.185	S	C	.	.	H	α-helix	trans	-67.4	-43.3	170.6	-77.1	-175	-119.5	0	0	112	K481 Q537 G538 K544 R545	K481-E541 VanDerWaalsContact NZ-CD 3.31Å; K481-E541 IonicContact NZ-OE1 3.09Å; K481-E541 PolarHBondContact NZ-OE1 3.49Å; K481-E541 IonicContact NZ-OE2 3.57Å; K481-E541 PolarHBondContact NZ-OE2 3.11Å; Q537-E541 PolarHBondContact O-N 2.66Å; G538-E541 PolarHBondContact O-N 2.91Å; G538-E541 VanDerWaalsContact O-N 3.16Å; E541-K544 WeakPolarHBondContact O-CB 3.31Å; E541-K544 PolarHBondContact O-N 2.83Å; E541-K544 VanDerWaalsContact O-N 3.09Å; E541-R545 WeakPolarHBondContact O-CG 3.27Å; E541-R545 PolarHBondContact O-N 3.16Å; E541-R545 IonicContact OE2-CZ 2.66Å; E541-R545 IonicContact OE2-NH2 2.65Å; E541-R545 PolarHBondContact OE2-NH2 2.87Å
542	L	85.7	Confident	83.5	Confident	12 Å²	12	36.2 Å²	36.2	6%	0.063	16%	0.159	C	C	.	.	H	α-helix	trans	-58.8	-47.3	177.1	-173.5	169.8	0	0	0	110.7	L484 C488 L492 G538 L539 K544 R545 T546 I550	L484-L542 HydrophobicContact CD1-CD1 4.29Å; L484-L542 HydrophobicContact CD2-CD1 3.95Å; L484-L542 HydrophobicContact CG-CD1 3.82Å; C488-L542 HydrophobicContact CB-CD1 3.87Å; L492-L542 HydrophobicContact CD1-CD1 3.9Å; L492-L542 HydrophobicContact CD1-CD2 3.54Å; L492-L542 HydrophobicContact CD1-CG 3.42Å; L492-L542 VanDerWaalsContact CD1-CG 3.42Å; L492-L542 HydrophobicContact CD2-CD2 3.73Å; L492-L542 HydrophobicContact CG-CD2 4.3Å; G538-L542 WeakPolarHBondContact O-CB 3.38Å; G538-L542 PolarHBondContact O-N 2.79Å; L539-L542 HydrophobicContact CD1-CD1 4.49Å; L539-L542 WeakPolarHBondContact O-CB 3.41Å; L539-L542 PolarHBondContact O-N 3.24Å; L542-K544 VanDerWaalsContact C-N 3.28Å; L542-K544 PolarHBondContact O-N 2.98Å; L542-R545 PolarHBondContact O-N 3.4Å; L542-R545 VanDerWaalsContact O-N 3.12Å; L542-T546 WeakPolarHBondContact O-CB 3.25Å; L542-T546 PolarHBondContact O-N 3.36Å; L542-I550 HydrophobicContact CD2-CD1 3.27Å
543	I	88.8	Confident	85	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-29.7	174.2	-71.6	164.2	0	0	0	112.6	K443 A444 L539 I550 L565 H568	K443-I543 VanDerWaalsContact CD-O 3.31Å; K443-I543 WeakPolarHBondContact CD-O 3.39Å; A444-I543 HydrophobicContact CB-CD1 3.98Å; A444-I543 HydrophobicContact CB-CG1 3.95Å; A444-I543 HydrophobicContact CB-CG2 3.76Å; L539-I543 HydrophobicContact CD1-CD1 4.19Å; L539-I543 HydrophobicContact CD1-CG1 4.44Å; L539-I543 HydrophobicContact CG-CD1 4Å; L539-I543 WeakPolarHBondContact O-CB 3.43Å; L539-I543 WeakPolarHBondContact O-CD1 3.34Å; L539-I543 WeakPolarHBondContact O-CG1 3.5Å; L539-I543 PolarHBondContact O-N 2.82Å; I543-I550 HydrophobicContact CG1-CD1 3.87Å; I543-L565 HydrophobicContact CD1-CD1 3.47Å; I543-L565 VanDerWaalsContact CD1-CD1 3.47Å; I543-H568 HydrophobicContact CG2-CB 4.41Å
544	K	87.5	Confident	86.5	Confident	110 Å²	110	31.5 Å²	31.5	48%	0.478	14%	0.14	S	C	.	.	H	α-helix	trans	-71.5	-42.1	173	-67.5	158.3	-168.7	167	0	110.8	K443 I540 E541 L542 H568	K443-K544 PolarHBondContact NZ-O 3.26Å; I540-K544 HydrophobicContact CG2-CD 4.47Å; I540-K544 VanDerWaalsContact CG2-CE 3.49Å; I540-K544 VanDerWaalsContact O-CD 3.27Å; I540-K544 WeakPolarHBondContact O-CD 3.47Å; I540-K544 WeakPolarHBondContact O-CE 3.37Å; I540-K544 VanDerWaalsContact O-CG 3.25Å; I540-K544 WeakPolarHBondContact O-CG 3.48Å; I540-K544 PolarHBondContact O-N 2.97Å; E541-K544 WeakPolarHBondContact O-CB 3.31Å; E541-K544 PolarHBondContact O-N 2.83Å; E541-K544 VanDerWaalsContact O-N 3.09Å; L542-K544 VanDerWaalsContact C-N 3.28Å; L542-K544 PolarHBondContact O-N 2.98Å; K544-H568 WeakPolarHBondContact CE-NE2 3.42Å
545	R	86.1	Confident	87.4	Confident	169 Å²	169	32 Å²	32	64%	0.638	14%	0.136	S	C	*	.	H	α-helix	trans	-80.9	-30.4	-175.5	-64.9	179.1	-165	-178.7	8.5	114.5	E541 L542	E541-R545 WeakPolarHBondContact O-CG 3.27Å; E541-R545 PolarHBondContact O-N 3.16Å; E541-R545 IonicContact OE2-CZ 2.66Å; E541-R545 IonicContact OE2-NH2 2.65Å; E541-R545 PolarHBondContact OE2-NH2 2.87Å; L542-R545 PolarHBondContact O-N 3.4Å; L542-R545 VanDerWaalsContact O-N 3.12Å
546	T	85.3	Confident	87.6	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.018	15%	0.153	C	C	.	.			trans	-50.5	146.4	-170	-173.5	0	0	0	0	115.6	K443 L492 L542 I548 I550	K443-T546 HydrophobicContact CB-CG2 3.99Å; K443-T546 HydrophobicContact CD-CG2 3.84Å; K443-T546 WeakPolarHBondContact CE-O 3.44Å; K443-T546 HydrophobicContact CG-CG2 4.47Å; K443-T546 PolarHBondContact NZ-O 3.29Å; L492-T546 VanDerWaalsContact CD2-OG1 3.25Å; L492-T546 WeakPolarHBondContact CD2-OG1 3.27Å; L542-T546 WeakPolarHBondContact O-CB 3.25Å; L542-T546 PolarHBondContact O-N 3.36Å; T546-I548 WeakPolarHBondContact CG2-O 3.27Å; T546-I548 WeakPolarHBondContact OG1-CG1 3.27Å; T546-I548 PolarHBondContact OG1-N 3.49Å; T546-I548 PolarHBondContact OG1-O 2.83Å; T546-I550 HydrophobicContact CG2-CD1 3.79Å; T546-I550 HydrophobicContact CG2-CG1 4.23Å
547	R	82.9	Confident	87.5	Confident	171 Å²	171	37 Å²	37	65%	0.645	16%	0.16	S	C	*	.	S	Bend	trans	-107.9	0.8	167.6	-57.8	-166.9	-166.9	-161.9	12.2	113.9	W416 D422	W416-R547 VanDerWaalsContact CH2-C 3.46Å; W416-R547 VanDerWaalsContact CH2-O 3.28Å; W416-R547 WeakPolarHBondContact CH2-O 3.37Å; W416-R547 WeakPolarHBondContact CZ3-O 3.35Å; D422-R547 IonicContact OD2-NH1 2.73Å
548	I	86.8	Confident	87.3	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	18%	0.177	C	C	.	.	S	Bend	trans	-117.7	153.8	175.5	60.3	174.1	0	0	0	111.1	W416 L492 N516 H517 L519 T546	W416-I548 WeakPolarHBondContact CZ2-O 3.5Å; L492-I548 HydrophobicContact CD2-CD1 3.89Å; L492-I548 HydrophobicContact CD2-CG1 3.8Å; N516-I548 HydrophobicContact CB-CG2 4.44Å; H517-I548 VanDerWaalsContact NE2-CD1 3.29Å; H517-I548 WeakPolarHBondContact NE2-CD1 3.4Å; L519-I548 HydrophobicContact CB-CD1 4Å; T546-I548 WeakPolarHBondContact CG2-O 3.27Å; T546-I548 WeakPolarHBondContact OG1-CG1 3.27Å; T546-I548 PolarHBondContact OG1-N 3.49Å; T546-I548 PolarHBondContact OG1-O 2.83Å
549	P	90.9	Very high	87	Confident	0 Å²	0	42 Å²	42	0%	0	19%	0.186	C	C	.	.			trans	-61	138.1	169.3	25.5	-35.3	0	0	0	111.4	W412 L413 W416 L515 V518 L519	W412-P549 HydrophobicContact CH2-CB 4.07Å; W412-P549 HydrophobicContact CZ3-CB 4.24Å; L413-P549 HydrophobicContact CD2-CB 3.89Å; L413-P549 HydrophobicContact CD2-CG 4.2Å; W416-P549 HydrophobicContact CD2-CB 4.08Å; W416-P549 HydrophobicContact CD2-CG 4.47Å; W416-P549 HydrophobicContact CG-CB 4.03Å; W416-P549 HydrophobicContact CZ2-CB 4.5Å; L515-P549 HydrophobicContact CD1-CG 4.34Å; V518-P549 HydrophobicContact CB-CG 4.27Å; V518-P549 HydrophobicContact CG1-CB 4.3Å; V518-P549 HydrophobicContact CG1-CG 4.12Å; V518-P549 HydrophobicContact CG2-CG 3.91Å; L519-P549 PolarHBondContact N-O 3.47Å
550	I	92.2	Very high	86.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.1	175	-56.2	178.6	0	0	0	108.9	A444 A445 L492 L519 M521 L542 I543 T546	A444-I550 CarbonylContact C-O 3.57Å; A444-I550 WeakPolarHBondContact CA-O 3.31Å; A444-I550 HydrophobicContact CB-CB 3.97Å; A444-I550 HydrophobicContact CB-CG2 4.5Å; A444-I550 WeakPolarHBondContact CB-O 3.49Å; A445-I550 PolarHBondContact N-O 3.19Å; L492-I550 HydrophobicContact CD2-CD1 4.05Å; L519-I550 HydrophobicContact CB-CG1 4.31Å; L519-I550 HydrophobicContact CD2-CD1 4.34Å; L519-I550 HydrophobicContact CD2-CG1 4.32Å; L519-I550 HydrophobicContact CD2-CG2 4.41Å; L519-I550 CarbonylContact O-C 3.54Å; L519-I550 WeakPolarHBondContact O-CA 3.35Å; M521-I550 HydrophobicContact CG-CG2 4.47Å; L542-I550 HydrophobicContact CD2-CD1 3.27Å; I543-I550 HydrophobicContact CG1-CD1 3.87Å; T546-I550 HydrophobicContact CG2-CD1 3.79Å; T546-I550 HydrophobicContact CG2-CG1 4.23Å
551	I	94.8	Very high	85.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	103.6	176.1	-59.5	178.9	0	0	0	107.2	L409 W412 L413 L447 A459 V518 L519 I520 M521 I553	L409-I551 HydrophobicContact CD1-CD1 4.25Å; L409-I551 HydrophobicContact CD1-CG1 4.44Å; L409-I551 HydrophobicContact CD2-CD1 4.49Å; W412-I551 HydrophobicContact CZ3-CG1 4.39Å; L413-I551 HydrophobicContact CD1-CD1 4.35Å; L413-I551 HydrophobicContact CD2-CD1 4.48Å; L447-I551 HydrophobicContact CD1-CG2 3.53Å; L447-I551 HydrophobicContact CD2-CG2 4.31Å; A459-I551 HydrophobicContact CB-CD1 4.22Å; A459-I551 HydrophobicContact CB-CG2 3.85Å; V518-I551 HydrophobicContact CG1-CD1 3.71Å; V518-I551 HydrophobicContact CG1-CG1 3.86Å; L519-I551 PolarHBondContact O-N 3.18Å; I520-I551 WeakPolarHBondContact CA-O 3.24Å; I520-I551 HydrophobicContact CG1-CB 4.33Å; I520-I551 HydrophobicContact CG1-CD1 4.4Å; M521-I551 PolarHBondContact N-O 2.86Å; I551-I553 HydrophobicContact CG2-CG1 4.16Å
552	C	94.1	Very high	85.6	Confident	0 Å²	0	47 Å²	47	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	142.3	169.8	-58.3	0	0	0	0	109.6	A445 L446 L447 M521 V524 L565	A445-C552 PolarHBondContact O-N 3.22Å; L446-C552 CarbonylContact C-O 3.53Å; L446-C552 WeakPolarHBondContact CA-O 3.23Å; L446-C552 HydrophobicContact CD1-CB 3.78Å; L447-C552 PolarHBondContact N-O 2.62Å; M521-C552 CarbonylContact O-C 3.48Å; M521-C552 WeakPolarHBondContact O-CA 3.19Å; V524-C552 HydrophobicContact CG1-CB 4.28Å; V524-C552 HydrophobicContact CG2-CB 4.07Å; C552-L565 HydrophobicContact CB-CD2 4.35Å
553	I	94.5	Very high	85.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.9	177.6	-48.1	-177.5	0	0	0	109.3	L447 K455 T456 A459 I520 M521 D522 E523 V524 I551	L447-I553 HydrophobicContact CB-CG1 4.24Å; L447-I553 HydrophobicContact CB-CG2 4.28Å; L447-I553 HydrophobicContact CD2-CD1 4.45Å; L447-I553 HydrophobicContact CD2-CG1 4.42Å; L447-I553 WeakPolarHBondContact O-CA 3.26Å; K455-I553 HydrophobicContact CB-CG2 3.65Å; K455-I553 HydrophobicContact CD-CG2 3.85Å; K455-I553 HydrophobicContact CG-CG2 4.39Å; T456-I553 HydrophobicContact CG2-CD1 4.44Å; A459-I553 HydrophobicContact CB-CD1 4Å; I520-I553 HydrophobicContact CG2-CD1 3.94Å; I520-I553 HydrophobicContact CG2-CG1 4.47Å; M521-I553 PolarHBondContact O-N 3.45Å; D522-I553 VanDerWaalsContact OD1-CB 3.29Å; D522-I553 WeakPolarHBondContact OD1-CB 3.35Å; D522-I553 WeakPolarHBondContact OD1-CG2 3.36Å; E523-I553 PolarHBondContact N-O 3.14Å; E523-I553 VanDerWaalsContact N-O 3.11Å; V524-I553 WeakPolarHBondContact CG2-O 3.43Å; V524-I553 PolarHBondContact N-O 3.43Å; I551-I553 HydrophobicContact CG2-CG1 4.16Å
554	C	91	Very high	85.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.4	175.5	70.3	0	0	0	0	112.2	L447 S448 K455 V524 D525 D556 V562	L447-C554 PolarHBondContact O-N 2.96Å; S448-C554 WeakPolarHBondContact CA-O 3.5Å; S448-C554 VanDerWaalsContact CB-SG 3.51Å; K455-C554 WeakPolarHBondContact CD-O 3.32Å; K455-C554 WeakPolarHBondContact CE-O 3.43Å; K455-C554 PolarHBondContact NZ-O 3.02Å; V524-C554 HydrophobicContact CG2-CB 4.09Å; D525-C554 HydrophobicContact CB-CB 4.08Å; D525-C554 VanDerWaalsContact OD1-CA 3.24Å; D525-C554 WeakPolarHBondContact OD1-CA 3.42Å; D525-C554 WeakPolarHBondContact OD1-CB 3.28Å; C554-D556 PolarHBondContact SG-O 3.38Å; C554-V562 HydrophobicContact CB-CG2 4.29Å
555	N	89.5	Confident	85.1	Confident	60 Å²	60	47 Å²	47	32%	0.321	21%	0.213	S	C	.	.	S	Bend	trans	-81.5	-45.9	172.5	-64.3	-62.6	0	0	0	111.2	G449 K455 D525	G449-N555 CarbonylContact C-O 3.56Å; G449-N555 VanDerWaalsContact C-O 3.23Å; G449-N555 PolarHBondContact N-O 3.4Å; G449-N555 CarbonylContact O-C 3.41Å; G449-N555 WeakPolarHBondContact O-CA 3.46Å; K455-N555 PolarHBondContact NZ-OD1 2.66Å; D525-N555 PolarHBondContact OD1-N 2.97Å; D525-N555 WeakPolarHBondContact OD2-CA 3.41Å; D525-N555 WeakPolarHBondContact OD2-CB 3.27Å; D525-N555 PolarHBondContact OD2-N 3.09Å
556	D	82.2	Confident	85.1	Confident	67 Å²	67	39.3 Å²	39.3	36%	0.358	19%	0.186	S	C	.	.			trans	-119	144.8	170.7	-176	43.7	0	0	0	114.1	D525 C554 Q558 S559	D525-D556 PolarHBondContact OD2-N 3.3Å; C554-D556 PolarHBondContact SG-O 3.38Å; D556-Q558 VanDerWaalsContact CG-N 3.27Å; D556-Q558 PolarHBondContact OD1-N 2.81Å; D556-Q558 WeakPolarHBondContact OD2-CA 3.43Å; D556-Q558 WeakPolarHBondContact OD2-CB 3.36Å; D556-Q558 PolarHBondContact OD2-N 2.69Å; D556-S559 PolarHBondContact OD2-N 2.8Å
557	R	81.3	Confident	85.1	Confident	49 Å²	49	44.3 Å²	44.3	19%	0.185	21%	0.212	C	C	.	.	S	Bend	trans	-121	5.6	-179.7	172.6	-93.7	172.5	-95.1	1.6	112.1	L446 V562 A566 D571 R573	L446-R557 HydrophobicContact CD2-CG 4.1Å; R557-V562 HydrophobicContact CB-CG1 4.32Å; R557-V562 HydrophobicContact CG-CG1 4.4Å; R557-A566 HydrophobicContact CG-CB 4.49Å; R557-D571 IonicContact CZ-OD2 2.83Å; R557-D571 VanDerWaalsContact CZ-OD2 3.26Å; R557-D571 IonicContact NE-OD1 2.67Å; R557-D571 PolarHBondContact NE-OD1 3.24Å; R557-D571 IonicContact NE-OD2 3.48Å; R557-D571 PolarHBondContact NE-OD2 2.85Å; R557-D571 IonicContact NH2-OD2 2.7Å; R557-D571 PolarHBondContact NH2-OD2 2.78Å; R557-R573 VanDerWaalsContact CZ-NH2 3.33Å
558	Q	77.9	Confident	85.3	Confident	145 Å²	145	39.6 Å²	39.6	68%	0.678	20%	0.197	S	C	*	.	S	Bend	trans	-88.2	-29.8	166	-56.7	-166.3	71.5	0	0	111.5	D556 R563	D556-Q558 VanDerWaalsContact CG-N 3.27Å; D556-Q558 PolarHBondContact OD1-N 2.81Å; D556-Q558 WeakPolarHBondContact OD2-CA 3.43Å; D556-Q558 WeakPolarHBondContact OD2-CB 3.36Å; D556-Q558 PolarHBondContact OD2-N 2.69Å; Q558-R563 PolarHBondContact O-NE 2.97Å; Q558-R563 PolarHBondContact O-NH2 3.42Å
559	S	74.9	Confident	85.6	Confident	27 Å²	27	39.5 Å²	39.5	19%	0.189	20%	0.197	C	C	.	.	S	Bend	trans	-33.3	125.1	168.6	172.9	0	0	0	0	112	D556 K561 V562 R563	D556-S559 PolarHBondContact OD2-N 2.8Å; S559-K561 PolarHBondContact O-N 3.2Å; S559-V562 PolarHBondContact O-N 3.25Å; S559-R563 WeakPolarHBondContact O-CB 3.5Å; S559-R563 PolarHBondContact O-N 2.66Å
560	P	76	Confident	85.6	Confident	72 Å²	72	40.1 Å²	40.1	47%	0.468	20%	0.2	S	C	.	.	H	α-helix	trans	-52.9	-41.4	-179.1	-27.3	35	0	0	0	112.9	V562 R563	P560-V562 PolarHBondContact O-N 3.49Å; P560-R563 WeakPolarHBondContact O-CB 3.43Å; P560-R563 PolarHBondContact O-N 2.87Å; P560-R563 VanDerWaalsContact O-N 3.11Å
561	K	73.4	Confident	85.6	Confident	94 Å²	94	42.4 Å²	42.4	41%	0.409	21%	0.212	S	C	.	.	H	α-helix	trans	-59.6	-49.8	-178.8	-57	-179.7	-173.2	-179.5	0	111.4	S528 M536 S559 R563 S564	S528-K561 VanDerWaalsContact CB-NZ 3.31Å; M536-K561 WeakPolarHBondContact CE-O 3.42Å; S559-K561 PolarHBondContact O-N 3.2Å; K561-R563 VanDerWaalsContact C-N 3.3Å; K561-R563 PolarHBondContact O-N 3.06Å; K561-S564 PolarHBondContact O-OG 2.91Å
562	V	82	Confident	85.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-71.6	-24.7	177.4	-178.9	0	0	0	0	112.3	L446 D525 C554 R557 S559 P560 S564 L565 A566	L446-V562 HydrophobicContact CD1-CG1 4.39Å; L446-V562 HydrophobicContact CD2-CG1 3.81Å; D525-V562 HydrophobicContact CB-CG2 3.77Å; C554-V562 HydrophobicContact CB-CG2 4.29Å; R557-V562 HydrophobicContact CB-CG1 4.32Å; R557-V562 HydrophobicContact CG-CG1 4.4Å; S559-V562 PolarHBondContact O-N 3.25Å; P560-V562 PolarHBondContact O-N 3.49Å; V562-S564 PolarHBondContact O-N 2.71Å; V562-L565 PolarHBondContact O-N 2.89Å; V562-A566 WeakPolarHBondContact O-CB 3.44Å; V562-A566 PolarHBondContact O-N 3.09Å
563	R	81	Confident	85.3	Confident	104 Å²	104	48.2 Å²	48.2	39%	0.392	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-30	-178.6	-160.4	-176.7	-60.7	166.7	0.3	113	Q558 S559 P560 K561 N567	Q558-R563 PolarHBondContact O-NE 2.97Å; Q558-R563 PolarHBondContact O-NH2 3.42Å; S559-R563 WeakPolarHBondContact O-CB 3.5Å; S559-R563 PolarHBondContact O-N 2.66Å; P560-R563 WeakPolarHBondContact O-CB 3.43Å; P560-R563 PolarHBondContact O-N 2.87Å; P560-R563 VanDerWaalsContact O-N 3.11Å; K561-R563 VanDerWaalsContact C-N 3.3Å; K561-R563 PolarHBondContact O-N 3.06Å; R563-N567 PolarHBondContact O-ND2 3.01Å
564	S	83.7	Confident	85.2	Confident	21 Å²	21	48.5 Å²	48.5	15%	0.147	24%	0.235	C	C	.	.	H	α-helix	trans	-70.3	-53.6	173.5	65.8	0	0	0	0	111	K561 V562 A566 N567	K561-S564 PolarHBondContact O-OG 2.91Å; V562-S564 PolarHBondContact O-N 2.71Å; S564-A566 VanDerWaalsContact C-N 3.34Å; S564-A566 PolarHBondContact O-N 3.5Å; S564-N567 PolarHBondContact O-N 3.36Å; S564-N567 PolarHBondContact O-ND2 3.08Å; S564-N567 VanDerWaalsContact O-ND2 3.12Å
565	L	86.5	Confident	85	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.5	-40.9	177.9	179	65.3	0	0	0	113	V524 M536 L539 I540 I543 C552 V562 N567 H568 C569	V524-L565 HydrophobicContact CB-CD2 4.38Å; V524-L565 HydrophobicContact CG2-CD2 3.83Å; M536-L565 HydrophobicContact CE-CB 3.92Å; M536-L565 HydrophobicContact CE-CD2 3.95Å; M536-L565 HydrophobicContact SD-CD2 4.5Å; L539-L565 HydrophobicContact CD2-CD1 4.2Å; L539-L565 HydrophobicContact CD2-CD2 4.07Å; L539-L565 HydrophobicContact CG-CD1 4.27Å; I540-L565 HydrophobicContact CD1-CB 4.33Å; I540-L565 HydrophobicContact CG1-CB 4.41Å; I540-L565 HydrophobicContact CG1-CD1 3.86Å; I543-L565 HydrophobicContact CD1-CD1 3.47Å; I543-L565 VanDerWaalsContact CD1-CD1 3.47Å; C552-L565 HydrophobicContact CB-CD2 4.35Å; V562-L565 PolarHBondContact O-N 2.89Å; L565-N567 PolarHBondContact O-N 3.37Å; L565-N567 VanDerWaalsContact O-N 3.09Å; L565-H568 PolarHBondContact O-N 2.86Å; L565-C569 PolarHBondContact O-N 2.91Å; L565-C569 PolarHBondContact O-SG 3.12Å; L565-C569 VanDerWaalsContact O-SG 3.32Å
566	A	85.7	Confident	84.9	Confident	8 Å²	8	57.7 Å²	57.7	7%	0.066	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.2	-179.8	0	0	0	0	0	114.2	L446 R557 V562 S564 H568	L446-A566 HydrophobicContact CD2-CB 3.72Å; R557-A566 HydrophobicContact CG-CB 4.49Å; V562-A566 WeakPolarHBondContact O-CB 3.44Å; V562-A566 PolarHBondContact O-N 3.09Å; S564-A566 VanDerWaalsContact C-N 3.34Å; S564-A566 PolarHBondContact O-N 3.5Å; A566-H568 VanDerWaalsContact C-N 3.29Å
567	N	85.6	Confident	85.2	Confident	109 Å²	109	54.9 Å²	54.9	58%	0.583	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-14	172.8	-59.4	-67.4	0	0	0	113.4	R563 S564 L565	R563-N567 PolarHBondContact O-ND2 3.01Å; S564-N567 PolarHBondContact O-N 3.36Å; S564-N567 PolarHBondContact O-ND2 3.08Å; S564-N567 VanDerWaalsContact O-ND2 3.12Å; L565-N567 PolarHBondContact O-N 3.37Å; L565-N567 VanDerWaalsContact O-N 3.09Å
568	H	88.2	Confident	85.6	Confident	71 Å²	71	58.8 Å²	58.8	33%	0.329	28%	0.277	S	S	.	.	S	Bend	trans	-108.2	-2.7	-177.9	-71	-58.1	0	0	0	113.7	F442 I543 K544 L565 A566	F442-H568 WeakPolarHBondContact CD1-O 3.38Å; I543-H568 HydrophobicContact CG2-CB 4.41Å; K544-H568 WeakPolarHBondContact CE-NE2 3.42Å; L565-H568 PolarHBondContact O-N 2.86Å; A566-H568 VanDerWaalsContact C-N 3.29Å
569	C	91.5	Very high	86.2	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.014	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	157.1	-173.5	-53.3	0	0	0	0	112.7	A444 L446 L565 D571	A444-C569 HydrophobicContact CB-CB 4.44Å; A444-C569 CarbonylContact O-C 3.47Å; A444-C569 VanDerWaalsContact O-CA 3.28Å; A444-C569 WeakPolarHBondContact O-CA 3.42Å; L446-C569 HydrophobicContact CB-CB 3.63Å; L565-C569 PolarHBondContact O-N 2.91Å; L565-C569 PolarHBondContact O-SG 3.12Å; L565-C569 VanDerWaalsContact O-SG 3.32Å; C569-D571 PolarHBondContact O-N 3.23Å
570	F	92.9	Very high	87	Confident	14 Å²	14	57 Å²	57	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	101	168.1	-178	-151.6	0	0	0	110.2	K408 W412 F442 A444 A445 L446 L572	K408-F570 HydrophobicContact CB-CE1 4.21Å; K408-F570 HydrophobicContact CB-CZ 4.17Å; K408-F570 HydrophobicContact CD-CZ 4.45Å; W412-F570 HydrophobicContact CB-CD1 4.08Å; W412-F570 HydrophobicContact CB-CE1 3.98Å; W412-F570 AromaticContact CD1-CD1 3.95Å; W412-F570 HydrophobicContact CD2-CD1 4.37Å; W412-F570 AromaticContact CG-CD1 3.85Å; W412-F570 HydrophobicContact CG-CD1 3.85Å; W412-F570 HydrophobicContact CG-CE1 4.24Å; F442-F570 HydrophobicContact CB-CB 4.22Å; F442-F570 HydrophobicContact CD2-CB 3.99Å; F442-F570 HydrophobicContact CG-CB 4.38Å; A444-F570 PolarHBondContact O-N 3.29Å; A445-F570 HydrophobicContact CB-CB 4.33Å; L446-F570 PolarHBondContact N-O 3.45Å; F570-L572 HydrophobicContact CD1-CD1 4.24Å; F570-L572 HydrophobicContact CD1-CD2 4.18Å; F570-L572 HydrophobicContact CD1-CG 4.13Å; F570-L572 HydrophobicContact CE1-CD1 4.32Å; F570-L572 HydrophobicContact CE1-CD2 3.76Å; F570-L572 HydrophobicContact CE1-CG 4.21Å; F570-L572 HydrophobicContact CE2-CD2 4.12Å; F570-L572 HydrophobicContact CG-CG 4.42Å; F570-L572 HydrophobicContact CZ-CD2 3.73Å; F570-L572 PolarHBondContact O-N 3.19Å; F570-L572 VanDerWaalsContact O-N 3.14Å
571	D	91.4	Very high	87.7	Confident	47 Å²	47	57.1 Å²	57.1	25%	0.251	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	96.5	-176.8	-174.4	-9.9	0	0	0	112	R557 C569 R573	R557-D571 IonicContact CZ-OD2 2.83Å; R557-D571 VanDerWaalsContact CZ-OD2 3.26Å; R557-D571 IonicContact NE-OD1 2.67Å; R557-D571 PolarHBondContact NE-OD1 3.24Å; R557-D571 IonicContact NE-OD2 3.48Å; R557-D571 PolarHBondContact NE-OD2 2.85Å; R557-D571 IonicContact NH2-OD2 2.7Å; R557-D571 PolarHBondContact NH2-OD2 2.78Å; C569-D571 PolarHBondContact O-N 3.23Å; D571-R573 VanDerWaalsContact OD1-CG 3.27Å; D571-R573 WeakPolarHBondContact OD1-CG 3.47Å; D571-R573 IonicContact OD1-CZ 3.11Å; D571-R573 IonicContact OD1-NE 3.64Å; D571-R573 PolarHBondContact OD1-NE 2.89Å; D571-R573 IonicContact OD1-NH2 2.67Å; D571-R573 IonicContact OD2-CZ 3.34Å; D571-R573 IonicContact OD2-NE 3.03Å; D571-R573 PolarHBondContact OD2-NE 2.75Å; D571-R573 IonicContact OD2-NH2 2.71Å; D571-R573 PolarHBondContact OD2-NH2 3.4Å
572	L	92.1	Very high	88.6	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.7	178.4	-68.8	178.4	0	0	0	110.2	C405 K408 L409 L446 L447 S448 F570	C405-L572 HydrophobicContact CB-CB 4.32Å; K408-L572 HydrophobicContact CB-CD2 3.73Å; K408-L572 HydrophobicContact CD-CD2 3.98Å; L409-L572 HydrophobicContact CB-CD1 3.82Å; L409-L572 HydrophobicContact CD1-CD1 4.03Å; L409-L572 HydrophobicContact CG-CD1 4.48Å; L446-L572 PolarHBondContact O-N 2.81Å; L447-L572 WeakPolarHBondContact CA-O 3.2Å; L447-L572 HydrophobicContact CD1-CD1 4.35Å; S448-L572 PolarHBondContact N-O 2.82Å; S448-L572 PolarHBondContact OG-O 3.09Å; F570-L572 HydrophobicContact CD1-CD1 4.24Å; F570-L572 HydrophobicContact CD1-CD2 4.18Å; F570-L572 HydrophobicContact CD1-CG 4.13Å; F570-L572 HydrophobicContact CE1-CD1 4.32Å; F570-L572 HydrophobicContact CE1-CD2 3.76Å; F570-L572 HydrophobicContact CE1-CG 4.21Å; F570-L572 HydrophobicContact CE2-CD2 4.12Å; F570-L572 HydrophobicContact CG-CG 4.42Å; F570-L572 HydrophobicContact CZ-CD2 3.73Å; F570-L572 PolarHBondContact O-N 3.19Å; F570-L572 VanDerWaalsContact O-N 3.14Å
573	R	90.4	Very high	89.1	Confident	119 Å²	119	55.7 Å²	55.7	45%	0.449	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	105.2	-171	-54.8	-159.7	-171.3	176	13.5	113	C405 S448 R557 D571 H575	C405-R573 PolarHBondContact SG-N 3.46Å; C405-R573 PolarHBondContact SG-O 3Å; S448-R573 CarbonylContact O-C 3.59Å; S448-R573 WeakPolarHBondContact O-CA 3.42Å; R557-R573 VanDerWaalsContact CZ-NH2 3.33Å; D571-R573 VanDerWaalsContact OD1-CG 3.27Å; D571-R573 WeakPolarHBondContact OD1-CG 3.47Å; D571-R573 IonicContact OD1-CZ 3.11Å; D571-R573 IonicContact OD1-NE 3.64Å; D571-R573 PolarHBondContact OD1-NE 2.89Å; D571-R573 IonicContact OD1-NH2 2.67Å; D571-R573 IonicContact OD2-CZ 3.34Å; D571-R573 IonicContact OD2-NE 3.03Å; D571-R573 PolarHBondContact OD2-NE 2.75Å; D571-R573 IonicContact OD2-NH2 2.71Å; D571-R573 PolarHBondContact OD2-NH2 3.4Å; R573-H575 PolarHBondContact O-CE1 3Å; R573-H575 VanDerWaalsContact O-CE1 3.3Å; R573-H575 PolarHBondContact O-ND1 3.39Å
574	F	91.5	Very high	89.6	Confident	5 Å²	5	54.7 Å²	54.7	2%	0.022	27%	0.266	C	S	.	.			trans	-73.4	137.8	172.4	-72.4	-116	0	0	0	109.4	Q399 C405 L447 S448 I453 K455 T458	Q399-F574 HydrophobicContact CG-CD1 4.19Å; Q399-F574 HydrophobicContact CG-CE1 3.96Å; C405-F574 HydrophobicContact CB-CD2 3.76Å; C405-F574 HydrophobicContact CB-CE1 4.37Å; C405-F574 HydrophobicContact CB-CE2 3.37Å; C405-F574 HydrophobicContact CB-CG 4.38Å; C405-F574 HydrophobicContact CB-CZ 3.72Å; L447-F574 HydrophobicContact CB-CD2 4.48Å; L447-F574 HydrophobicContact CB-CE2 4.09Å; L447-F574 HydrophobicContact CD2-CE2 3.95Å; L447-F574 HydrophobicContact CD2-CZ 4.11Å; L447-F574 HydrophobicContact CG-CE2 3.8Å; L447-F574 HydrophobicContact CG-CZ 4.45Å; S448-F574 PolarHBondContact O-N 3.19Å; I453-F574 HydrophobicContact CD1-CB 3.45Å; I453-F574 VanDerWaalsContact CD1-CB 3.45Å; I453-F574 HydrophobicContact CG1-CB 4.01Å; K455-F574 HydrophobicContact CG-CD1 4.49Å; K455-F574 HydrophobicContact CG-CD2 4.49Å; K455-F574 HydrophobicContact CG-CG 4.26Å; T458-F574 HydrophobicContact CG2-CE1 4.22Å; T458-F574 HydrophobicContact CG2-CZ 3.87Å; T458-F574 WeakPolarHBondContact OG1-CE1 3.33Å
575	H	87.8	Confident	90	Very high	137 Å²	137	55.2 Å²	55.2	63%	0.634	27%	0.271	S	S	*	.			trans	-117.9	153.7	-180	-65.8	61.7	0	0	0	108.4	R573 P577	R573-H575 PolarHBondContact O-CE1 3Å; R573-H575 VanDerWaalsContact O-CE1 3.3Å; R573-H575 PolarHBondContact O-ND1 3.39Å; H575-P577 WeakPolarHBondContact O-CD 3.43Å
576	R	87.7	Confident	90.3	Very high	117 Å²	117	55.4 Å²	55.4	44%	0.442	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-54.2	123.7	174	-75.7	179.8	170.8	164.9	-3.3	110.2	P450 Q610 H611	P450-R576 HydrophobicContact CG-CG 4.23Å; R576-Q610 WeakPolarHBondContact CD-O 3.41Å; R576-Q610 VanDerWaalsContact CZ-OE1 3.3Å; R576-Q610 PolarHBondContact NE-O 2.8Å; R576-H611 HydrophobicContact CB-CB 4.04Å; R576-H611 HydrophobicContact CG-CB 4.16Å
577	P	88.6	Confident	90.6	Very high	8 Å²	8	58.6 Å²	58.6	5%	0.052	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-64.1	157.4	174.9	-21.6	34.2	0	0	0	111.6	I397 H575 I582 I613	I397-P577 HydrophobicContact CG2-CB 4.15Å; H575-P577 WeakPolarHBondContact O-CD 3.43Å; P577-I582 HydrophobicContact CB-CD1 4.11Å; P577-I582 HydrophobicContact CB-CG1 3.95Å; P577-I613 HydrophobicContact CG-CD1 4.19Å
578	Q	89.4	Confident	90.8	Very high	131 Å²	131	56.2 Å²	56.2	61%	0.612	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-70.6	144.5	179.7	-60.3	179.7	-2.6	0	0	110.7	L580 Q581 I582	Q578-L580 PolarHBondContact O-N 3.14Å; Q578-L580 VanDerWaalsContact O-N 3.09Å; Q578-Q581 HydrophobicContact CB-CG 4.15Å; Q578-Q581 WeakPolarHBondContact O-CA 3.46Å; Q578-Q581 WeakPolarHBondContact O-CB 3.32Å; Q578-Q581 PolarHBondContact O-N 2.84Å; Q578-I582 PolarHBondContact O-N 2.91Å
579	T	89.1	Confident	91	Very high	29 Å²	29	53.6 Å²	53.6	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-48.3	-42.5	178.6	-40.1	0	0	0	0	112.2	Q581 I582 R583 D603 I606 H611	T579-Q581 VanDerWaalsContact C-N 3.34Å; T579-Q581 PolarHBondContact O-N 3.05Å; T579-I582 PolarHBondContact O-N 2.85Å; T579-R583 WeakPolarHBondContact O-CB 3.49Å; T579-R583 PolarHBondContact O-N 3.41Å; T579-D603 HydrophobicContact CG2-CB 4.44Å; T579-D603 WeakPolarHBondContact CG2-OD1 3.23Å; T579-I606 HydrophobicContact CG2-CB 3.96Å; T579-I606 HydrophobicContact CG2-CD1 3.96Å; T579-I606 HydrophobicContact CG2-CG2 3.81Å; T579-H611 PolarHBondContact OG1-NE2 2.64Å
580	L	91.7	Very high	91	Very high	106 Å²	106	53.7 Å²	53.7	56%	0.555	27%	0.268	S	S	*	.	H	α-helix	trans	-59.8	-37.1	176.4	-179.3	62.9	0	0	0	113.9	Q578 S584	Q578-L580 PolarHBondContact O-N 3.14Å; Q578-L580 VanDerWaalsContact O-N 3.09Å; L580-S584 WeakPolarHBondContact O-CB 3.38Å; L580-S584 PolarHBondContact O-N 3.43Å; L580-S584 VanDerWaalsContact O-N 3.09Å
581	Q	91.5	Very high	90.9	Very high	73 Å²	73	60.4 Å²	60.4	34%	0.341	30%	0.299	S	S	.	.	H	α-helix	trans	-71.4	-41.5	179.5	-63.6	173.4	-45	0	0	110.9	I397 Q578 T579 A585	I397-Q581 HydrophobicContact CG2-CB 3.98Å; Q578-Q581 HydrophobicContact CB-CG 4.15Å; Q578-Q581 WeakPolarHBondContact O-CA 3.46Å; Q578-Q581 WeakPolarHBondContact O-CB 3.32Å; Q578-Q581 PolarHBondContact O-N 2.84Å; T579-Q581 VanDerWaalsContact C-N 3.34Å; T579-Q581 PolarHBondContact O-N 3.05Å; Q581-A585 PolarHBondContact O-N 3.25Å
582	I	92.2	Very high	90.8	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-69.1	-47.9	177.6	-56.9	175.5	0	0	0	109.9	I397 P577 Q578 T579 S584 A585 L586 I606 H611 I613	I397-I582 HydrophobicContact CG2-CG1 4.19Å; P577-I582 HydrophobicContact CB-CD1 4.11Å; P577-I582 HydrophobicContact CB-CG1 3.95Å; Q578-I582 PolarHBondContact O-N 2.91Å; T579-I582 PolarHBondContact O-N 2.85Å; I582-S584 VanDerWaalsContact C-N 3.29Å; I582-S584 PolarHBondContact O-N 3.18Å; I582-A585 PolarHBondContact O-N 2.73Å; I582-A585 VanDerWaalsContact O-N 3.11Å; I582-L586 HydrophobicContact CG2-CD1 3.73Å; I582-L586 HydrophobicContact CG2-CG 4.23Å; I582-L586 WeakPolarHBondContact O-CG 3.49Å; I582-L586 PolarHBondContact O-N 3.41Å; I582-I606 HydrophobicContact CB-CD1 4.07Å; I582-I606 HydrophobicContact CB-CG1 4.36Å; I582-I606 HydrophobicContact CB-CG2 4.2Å; I582-I606 HydrophobicContact CD1-CG2 3.86Å; I582-I606 HydrophobicContact CG2-CD1 3.94Å; I582-I606 HydrophobicContact CG2-CG1 3.83Å; I582-I606 HydrophobicContact CG2-CG2 4.2Å; I582-H611 HydrophobicContact CD1-CB 3.87Å; I582-I613 HydrophobicContact CD1-CG1 4.08Å; I582-I613 HydrophobicContact CG1-CG1 4.15Å; I582-I613 HydrophobicContact CG2-CG1 4.28Å
583	R	92.8	Very high	90.6	Very high	64 Å²	64	66 Å²	66	24%	0.242	32%	0.321	C	S	.	.	H	α-helix	trans	-57.3	-39.8	177.2	-168.8	179	73.9	-140.9	12.7	112.4	T579 A585 L586 M587 P599 L602 D603 I606	T579-R583 WeakPolarHBondContact O-CB 3.49Å; T579-R583 PolarHBondContact O-N 3.41Å; R583-A585 VanDerWaalsContact C-N 3.34Å; R583-A585 PolarHBondContact O-N 3.33Å; R583-L586 PolarHBondContact O-N 2.63Å; R583-M587 HydrophobicContact CG-CG 4.27Å; R583-M587 WeakPolarHBondContact O-CB 3.49Å; R583-M587 VanDerWaalsContact O-CG 3.28Å; R583-M587 WeakPolarHBondContact O-CG 3.33Å; R583-M587 PolarHBondContact O-N 3.47Å; R583-P599 WeakPolarHBondContact CD-O 3.2Å; R583-L602 HydrophobicContact CG-CB 4.12Å; R583-L602 HydrophobicContact CG-CD1 4.3Å; R583-D603 WeakPolarHBondContact CD-OD1 3.39Å; R583-D603 IonicContact CZ-OD1 3.87Å; R583-D603 IonicContact CZ-OD2 2.71Å; R583-D603 IonicContact NE-OD1 2.85Å; R583-D603 IonicContact NE-OD2 2.72Å; R583-D603 IonicContact NH1-OD1 3.77Å; R583-D603 PolarHBondContact NH1-OD1 3.42Å; R583-D603 IonicContact NH1-OD2 3.12Å; R583-D603 PolarHBondContact NH1-OD2 3.29Å; R583-I606 HydrophobicContact CB-CD1 3.78Å
584	S	91.8	Very high	90.4	Very high	84 Å²	84	71.6 Å²	71.6	59%	0.587	34%	0.342	S	S	*	.	H	α-helix	trans	-57.6	-44.9	176.3	-171.8	0	0	0	0	112.3	L580 I582	L580-S584 WeakPolarHBondContact O-CB 3.38Å; L580-S584 PolarHBondContact O-N 3.43Å; L580-S584 VanDerWaalsContact O-N 3.09Å; I582-S584 VanDerWaalsContact C-N 3.29Å; I582-S584 PolarHBondContact O-N 3.18Å
585	A	92.2	Very high	90	Very high	31 Å²	31	72.8 Å²	72.8	26%	0.256	35%	0.349	S	S	.	.	H	α-helix	trans	-69.7	-42.9	176.7	0	0	0	0	0	112.3	I397 Q581 I582 R583 M587 S588 I589	I397-A585 HydrophobicContact CD1-CB 3.4Å; I397-A585 HydrophobicContact CG1-CB 3.97Å; Q581-A585 PolarHBondContact O-N 3.25Å; I582-A585 PolarHBondContact O-N 2.73Å; I582-A585 VanDerWaalsContact O-N 3.11Å; R583-A585 VanDerWaalsContact C-N 3.34Å; R583-A585 PolarHBondContact O-N 3.33Å; A585-M587 PolarHBondContact O-N 3.01Å; A585-S588 WeakPolarHBondContact O-CB 3.46Å; A585-S588 PolarHBondContact O-N 3.23Å; A585-S588 VanDerWaalsContact O-N 3.11Å; A585-I589 PolarHBondContact O-N 3.12Å
586	L	92.2	Very high	89.7	Confident	4 Å²	4	69.5 Å²	69.5	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-64.4	-39	179.3	-68.5	171.1	0	0	0	112.7	I582 R583 S588 I589 V590 L602 I606 V616 L617 L620	I582-L586 HydrophobicContact CG2-CD1 3.73Å; I582-L586 HydrophobicContact CG2-CG 4.23Å; I582-L586 WeakPolarHBondContact O-CG 3.49Å; I582-L586 PolarHBondContact O-N 3.41Å; R583-L586 PolarHBondContact O-N 2.63Å; L586-S588 PolarHBondContact O-N 3.02Å; L586-I589 CarbonylContact O-C 3.57Å; L586-I589 WeakPolarHBondContact O-CA 3.47Å; L586-I589 PolarHBondContact O-N 2.82Å; L586-V590 WeakPolarHBondContact O-CB 3.35Å; L586-V590 WeakPolarHBondContact O-CG2 3.48Å; L586-V590 PolarHBondContact O-N 3.44Å; L586-L602 HydrophobicContact CB-CD1 4.22Å; L586-I606 HydrophobicContact CD1-CD1 3.94Å; L586-I606 HydrophobicContact CD1-CG1 3.81Å; L586-V616 HydrophobicContact CD1-CB 4.47Å; L586-V616 HydrophobicContact CD1-CG1 3.37Å; L586-V616 HydrophobicContact CD2-CG1 4.18Å; L586-V616 HydrophobicContact CG-CG1 4.43Å; L586-L617 HydrophobicContact CD2-CD2 3.64Å; L586-L617 HydrophobicContact CD2-CG 4.31Å; L586-L620 HydrophobicContact CD2-CD2 4.32Å
587	M	91.4	Very high	89.4	Confident	75 Å²	75	64.6 Å²	64.6	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-58.1	-34.8	172.9	-73.5	-65.4	-57.4	0	0	112.1	R583 A585 I589 H591 P599 L602	R583-M587 HydrophobicContact CG-CG 4.27Å; R583-M587 WeakPolarHBondContact O-CB 3.49Å; R583-M587 VanDerWaalsContact O-CG 3.28Å; R583-M587 WeakPolarHBondContact O-CG 3.33Å; R583-M587 PolarHBondContact O-N 3.47Å; A585-M587 PolarHBondContact O-N 3.01Å; M587-I589 VanDerWaalsContact C-N 3.34Å; M587-H591 WeakPolarHBondContact O-CB 3.19Å; M587-H591 PolarHBondContact O-N 2.98Å; M587-H591 VanDerWaalsContact O-N 3.08Å; M587-P599 HydrophobicContact SD-CG 4.43Å; M587-L602 HydrophobicContact CG-CD1 3.97Å; M587-L602 HydrophobicContact SD-CD1 3.5Å; M587-L602 VanDerWaalsContact SD-CD1 3.5Å
588	S	91.3	Very high	89.1	Confident	59 Å²	59	65.6 Å²	65.6	41%	0.413	34%	0.336	S	S	.	.	H	α-helix	trans	-69.8	-30.3	174.1	-171.4	0	0	0	0	112.7	A585 L586 K592	A585-S588 WeakPolarHBondContact O-CB 3.46Å; A585-S588 PolarHBondContact O-N 3.23Å; A585-S588 VanDerWaalsContact O-N 3.11Å; L586-S588 PolarHBondContact O-N 3.02Å; S588-K592 WeakPolarHBondContact O-CD 3.39Å; S588-K592 WeakPolarHBondContact O-CG 3.47Å; S588-K592 PolarHBondContact O-N 3.18Å
589	I	92	Very high	89	Confident	16 Å²	16	61.9 Å²	61.9	8%	0.082	32%	0.323	C	S	.	.	H	α-helix	trans	-77.7	-49.1	177.3	-68.2	170.6	0	0	0	110.5	W384 Y388 A585 L586 M587 H591 K592 E593 L617	W384-I589 HydrophobicContact CE3-CG2 4.06Å; W384-I589 HydrophobicContact CZ3-CG2 4.09Å; Y388-I589 HydrophobicContact CD1-CD1 4.32Å; Y388-I589 HydrophobicContact CD1-CG1 3.91Å; Y388-I589 HydrophobicContact CD2-CD1 4.21Å; Y388-I589 HydrophobicContact CD2-CG1 4.21Å; Y388-I589 HydrophobicContact CD2-CG2 3.7Å; Y388-I589 HydrophobicContact CE1-CG1 4.34Å; Y388-I589 HydrophobicContact CE2-CG2 3.61Å; Y388-I589 HydrophobicContact CG-CD1 3.81Å; Y388-I589 HydrophobicContact CG-CG1 3.84Å; Y388-I589 HydrophobicContact CG-CG2 4.23Å; A585-I589 PolarHBondContact O-N 3.12Å; L586-I589 CarbonylContact O-C 3.57Å; L586-I589 WeakPolarHBondContact O-CA 3.47Å; L586-I589 PolarHBondContact O-N 2.82Å; M587-I589 VanDerWaalsContact C-N 3.34Å; I589-H591 VanDerWaalsContact C-N 3.26Å; I589-H591 PolarHBondContact O-N 2.75Å; I589-K592 WeakPolarHBondContact O-CA 3.41Å; I589-K592 WeakPolarHBondContact O-CB 3.34Å; I589-K592 PolarHBondContact O-N 2.91Å; I589-E593 HydrophobicContact CG2-CG 4.46Å; I589-E593 PolarHBondContact O-N 3.11Å; I589-L617 HydrophobicContact CD1-CD2 3.66Å
590	V	90.4	Very high	88.6	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.03	32%	0.323	C	S	.	.	H	α-helix	trans	-50.1	-46.1	172.3	167.1	0	0	0	0	111.1	L586 E593 R594 L595 V597 L602 L620	L586-V590 WeakPolarHBondContact O-CB 3.35Å; L586-V590 WeakPolarHBondContact O-CG2 3.48Å; L586-V590 PolarHBondContact O-N 3.44Å; V590-E593 PolarHBondContact O-N 3.23Å; V590-R594 PolarHBondContact O-N 3.36Å; V590-R594 VanDerWaalsContact O-N 3.13Å; V590-L595 HydrophobicContact CG1-CB 4.08Å; V590-L595 WeakPolarHBondContact CG1-O 3.19Å; V590-L595 PolarHBondContact O-N 2.72Å; V590-V597 HydrophobicContact CG1-CB 4.13Å; V590-V597 HydrophobicContact CG1-CG2 4.14Å; V590-V597 HydrophobicContact CG2-CB 4.4Å; V590-V597 HydrophobicContact CG2-CG2 4.31Å; V590-L602 HydrophobicContact CG2-CD1 4.33Å; V590-L602 HydrophobicContact CG2-CD2 4.33Å; V590-L620 HydrophobicContact CG2-CD2 3.92Å
591	H	90.6	Very high	88.1	Confident	155 Å²	155	57.4 Å²	57.4	72%	0.718	30%	0.297	S	S	*	.	H	α-helix	trans	-67.6	-33.3	176.3	-173.4	-73.9	0	0	0	113.7	M587 I589 R594	M587-H591 WeakPolarHBondContact O-CB 3.19Å; M587-H591 PolarHBondContact O-N 2.98Å; M587-H591 VanDerWaalsContact O-N 3.08Å; I589-H591 VanDerWaalsContact C-N 3.26Å; I589-H591 PolarHBondContact O-N 2.75Å; H591-R594 PolarHBondContact O-N 2.71Å
592	K	90.7	Very high	87.9	Confident	122 Å²	122	53.9 Å²	53.9	53%	0.53	28%	0.281	S	S	.	.	H	α-helix	trans	-71.1	-38.5	177	-77.5	167.8	-174.4	175	0	112.2	Y388 S588 I589 R594	Y388-K592 HydrophobicContact CE1-CB 4.45Å; Y388-K592 HydrophobicContact CE1-CD 3.86Å; S588-K592 WeakPolarHBondContact O-CD 3.39Å; S588-K592 WeakPolarHBondContact O-CG 3.47Å; S588-K592 PolarHBondContact O-N 3.18Å; I589-K592 WeakPolarHBondContact O-CA 3.41Å; I589-K592 WeakPolarHBondContact O-CB 3.34Å; I589-K592 PolarHBondContact O-N 2.91Å; K592-R594 PolarHBondContact O-N 3.44Å
593	E	88.1	Confident	87.6	Confident	46 Å²	46	55.6 Å²	55.6	22%	0.215	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	2.3	176.1	-56.9	-70.9	-138.5	0	0	112.8	W384 K387 Y388 I589 V590 L595	W384-E593 VanDerWaalsContact CE2-OE1 3.26Å; W384-E593 HydrophobicContact CH2-CB 4.32Å; W384-E593 HydrophobicContact CH2-CG 3.94Å; W384-E593 HydrophobicContact CZ2-CB 4.29Å; W384-E593 HydrophobicContact CZ2-CG 3.78Å; W384-E593 HydrophobicContact CZ3-CG 4.45Å; W384-E593 PolarHBondContact NE1-OE1 2.99Å; W384-E593 VanDerWaalsContact NE1-OE1 3.16Å; K387-E593 IonicContact NZ-OE1 3.97Å; K387-E593 PolarHBondContact NZ-OE1 2.78Å; K387-E593 IonicContact NZ-OE2 3.97Å; K387-E593 PolarHBondContact NZ-OE2 3.06Å; Y388-E593 HydrophobicContact CE2-CG 4.14Å; Y388-E593 WeakPolarHBondContact CE2-OE1 3.43Å; Y388-E593 WeakPolarHBondContact OH-CG 3.29Å; Y388-E593 PolarHBondContact OH-OE1 3.44Å; Y388-E593 PolarHBondContact OH-OE2 3.17Å; I589-E593 HydrophobicContact CG2-CG 4.46Å; I589-E593 PolarHBondContact O-N 3.11Å; V590-E593 PolarHBondContact O-N 3.23Å; E593-L595 VanDerWaalsContact C-N 3.34Å; E593-L595 HydrophobicContact CB-CD1 3.79Å; E593-L595 HydrophobicContact CB-CG 4.11Å; E593-L595 PolarHBondContact O-N 2.82Å
594	R	85.1	Confident	86.9	Confident	236 Å²	236	54.1 Å²	54.1	89%	0.891	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	32.4	177.7	-51.7	179.6	178.7	-177.4	-0.9	114.8	V590 H591 K592	V590-R594 PolarHBondContact O-N 3.36Å; V590-R594 VanDerWaalsContact O-N 3.13Å; H591-R594 PolarHBondContact O-N 2.71Å; K592-R594 PolarHBondContact O-N 3.44Å
595	L	82.6	Confident	86.5	Confident	30 Å²	30	50.1 Å²	50.1	16%	0.157	26%	0.258	C	S	.	.			trans	-94.8	149.6	-176	-65.9	163.9	0	0	0	112.5	W384 V590 E593 V597 T624 Q628	W384-L595 HydrophobicContact CH2-CD1 3.62Å; W384-L595 HydrophobicContact CZ2-CD1 4.3Å; V590-L595 HydrophobicContact CG1-CB 4.08Å; V590-L595 WeakPolarHBondContact CG1-O 3.19Å; V590-L595 PolarHBondContact O-N 2.72Å; E593-L595 VanDerWaalsContact C-N 3.34Å; E593-L595 HydrophobicContact CB-CD1 3.79Å; E593-L595 HydrophobicContact CB-CG 4.11Å; E593-L595 PolarHBondContact O-N 2.82Å; L595-V597 HydrophobicContact CB-CG2 4.31Å; L595-T624 HydrophobicContact CD1-CG2 3.41Å; L595-T624 VanDerWaalsContact CD1-CG2 3.41Å; L595-T624 HydrophobicContact CD2-CG2 4.01Å; L595-T624 HydrophobicContact CG-CG2 4.31Å; L595-Q628 WeakPolarHBondContact CD2-O 3.13Å
596	A	81.3	Confident	86.2	Confident	68 Å²	68	48.7 Å²	48.7	56%	0.562	25%	0.246	S	C	*	.	B	Isolated β-bridge	trans	-102.8	98.8	172.8	0	0	0	0	0	109.9
597	V	82.2	Confident	85.6	Confident	14 Å²	14	53 Å²	53	9%	0.085	27%	0.266	C	S	.	.			trans	-129.6	128.3	177.6	-171.4	0	0	0	0	109.3	V590 L595 T601 L602 L620 V630	V590-V597 HydrophobicContact CG1-CB 4.13Å; V590-V597 HydrophobicContact CG1-CG2 4.14Å; V590-V597 HydrophobicContact CG2-CB 4.4Å; V590-V597 HydrophobicContact CG2-CG2 4.31Å; L595-V597 HydrophobicContact CB-CG2 4.31Å; V597-T601 HydrophobicContact CG1-CG2 3.94Å; V597-L602 HydrophobicContact CG1-CD2 3.87Å; V597-L602 HydrophobicContact CG1-CG 3.95Å; V597-L620 HydrophobicContact CG2-CD1 4.47Å; V597-V630 HydrophobicContact CG1-CB 4.29Å; V597-V630 HydrophobicContact CG2-CB 4.1Å; V597-V630 HydrophobicContact CG2-CG2 4.07Å
598	S	83.4	Confident	84.6	Confident	30 Å²	30	51 Å²	51	21%	0.21	26%	0.261	C	S	.	.			trans	-70.5	147.2	-179	78.4	0	0	0	0	111.7	Q600 T601 L602	S598-Q600 PolarHBondContact O-N 3.23Å; S598-T601 PolarHBondContact O-N 2.76Å; S598-T601 WeakPolarHBondContact OG-CB 3.45Å; S598-T601 PolarHBondContact OG-N 3.17Å; S598-T601 PolarHBondContact OG-OG1 2.82Å; S598-L602 PolarHBondContact O-N 2.8Å; S598-L602 VanDerWaalsContact O-N 3.12Å
599	P	86.1	Confident	84	Confident	53 Å²	53	48.5 Å²	48.5	34%	0.344	24%	0.244	S	C	.	.	H	α-helix	trans	-56.1	-31	175.9	-27.8	35.5	0	0	0	114	R583 M587 L602 D603	R583-P599 WeakPolarHBondContact CD-O 3.2Å; M587-P599 HydrophobicContact SD-CG 4.43Å; P599-L602 PolarHBondContact O-N 3.25Å; P599-D603 PolarHBondContact O-N 3.48Å
600	Q	81.7	Confident	83.4	Confident	38 Å²	38	50.6 Å²	50.6	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-69.5	-44	178.9	-64.6	82.1	-26.7	0	0	111	G283 S598 L602 D603 Q604 F632	G283-Q600 PolarHBondContact O-NE2 2.78Å; S598-Q600 PolarHBondContact O-N 3.23Å; Q600-L602 VanDerWaalsContact C-N 3.33Å; Q600-D603 PolarHBondContact O-N 2.98Å; Q600-Q604 PolarHBondContact O-N 3.27Å; Q600-F632 HydrophobicContact CB-CD2 4.38Å; Q600-F632 HydrophobicContact CB-CE2 4.35Å
601	T	81.3	Confident	83.1	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-41.2	173.1	-61.8	0	0	0	0	111	V597 S598 Q604 L605 V630 F632 A635	V597-T601 HydrophobicContact CG1-CG2 3.94Å; S598-T601 PolarHBondContact O-N 2.76Å; S598-T601 WeakPolarHBondContact OG-CB 3.45Å; S598-T601 PolarHBondContact OG-N 3.17Å; S598-T601 PolarHBondContact OG-OG1 2.82Å; T601-Q604 PolarHBondContact O-N 2.96Å; T601-L605 WeakPolarHBondContact O-CB 3.26Å; T601-L605 PolarHBondContact O-N 3.44Å; T601-V630 HydrophobicContact CG2-CG1 4.01Å; T601-F632 WeakPolarHBondContact OG1-CA 3.44Å; T601-A635 HydrophobicContact CG2-CB 3.6Å
602	L	86.7	Confident	83	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.7	-42.3	173.7	-67.6	-178.6	0	0	0	112.8	R583 L586 M587 V590 V597 S598 P599 Q600 Q604 L605 I606 L620	R583-L602 HydrophobicContact CG-CB 4.12Å; R583-L602 HydrophobicContact CG-CD1 4.3Å; L586-L602 HydrophobicContact CB-CD1 4.22Å; M587-L602 HydrophobicContact CG-CD1 3.97Å; M587-L602 HydrophobicContact SD-CD1 3.5Å; M587-L602 VanDerWaalsContact SD-CD1 3.5Å; V590-L602 HydrophobicContact CG2-CD1 4.33Å; V590-L602 HydrophobicContact CG2-CD2 4.33Å; V597-L602 HydrophobicContact CG1-CD2 3.87Å; V597-L602 HydrophobicContact CG1-CG 3.95Å; S598-L602 PolarHBondContact O-N 2.8Å; S598-L602 VanDerWaalsContact O-N 3.12Å; P599-L602 PolarHBondContact O-N 3.25Å; Q600-L602 VanDerWaalsContact C-N 3.33Å; L602-Q604 VanDerWaalsContact C-N 3.31Å; L602-Q604 PolarHBondContact O-N 2.79Å; L602-L605 PolarHBondContact O-N 3.04Å; L602-I606 VanDerWaalsContact O-CD1 3.28Å; L602-I606 WeakPolarHBondContact O-CD1 3.18Å; L602-I606 WeakPolarHBondContact O-CG1 3.38Å; L602-I606 PolarHBondContact O-N 3.38Å; L602-L620 HydrophobicContact CD2-CD1 4.24Å; L602-L620 HydrophobicContact CD2-CD2 4.31Å
603	D	86.5	Confident	83.1	Confident	35 Å²	35	41.5 Å²	41.5	19%	0.187	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-44	175.3	-80.1	-41	0	0	0	111.1	T579 R583 P599 Q600 I606 E607	T579-D603 HydrophobicContact CG2-CB 4.44Å; T579-D603 WeakPolarHBondContact CG2-OD1 3.23Å; R583-D603 WeakPolarHBondContact CD-OD1 3.39Å; R583-D603 IonicContact CZ-OD1 3.87Å; R583-D603 IonicContact CZ-OD2 2.71Å; R583-D603 IonicContact NE-OD1 2.85Å; R583-D603 IonicContact NE-OD2 2.72Å; R583-D603 IonicContact NH1-OD1 3.77Å; R583-D603 PolarHBondContact NH1-OD1 3.42Å; R583-D603 IonicContact NH1-OD2 3.12Å; R583-D603 PolarHBondContact NH1-OD2 3.29Å; P599-D603 PolarHBondContact O-N 3.48Å; Q600-D603 PolarHBondContact O-N 2.98Å; D603-I606 PolarHBondContact O-N 3.36Å; D603-E607 WeakPolarHBondContact O-CG 3.34Å; D603-E607 PolarHBondContact O-N 3.05Å
604	Q	77.4	Confident	83.3	Confident	33 Å²	33	46.4 Å²	46.4	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-42	174.9	-69.1	-54.4	-93.1	0	0	113.1	Q600 T601 L602 I606 E607 A608 F632	Q600-Q604 PolarHBondContact O-N 3.27Å; T601-Q604 PolarHBondContact O-N 2.96Å; L602-Q604 VanDerWaalsContact C-N 3.31Å; L602-Q604 PolarHBondContact O-N 2.79Å; Q604-I606 VanDerWaalsContact C-N 3.28Å; Q604-I606 PolarHBondContact O-N 2.88Å; Q604-E607 PolarHBondContact NE2-OE2 3.36Å; Q604-E607 PolarHBondContact O-N 3.48Å; Q604-A608 WeakPolarHBondContact O-CB 3.33Å; Q604-A608 PolarHBondContact O-N 3.32Å; Q604-F632 HydrophobicContact CG-CD2 4.25Å; Q604-F632 HydrophobicContact CG-CE2 3.44Å; Q604-F632 VanDerWaalsContact CG-CE2 3.44Å; Q604-F632 HydrophobicContact CG-CZ 3.62Å
605	L	82.4	Confident	83.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-36.6	178.5	-166	65.4	0	0	0	112	T601 L602 A609 V616 N619 L620 M623 A635	T601-L605 WeakPolarHBondContact O-CB 3.26Å; T601-L605 PolarHBondContact O-N 3.44Å; L602-L605 PolarHBondContact O-N 3.04Å; L605-A609 VanDerWaalsContact O-CB 3.32Å; L605-A609 WeakPolarHBondContact O-CB 3.4Å; L605-A609 PolarHBondContact O-N 3.22Å; L605-A609 VanDerWaalsContact O-N 3.12Å; L605-V616 HydrophobicContact CD2-CG1 3.98Å; L605-V616 HydrophobicContact CG-CG1 4.1Å; L605-N619 HydrophobicContact CD1-CB 3.94Å; L605-N619 HydrophobicContact CD2-CB 4.47Å; L605-L620 HydrophobicContact CD2-CB 4Å; L605-L620 HydrophobicContact CD2-CD1 4.19Å; L605-M623 HydrophobicContact CD1-SD 4.25Å; L605-A635 HydrophobicContact CB-CB 4.49Å; L605-A635 HydrophobicContact CD1-CB 4.3Å
606	I	86.1	Confident	83.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-70.8	-43.5	175.7	-60.7	157.4	0	0	0	111.9	T579 I582 R583 L586 L602 D603 Q604 H611 V616	T579-I606 HydrophobicContact CG2-CB 3.96Å; T579-I606 HydrophobicContact CG2-CD1 3.96Å; T579-I606 HydrophobicContact CG2-CG2 3.81Å; I582-I606 HydrophobicContact CB-CD1 4.07Å; I582-I606 HydrophobicContact CB-CG1 4.36Å; I582-I606 HydrophobicContact CB-CG2 4.2Å; I582-I606 HydrophobicContact CD1-CG2 3.86Å; I582-I606 HydrophobicContact CG2-CD1 3.94Å; I582-I606 HydrophobicContact CG2-CG1 3.83Å; I582-I606 HydrophobicContact CG2-CG2 4.2Å; R583-I606 HydrophobicContact CB-CD1 3.78Å; L586-I606 HydrophobicContact CD1-CD1 3.94Å; L586-I606 HydrophobicContact CD1-CG1 3.81Å; L602-I606 VanDerWaalsContact O-CD1 3.28Å; L602-I606 WeakPolarHBondContact O-CD1 3.18Å; L602-I606 WeakPolarHBondContact O-CG1 3.38Å; L602-I606 PolarHBondContact O-N 3.38Å; D603-I606 PolarHBondContact O-N 3.36Å; Q604-I606 VanDerWaalsContact C-N 3.28Å; Q604-I606 PolarHBondContact O-N 2.88Å; I606-H611 PolarHBondContact O-N 2.97Å; I606-V616 HydrophobicContact CG1-CG1 4.24Å; I606-V616 HydrophobicContact CG1-CG2 4.35Å
607	E	80.2	Confident	84.1	Confident	96 Å²	96	35.1 Å²	35.1	45%	0.449	18%	0.176	S	C	.	.	H	α-helix	trans	-64.7	-44	177.6	-75.2	-179.4	168.1	0	0	111.3	D603 Q604 Q610	D603-E607 WeakPolarHBondContact O-CG 3.34Å; D603-E607 PolarHBondContact O-N 3.05Å; Q604-E607 PolarHBondContact NE2-OE2 3.36Å; Q604-E607 PolarHBondContact O-N 3.48Å; E607-Q610 PolarHBondContact O-N 3.3Å
608	A	71.2	Confident	84.4	Confident	31 Å²	31	38.6 Å²	38.6	26%	0.256	19%	0.191	S	C	.	.	H	α-helix	trans	-66	-43.8	-179.4	0	0	0	0	0	112.4	Q604 Q610 V639	Q604-A608 WeakPolarHBondContact O-CB 3.33Å; Q604-A608 PolarHBondContact O-N 3.32Å; A608-Q610 PolarHBondContact O-N 2.58Å; A608-Q610 VanDerWaalsContact O-N 3.1Å; A608-V639 HydrophobicContact CB-CB 3.86Å; A608-V639 HydrophobicContact CB-CG2 3.57Å
609	A	77.3	Confident	84.5	Confident	8 Å²	8	37.7 Å²	37.7	7%	0.066	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	19.8	174.6	0	0	0	0	0	114.1	L605 H611 D612 Q615 V616	L605-A609 VanDerWaalsContact O-CB 3.32Å; L605-A609 WeakPolarHBondContact O-CB 3.4Å; L605-A609 PolarHBondContact O-N 3.22Å; L605-A609 VanDerWaalsContact O-N 3.12Å; A609-H611 PolarHBondContact O-N 2.94Å; A609-H611 VanDerWaalsContact O-N 3.08Å; A609-D612 WeakPolarHBondContact O-CB 3.19Å; A609-D612 PolarHBondContact O-N 3.18Å; A609-Q615 HydrophobicContact CB-CB 4.3Å; A609-Q615 HydrophobicContact CB-CG 4.28Å; A609-V616 HydrophobicContact CB-CG2 3.57Å
610	Q	79.4	Confident	84.5	Confident	60 Å²	60	35.2 Å²	35.2	28%	0.28	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.8	40.8	-179.6	-56.3	-162.9	10.2	0	0	115.2	R576 E607 A608 D612 V643	R576-Q610 WeakPolarHBondContact CD-O 3.41Å; R576-Q610 VanDerWaalsContact CZ-OE1 3.3Å; R576-Q610 PolarHBondContact NE-O 2.8Å; E607-Q610 PolarHBondContact O-N 3.3Å; A608-Q610 PolarHBondContact O-N 2.58Å; A608-Q610 VanDerWaalsContact O-N 3.1Å; Q610-D612 PolarHBondContact O-N 2.92Å; Q610-V643 VanDerWaalsContact NE2-CG1 3.31Å
611	H	84.9	Confident	84.7	Confident	40 Å²	40	34.4 Å²	34.4	19%	0.185	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	17.9	-179	-50.1	84.2	0	0	0	115.8	R576 T579 I582 I606 A609 I613	R576-H611 HydrophobicContact CB-CB 4.04Å; R576-H611 HydrophobicContact CG-CB 4.16Å; T579-H611 PolarHBondContact OG1-NE2 2.64Å; I582-H611 HydrophobicContact CD1-CB 3.87Å; I606-H611 PolarHBondContact O-N 2.97Å; A609-H611 PolarHBondContact O-N 2.94Å; A609-H611 VanDerWaalsContact O-N 3.08Å; H611-I613 PolarHBondContact O-N 2.95Å
612	D	89.2	Confident	84.8	Confident	26 Å²	26	39.6 Å²	39.6	14%	0.139	19%	0.194	C	C	.	.			trans	-75.8	111.3	170	-173	-54	0	0	0	110.5	P451 G452 A609 Q610 R614 Q615 V616	P451-D612 WeakPolarHBondContact CB-OD2 3.36Å; G452-D612 WeakPolarHBondContact CA-OD1 3.3Å; G452-D612 WeakPolarHBondContact CA-OD2 3.47Å; G452-D612 PolarHBondContact N-OD2 3.24Å; A609-D612 WeakPolarHBondContact O-CB 3.19Å; A609-D612 PolarHBondContact O-N 3.18Å; Q610-D612 PolarHBondContact O-N 2.92Å; D612-R614 VanDerWaalsContact C-N 3.32Å; D612-R614 PolarHBondContact O-N 2.89Å; D612-R614 WeakPolarHBondContact OD1-CA 3.47Å; D612-R614 VanDerWaalsContact OD1-CB 3.31Å; D612-R614 WeakPolarHBondContact OD1-CB 3.29Å; D612-R614 PolarHBondContact OD1-N 3.24Å; D612-Q615 HydrophobicContact CB-CB 4.01Å; D612-Q615 PolarHBondContact O-N 3.21Å; D612-Q615 PolarHBondContact OD1-N 3.16Å; D612-V616 VanDerWaalsContact O-CG2 3.27Å; D612-V616 WeakPolarHBondContact O-CG2 3.13Å; D612-V616 PolarHBondContact O-N 3.04Å
613	I	92.1	Very high	84.3	Confident	25 Å²	25	40.6 Å²	40.6	13%	0.128	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-32.2	-176.1	-60.8	158.4	0	0	0	111.9	I397 P577 I582 H611 L617	I397-I613 HydrophobicContact CB-CD1 4.05Å; I397-I613 HydrophobicContact CD1-CD1 4.01Å; I397-I613 HydrophobicContact CD1-CG2 4.23Å; I397-I613 HydrophobicContact CG2-CD1 4.33Å; P577-I613 HydrophobicContact CG-CD1 4.19Å; I582-I613 HydrophobicContact CD1-CG1 4.08Å; I582-I613 HydrophobicContact CG1-CG1 4.15Å; I582-I613 HydrophobicContact CG2-CG1 4.28Å; H611-I613 PolarHBondContact O-N 2.95Å; I613-L617 HydrophobicContact CG2-CD1 4.16Å; I613-L617 WeakPolarHBondContact O-CB 3.24Å; I613-L617 VanDerWaalsContact O-CG 3.29Å; I613-L617 WeakPolarHBondContact O-CG 3.25Å; I613-L617 PolarHBondContact O-N 3.08Å; I613-L617 VanDerWaalsContact O-N 3.08Å
614	R	91.3	Very high	84	Confident	148 Å²	148	40 Å²	40	56%	0.558	20%	0.196	S	C	*	.	H	α-helix	trans	-68.2	-45.4	178.3	-176.6	-168.8	-76	170.9	-6.4	109.6	T385 D612 L617 H618	T385-R614 HydrophobicContact CG2-CG 3.81Å; D612-R614 VanDerWaalsContact C-N 3.32Å; D612-R614 PolarHBondContact O-N 2.89Å; D612-R614 WeakPolarHBondContact OD1-CA 3.47Å; D612-R614 VanDerWaalsContact OD1-CB 3.31Å; D612-R614 WeakPolarHBondContact OD1-CB 3.29Å; D612-R614 PolarHBondContact OD1-N 3.24Å; R614-L617 PolarHBondContact O-N 3.09Å; R614-H618 WeakPolarHBondContact O-CB 3.17Å; R614-H618 PolarHBondContact O-N 3.14Å
615	Q	87.3	Confident	83.9	Confident	84 Å²	84	43.1 Å²	43.1	39%	0.393	22%	0.222	S	C	.	.	H	α-helix	trans	-68.5	-40.1	178.4	-164.6	63.3	37.1	0	0	112.2	A609 D612 L617 H618 N619	A609-Q615 HydrophobicContact CB-CB 4.3Å; A609-Q615 HydrophobicContact CB-CG 4.28Å; D612-Q615 HydrophobicContact CB-CB 4.01Å; D612-Q615 PolarHBondContact O-N 3.21Å; D612-Q615 PolarHBondContact OD1-N 3.16Å; Q615-L617 VanDerWaalsContact C-N 3.34Å; Q615-L617 PolarHBondContact O-N 3.33Å; Q615-H618 PolarHBondContact O-N 2.77Å; Q615-N619 PolarHBondContact NE2-OD1 3.35Å; Q615-N619 WeakPolarHBondContact O-CB 3.5Å; Q615-N619 VanDerWaalsContact O-CG 3.26Å; Q615-N619 PolarHBondContact O-N 3.11Å; Q615-N619 PolarHBondContact O-OD1 3.25Å
616	V	89	Confident	83.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.7	-41.3	175.6	179.3	0	0	0	0	111.4	L586 L605 I606 A609 D612 L620	L586-V616 HydrophobicContact CD1-CB 4.47Å; L586-V616 HydrophobicContact CD1-CG1 3.37Å; L586-V616 HydrophobicContact CD2-CG1 4.18Å; L586-V616 HydrophobicContact CG-CG1 4.43Å; L605-V616 HydrophobicContact CD2-CG1 3.98Å; L605-V616 HydrophobicContact CG-CG1 4.1Å; I606-V616 HydrophobicContact CG1-CG1 4.24Å; I606-V616 HydrophobicContact CG1-CG2 4.35Å; A609-V616 HydrophobicContact CB-CG2 3.57Å; D612-V616 VanDerWaalsContact O-CG2 3.27Å; D612-V616 WeakPolarHBondContact O-CG2 3.13Å; D612-V616 PolarHBondContact O-N 3.04Å; V616-L620 WeakPolarHBondContact O-CB 3.24Å; V616-L620 PolarHBondContact O-N 2.69Å
617	L	90.8	Very high	82.5	Confident	13 Å²	13	52.6 Å²	52.6	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-40.8	174.6	-73.7	172.6	0	0	0	112.2	T385 L586 I589 I613 R614 Q615 S621	T385-L617 HydrophobicContact CG2-CB 4.04Å; L586-L617 HydrophobicContact CD2-CD2 3.64Å; L586-L617 HydrophobicContact CD2-CG 4.31Å; I589-L617 HydrophobicContact CD1-CD2 3.66Å; I613-L617 HydrophobicContact CG2-CD1 4.16Å; I613-L617 WeakPolarHBondContact O-CB 3.24Å; I613-L617 VanDerWaalsContact O-CG 3.29Å; I613-L617 WeakPolarHBondContact O-CG 3.25Å; I613-L617 PolarHBondContact O-N 3.08Å; I613-L617 VanDerWaalsContact O-N 3.08Å; R614-L617 PolarHBondContact O-N 3.09Å; Q615-L617 VanDerWaalsContact C-N 3.34Å; Q615-L617 PolarHBondContact O-N 3.33Å; L617-S621 VanDerWaalsContact O-CB 3.3Å; L617-S621 WeakPolarHBondContact O-CB 3.42Å; L617-S621 PolarHBondContact O-N 2.85Å
618	H	88.3	Confident	81.8	Confident	88 Å²	88	55.6 Å²	55.6	41%	0.407	29%	0.289	S	S	.	.	H	α-helix	trans	-64.8	-49.6	176.7	-177.3	75.4	0	0	0	111.9	R614 Q615 L620 S621 L622	R614-H618 WeakPolarHBondContact O-CB 3.17Å; R614-H618 PolarHBondContact O-N 3.14Å; Q615-H618 PolarHBondContact O-N 2.77Å; H618-L620 VanDerWaalsContact C-N 3.34Å; H618-L620 PolarHBondContact O-N 3.35Å; H618-S621 WeakPolarHBondContact O-CB 3.44Å; H618-S621 PolarHBondContact O-N 3.09Å; H618-L622 WeakPolarHBondContact O-CB 3.17Å; H618-L622 PolarHBondContact O-N 3.07Å
619	N	84.7	Confident	81.7	Confident	11 Å²	11	59.2 Å²	59.2	6%	0.059	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-45	177.6	-67.3	4.4	0	0	0	111.1	L605 Q615 S621 L622 M623	L605-N619 HydrophobicContact CD1-CB 3.94Å; L605-N619 HydrophobicContact CD2-CB 4.47Å; Q615-N619 PolarHBondContact NE2-OD1 3.35Å; Q615-N619 WeakPolarHBondContact O-CB 3.5Å; Q615-N619 VanDerWaalsContact O-CG 3.26Å; Q615-N619 PolarHBondContact O-N 3.11Å; Q615-N619 PolarHBondContact O-OD1 3.25Å; N619-S621 PolarHBondContact O-N 2.96Å; N619-L622 PolarHBondContact O-N 3.49Å; N619-M623 VanDerWaalsContact O-CG 3.23Å; N619-M623 WeakPolarHBondContact O-CG 3.31Å; N619-M623 PolarHBondContact O-N 2.76Å
620	L	86	Confident	81.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-41.1	177.9	-170.8	63.2	0	0	0	111.6	W384 L586 V590 V597 L602 L605 V616 H618 T624	W384-L620 HydrophobicContact CH2-CG 4.37Å; W384-L620 HydrophobicContact CZ3-CB 4.22Å; W384-L620 HydrophobicContact CZ3-CD2 3.84Å; W384-L620 HydrophobicContact CZ3-CG 3.73Å; L586-L620 HydrophobicContact CD2-CD2 4.32Å; V590-L620 HydrophobicContact CG2-CD2 3.92Å; V597-L620 HydrophobicContact CG2-CD1 4.47Å; L602-L620 HydrophobicContact CD2-CD1 4.24Å; L602-L620 HydrophobicContact CD2-CD2 4.31Å; L605-L620 HydrophobicContact CD2-CB 4Å; L605-L620 HydrophobicContact CD2-CD1 4.19Å; V616-L620 WeakPolarHBondContact O-CB 3.24Å; V616-L620 PolarHBondContact O-N 2.69Å; H618-L620 VanDerWaalsContact C-N 3.34Å; H618-L620 PolarHBondContact O-N 3.35Å; L620-T624 HydrophobicContact CD1-CG2 4.29Å; L620-T624 VanDerWaalsContact O-CB 3.31Å; L620-T624 WeakPolarHBondContact O-CB 3.48Å; L620-T624 WeakPolarHBondContact O-CG2 3.41Å; L620-T624 PolarHBondContact O-N 2.92Å; L620-T624 PolarHBondContact O-OG1 3.2Å
621	S	87	Confident	80.8	Confident	21 Å²	21	58.2 Å²	58.2	15%	0.147	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-37.7	173.5	-172.5	0	0	0	0	112.6	L617 H618 N619 T624 S625	L617-S621 VanDerWaalsContact O-CB 3.3Å; L617-S621 WeakPolarHBondContact O-CB 3.42Å; L617-S621 PolarHBondContact O-N 2.85Å; H618-S621 WeakPolarHBondContact O-CB 3.44Å; H618-S621 PolarHBondContact O-N 3.09Å; N619-S621 PolarHBondContact O-N 2.96Å; S621-T624 WeakPolarHBondContact CA-OG1 3.36Å; S621-T624 PolarHBondContact O-OG1 3.26Å; S621-S625 WeakPolarHBondContact O-CB 3.38Å; S621-S625 PolarHBondContact O-N 3.08Å; S621-S625 VanDerWaalsContact O-N 3.09Å; S621-S625 PolarHBondContact O-OG 3.4Å
622	L	82.3	Confident	80	Confident	111 Å²	111	56.5 Å²	56.5	58%	0.581	29%	0.293	S	S	*	.	H	α-helix	trans	-69.7	-47	179.9	179.9	63.3	0	0	0	111.6	H618 N619 T624 S625	H618-L622 WeakPolarHBondContact O-CB 3.17Å; H618-L622 PolarHBondContact O-N 3.07Å; N619-L622 PolarHBondContact O-N 3.49Å; L622-T624 VanDerWaalsContact C-N 3.34Å; L622-T624 PolarHBondContact O-N 3.26Å; L622-S625 PolarHBondContact O-N 2.83Å
623	M	76.9	Confident	79	Confident	22 Å²	22	57.6 Å²	57.6	11%	0.108	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-43	177.3	-64.6	176.1	90.6	0	0	111.3	L605 N619 S625 S626 K627 V630 E634 A635	L605-M623 HydrophobicContact CD1-SD 4.25Å; N619-M623 VanDerWaalsContact O-CG 3.23Å; N619-M623 WeakPolarHBondContact O-CG 3.31Å; N619-M623 PolarHBondContact O-N 2.76Å; M623-S625 VanDerWaalsContact C-N 3.31Å; M623-S625 PolarHBondContact O-N 3.31Å; M623-S626 WeakPolarHBondContact O-CB 3.34Å; M623-S626 PolarHBondContact O-N 3.13Å; M623-K627 PolarHBondContact O-N 2.83Å; M623-V630 HydrophobicContact CB-CG1 4.31Å; M623-V630 HydrophobicContact CB-CG2 4.23Å; M623-V630 HydrophobicContact CE-CG1 3.4Å; M623-V630 HydrophobicContact SD-CG1 3.83Å; M623-E634 HydrophobicContact CE-CB 3.44Å; M623-E634 VanDerWaalsContact CE-CB 3.44Å; M623-A635 HydrophobicContact CE-CB 4.12Å; M623-A635 VanDerWaalsContact CE-N 3.27Å
624	T	79.6	Confident	77.9	Confident	21 Å²	21	59.2 Å²	59.2	13%	0.129	31%	0.306	C	S	.	.	H	α-helix	trans	-75.5	-19	-177.1	57.6	0	0	0	0	113.7	W384 L595 L620 S621 L622 S626 K627 V630	W384-T624 HydrophobicContact CH2-CG2 4.27Å; W384-T624 WeakPolarHBondContact CH2-OG1 3.43Å; W384-T624 WeakPolarHBondContact CZ2-OG1 3.26Å; L595-T624 HydrophobicContact CD1-CG2 3.41Å; L595-T624 VanDerWaalsContact CD1-CG2 3.41Å; L595-T624 HydrophobicContact CD2-CG2 4.01Å; L595-T624 HydrophobicContact CG-CG2 4.31Å; L620-T624 HydrophobicContact CD1-CG2 4.29Å; L620-T624 VanDerWaalsContact O-CB 3.31Å; L620-T624 WeakPolarHBondContact O-CB 3.48Å; L620-T624 WeakPolarHBondContact O-CG2 3.41Å; L620-T624 PolarHBondContact O-N 2.92Å; L620-T624 PolarHBondContact O-OG1 3.2Å; S621-T624 WeakPolarHBondContact CA-OG1 3.36Å; S621-T624 PolarHBondContact O-OG1 3.26Å; L622-T624 VanDerWaalsContact C-N 3.34Å; L622-T624 PolarHBondContact O-N 3.26Å; T624-S626 VanDerWaalsContact C-N 3.26Å; T624-K627 WeakPolarHBondContact CA-O 3.26Å; T624-V630 HydrophobicContact CG2-CG2 3.78Å
625	S	76.2	Confident	76.6	Confident	99 Å²	99	52.2 Å²	52.2	69%	0.692	28%	0.279	S	S	*	.	H	α-helix	trans	-72.8	-18	167.1	-59.4	0	0	0	0	113.1	S621 L622 M623	S621-S625 WeakPolarHBondContact O-CB 3.38Å; S621-S625 PolarHBondContact O-N 3.08Å; S621-S625 VanDerWaalsContact O-N 3.09Å; S621-S625 PolarHBondContact O-OG 3.4Å; L622-S625 PolarHBondContact O-N 2.83Å; M623-S625 VanDerWaalsContact C-N 3.31Å; M623-S625 PolarHBondContact O-N 3.31Å
626	S	69.9	Low	75.5	Confident	95 Å²	95	53.3 Å²	53.3	66%	0.664	28%	0.28	S	S	*	.	H	α-helix	trans	-94.9	-44.5	175.9	-175	0	0	0	0	112.1	M623 T624	M623-S626 WeakPolarHBondContact O-CB 3.34Å; M623-S626 PolarHBondContact O-N 3.13Å; T624-S626 VanDerWaalsContact C-N 3.26Å
627	K	68.3	Low	74.3	Confident	106 Å²	106	60 Å²	60	46%	0.461	31%	0.311	S	S	.	.			trans	-145.3	142	-176.9	-60.6	176.6	-173.6	171.4	0	111.6	M623 T624 N629 E634	M623-K627 PolarHBondContact O-N 2.83Å; T624-K627 WeakPolarHBondContact CA-O 3.26Å; K627-N629 VanDerWaalsContact C-N 3.3Å; K627-N629 WeakPolarHBondContact CB-O 3.31Å; K627-N629 PolarHBondContact O-N 3.07Å; K627-E634 IonicContact NZ-OE1 2.64Å; K627-E634 PolarHBondContact NZ-OE1 2.65Å
628	Q	67.2	Low	72.8	Confident	158 Å²	158	61.7 Å²	61.7	74%	0.738	33%	0.325	S	S	*	.	S	Bend	trans	-69.6	-25.3	176.6	-67.4	-177.1	-3	0	0	113.9	L595	L595-Q628 WeakPolarHBondContact CD2-O 3.13Å
629	N	68.5	Low	71.2	Confident	108 Å²	108	58.6 Å²	58.6	58%	0.578	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-106.9	135.4	175.8	-63.7	-14.4	0	0	0	109	K627	K627-N629 VanDerWaalsContact C-N 3.3Å; K627-N629 WeakPolarHBondContact CB-O 3.31Å; K627-N629 PolarHBondContact O-N 3.07Å
630	V	68.2	Low	69.8	Low	5 Å²	5	66.7 Å²	66.7	3%	0.03	35%	0.346	C	S	.	.			trans	-116.3	104.7	-176	-177.4	0	0	0	0	110.1	V597 T601 M623 T624	V597-V630 HydrophobicContact CG1-CB 4.29Å; V597-V630 HydrophobicContact CG2-CB 4.1Å; V597-V630 HydrophobicContact CG2-CG2 4.07Å; T601-V630 HydrophobicContact CG2-CG1 4.01Å; M623-V630 HydrophobicContact CB-CG1 4.31Å; M623-V630 HydrophobicContact CB-CG2 4.23Å; M623-V630 HydrophobicContact CE-CG1 3.4Å; M623-V630 HydrophobicContact SD-CG1 3.83Å; T624-V630 HydrophobicContact CG2-CG2 3.78Å
631	T	69.8	Low	68.1	Low	42 Å²	42	74.9 Å²	74.9	26%	0.258	38%	0.382	S	S	.	.			trans	-73.7	145.9	-178.3	-68.5	0	0	0	0	111.8	E253 D633 E634 A635	E253-T631 VanDerWaalsContact OE1-CB 3.3Å; E253-T631 WeakPolarHBondContact OE1-CB 3.4Å; E253-T631 WeakPolarHBondContact OE1-CG2 3.23Å; E253-T631 PolarHBondContact OE1-OG1 3.1Å; T631-D633 VanDerWaalsContact C-N 3.3Å; T631-D633 HydrophobicContact CG2-CB 4.39Å; T631-D633 PolarHBondContact O-N 3.44Å; T631-E634 PolarHBondContact O-N 3.04Å; T631-E634 VanDerWaalsContact O-N 3.14Å; T631-A635 PolarHBondContact O-N 2.9Å
632	F	67	Low	66.4	Low	4 Å²	4	80.7 Å²	80.7	2%	0.018	41%	0.411	C	S	.	.	H	α-helix	trans	-51.4	-43.2	180	-177.4	-89.7	0	0	0	113.9	L280 K281 Q600 T601 Q604 A635 R636	L280-F632 HydrophobicContact CB-CE2 3.85Å; L280-F632 HydrophobicContact CB-CZ 3.73Å; K281-F632 HydrophobicContact CB-CD1 3.66Å; K281-F632 HydrophobicContact CB-CE1 3.88Å; K281-F632 HydrophobicContact CB-CG 4.15Å; K281-F632 HydrophobicContact CG-CB 4.46Å; K281-F632 HydrophobicContact CG-CD1 4.05Å; K281-F632 HydrophobicContact CG-CG 4.46Å; Q600-F632 HydrophobicContact CB-CD2 4.38Å; Q600-F632 HydrophobicContact CB-CE2 4.35Å; T601-F632 WeakPolarHBondContact OG1-CA 3.44Å; Q604-F632 HydrophobicContact CG-CD2 4.25Å; Q604-F632 HydrophobicContact CG-CE2 3.44Å; Q604-F632 VanDerWaalsContact CG-CE2 3.44Å; Q604-F632 HydrophobicContact CG-CZ 3.62Å; F632-A635 PolarHBondContact O-N 3.01Å; F632-R636 PolarHBondContact O-N 3.33Å; F632-R636 VanDerWaalsContact O-N 3.12Å
633	D	68.1	Low	65	Low	49 Å²	49	79 Å²	79	26%	0.262	41%	0.406	S	S	.	.	H	α-helix	trans	-68.7	-35.8	-179.1	-70.2	-21.8	0	0	0	112.7	K281 T631 A635 R636 Q637	K281-D633 VanDerWaalsContact CE-OD2 3.31Å; K281-D633 WeakPolarHBondContact CE-OD2 3.47Å; K281-D633 IonicContact NZ-OD1 2.71Å; K281-D633 IonicContact NZ-OD2 2.75Å; K281-D633 PolarHBondContact NZ-OD2 2.75Å; T631-D633 VanDerWaalsContact C-N 3.3Å; T631-D633 HydrophobicContact CG2-CB 4.39Å; T631-D633 PolarHBondContact O-N 3.44Å; D633-A635 VanDerWaalsContact C-N 3.32Å; D633-A635 PolarHBondContact O-N 3.43Å; D633-R636 PolarHBondContact O-N 3.49Å; D633-Q637 WeakPolarHBondContact O-CB 3.48Å; D633-Q637 WeakPolarHBondContact O-CG 3.42Å; D633-Q637 PolarHBondContact O-N 3.23Å
634	E	69.5	Low	64	Low	59 Å²	59	84.6 Å²	84.6	28%	0.276	44%	0.436	S	S	.	.	H	α-helix	trans	-63.9	-41.4	176.2	-61.4	-173	146.7	0	0	110.3	M623 K627 T631 R636 Q637 S638	M623-E634 HydrophobicContact CE-CB 3.44Å; M623-E634 VanDerWaalsContact CE-CB 3.44Å; K627-E634 IonicContact NZ-OE1 2.64Å; K627-E634 PolarHBondContact NZ-OE1 2.65Å; T631-E634 PolarHBondContact O-N 3.04Å; T631-E634 VanDerWaalsContact O-N 3.14Å; E634-R636 VanDerWaalsContact C-N 3.33Å; E634-R636 PolarHBondContact O-N 3.13Å; E634-Q637 PolarHBondContact O-N 2.85Å; E634-S638 WeakPolarHBondContact O-CB 3.44Å; E634-S638 PolarHBondContact O-N 3.06Å
635	A	63.1	Low	63.3	Low	0 Å²	0	86.1 Å²	86.1	0%	0	44%	0.442	C	S	.	.	H	α-helix	trans	-64.5	-38.4	176.5	0	0	0	0	0	111.7	T601 L605 M623 T631 F632 D633 S638	T601-A635 HydrophobicContact CG2-CB 3.6Å; L605-A635 HydrophobicContact CB-CB 4.49Å; L605-A635 HydrophobicContact CD1-CB 4.3Å; M623-A635 HydrophobicContact CE-CB 4.12Å; M623-A635 VanDerWaalsContact CE-N 3.27Å; T631-A635 PolarHBondContact O-N 2.9Å; F632-A635 PolarHBondContact O-N 3.01Å; D633-A635 VanDerWaalsContact C-N 3.32Å; D633-A635 PolarHBondContact O-N 3.43Å; A635-S638 PolarHBondContact O-OG 3.15Å
636	R	64.4	Low	63.1	Low	108 Å²	108	85.7 Å²	85.7	41%	0.408	43%	0.432	S	S	.	.	H	α-helix	trans	-68.8	-30.4	174.8	-167.2	178.6	-178.3	-160.4	0.6	112.9	F632 D633 E634	F632-R636 PolarHBondContact O-N 3.33Å; F632-R636 VanDerWaalsContact O-N 3.12Å; D633-R636 PolarHBondContact O-N 3.49Å; E634-R636 VanDerWaalsContact C-N 3.33Å; E634-R636 PolarHBondContact O-N 3.13Å
637	Q	64.8	Low	63.7	Low	139 Å²	139	82.8 Å²	82.8	65%	0.65	41%	0.409	S	S	*	.	H	α-helix	trans	-82.1	-33.8	176.7	-71.9	-179.7	20.1	0	0	113.2	D633 E634 V639 K640	D633-Q637 WeakPolarHBondContact O-CB 3.48Å; D633-Q637 WeakPolarHBondContact O-CG 3.42Å; D633-Q637 PolarHBondContact O-N 3.23Å; E634-Q637 PolarHBondContact O-N 2.85Å; Q637-V639 PolarHBondContact O-N 3.33Å; Q637-K640 PolarHBondContact O-N 3.37Å
638	S	59	Low	64.4	Low	50 Å²	50	81.8 Å²	81.8	35%	0.35	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.3	-172.8	69	0	0	0	0	115.7	E634 A635	E634-S638 WeakPolarHBondContact O-CB 3.44Å; E634-S638 PolarHBondContact O-N 3.06Å; A635-S638 PolarHBondContact O-OG 3.15Å
639	V	54.7	Low	65.1	Low	23 Å²	23	79.5 Å²	79.5	14%	0.139	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	21.5	179.2	-145.9	0	0	0	0	112.5	A608 Q637 K641 V643	A608-V639 HydrophobicContact CB-CB 3.86Å; A608-V639 HydrophobicContact CB-CG2 3.57Å; Q637-V639 PolarHBondContact O-N 3.33Å; V639-K641 PolarHBondContact O-N 3.18Å; V639-V643 HydrophobicContact CG1-CG2 4.26Å; V639-V643 WeakPolarHBondContact O-CG2 3.47Å
640	K	54.8	Low	65.7	Low	180 Å²	180	74.4 Å²	74.4	78%	0.783	37%	0.367	S	S	*	.	S	Bend	trans	-76.4	-4	168.3	-90.5	-159.8	169.5	-161.4	0	113.7	Q637	Q637-K640 PolarHBondContact O-N 3.37Å
641	K	51.4	Low	66.5	Low	172 Å²	172	74.1 Å²	74.1	75%	0.748	37%	0.365	S	S	*	.	S	Bend	trans	-98.7	134.9	169.4	-64.3	-173.5	175.6	-173	0	109.5	V639 V643	V639-K641 PolarHBondContact O-N 3.18Å; K641-V643 PolarHBondContact O-N 3.01Å
642	D	51.2	Low	67.3	Low	143 Å²	143	77.4 Å²	77.4	77%	0.765	37%	0.373	S	S	*	.			trans	57.6	40.1	162.8	-44	-28.6	0	0	0	116.2	N644	D642-N644 VanDerWaalsContact C-N 3.29Å; D642-N644 PolarHBondContact O-N 3.25Å
643	V	52.1	Low	68.1	Low	76 Å²	76	78.7 Å²	78.7	46%	0.461	38%	0.382	S	S	.	.			trans	-73.2	88	162.1	-176.7	0	0	0	0	108.6	Q610 V639 K641 M645	Q610-V643 VanDerWaalsContact NE2-CG1 3.31Å; V639-V643 HydrophobicContact CG1-CG2 4.26Å; V639-V643 WeakPolarHBondContact O-CG2 3.47Å; K641-V643 PolarHBondContact O-N 3.01Å; V643-M645 PolarHBondContact O-N 3.33Å
644	N	56.2	Low	68.9	Low	139 Å²	139	76.3 Å²	76.3	74%	0.743	37%	0.37	S	S	*	.			trans	-55.5	97.8	174.5	-73.6	-15.9	0	0	0	110.7	D642	D642-N644 VanDerWaalsContact C-N 3.29Å; D642-N644 PolarHBondContact O-N 3.25Å
645	M	65.1	Low	69.7	Low	53 Å²	53	73.6 Å²	73.6	26%	0.261	36%	0.357	S	S	.	.			trans	-71.4	135	176	-178.2	157.6	47.3	0	0	109	V643 I647 E649 A650 I672 T675	V643-M645 PolarHBondContact O-N 3.33Å; M645-I647 PolarHBondContact O-N 3.48Å; M645-E649 HydrophobicContact CG-CB 3.95Å; M645-E649 HydrophobicContact CG-CG 4.07Å; M645-E649 HydrophobicContact SD-CB 4.5Å; M645-E649 HydrophobicContact SD-CG 4.14Å; M645-A650 HydrophobicContact CE-CB 4.21Å; M645-A650 HydrophobicContact CG-CB 4.24Å; M645-I672 HydrophobicContact CE-CD1 4.05Å; M645-I672 HydrophobicContact CE-CG1 3.81Å; M645-I672 HydrophobicContact CE-CG2 4.45Å; M645-T675 VanDerWaalsContact O-CG2 3.23Å; M645-T675 WeakPolarHBondContact O-CG2 3.48Å
646	N	72.5	Confident	70.5	Confident	90 Å²	90	75.6 Å²	75.6	48%	0.481	37%	0.369	S	S	.	.			trans	-62.5	138.2	178.2	-179.4	-15.1	0	0	0	109.5	F648 E649 A650	N646-F648 PolarHBondContact O-N 3.31Å; N646-F648 VanDerWaalsContact O-N 3.12Å; N646-F648 PolarHBondContact OD1-N 3.32Å; N646-E649 HydrophobicContact CB-CB 4.08Å; N646-E649 CarbonylContact O-C 3.56Å; N646-E649 WeakPolarHBondContact O-CA 3.43Å; N646-E649 WeakPolarHBondContact O-CB 3.31Å; N646-E649 PolarHBondContact O-N 3.49Å; N646-A650 PolarHBondContact O-N 3.46Å
647	I	81.4	Confident	70.7	Confident	35 Å²	35	74.9 Å²	74.9	18%	0.179	37%	0.373	C	S	.	.	H	α-helix	trans	-53.3	-36.4	179.6	-59.7	163.6	0	0	0	111.9	M645 E649 T651 D676 L679 V680 F683	M645-I647 PolarHBondContact O-N 3.48Å; I647-E649 VanDerWaalsContact C-N 3.28Å; I647-E649 PolarHBondContact O-N 2.86Å; I647-T651 VanDerWaalsContact O-CB 3.31Å; I647-T651 WeakPolarHBondContact O-CB 3.12Å; I647-T651 PolarHBondContact O-N 3.42Å; I647-T651 PolarHBondContact O-OG1 3Å; I647-D676 HydrophobicContact CD1-CB 3.9Å; I647-D676 WeakPolarHBondContact CD1-OD2 3.48Å; I647-D676 HydrophobicContact CG1-CB 4.08Å; I647-L679 HydrophobicContact CD1-CB 4.21Å; I647-L679 HydrophobicContact CD1-CD1 3.81Å; I647-V680 HydrophobicContact CG2-CG2 4.25Å; I647-F683 HydrophobicContact CG2-CD1 4.43Å; I647-F683 HydrophobicContact CG2-CD2 3.48Å; I647-F683 VanDerWaalsContact CG2-CD2 3.48Å; I647-F683 HydrophobicContact CG2-CE1 4.48Å; I647-F683 HydrophobicContact CG2-CE2 3.55Å; I647-F683 HydrophobicContact CG2-CG 3.94Å; I647-F683 HydrophobicContact CG2-CZ 4.05Å
648	F	84.2	Confident	70.6	Confident	84 Å²	84	71.2 Å²	71.2	37%	0.368	36%	0.363	S	S	.	.	H	α-helix	trans	-69.5	-20.7	174.4	-71.6	-92.8	0	0	0	114.2	N646 F683 I753 F755	N646-F648 PolarHBondContact O-N 3.31Å; N646-F648 VanDerWaalsContact O-N 3.12Å; N646-F648 PolarHBondContact OD1-N 3.32Å; F648-F683 AromaticContact CD1-CE1 3.81Å; F648-F683 HydrophobicContact CD1-CE1 3.81Å; F648-F683 HydrophobicContact CD1-CZ 4.44Å; F648-F683 HydrophobicContact CD2-CE1 4.36Å; F648-F683 HydrophobicContact CD2-CZ 4.27Å; F648-F683 AromaticContact CE1-CE1 3.61Å; F648-F683 HydrophobicContact CE1-CE1 3.61Å; F648-F683 HydrophobicContact CE1-CZ 4.05Å; F648-F683 HydrophobicContact CE2-CE1 4.18Å; F648-F683 AromaticContact CE2-CZ 3.85Å; F648-F683 HydrophobicContact CE2-CZ 3.85Å; F648-F683 HydrophobicContact CG-CE1 4.19Å; F648-F683 AromaticContact CZ-CE1 3.82Å; F648-F683 HydrophobicContact CZ-CE1 3.82Å; F648-F683 AromaticContact CZ-CZ 3.74Å; F648-F683 HydrophobicContact CZ-CZ 3.74Å; F648-I753 HydrophobicContact CD1-CB 4.15Å; F648-I753 HydrophobicContact CD1-CG2 3.8Å; F648-I753 HydrophobicContact CE1-CG2 4.33Å; F648-I753 WeakPolarHBondContact O-CD1 3.16Å; F648-F755 HydrophobicContact CZ-CB 4.43Å; F648-F755 HydrophobicContact CZ-CD2 4.2Å
649	E	81.4	Confident	70.5	Confident	111 Å²	111	74.4 Å²	74.4	52%	0.519	37%	0.372	S	S	.	.	H	α-helix	trans	-94.4	-40.4	178.4	-169.7	160.3	-144.5	0	0	110.9	M645 N646 I647 R652 S653	M645-E649 HydrophobicContact CG-CB 3.95Å; M645-E649 HydrophobicContact CG-CG 4.07Å; M645-E649 HydrophobicContact SD-CB 4.5Å; M645-E649 HydrophobicContact SD-CG 4.14Å; N646-E649 HydrophobicContact CB-CB 4.08Å; N646-E649 CarbonylContact O-C 3.56Å; N646-E649 WeakPolarHBondContact O-CA 3.43Å; N646-E649 WeakPolarHBondContact O-CB 3.31Å; N646-E649 PolarHBondContact O-N 3.49Å; I647-E649 VanDerWaalsContact C-N 3.28Å; I647-E649 PolarHBondContact O-N 2.86Å; E649-R652 WeakPolarHBondContact O-CB 3.12Å; E649-R652 PolarHBondContact O-N 3.03Å; E649-R652 VanDerWaalsContact O-N 3.13Å; E649-S653 WeakPolarHBondContact O-CB 3.41Å; E649-S653 PolarHBondContact O-N 3.38Å
650	A	81.6	Confident	70.7	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-51.6	-55.6	165.7	0	0	0	0	0	111.6	M645 N646 R652 S653 L654 I672	M645-A650 HydrophobicContact CE-CB 4.21Å; M645-A650 HydrophobicContact CG-CB 4.24Å; N646-A650 PolarHBondContact O-N 3.46Å; A650-R652 PolarHBondContact O-N 3.26Å; A650-S653 WeakPolarHBondContact O-CB 3.36Å; A650-S653 PolarHBondContact O-N 3.19Å; A650-S653 VanDerWaalsContact O-N 3.07Å; A650-L654 WeakPolarHBondContact O-CG 3.26Å; A650-L654 PolarHBondContact O-N 3.37Å; A650-L654 VanDerWaalsContact O-N 3.08Å; A650-I672 HydrophobicContact CB-CG2 3.56Å
651	T	84.9	Confident	70.9	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-59.6	-33.9	176.8	-53.5	0	0	0	0	112	I647 F655 F683 I753	I647-T651 VanDerWaalsContact O-CB 3.31Å; I647-T651 WeakPolarHBondContact O-CB 3.12Å; I647-T651 PolarHBondContact O-N 3.42Å; I647-T651 PolarHBondContact O-OG1 3Å; T651-F655 HydrophobicContact CG2-CD2 4.13Å; T651-F655 HydrophobicContact CG2-CE2 3.95Å; T651-F655 VanDerWaalsContact O-CD2 3.29Å; T651-F655 WeakPolarHBondContact O-CD2 3.31Å; T651-F683 HydrophobicContact CG2-CB 4.09Å; T651-F683 WeakPolarHBondContact OG1-CB 3.45Å; T651-I753 HydrophobicContact CG2-CD1 4.18Å; T651-I753 HydrophobicContact CG2-CG2 4.22Å
652	R	85.5	Confident	71.2	Confident	110 Å²	110	62.2 Å²	62.2	42%	0.415	34%	0.344	S	S	.	.	H	α-helix	trans	-68.4	-44.3	174.6	-178.2	176.3	-63.5	-75.1	-7.9	111.5	E649 A650 L654 F655 T656 I753	E649-R652 WeakPolarHBondContact O-CB 3.12Å; E649-R652 PolarHBondContact O-N 3.03Å; E649-R652 VanDerWaalsContact O-N 3.13Å; A650-R652 PolarHBondContact O-N 3.26Å; R652-L654 VanDerWaalsContact C-N 3.34Å; R652-L654 PolarHBondContact O-N 3.2Å; R652-F655 PolarHBondContact O-N 2.95Å; R652-T656 VanDerWaalsContact O-CB 3.26Å; R652-T656 WeakPolarHBondContact O-CB 3.32Å; R652-T656 PolarHBondContact O-N 3.48Å; R652-T656 VanDerWaalsContact O-N 3.07Å; R652-T656 PolarHBondContact O-OG1 3.21Å; R652-I753 HydrophobicContact CB-CD1 3.68Å
653	S	83.3	Confident	71.9	Confident	31 Å²	31	62 Å²	62	22%	0.217	34%	0.338	C	S	.	.	H	α-helix	trans	-60.7	-43.9	-177.8	-158.7	0	0	0	0	111.4	E649 A650 F655 S661	E649-S653 WeakPolarHBondContact O-CB 3.41Å; E649-S653 PolarHBondContact O-N 3.38Å; A650-S653 WeakPolarHBondContact O-CB 3.36Å; A650-S653 PolarHBondContact O-N 3.19Å; A650-S653 VanDerWaalsContact O-N 3.07Å; S653-F655 PolarHBondContact O-N 3.1Å; S653-S661 WeakPolarHBondContact O-CB 3.36Å; S653-S661 PolarHBondContact O-OG 3.16Å
654	L	86.4	Confident	72.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.9	-44.5	178.4	-70.4	170.3	0	0	0	113.7	A650 R652 R669 I672 V680 V684 T742	A650-L654 WeakPolarHBondContact O-CG 3.26Å; A650-L654 PolarHBondContact O-N 3.37Å; A650-L654 VanDerWaalsContact O-N 3.08Å; R652-L654 VanDerWaalsContact C-N 3.34Å; R652-L654 PolarHBondContact O-N 3.2Å; L654-R669 HydrophobicContact CD2-CB 4.13Å; L654-R669 HydrophobicContact CD2-CG 4.25Å; L654-I672 HydrophobicContact CD1-CG2 3.8Å; L654-I672 HydrophobicContact CD2-CB 4.26Å; L654-I672 HydrophobicContact CD2-CD1 4.19Å; L654-I672 HydrophobicContact CD2-CG2 4.15Å; L654-I672 HydrophobicContact CG-CG2 3.87Å; L654-V680 HydrophobicContact CD1-CG1 4.16Å; L654-V684 HydrophobicContact CD1-CG2 4.38Å; L654-T742 HydrophobicContact CB-CG2 3.74Å; L654-T742 HydrophobicContact CD1-CG2 4.3Å
655	F	86.2	Confident	74.2	Confident	1 Å²	1	56 Å²	56	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-87.5	-22.4	-176.5	-72.3	-60.8	0	0	0	115.3	T651 R652 S653 V684 N687 C691 T742 M745 G747	T651-F655 HydrophobicContact CG2-CD2 4.13Å; T651-F655 HydrophobicContact CG2-CE2 3.95Å; T651-F655 VanDerWaalsContact O-CD2 3.29Å; T651-F655 WeakPolarHBondContact O-CD2 3.31Å; R652-F655 PolarHBondContact O-N 2.95Å; S653-F655 PolarHBondContact O-N 3.1Å; F655-V684 HydrophobicContact CZ-CB 4.34Å; F655-V684 HydrophobicContact CZ-CG1 3.9Å; F655-V684 HydrophobicContact CZ-CG2 4.43Å; F655-N687 HydrophobicContact CE2-CB 3.91Å; F655-C691 WeakPolarHBondContact CD1-SG 3.44Å; F655-C691 VanDerWaalsContact CG-SG 3.53Å; F655-T742 HydrophobicContact CD1-CG2 3.94Å; F655-T742 HydrophobicContact CE1-CG2 3.67Å; F655-T742 HydrophobicContact CE2-CG2 4.46Å; F655-T742 HydrophobicContact CG-CG2 4.46Å; F655-T742 HydrophobicContact CZ-CG2 3.96Å; F655-M745 HydrophobicContact CD1-CB 4.28Å; F655-M745 HydrophobicContact CE1-CB 4.06Å; F655-G747 PolarHBondContact O-N 3.32Å
656	T	79.6	Confident	75.2	Confident	42 Å²	42	59.8 Å²	59.8	26%	0.258	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-88.1	117.2	-167.6	-53.5	0	0	0	0	111.6	R652 S658 S661	R652-T656 VanDerWaalsContact O-CB 3.26Å; R652-T656 WeakPolarHBondContact O-CB 3.32Å; R652-T656 PolarHBondContact O-N 3.48Å; R652-T656 VanDerWaalsContact O-N 3.07Å; R652-T656 PolarHBondContact O-OG1 3.21Å; T656-S658 VanDerWaalsContact C-N 3.31Å; T656-S658 PolarHBondContact O-N 3.23Å; T656-S661 WeakPolarHBondContact O-CB 3.43Å; T656-S661 PolarHBondContact O-OG 2.96Å
657	D	68.9	Low	75.9	Confident	94 Å²	94	60.9 Å²	60.9	50%	0.503	33%	0.333	S	S	.	.			trans	-76.7	80.3	173.9	-160.1	35.4	0	0	0	111.3	K746 G747	D657-K746 HydrophobicContact CB-CD 4.2Å; D657-K746 HydrophobicContact CB-CG 4.23Å; D657-K746 WeakPolarHBondContact OD1-CD 3.45Å; D657-K746 WeakPolarHBondContact OD1-CE 3.34Å; D657-K746 IonicContact OD1-NZ 3.54Å; D657-K746 PolarHBondContact OD1-NZ 2.88Å; D657-G747 PolarHBondContact N-O 2.85Å
658	S	62.8	Low	76	Confident	61 Å²	61	62.1 Å²	62.1	43%	0.427	34%	0.34	S	S	.	.			trans	-123.7	156.9	179.7	-171.3	0	0	0	0	110.5	T656 G660 S661 A662	T656-S658 VanDerWaalsContact C-N 3.31Å; T656-S658 PolarHBondContact O-N 3.23Å; S658-G660 PolarHBondContact O-N 3.24Å; S658-S661 PolarHBondContact O-N 2.92Å; S658-A662 PolarHBondContact O-N 3.22Å
659	E	55.5	Low	76.2	Confident	117 Å²	117	59 Å²	59	55%	0.547	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-41.5	-178.2	-65.6	170.4	-165.5	0	0	113.1	Q663	E659-Q663 WeakPolarHBondContact O-CG 3.28Å
660	G	59.5	Low	76.5	Confident	48 Å²	48	54.7 Å²	54.7	50%	0.495	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-17.2	178.4	0	0	0	0	0	116.3	S658	S658-G660 PolarHBondContact O-N 3.24Å
661	S	58.7	Low	76.9	Confident	5 Å²	5	60.3 Å²	60.3	4%	0.035	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-29	174.2	179.3	0	0	0	0	111.8	S653 T656 S658 Q663 L664	S653-S661 WeakPolarHBondContact O-CB 3.36Å; S653-S661 PolarHBondContact O-OG 3.16Å; T656-S661 WeakPolarHBondContact O-CB 3.43Å; T656-S661 PolarHBondContact O-OG 2.96Å; S658-S661 PolarHBondContact O-N 2.92Å; S661-Q663 PolarHBondContact O-N 3.1Å; S661-L664 WeakPolarHBondContact O-CB 3.46Å; S661-L664 PolarHBondContact O-N 2.93Å; S661-L664 VanDerWaalsContact O-N 3.09Å
662	A	59.5	Low	77	Confident	66 Å²	66	60.8 Å²	60.8	55%	0.545	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.5	167.1	0	0	0	0	0	113.3	S658	S658-A662 PolarHBondContact O-N 3.22Å
663	Q	65	Low	77.3	Confident	138 Å²	138	55.5 Å²	55.5	65%	0.645	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.7	174.5	-70.6	175.7	0.5	0	0	114.2	E659 S661 S665	E659-Q663 WeakPolarHBondContact O-CG 3.28Å; S661-Q663 PolarHBondContact O-N 3.1Å; Q663-S665 PolarHBondContact O-N 3.4Å
664	L	73.4	Confident	77.6	Confident	39 Å²	39	58.2 Å²	58.2	20%	0.204	33%	0.326	C	S	.	.			trans	-74.3	117.7	179.1	-66.5	169.4	0	0	0	110.4	S661 D668 R669 I672	S661-L664 WeakPolarHBondContact O-CB 3.46Å; S661-L664 PolarHBondContact O-N 2.93Å; S661-L664 VanDerWaalsContact O-N 3.09Å; L664-D668 HydrophobicContact CB-CB 4.3Å; L664-D668 HydrophobicContact CD2-CB 3.75Å; L664-R669 HydrophobicContact CB-CG 4.01Å; L664-I672 HydrophobicContact CD1-CD1 3.96Å; L664-I672 HydrophobicContact CD2-CD1 4.46Å
665	S	83.5	Confident	77.5	Confident	51 Å²	51	60.9 Å²	60.9	36%	0.357	34%	0.342	S	S	.	.			trans	-66.9	169.1	171.8	76.2	0	0	0	0	111.6	Q663 I667 D668 R669	Q663-S665 PolarHBondContact O-N 3.4Å; S665-I667 PolarHBondContact O-N 2.71Å; S665-I667 PolarHBondContact OG-N 2.74Å; S665-D668 WeakPolarHBondContact CA-OD2 3.25Å; S665-D668 WeakPolarHBondContact CB-OD2 3.46Å; S665-D668 PolarHBondContact N-OD2 3.25Å; S665-D668 PolarHBondContact O-N 3.23Å; S665-D668 VanDerWaalsContact OG-CG 3.25Å; S665-D668 PolarHBondContact OG-N 2.86Å; S665-D668 PolarHBondContact OG-OD2 3.49Å; S665-R669 WeakPolarHBondContact O-CG 3.37Å; S665-R669 PolarHBondContact O-N 3.01Å; S665-R669 VanDerWaalsContact O-N 3.14Å
666	L	85.1	Confident	77.5	Confident	132 Å²	132	62.6 Å²	62.6	69%	0.691	35%	0.352	S	S	*	.	H	α-helix	trans	-56.2	-34.2	173.2	-165.2	78.3	0	0	0	112	A670 V739	L666-A670 PolarHBondContact O-N 2.83Å; L666-V739 HydrophobicContact CD1-CG1 3.63Å; L666-V739 HydrophobicContact CG-CG1 4.5Å
667	I	87.1	Confident	78	Confident	113 Å²	113	65.3 Å²	65.3	58%	0.579	36%	0.358	S	S	*	.	H	α-helix	trans	-72.2	-50.3	-179.8	-59.4	173.1	0	0	0	109.8	S665 R669 A670 E671	S665-I667 PolarHBondContact O-N 2.71Å; S665-I667 PolarHBondContact OG-N 2.74Å; I667-R669 PolarHBondContact O-N 2.74Å; I667-A670 CarbonylContact O-C 3.53Å; I667-A670 WeakPolarHBondContact O-CA 3.42Å; I667-A670 WeakPolarHBondContact O-CB 3.4Å; I667-A670 PolarHBondContact O-N 2.67Å; I667-E671 HydrophobicContact CG2-CG 4.47Å; I667-E671 PolarHBondContact O-N 3.34Å
668	D	85	Confident	78.8	Confident	61 Å²	61	63.2 Å²	63.2	33%	0.326	35%	0.351	S	S	.	.	H	α-helix	trans	-57.3	-37	179.2	-50.9	-64	0	0	0	111.5	L664 S665 E671 I672	L664-D668 HydrophobicContact CB-CB 4.3Å; L664-D668 HydrophobicContact CD2-CB 3.75Å; S665-D668 WeakPolarHBondContact CA-OD2 3.25Å; S665-D668 WeakPolarHBondContact CB-OD2 3.46Å; S665-D668 PolarHBondContact N-OD2 3.25Å; S665-D668 PolarHBondContact O-N 3.23Å; S665-D668 VanDerWaalsContact OG-CG 3.25Å; S665-D668 PolarHBondContact OG-N 2.86Å; S665-D668 PolarHBondContact OG-OD2 3.49Å; D668-E671 PolarHBondContact O-N 2.67Å; D668-I672 VanDerWaalsContact O-CG1 3.31Å; D668-I672 WeakPolarHBondContact O-CG1 3.48Å; D668-I672 PolarHBondContact O-N 3.17Å
669	R	86.7	Confident	80.1	Confident	18 Å²	18	62.1 Å²	62.1	7%	0.068	34%	0.34	C	S	.	.	H	α-helix	trans	-68.9	-33.4	175.7	-67.1	177.6	-176.9	-144.3	23.5	113.4	L654 L664 S665 I667 V739 E743	L654-R669 HydrophobicContact CD2-CB 4.13Å; L654-R669 HydrophobicContact CD2-CG 4.25Å; L664-R669 HydrophobicContact CB-CG 4.01Å; S665-R669 WeakPolarHBondContact O-CG 3.37Å; S665-R669 PolarHBondContact O-N 3.01Å; S665-R669 VanDerWaalsContact O-N 3.14Å; I667-R669 PolarHBondContact O-N 2.74Å; R669-V739 HydrophobicContact CB-CG1 4.4Å; R669-V739 HydrophobicContact CB-CG2 4.26Å; R669-E743 IonicContact CZ-OE2 2.64Å; R669-E743 IonicContact NH1-OE2 2.82Å; R669-E743 PolarHBondContact NH1-OE2 3.32Å; R669-E743 IonicContact NH2-OE1 2.64Å; R669-E743 IonicContact NH2-OE2 3.83Å; R669-E743 PolarHBondContact NH2-OE2 2.96Å
670	A	89.3	Confident	81.8	Confident	22 Å²	22	56.6 Å²	56.6	18%	0.182	31%	0.314	C	S	.	.	H	α-helix	trans	-71.2	-38.4	172	0	0	0	0	0	111.2	L666 I667 I672 F673 F674 V739	L666-A670 PolarHBondContact O-N 2.83Å; I667-A670 CarbonylContact O-C 3.53Å; I667-A670 WeakPolarHBondContact O-CA 3.42Å; I667-A670 WeakPolarHBondContact O-CB 3.4Å; I667-A670 PolarHBondContact O-N 2.67Å; A670-I672 VanDerWaalsContact C-N 3.27Å; A670-I672 PolarHBondContact O-N 3.23Å; A670-F673 WeakPolarHBondContact O-CB 3.3Å; A670-F673 PolarHBondContact O-N 2.91Å; A670-F674 VanDerWaalsContact O-CD2 3.24Å; A670-F674 WeakPolarHBondContact O-CD2 3.47Å; A670-F674 PolarHBondContact O-N 3.33Å; A670-V739 HydrophobicContact CB-CG2 4.42Å
671	E	88.3	Confident	83.4	Confident	118 Å²	118	55.1 Å²	55.1	55%	0.551	30%	0.295	S	S	*	.	H	α-helix	trans	-61.3	-34.1	172.9	-68.9	-176.7	-174.8	0	0	112.4	I667 D668 F673 F674 T675	I667-E671 HydrophobicContact CG2-CG 4.47Å; I667-E671 PolarHBondContact O-N 3.34Å; D668-E671 PolarHBondContact O-N 2.67Å; E671-F673 VanDerWaalsContact C-N 3.28Å; E671-F673 PolarHBondContact O-N 3.07Å; E671-F674 WeakPolarHBondContact O-CA 3.5Å; E671-F674 PolarHBondContact O-N 2.94Å; E671-T675 PolarHBondContact O-N 3.17Å
672	I	87.9	Confident	85	Confident	9 Å²	9	56.6 Å²	56.6	5%	0.046	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-31.8	172.9	-66.8	167.9	0	0	0	112.2	M645 A650 L654 L664 D668 A670 T675	M645-I672 HydrophobicContact CE-CD1 4.05Å; M645-I672 HydrophobicContact CE-CG1 3.81Å; M645-I672 HydrophobicContact CE-CG2 4.45Å; A650-I672 HydrophobicContact CB-CG2 3.56Å; L654-I672 HydrophobicContact CD1-CG2 3.8Å; L654-I672 HydrophobicContact CD2-CB 4.26Å; L654-I672 HydrophobicContact CD2-CD1 4.19Å; L654-I672 HydrophobicContact CD2-CG2 4.15Å; L654-I672 HydrophobicContact CG-CG2 3.87Å; L664-I672 HydrophobicContact CD1-CD1 3.96Å; L664-I672 HydrophobicContact CD2-CD1 4.46Å; D668-I672 VanDerWaalsContact O-CG1 3.31Å; D668-I672 WeakPolarHBondContact O-CG1 3.48Å; D668-I672 PolarHBondContact O-N 3.17Å; A670-I672 VanDerWaalsContact C-N 3.27Å; A670-I672 PolarHBondContact O-N 3.23Å; I672-T675 VanDerWaalsContact O-CB 3.26Å; I672-T675 WeakPolarHBondContact O-CB 3.42Å; I672-T675 PolarHBondContact O-N 3.4Å; I672-T675 PolarHBondContact O-OG1 2.93Å
673	F	91.3	Very high	86.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-40.5	170.7	157.9	-87.1	0	0	0	111.4	A670 E671 T675 D676 Y677 P681 L730 Q733 A734 T738	A670-F673 WeakPolarHBondContact O-CB 3.3Å; A670-F673 PolarHBondContact O-N 2.91Å; E671-F673 VanDerWaalsContact C-N 3.28Å; E671-F673 PolarHBondContact O-N 3.07Å; F673-T675 PolarHBondContact O-N 3.35Å; F673-T675 VanDerWaalsContact O-N 3.16Å; F673-D676 CarbonylContact O-C 3.48Å; F673-D676 PolarHBondContact O-N 2.82Å; F673-Y677 WeakPolarHBondContact O-CA 3.49Å; F673-Y677 PolarHBondContact O-N 3.1Å; F673-Y677 VanDerWaalsContact O-N 3.08Å; F673-P681 HydrophobicContact CD2-CG 3.87Å; F673-P681 HydrophobicContact CE2-CG 3.61Å; F673-L730 HydrophobicContact CE1-CB 4.38Å; F673-L730 HydrophobicContact CE1-CD2 4.31Å; F673-L730 WeakPolarHBondContact CE1-O 3.33Å; F673-L730 HydrophobicContact CZ-CD2 4.13Å; F673-Q733 HydrophobicContact CE2-CB 4.46Å; F673-Q733 HydrophobicContact CE2-CG 4.01Å; F673-Q733 HydrophobicContact CZ-CB 4.1Å; F673-Q733 HydrophobicContact CZ-CG 4.03Å; F673-A734 HydrophobicContact CB-CB 3.93Å; F673-A734 HydrophobicContact CD1-CB 3.45Å; F673-A734 VanDerWaalsContact CD1-CB 3.45Å; F673-A734 HydrophobicContact CD2-CB 4.12Å; F673-A734 HydrophobicContact CE1-CB 3.85Å; F673-A734 HydrophobicContact CE2-CB 4.46Å; F673-A734 HydrophobicContact CG-CB 3.59Å; F673-A734 HydrophobicContact CZ-CB 4.32Å; F673-T738 HydrophobicContact CB-CG2 4.12Å; F673-T738 HydrophobicContact CD2-CG2 3.81Å; F673-T738 HydrophobicContact CG-CG2 4.44Å
674	F	90.1	Very high	88	Confident	87 Å²	87	47 Å²	47	38%	0.382	25%	0.246	S	C	.	.	H	α-helix	trans	-69.7	-6.9	177.6	-69.3	-72.1	0	0	0	114.6	A670 E671 D676 L730 N731	A670-F674 VanDerWaalsContact O-CD2 3.24Å; A670-F674 WeakPolarHBondContact O-CD2 3.47Å; A670-F674 PolarHBondContact O-N 3.33Å; E671-F674 WeakPolarHBondContact O-CA 3.5Å; E671-F674 PolarHBondContact O-N 2.94Å; F674-D676 VanDerWaalsContact C-N 3.29Å; F674-D676 PolarHBondContact O-N 3.14Å; F674-L730 HydrophobicContact CE1-CB 3.86Å; F674-L730 HydrophobicContact CE1-CD1 4.21Å; F674-L730 HydrophobicContact CZ-CB 3.98Å; F674-N731 WeakPolarHBondContact CE2-OD1 3.07Å; F674-N731 VanDerWaalsContact CZ-OD1 3.3Å; F674-N731 WeakPolarHBondContact CZ-OD1 3.44Å
675	T	84.7	Confident	89	Confident	56 Å²	56	48.5 Å²	48.5	34%	0.344	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-38.1	168.4	-58.8	0	0	0	0	111.8	M645 E671 I672 F673	M645-T675 VanDerWaalsContact O-CG2 3.23Å; M645-T675 WeakPolarHBondContact O-CG2 3.48Å; E671-T675 PolarHBondContact O-N 3.17Å; I672-T675 VanDerWaalsContact O-CB 3.26Å; I672-T675 WeakPolarHBondContact O-CB 3.42Å; I672-T675 PolarHBondContact O-N 3.4Å; I672-T675 PolarHBondContact O-OG1 2.93Å; F673-T675 PolarHBondContact O-N 3.35Å; F673-T675 VanDerWaalsContact O-N 3.16Å
676	D	85.5	Confident	89.5	Confident	37 Å²	37	47.9 Å²	47.9	20%	0.198	24%	0.244	C	C	.	.			trans	-159.7	93.2	163.8	-173.5	-29.5	0	0	0	108.6	I647 F673 F674 S678 L679 V680	I647-D676 HydrophobicContact CD1-CB 3.9Å; I647-D676 WeakPolarHBondContact CD1-OD2 3.48Å; I647-D676 HydrophobicContact CG1-CB 4.08Å; F673-D676 CarbonylContact O-C 3.48Å; F673-D676 PolarHBondContact O-N 2.82Å; F674-D676 VanDerWaalsContact C-N 3.29Å; F674-D676 PolarHBondContact O-N 3.14Å; D676-S678 PolarHBondContact O-N 3.32Å; D676-S678 VanDerWaalsContact O-N 3.09Å; D676-S678 WeakPolarHBondContact OD1-CA 3.4Å; D676-S678 WeakPolarHBondContact OD1-CB 3.44Å; D676-S678 PolarHBondContact OD1-N 2.91Å; D676-S678 PolarHBondContact OD1-OG 3.22Å; D676-L679 HydrophobicContact CB-CB 4.28Å; D676-L679 PolarHBondContact O-N 3.13Å; D676-L679 PolarHBondContact OD1-N 2.98Å; D676-L679 VanDerWaalsContact OD2-CD1 3.31Å; D676-L679 WeakPolarHBondContact OD2-CD1 3.32Å; D676-L679 VanDerWaalsContact OD2-CG 3.26Å; D676-L679 WeakPolarHBondContact OD2-CG 3.19Å; D676-V680 HydrophobicContact CB-CG2 4.29Å; D676-V680 WeakPolarHBondContact O-CB 3.4Å; D676-V680 VanDerWaalsContact O-CG2 3.26Å; D676-V680 WeakPolarHBondContact O-CG2 3.21Å; D676-V680 PolarHBondContact O-N 3.08Å
677	Y	90	Very high	89.8	Confident	100 Å²	100	41.6 Å²	41.6	39%	0.392	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.7	-177	67.9	-91.7	0	0	0	113.2	F673 P681 W727 L730	F673-Y677 WeakPolarHBondContact O-CA 3.49Å; F673-Y677 PolarHBondContact O-N 3.1Å; F673-Y677 VanDerWaalsContact O-N 3.08Å; Y677-P681 WeakPolarHBondContact O-CD 3.5Å; Y677-P681 WeakPolarHBondContact O-CG 3.29Å; Y677-W727 HydrophobicContact CE2-CZ3 4.28Å; Y677-L730 HydrophobicContact CD2-CD2 3.9Å; Y677-L730 HydrophobicContact CE2-CD2 4.49Å; Y677-L730 HydrophobicContact CG-CD2 4.3Å
678	S	87	Confident	90.1	Very high	50 Å²	50	38 Å²	38	35%	0.35	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-33.7	178.7	79.1	0	0	0	0	112.9	D676	D676-S678 PolarHBondContact O-N 3.32Å; D676-S678 VanDerWaalsContact O-N 3.09Å; D676-S678 WeakPolarHBondContact OD1-CA 3.4Å; D676-S678 WeakPolarHBondContact OD1-CB 3.44Å; D676-S678 PolarHBondContact OD1-N 2.91Å; D676-S678 PolarHBondContact OD1-OG 3.22Å
679	L	88.3	Confident	90.3	Very high	38 Å²	38	37.6 Å²	37.6	20%	0.199	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-37.1	-176.5	-62.4	-170.5	0	0	0	113.7	I647 D676 L682 F683 F759	I647-L679 HydrophobicContact CD1-CB 4.21Å; I647-L679 HydrophobicContact CD1-CD1 3.81Å; D676-L679 HydrophobicContact CB-CB 4.28Å; D676-L679 PolarHBondContact O-N 3.13Å; D676-L679 PolarHBondContact OD1-N 2.98Å; D676-L679 VanDerWaalsContact OD2-CD1 3.31Å; D676-L679 WeakPolarHBondContact OD2-CD1 3.32Å; D676-L679 VanDerWaalsContact OD2-CG 3.26Å; D676-L679 WeakPolarHBondContact OD2-CG 3.19Å; L679-L682 PolarHBondContact O-N 3.06Å; L679-L682 VanDerWaalsContact O-N 3.1Å; L679-F683 HydrophobicContact CB-CD2 4.24Å; L679-F683 HydrophobicContact CB-CE2 4.4Å; L679-F683 WeakPolarHBondContact O-CD2 3.48Å; L679-F683 PolarHBondContact O-N 3.36Å; L679-F759 HydrophobicContact CD2-CE1 4.5Å; L679-F759 HydrophobicContact CD2-CE2 3.8Å; L679-F759 HydrophobicContact CD2-CZ 3.41Å; L679-F759 VanDerWaalsContact CD2-CZ 3.41Å
680	V	91.2	Very high	90.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.5	-41.8	-175.9	179.3	0	0	0	0	112.7	I647 L654 D676 L682 F683 V684 T738	I647-V680 HydrophobicContact CG2-CG2 4.25Å; L654-V680 HydrophobicContact CD1-CG1 4.16Å; D676-V680 HydrophobicContact CB-CG2 4.29Å; D676-V680 WeakPolarHBondContact O-CB 3.4Å; D676-V680 VanDerWaalsContact O-CG2 3.26Å; D676-V680 WeakPolarHBondContact O-CG2 3.21Å; D676-V680 PolarHBondContact O-N 3.08Å; V680-L682 PolarHBondContact O-N 3.32Å; V680-F683 PolarHBondContact O-N 3.2Å; V680-V684 HydrophobicContact CG1-CG2 4.46Å; V680-V684 WeakPolarHBondContact O-CG2 3.36Å; V680-V684 PolarHBondContact O-N 2.9Å; V680-T738 HydrophobicContact CG1-CG2 3.82Å
681	P	93.2	Very high	90.2	Very high	17 Å²	17	38.8 Å²	38.8	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-43.9	174	-28.7	38.3	0	0	0	113.8	F673 Y677 F683 V684 Q685 T738	F673-P681 HydrophobicContact CD2-CG 3.87Å; F673-P681 HydrophobicContact CE2-CG 3.61Å; Y677-P681 WeakPolarHBondContact O-CD 3.5Å; Y677-P681 WeakPolarHBondContact O-CG 3.29Å; P681-F683 VanDerWaalsContact C-N 3.35Å; P681-V684 PolarHBondContact O-N 3.39Å; P681-Q685 WeakPolarHBondContact O-CB 3.48Å; P681-Q685 PolarHBondContact O-N 3.06Å; P681-T738 HydrophobicContact CG-CG2 4.49Å
682	L	93.6	Very high	89.9	Confident	36 Å²	36	35.2 Å²	35.2	19%	0.188	18%	0.18	C	C	.	.	H	α-helix	trans	-68.2	-35.7	178.8	-63.5	173.7	0	0	0	111.4	L679 V680 Q685 E686 P756 W758 F759	L679-L682 PolarHBondContact O-N 3.06Å; L679-L682 VanDerWaalsContact O-N 3.1Å; V680-L682 PolarHBondContact O-N 3.32Å; L682-Q685 PolarHBondContact O-N 2.94Å; L682-E686 PolarHBondContact O-N 2.88Å; L682-P756 VanDerWaalsContact C-CG 3.49Å; L682-P756 HydrophobicContact CB-CB 3.87Å; L682-P756 HydrophobicContact CB-CG 3.71Å; L682-W758 HydrophobicContact CD1-CE3 4.26Å; L682-W758 HydrophobicContact CD2-CB 4.38Å; L682-W758 HydrophobicContact CD2-CD2 4.33Å; L682-W758 HydrophobicContact CD2-CG 4.18Å; L682-F759 HydrophobicContact CD1-CE1 4.3Å; L682-F759 HydrophobicContact CD1-CE2 3.58Å; L682-F759 HydrophobicContact CD1-CZ 3.39Å
683	F	92.8	Very high	89.4	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-40.4	173	-93.3	-89.7	0	0	0	112.4	I647 F648 T651 L679 V680 P681 N687 I753 F755 P756	I647-F683 HydrophobicContact CG2-CD1 4.43Å; I647-F683 HydrophobicContact CG2-CD2 3.48Å; I647-F683 VanDerWaalsContact CG2-CD2 3.48Å; I647-F683 HydrophobicContact CG2-CE1 4.48Å; I647-F683 HydrophobicContact CG2-CE2 3.55Å; I647-F683 HydrophobicContact CG2-CG 3.94Å; I647-F683 HydrophobicContact CG2-CZ 4.05Å; F648-F683 AromaticContact CD1-CE1 3.81Å; F648-F683 HydrophobicContact CD1-CE1 3.81Å; F648-F683 HydrophobicContact CD1-CZ 4.44Å; F648-F683 HydrophobicContact CD2-CE1 4.36Å; F648-F683 HydrophobicContact CD2-CZ 4.27Å; F648-F683 AromaticContact CE1-CE1 3.61Å; F648-F683 HydrophobicContact CE1-CE1 3.61Å; F648-F683 HydrophobicContact CE1-CZ 4.05Å; F648-F683 HydrophobicContact CE2-CE1 4.18Å; F648-F683 AromaticContact CE2-CZ 3.85Å; F648-F683 HydrophobicContact CE2-CZ 3.85Å; F648-F683 HydrophobicContact CG-CE1 4.19Å; F648-F683 AromaticContact CZ-CE1 3.82Å; F648-F683 HydrophobicContact CZ-CE1 3.82Å; F648-F683 AromaticContact CZ-CZ 3.74Å; F648-F683 HydrophobicContact CZ-CZ 3.74Å; T651-F683 HydrophobicContact CG2-CB 4.09Å; T651-F683 WeakPolarHBondContact OG1-CB 3.45Å; L679-F683 HydrophobicContact CB-CD2 4.24Å; L679-F683 HydrophobicContact CB-CE2 4.4Å; L679-F683 WeakPolarHBondContact O-CD2 3.48Å; L679-F683 PolarHBondContact O-N 3.36Å; V680-F683 PolarHBondContact O-N 3.2Å; P681-F683 VanDerWaalsContact C-N 3.35Å; F683-N687 WeakPolarHBondContact O-CB 3.46Å; F683-N687 PolarHBondContact O-N 3.25Å; F683-N687 PolarHBondContact O-ND2 3.47Å; F683-I753 HydrophobicContact CD1-CG2 3.72Å; F683-I753 HydrophobicContact CE1-CG2 3.92Å; F683-F755 HydrophobicContact CE2-CD2 4.12Å; F683-F755 HydrophobicContact CE2-CE2 4.21Å; F683-F755 AromaticContact CZ-CD2 3.65Å; F683-F755 HydrophobicContact CZ-CD2 3.65Å; F683-F755 HydrophobicContact CZ-CE2 4.16Å; F683-F755 HydrophobicContact CZ-CG 4.46Å; F683-P756 HydrophobicContact CD2-CG 3.75Å; F683-P756 HydrophobicContact CE2-CG 4.11Å; F683-P756 HydrophobicContact CG-CG 4.02Å
684	V	93.2	Very high	88.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-46.4	172.6	171.4	0	0	0	0	110.4	L654 F655 V680 P681 E686 N687 Y688 S737 T738 P741 T742	L654-V684 HydrophobicContact CD1-CG2 4.38Å; F655-V684 HydrophobicContact CZ-CB 4.34Å; F655-V684 HydrophobicContact CZ-CG1 3.9Å; F655-V684 HydrophobicContact CZ-CG2 4.43Å; V680-V684 HydrophobicContact CG1-CG2 4.46Å; V680-V684 WeakPolarHBondContact O-CG2 3.36Å; V680-V684 PolarHBondContact O-N 2.9Å; P681-V684 PolarHBondContact O-N 3.39Å; V684-E686 PolarHBondContact O-N 3.23Å; V684-N687 PolarHBondContact O-N 3.46Å; V684-Y688 PolarHBondContact O-N 3.03Å; V684-S737 WeakPolarHBondContact CG1-O 3.19Å; V684-T738 HydrophobicContact CG2-CG2 4.13Å; V684-P741 HydrophobicContact CG1-CB 4.12Å; V684-T742 HydrophobicContact CG1-CG2 3.94Å; V684-T742 HydrophobicContact CG2-CG2 3.83Å
685	Q	94.8	Very high	87.4	Confident	71 Å²	71	42.4 Å²	42.4	33%	0.332	24%	0.238	S	C	.	.	H	α-helix	trans	-59.9	-41.6	179.4	-172.9	-77.7	-41.9	0	0	113.4	P681 L682 Y688 I711	P681-Q685 WeakPolarHBondContact O-CB 3.48Å; P681-Q685 PolarHBondContact O-N 3.06Å; L682-Q685 PolarHBondContact O-N 2.94Å; Q685-Y688 WeakPolarHBondContact O-CD1 3.32Å; Q685-Y688 VanDerWaalsContact O-CE1 3.32Å; Q685-Y688 WeakPolarHBondContact O-CE1 3.49Å; Q685-I711 HydrophobicContact CB-CG2 4.21Å; Q685-I711 HydrophobicContact CG-CG2 3.89Å
686	E	93.7	Very high	87.4	Confident	39 Å²	39	44.2 Å²	44.2	18%	0.182	25%	0.246	C	C	.	.	H	α-helix	trans	-72.2	-31.2	178.2	-172.1	77.3	-151.5	0	0	112.2	L682 V684 S754 A757	L682-E686 PolarHBondContact O-N 2.88Å; V684-E686 PolarHBondContact O-N 3.23Å; E686-S754 WeakPolarHBondContact CG-OG 3.44Å; E686-A757 WeakPolarHBondContact OE2-CB 3.19Å; E686-A757 PolarHBondContact OE2-N 3.17Å
687	N	92.4	Very high	87.4	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-102.9	-23.6	-167.3	-73	-93.3	0	0	0	115.6	F655 F683 V684 P689 H690 L749 I753 S754	F655-N687 HydrophobicContact CE2-CB 3.91Å; F683-N687 WeakPolarHBondContact O-CB 3.46Å; F683-N687 PolarHBondContact O-N 3.25Å; F683-N687 PolarHBondContact O-ND2 3.47Å; V684-N687 PolarHBondContact O-N 3.46Å; N687-P689 VanDerWaalsContact C-N 3.31Å; N687-H690 WeakPolarHBondContact O-CB 3.34Å; N687-H690 PolarHBondContact O-N 2.85Å; N687-L749 HydrophobicContact CB-CD1 4.43Å; N687-I753 WeakPolarHBondContact OD1-CA 3.32Å; N687-S754 PolarHBondContact ND2-O 2.97Å; N687-S754 PolarHBondContact OD1-N 3.42Å; N687-S754 PolarHBondContact OD1-OG 2.91Å; N687-S754 VanDerWaalsContact OD1-OG 3.14Å
688	Y	92.5	Very high	87.4	Confident	36 Å²	36	50.7 Å²	50.7	14%	0.141	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-54.3	-33.6	-179.2	87.3	-83.9	0	0	0	114.8	V684 Q685 H690 C691 L704 A707 A708 I711 M745	V684-Y688 PolarHBondContact O-N 3.03Å; Q685-Y688 WeakPolarHBondContact O-CD1 3.32Å; Q685-Y688 VanDerWaalsContact O-CE1 3.32Å; Q685-Y688 WeakPolarHBondContact O-CE1 3.49Å; Y688-H690 PolarHBondContact O-N 3.36Å; Y688-C691 WeakPolarHBondContact O-CB 3.48Å; Y688-C691 PolarHBondContact O-N 2.96Å; Y688-C691 VanDerWaalsContact O-N 3.16Å; Y688-L704 HydrophobicContact CD2-CD2 3.78Å; Y688-L704 HydrophobicContact CE2-CD2 3.83Å; Y688-A707 HydrophobicContact CD2-CB 4.07Å; Y688-A707 HydrophobicContact CE2-CB 4.34Å; Y688-A708 HydrophobicContact CE2-CB 4.4Å; Y688-A708 WeakPolarHBondContact OH-CB 3.45Å; Y688-I711 HydrophobicContact CD1-CD1 3.47Å; Y688-I711 VanDerWaalsContact CD1-CD1 3.47Å; Y688-I711 HydrophobicContact CD2-CD1 4.48Å; Y688-I711 HydrophobicContact CE1-CD1 3.59Å; Y688-I711 HydrophobicContact CG-CD1 3.99Å; Y688-M745 HydrophobicContact CD2-CG 4.1Å
689	P	90.9	Very high	87.4	Confident	54 Å²	54	52.8 Å²	52.8	35%	0.351	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-69.1	-20	178.9	-17.7	34	0	0	0	113.2	N687 R700	N687-P689 VanDerWaalsContact C-N 3.31Å; P689-R700 PolarHBondContact O-NH2 2.83Å
690	H	87.9	Confident	87.3	Confident	64 Å²	64	53.7 Å²	53.7	30%	0.296	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-84.6	-10.7	178.2	-58.3	-23.7	0	0	0	112.7	N687 Y688 L749 K750	N687-H690 WeakPolarHBondContact O-CB 3.34Å; N687-H690 PolarHBondContact O-N 2.85Å; Y688-H690 PolarHBondContact O-N 3.36Å; H690-L749 HydrophobicContact CB-CD1 3.85Å; H690-K750 WeakPolarHBondContact O-CB 3.46Å; H690-K750 PolarHBondContact O-N 3.22Å
691	C	85.8	Confident	87.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	140.6	174.6	-66.5	0	0	0	0	112.3	F655 Y688 R700 M745 L749	F655-C691 WeakPolarHBondContact CD1-SG 3.44Å; F655-C691 VanDerWaalsContact CG-SG 3.53Å; Y688-C691 WeakPolarHBondContact O-CB 3.48Å; Y688-C691 PolarHBondContact O-N 2.96Å; Y688-C691 VanDerWaalsContact O-N 3.16Å; C691-R700 VanDerWaalsContact O-CZ 3.3Å; C691-R700 PolarHBondContact O-NE 3.16Å; C691-R700 PolarHBondContact O-NH2 3.09Å; C691-M745 HydrophobicContact CB-CB 4.1Å; C691-M745 HydrophobicContact CB-CE 3.92Å; C691-M745 VanDerWaalsContact CB-O 3.27Å; C691-M745 WeakPolarHBondContact CB-O 3.36Å; C691-L749 VanDerWaalsContact SG-CD1 3.56Å
692	V	81.5	Confident	87.3	Confident	43 Å²	43	60.6 Å²	60.6	26%	0.261	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	107.9	175.3	-175.3	0	0	0	0	108.8	Y748 K750	V692-Y748 WeakPolarHBondContact CB-O 3.44Å; V692-Y748 PolarHBondContact N-O 3.4Å; V692-Y748 PolarHBondContact O-N 3Å; V692-K750 HydrophobicContact CG2-CD 3.54Å; V692-K750 HydrophobicContact CG2-CG 3.66Å
693	T	77.7	Confident	87.2	Confident	18 Å²	18	59.7 Å²	59.7	11%	0.11	33%	0.334	C	S	.	.			trans	-103.3	141.6	170.2	44.8	0	0	0	0	110.1	L744 M745 K746	T693-L744 WeakPolarHBondContact CG2-O 3.49Å; T693-M745 VanDerWaalsContact CG2-C 3.4Å; T693-M745 HydrophobicContact CG2-CE 4.16Å; T693-K746 WeakPolarHBondContact CG2-O 3.37Å
694	G	70.7	Confident	87.2	Confident	62 Å²	62	60.9 Å²	60.9	64%	0.639	34%	0.341	S	S	*	.	S	Bend	trans	61.7	-176.5	174.7	0	0	0	0	0	116.3
695	N	67.9	Low	87.2	Confident	168 Å²	168	63.7 Å²	63.7	90%	0.898	36%	0.364	S	S	*	.	S	Bend	trans	-99.7	-23.6	168.6	-65.6	-39.2	0	0	0	112.1
696	N	85.1	Confident	87.2	Confident	94 Å²	94	64.6 Å²	64.6	50%	0.503	37%	0.368	S	S	.	.			trans	-90.6	136.2	-171.8	-67.9	-19.6	0	0	0	111.4	D699 R700	N696-D699 HydrophobicContact CB-CB 4.08Å; N696-D699 VanDerWaalsContact CB-CG 3.47Å; N696-D699 VanDerWaalsContact CB-OD2 3.24Å; N696-D699 WeakPolarHBondContact CB-OD2 3.48Å; N696-D699 PolarHBondContact ND2-OD2 2.93Å; N696-R700 WeakPolarHBondContact O-CB 3.17Å; N696-R700 PolarHBondContact O-N 2.94Å
697	I	86.4	Confident	87.3	Confident	137 Å²	137	62.7 Å²	62.7	70%	0.703	36%	0.36	S	S	*	.	H	α-helix	trans	-70.6	-38	179.7	-60.7	173.6	0	0	0	111.1	L701	I697-L701 HydrophobicContact CG2-CD1 4.01Å; I697-L701 HydrophobicContact CG2-CG 4.48Å; I697-L701 VanDerWaalsContact O-CG 3.31Å; I697-L701 WeakPolarHBondContact O-CG 3.24Å; I697-L701 PolarHBondContact O-N 2.83Å
698	L	88.6	Confident	87.5	Confident	135 Å²	135	64.3 Å²	64.3	71%	0.707	37%	0.373	S	S	*	.	H	α-helix	trans	-66.2	-50.5	-179.3	-61.8	178.4	0	0	0	111.6	R700 L701 A702	L698-R700 VanDerWaalsContact C-N 3.28Å; L698-R700 PolarHBondContact O-N 3.46Å; L698-L701 WeakPolarHBondContact O-CA 3.24Å; L698-L701 WeakPolarHBondContact O-CB 3.38Å; L698-L701 PolarHBondContact O-N 2.7Å; L698-A702 PolarHBondContact O-N 3.48Å
699	D	86.9	Confident	87.7	Confident	95 Å²	95	67.5 Å²	67.5	51%	0.508	39%	0.389	S	S	.	.	H	α-helix	trans	-59.7	-40.2	179.3	-45.1	-0.2	0	0	0	110.9	N696 A702 A703	N696-D699 HydrophobicContact CB-CB 4.08Å; N696-D699 VanDerWaalsContact CB-CG 3.47Å; N696-D699 VanDerWaalsContact CB-OD2 3.24Å; N696-D699 WeakPolarHBondContact CB-OD2 3.48Å; N696-D699 PolarHBondContact ND2-OD2 2.93Å; D699-A702 PolarHBondContact O-N 3.47Å; D699-A703 WeakPolarHBondContact O-CB 3.49Å; D699-A703 PolarHBondContact O-N 2.81Å
700	R	87.3	Confident	88	Confident	57 Å²	57	66.9 Å²	66.9	22%	0.215	38%	0.381	C	S	.	.	H	α-helix	trans	-65.3	-36.7	173.3	-179.5	167.7	179.7	-90.1	-5.7	112.8	P689 C691 N696 L698 L704	P689-R700 PolarHBondContact O-NH2 2.83Å; C691-R700 VanDerWaalsContact O-CZ 3.3Å; C691-R700 PolarHBondContact O-NE 3.16Å; C691-R700 PolarHBondContact O-NH2 3.09Å; N696-R700 WeakPolarHBondContact O-CB 3.17Å; N696-R700 PolarHBondContact O-N 2.94Å; L698-R700 VanDerWaalsContact C-N 3.28Å; L698-R700 PolarHBondContact O-N 3.46Å; R700-L704 HydrophobicContact CG-CD1 4.05Å; R700-L704 HydrophobicContact CG-CG 4.48Å; R700-L704 VanDerWaalsContact O-CB 3.31Å; R700-L704 WeakPolarHBondContact O-CB 3.46Å; R700-L704 WeakPolarHBondContact O-CD1 3.1Å; R700-L704 WeakPolarHBondContact O-CG 3.42Å; R700-L704 PolarHBondContact O-N 3.43Å
701	L	91	Very high	88.4	Confident	100 Å²	100	65 Å²	65	52%	0.524	37%	0.373	S	S	.	.	H	α-helix	trans	-69.7	-36.9	175.1	-75.6	169.1	0	0	0	112	I697 L698 L704 A705	I697-L701 HydrophobicContact CG2-CD1 4.01Å; I697-L701 HydrophobicContact CG2-CG 4.48Å; I697-L701 VanDerWaalsContact O-CG 3.31Å; I697-L701 WeakPolarHBondContact O-CG 3.24Å; I697-L701 PolarHBondContact O-N 2.83Å; L698-L701 WeakPolarHBondContact O-CA 3.24Å; L698-L701 WeakPolarHBondContact O-CB 3.38Å; L698-L701 PolarHBondContact O-N 2.7Å; L701-L704 PolarHBondContact O-N 3.42Å; L701-A705 WeakPolarHBondContact O-CB 3.41Å; L701-A705 PolarHBondContact O-N 2.98Å
702	A	92.1	Very high	88.9	Confident	62 Å²	62	67.4 Å²	67.4	51%	0.512	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-51.1	173.6	0	0	0	0	0	111.2	L698 D699 L704 A705 E706	L698-A702 PolarHBondContact O-N 3.48Å; D699-A702 PolarHBondContact O-N 3.47Å; A702-L704 VanDerWaalsContact C-N 3.31Å; A702-L704 PolarHBondContact O-N 2.78Å; A702-A705 PolarHBondContact O-N 2.64Å; A702-A705 VanDerWaalsContact O-N 3.09Å; A702-E706 PolarHBondContact O-N 3.46Å
703	A	91.4	Very high	89.6	Confident	16 Å²	16	70.2 Å²	70.2	13%	0.132	40%	0.4	C	S	.	.	H	α-helix	trans	-60	-37.7	176.3	0	0	0	0	0	112.9	D699 A707 M745	D699-A703 WeakPolarHBondContact O-CB 3.49Å; D699-A703 PolarHBondContact O-N 2.81Å; A703-A707 WeakPolarHBondContact O-CB 3.41Å; A703-A707 PolarHBondContact O-N 3.24Å; A703-M745 HydrophobicContact CB-SD 4.09Å
704	L	93.2	Very high	90.5	Very high	27 Å²	27	69.5 Å²	69.5	14%	0.141	40%	0.395	C	S	.	.	H	α-helix	trans	-64.8	-38.1	173.9	-79.8	167.4	0	0	0	112.8	Y688 R700 L701 A702 A708 M745	Y688-L704 HydrophobicContact CD2-CD2 3.78Å; Y688-L704 HydrophobicContact CE2-CD2 3.83Å; R700-L704 HydrophobicContact CG-CD1 4.05Å; R700-L704 HydrophobicContact CG-CG 4.48Å; R700-L704 VanDerWaalsContact O-CB 3.31Å; R700-L704 WeakPolarHBondContact O-CB 3.46Å; R700-L704 WeakPolarHBondContact O-CD1 3.1Å; R700-L704 WeakPolarHBondContact O-CG 3.42Å; R700-L704 PolarHBondContact O-N 3.43Å; L701-L704 PolarHBondContact O-N 3.42Å; A702-L704 VanDerWaalsContact C-N 3.31Å; A702-L704 PolarHBondContact O-N 2.78Å; L704-A708 VanDerWaalsContact O-CB 3.3Å; L704-A708 WeakPolarHBondContact O-CB 3.37Å; L704-A708 PolarHBondContact O-N 3Å; L704-M745 HydrophobicContact CD2-CE 3.47Å; L704-M745 VanDerWaalsContact CD2-CE 3.47Å; L704-M745 HydrophobicContact CD2-SD 3.74Å; L704-M745 HydrophobicContact CG-CE 3.83Å; L704-M745 HydrophobicContact CG-SD 3.9Å
705	A	94.7	Very high	91.6	Very high	60 Å²	60	71.7 Å²	71.7	50%	0.496	39%	0.392	S	S	.	.	H	α-helix	trans	-71.4	-42.9	177.8	0	0	0	0	0	111.6	L701 A702 A708 Q709	L701-A705 WeakPolarHBondContact O-CB 3.41Å; L701-A705 PolarHBondContact O-N 2.98Å; A702-A705 PolarHBondContact O-N 2.64Å; A702-A705 VanDerWaalsContact O-N 3.09Å; A705-A708 PolarHBondContact O-N 2.65Å; A705-Q709 PolarHBondContact O-N 2.99Å
706	E	94.7	Very high	93	Very high	89 Å²	89	68.2 Å²	68.2	42%	0.416	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-45.8	176.5	-168.5	-179.3	176.4	0	0	111.3	A702 A708 Q709 F710 L744	A702-E706 PolarHBondContact O-N 3.46Å; E706-A708 VanDerWaalsContact C-N 3.32Å; E706-A708 PolarHBondContact O-N 3Å; E706-Q709 WeakPolarHBondContact O-CB 3.43Å; E706-Q709 PolarHBondContact O-N 3.01Å; E706-Q709 VanDerWaalsContact O-N 3.13Å; E706-F710 HydrophobicContact CG-CD2 4Å; E706-F710 HydrophobicContact CG-CE2 3.81Å; E706-F710 WeakPolarHBondContact O-CD2 3.26Å; E706-F710 PolarHBondContact O-N 3.22Å; E706-L744 HydrophobicContact CB-CD1 4Å; E706-L744 HydrophobicContact CG-CD1 3.65Å; E706-L744 HydrophobicContact CG-CD2 4.48Å
707	A	95.1	Very high	93.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-59.7	-40.2	173.8	0	0	0	0	0	112.2	Y688 A703 Q709 F710 I711 P741 L744 M745	Y688-A707 HydrophobicContact CD2-CB 4.07Å; Y688-A707 HydrophobicContact CE2-CB 4.34Å; A703-A707 WeakPolarHBondContact O-CB 3.41Å; A703-A707 PolarHBondContact O-N 3.24Å; A707-Q709 VanDerWaalsContact C-N 3.35Å; A707-F710 PolarHBondContact O-N 3.26Å; A707-I711 WeakPolarHBondContact O-CD1 3.32Å; A707-I711 VanDerWaalsContact O-CG1 3.24Å; A707-I711 WeakPolarHBondContact O-CG1 3.41Å; A707-I711 PolarHBondContact O-N 3.37Å; A707-P741 HydrophobicContact CB-CB 4.18Å; A707-L744 HydrophobicContact CB-CB 4.35Å; A707-L744 HydrophobicContact CB-CD1 4.31Å; A707-M745 HydrophobicContact CB-CG 3.81Å; A707-M745 HydrophobicContact CB-SD 4.47Å
708	A	96.3	Very high	93.9	Very high	34 Å²	34	59.3 Å²	59.3	28%	0.281	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-38.5	174.9	0	0	0	0	0	112.5	Y688 L704 A705 E706 I711 A712	Y688-A708 HydrophobicContact CE2-CB 4.4Å; Y688-A708 WeakPolarHBondContact OH-CB 3.45Å; L704-A708 VanDerWaalsContact O-CB 3.3Å; L704-A708 WeakPolarHBondContact O-CB 3.37Å; L704-A708 PolarHBondContact O-N 3Å; A705-A708 PolarHBondContact O-N 2.65Å; E706-A708 VanDerWaalsContact C-N 3.32Å; E706-A708 PolarHBondContact O-N 3Å; A708-I711 PolarHBondContact O-N 3.46Å; A708-A712 PolarHBondContact O-N 3.13Å
709	Q	96.9	Very high	94.1	Very high	102 Å²	102	59.7 Å²	59.7	48%	0.477	33%	0.327	S	S	.	.	H	α-helix	trans	-65.9	-42.8	176.7	-176.5	174	-7.3	0	0	111.8	A705 E706 A707 A712 Y713	A705-Q709 PolarHBondContact O-N 2.99Å; E706-Q709 WeakPolarHBondContact O-CB 3.43Å; E706-Q709 PolarHBondContact O-N 3.01Å; E706-Q709 VanDerWaalsContact O-N 3.13Å; A707-Q709 VanDerWaalsContact C-N 3.35Å; Q709-A712 PolarHBondContact O-N 3.13Å; Q709-Y713 HydrophobicContact CG-CD2 4.43Å; Q709-Y713 HydrophobicContact CG-CE2 3.77Å; Q709-Y713 PolarHBondContact NE2-OH 3.43Å; Q709-Y713 PolarHBondContact O-N 3.03Å
710	F	96.9	Very high	94.5	Very high	42 Å²	42	59.3 Å²	59.3	18%	0.184	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-38.8	174.4	-80.6	-70.4	0	0	0	112.9	E706 A707 A712 Y713 G714 F736 I740 P741 L744	E706-F710 HydrophobicContact CG-CD2 4Å; E706-F710 HydrophobicContact CG-CE2 3.81Å; E706-F710 WeakPolarHBondContact O-CD2 3.26Å; E706-F710 PolarHBondContact O-N 3.22Å; A707-F710 PolarHBondContact O-N 3.26Å; F710-A712 VanDerWaalsContact C-N 3.31Å; F710-A712 PolarHBondContact O-N 2.71Å; F710-Y713 HydrophobicContact CD1-CD2 4.16Å; F710-Y713 HydrophobicContact CE1-CD2 4.5Å; F710-Y713 PolarHBondContact O-N 3.37Å; F710-Y713 VanDerWaalsContact O-N 3.17Å; F710-G714 PolarHBondContact O-N 3.27Å; F710-F736 CarbonylContact C-O 3.26Å; F710-F736 VanDerWaalsContact C-O 3.25Å; F710-F736 AromaticContact CD1-CD1 3.91Å; F710-F736 HydrophobicContact CD1-CD1 3.91Å; F710-F736 HydrophobicContact CD1-CE1 4.42Å; F710-F736 HydrophobicContact CE1-CD1 4.24Å; F710-F736 HydrophobicContact CE1-CE1 4.32Å; F710-F736 VanDerWaalsContact O-O 3.09Å; F710-I740 HydrophobicContact CB-CG2 4.33Å; F710-I740 HydrophobicContact CD1-CB 4.49Å; F710-I740 HydrophobicContact CD1-CD1 4.04Å; F710-I740 HydrophobicContact CD1-CG2 4.12Å; F710-I740 HydrophobicContact CD2-CG2 3.45Å; F710-I740 VanDerWaalsContact CD2-CG2 3.45Å; F710-I740 HydrophobicContact CE1-CD1 3.81Å; F710-I740 HydrophobicContact CE1-CG2 4.31Å; F710-I740 HydrophobicContact CE2-CG2 3.67Å; F710-I740 HydrophobicContact CG-CB 4.32Å; F710-I740 HydrophobicContact CG-CG2 3.7Å; F710-I740 HydrophobicContact CZ-CD1 4.24Å; F710-I740 HydrophobicContact CZ-CG2 4.09Å; F710-P741 HydrophobicContact CB-CG 4.02Å; F710-L744 HydrophobicContact CD2-CD1 4.01Å; F710-L744 HydrophobicContact CE2-CD1 4.4Å
711	I	96.1	Very high	94.9	Very high	24 Å²	24	56.7 Å²	56.7	12%	0.123	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-42.1	172.1	-70.2	163.4	0	0	0	110.9	Q685 Y688 A707 A708 Y713 G714 D715 P741	Q685-I711 HydrophobicContact CB-CG2 4.21Å; Q685-I711 HydrophobicContact CG-CG2 3.89Å; Y688-I711 HydrophobicContact CD1-CD1 3.47Å; Y688-I711 VanDerWaalsContact CD1-CD1 3.47Å; Y688-I711 HydrophobicContact CD2-CD1 4.48Å; Y688-I711 HydrophobicContact CE1-CD1 3.59Å; Y688-I711 HydrophobicContact CG-CD1 3.99Å; A707-I711 WeakPolarHBondContact O-CD1 3.32Å; A707-I711 VanDerWaalsContact O-CG1 3.24Å; A707-I711 WeakPolarHBondContact O-CG1 3.41Å; A707-I711 PolarHBondContact O-N 3.37Å; A708-I711 PolarHBondContact O-N 3.46Å; I711-Y713 PolarHBondContact O-N 3.13Å; I711-G714 WeakPolarHBondContact O-CA 3.46Å; I711-G714 PolarHBondContact O-N 2.88Å; I711-G714 VanDerWaalsContact O-N 3.11Å; I711-D715 PolarHBondContact O-N 2.93Å; I711-P741 HydrophobicContact CD1-CB 4.13Å; I711-P741 HydrophobicContact CD1-CG 4.41Å; I711-P741 HydrophobicContact CG1-CB 3.99Å; I711-P741 HydrophobicContact CG1-CG 3.72Å
712	A	96.7	Very high	94.9	Very high	51 Å²	51	59.1 Å²	59.1	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-34.9	175.6	0	0	0	0	0	113	A708 Q709 F710 G714 D715 V716	A708-A712 PolarHBondContact O-N 3.13Å; Q709-A712 PolarHBondContact O-N 3.13Å; F710-A712 VanDerWaalsContact C-N 3.31Å; F710-A712 PolarHBondContact O-N 2.71Å; A712-G714 VanDerWaalsContact C-N 3.34Å; A712-D715 PolarHBondContact O-N 3.16Å; A712-V716 WeakPolarHBondContact O-CG2 3.37Å; A712-V716 PolarHBondContact O-N 3.4Å
713	Y	97	Very high	95	Very high	102 Å²	102	59.9 Å²	59.9	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-67.5	-34.3	169.7	-62.8	-30.3	0	0	0	112.3	Q709 F710 I711 V716 V717	Q709-Y713 HydrophobicContact CG-CD2 4.43Å; Q709-Y713 HydrophobicContact CG-CE2 3.77Å; Q709-Y713 PolarHBondContact NE2-OH 3.43Å; Q709-Y713 PolarHBondContact O-N 3.03Å; F710-Y713 HydrophobicContact CD1-CD2 4.16Å; F710-Y713 HydrophobicContact CE1-CD2 4.5Å; F710-Y713 PolarHBondContact O-N 3.37Å; F710-Y713 VanDerWaalsContact O-N 3.17Å; I711-Y713 PolarHBondContact O-N 3.13Å; Y713-V716 PolarHBondContact O-N 3.06Å; Y713-V717 WeakPolarHBondContact O-CG2 3.41Å; Y713-V717 PolarHBondContact O-N 2.99Å; Y713-V717 VanDerWaalsContact O-N 3.08Å
714	G	95.3	Very high	95.1	Very high	2 Å²	2	65.8 Å²	65.8	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-40.7	171.4	0	0	0	0	0	113.2	F710 I711 A712 V717 D718	F710-G714 PolarHBondContact O-N 3.27Å; I711-G714 WeakPolarHBondContact O-CA 3.46Å; I711-G714 PolarHBondContact O-N 2.88Å; I711-G714 VanDerWaalsContact O-N 3.11Å; A712-G714 VanDerWaalsContact C-N 3.34Å; G714-V717 PolarHBondContact O-N 3.43Å; G714-D718 WeakPolarHBondContact O-CB 3.48Å; G714-D718 PolarHBondContact O-N 3.26Å
715	D	95.3	Very high	95	Very high	108 Å²	108	68.2 Å²	68.2	58%	0.578	36%	0.359	S	S	*	.	H	α-helix	trans	-65.1	-43.3	175.7	-176.3	76.2	0	0	0	112.4	I711 A712 V717 D718 K719	I711-D715 PolarHBondContact O-N 2.93Å; A712-D715 PolarHBondContact O-N 3.16Å; D715-V717 VanDerWaalsContact C-N 3.29Å; D715-V717 PolarHBondContact O-N 2.91Å; D715-D718 PolarHBondContact O-N 3.02Å; D715-K719 PolarHBondContact O-N 3.23Å
716	V	96	Very high	94.9	Very high	96 Å²	96	67 Å²	67	58%	0.582	35%	0.347	S	S	*	.	H	α-helix	trans	-61.2	-37.9	173.6	173.8	0	0	0	0	111.6	A712 Y713 Q720	A712-V716 WeakPolarHBondContact O-CG2 3.37Å; A712-V716 PolarHBondContact O-N 3.4Å; Y713-V716 PolarHBondContact O-N 3.06Å; V716-Q720 PolarHBondContact O-N 3.08Å; V716-Q720 VanDerWaalsContact O-N 3.13Å
717	V	95.7	Very high	94.8	Very high	14 Å²	14	69 Å²	69	9%	0.085	35%	0.351	C	S	.	.	H	α-helix	trans	-71.6	-40.9	175.4	175	0	0	0	0	111.7	Y713 G714 D715 K719 Q720 I721 L729 L732 Q733 F736	Y713-V717 WeakPolarHBondContact O-CG2 3.41Å; Y713-V717 PolarHBondContact O-N 2.99Å; Y713-V717 VanDerWaalsContact O-N 3.08Å; G714-V717 PolarHBondContact O-N 3.43Å; D715-V717 VanDerWaalsContact C-N 3.29Å; D715-V717 PolarHBondContact O-N 2.91Å; V717-K719 PolarHBondContact O-N 3.31Å; V717-Q720 PolarHBondContact O-N 3.29Å; V717-Q720 VanDerWaalsContact O-N 3.15Å; V717-I721 HydrophobicContact CG1-CD1 3.88Å; V717-I721 HydrophobicContact CG1-CG1 4.38Å; V717-I721 WeakPolarHBondContact O-CG1 3.34Å; V717-I721 PolarHBondContact O-N 3.29Å; V717-L729 HydrophobicContact CG1-CB 4.02Å; V717-L732 HydrophobicContact CG1-CB 4.5Å; V717-L732 HydrophobicContact CG1-CD2 4.48Å; V717-L732 HydrophobicContact CG2-CD2 3.96Å; V717-L732 HydrophobicContact CG2-CG 4.31Å; V717-Q733 HydrophobicContact CG1-CB 3.93Å; V717-F736 HydrophobicContact CG2-CD2 4.08Å; V717-F736 HydrophobicContact CG2-CE2 4.32Å
718	D	94.3	Very high	94.8	Very high	29 Å²	29	73.6 Å²	73.6	16%	0.155	38%	0.383	C	S	.	.	H	α-helix	trans	-59.2	-44.8	175.1	-174.9	80.2	0	0	0	111.5	G714 D715 Q720 I721 R722 Q733	G714-D718 WeakPolarHBondContact O-CB 3.48Å; G714-D718 PolarHBondContact O-N 3.26Å; D715-D718 PolarHBondContact O-N 3.02Å; D718-Q720 VanDerWaalsContact C-N 3.35Å; D718-Q720 PolarHBondContact O-N 3.24Å; D718-I721 WeakPolarHBondContact O-CB 3.35Å; D718-I721 PolarHBondContact O-N 3.42Å; D718-R722 WeakPolarHBondContact O-CG 3.38Å; D718-R722 PolarHBondContact O-N 3.17Å; D718-R722 IonicContact OD1-CZ 3.71Å; D718-R722 IonicContact OD1-NE 3.65Å; D718-R722 PolarHBondContact OD1-NE 3.4Å; D718-R722 IonicContact OD1-NH2 3.69Å; D718-R722 PolarHBondContact OD1-NH2 2.81Å; D718-R722 IonicContact OD2-CZ 3.72Å; D718-R722 VanDerWaalsContact OD2-CZ 3.32Å; D718-R722 IonicContact OD2-NE 3.43Å; D718-R722 PolarHBondContact OD2-NE 3.24Å; D718-R722 IonicContact OD2-NH2 2.78Å; D718-R722 PolarHBondContact OD2-NH2 3.41Å; D718-R722 VanDerWaalsContact OD2-NH2 3.09Å; D718-Q733 PolarHBondContact OD1-NE2 3.35Å
719	K	94.2	Very high	94.7	Very high	144 Å²	144	74.2 Å²	74.2	63%	0.626	38%	0.381	S	S	*	.	H	α-helix	trans	-58	-45.7	172.5	-176.2	172	-178.5	172.3	0	111.9	D715 V717 I721 R722 S723	D715-K719 PolarHBondContact O-N 3.23Å; V717-K719 PolarHBondContact O-N 3.31Å; K719-I721 VanDerWaalsContact C-N 3.34Å; K719-I721 PolarHBondContact O-N 3.13Å; K719-R722 PolarHBondContact O-N 3.36Å; K719-S723 WeakPolarHBondContact O-CB 3.42Å; K719-S723 PolarHBondContact O-N 3.13Å; K719-S723 PolarHBondContact O-OG 3.04Å
720	Q	94.9	Very high	94.6	Very high	87 Å²	87	70.6 Å²	70.6	41%	0.407	37%	0.365	S	S	.	.	H	α-helix	trans	-65.3	-35.6	177.9	-170.9	65.8	14.3	0	0	112.6	V716 V717 D718 F724 L729	V716-Q720 PolarHBondContact O-N 3.08Å; V716-Q720 VanDerWaalsContact O-N 3.13Å; V717-Q720 PolarHBondContact O-N 3.29Å; V717-Q720 VanDerWaalsContact O-N 3.15Å; D718-Q720 VanDerWaalsContact C-N 3.35Å; D718-Q720 PolarHBondContact O-N 3.24Å; Q720-F724 VanDerWaalsContact CD-CD2 3.5Å; Q720-F724 HydrophobicContact CG-CD2 4.42Å; Q720-F724 PolarHBondContact O-N 3.38Å; Q720-L729 HydrophobicContact CB-CD1 4.38Å; Q720-L729 HydrophobicContact CG-CD1 3.87Å
721	I	94.6	Very high	94.4	Very high	2 Å²	2	73.5 Å²	73.5	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-62.7	-52	173.5	-71.4	162.3	0	0	0	109.9	V717 D718 K719 S725 S726 W727 L729 L730 Q733	V717-I721 HydrophobicContact CG1-CD1 3.88Å; V717-I721 HydrophobicContact CG1-CG1 4.38Å; V717-I721 WeakPolarHBondContact O-CG1 3.34Å; V717-I721 PolarHBondContact O-N 3.29Å; D718-I721 WeakPolarHBondContact O-CB 3.35Å; D718-I721 PolarHBondContact O-N 3.42Å; K719-I721 VanDerWaalsContact C-N 3.34Å; K719-I721 PolarHBondContact O-N 3.13Å; I721-S725 CarbonylContact O-C 3.25Å; I721-S725 WeakPolarHBondContact O-CA 3.27Å; I721-S725 PolarHBondContact O-N 3.2Å; I721-S726 PolarHBondContact O-N 2.77Å; I721-W727 HydrophobicContact CG2-CD2 4.34Å; I721-W727 HydrophobicContact CG2-CE3 3.57Å; I721-W727 HydrophobicContact CG2-CH2 4.45Å; I721-W727 HydrophobicContact CG2-CZ3 3.64Å; I721-L729 HydrophobicContact CD1-CB 3.96Å; I721-L729 HydrophobicContact CG1-CB 3.68Å; I721-L729 HydrophobicContact CG1-CD1 4.41Å; I721-L730 HydrophobicContact CD1-CD2 4.18Å; I721-L730 HydrophobicContact CD1-CG 4.44Å; I721-Q733 HydrophobicContact CD1-CB 3.97Å; I721-Q733 HydrophobicContact CD1-CG 4.47Å
722	R	91.1	Very high	94.4	Very high	150 Å²	150	75.7 Å²	75.7	57%	0.566	39%	0.394	S	S	*	.	H	α-helix	trans	-65.7	-47.5	-177.4	-66	-178.9	-157.2	-96.4	-11.9	112.5	D718 K719 F724	D718-R722 WeakPolarHBondContact O-CG 3.38Å; D718-R722 PolarHBondContact O-N 3.17Å; D718-R722 IonicContact OD1-CZ 3.71Å; D718-R722 IonicContact OD1-NE 3.65Å; D718-R722 PolarHBondContact OD1-NE 3.4Å; D718-R722 IonicContact OD1-NH2 3.69Å; D718-R722 PolarHBondContact OD1-NH2 2.81Å; D718-R722 IonicContact OD2-CZ 3.72Å; D718-R722 VanDerWaalsContact OD2-CZ 3.32Å; D718-R722 IonicContact OD2-NE 3.43Å; D718-R722 PolarHBondContact OD2-NE 3.24Å; D718-R722 IonicContact OD2-NH2 2.78Å; D718-R722 PolarHBondContact OD2-NH2 3.41Å; D718-R722 VanDerWaalsContact OD2-NH2 3.09Å; K719-R722 PolarHBondContact O-N 3.36Å; R722-F724 VanDerWaalsContact C-N 3.26Å; R722-F724 PolarHBondContact O-N 3.32Å
723	S	94.2	Very high	94.3	Very high	79 Å²	79	73.4 Å²	73.4	55%	0.552	38%	0.375	S	S	*	.	H	α-helix	trans	-65.7	-23.1	-176.9	-65.5	0	0	0	0	114.5	K719	K719-S723 WeakPolarHBondContact O-CB 3.42Å; K719-S723 PolarHBondContact O-N 3.13Å; K719-S723 PolarHBondContact O-OG 3.04Å
724	F	94.2	Very high	94.2	Very high	139 Å²	139	68.6 Å²	68.6	61%	0.61	36%	0.356	S	S	*	.	H	α-helix	trans	-125.5	7.1	-176.1	-63.6	-83.8	0	0	0	114.2	Q720 R722 S726	Q720-F724 VanDerWaalsContact CD-CD2 3.5Å; Q720-F724 HydrophobicContact CG-CD2 4.42Å; Q720-F724 PolarHBondContact O-N 3.38Å; R722-F724 VanDerWaalsContact C-N 3.26Å; R722-F724 PolarHBondContact O-N 3.32Å; F724-S726 PolarHBondContact O-N 3.39Å
725	S	91.4	Very high	94.2	Very high	79 Å²	79	71.1 Å²	71.1	55%	0.552	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	35.4	-170.2	-65.7	0	0	0	0	113.6	I721 W727	I721-S725 CarbonylContact O-C 3.25Å; I721-S725 WeakPolarHBondContact O-CA 3.27Å; I721-S725 PolarHBondContact O-N 3.2Å; S725-W727 VanDerWaalsContact C-N 3.3Å; S725-W727 PolarHBondContact O-N 3.43Å; S725-W727 PolarHBondContact O-NE1 2.93Å
726	S	92.7	Very high	94.2	Very high	35 Å²	35	68.3 Å²	68.3	25%	0.245	35%	0.353	C	S	.	.			trans	-87.5	61.3	-168.7	-163.3	0	0	0	0	112.3	I721 F724 S728 L729	I721-S726 PolarHBondContact O-N 2.77Å; F724-S726 PolarHBondContact O-N 3.39Å; S726-S728 PolarHBondContact O-N 3.49Å; S726-L729 WeakPolarHBondContact O-CB 3.37Å; S726-L729 PolarHBondContact O-N 3.21Å
727	W	92.4	Very high	94.1	Very high	131 Å²	131	63.9 Å²	63.9	50%	0.496	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-59.8	-17.6	-172.1	-54	110.3	0	0	0	115	Y677 I721 S725 L729 L730	Y677-W727 HydrophobicContact CE2-CZ3 4.28Å; I721-W727 HydrophobicContact CG2-CD2 4.34Å; I721-W727 HydrophobicContact CG2-CE3 3.57Å; I721-W727 HydrophobicContact CG2-CH2 4.45Å; I721-W727 HydrophobicContact CG2-CZ3 3.64Å; S725-W727 VanDerWaalsContact C-N 3.3Å; S725-W727 PolarHBondContact O-N 3.43Å; S725-W727 PolarHBondContact O-NE1 2.93Å; W727-L729 PolarHBondContact O-N 2.9Å; W727-L730 HydrophobicContact CB-CD1 4.22Å; W727-L730 HydrophobicContact CE3-CD1 4.1Å; W727-L730 HydrophobicContact CE3-CG 4.43Å; W727-L730 WeakPolarHBondContact O-CB 3.49Å; W727-L730 WeakPolarHBondContact O-CD1 3.43Å; W727-L730 VanDerWaalsContact O-CG 3.25Å; W727-L730 WeakPolarHBondContact O-CG 3.36Å; W727-L730 PolarHBondContact O-N 3.46Å; W727-L730 VanDerWaalsContact O-N 3.16Å
728	S	93.8	Very high	94	Very high	95 Å²	95	63.2 Å²	63.2	66%	0.664	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-61.1	-23.1	172.2	53.2	0	0	0	0	113.4	S726 L730	S726-S728 PolarHBondContact O-N 3.49Å; S728-L730 VanDerWaalsContact C-N 3.29Å; S728-L730 PolarHBondContact O-N 2.78Å
729	L	94.7	Very high	93.9	Very high	48 Å²	48	62.2 Å²	62.2	25%	0.251	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-79.1	-5.1	177.5	-60.9	174.9	0	0	0	113.7	V717 Q720 I721 S726 W727 N731 L732 Q733	V717-L729 HydrophobicContact CG1-CB 4.02Å; Q720-L729 HydrophobicContact CB-CD1 4.38Å; Q720-L729 HydrophobicContact CG-CD1 3.87Å; I721-L729 HydrophobicContact CD1-CB 3.96Å; I721-L729 HydrophobicContact CG1-CB 3.68Å; I721-L729 HydrophobicContact CG1-CD1 4.41Å; S726-L729 WeakPolarHBondContact O-CB 3.37Å; S726-L729 PolarHBondContact O-N 3.21Å; W727-L729 PolarHBondContact O-N 2.9Å; L729-N731 PolarHBondContact O-N 3.07Å; L729-L732 HydrophobicContact CD2-CD2 4.36Å; L729-L732 WeakPolarHBondContact O-CA 3.35Å; L729-L732 WeakPolarHBondContact O-CB 3.41Å; L729-L732 PolarHBondContact O-N 3Å; L729-Q733 PolarHBondContact O-N 2.84Å
730	L	94.3	Very high	93.9	Very high	25 Å²	25	57.6 Å²	57.6	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-56	-35.5	179.2	-75.4	168.5	0	0	0	112.8	F673 F674 Y677 I721 W727 S728 L732 Q733 A734	F673-L730 HydrophobicContact CE1-CB 4.38Å; F673-L730 HydrophobicContact CE1-CD2 4.31Å; F673-L730 WeakPolarHBondContact CE1-O 3.33Å; F673-L730 HydrophobicContact CZ-CD2 4.13Å; F674-L730 HydrophobicContact CE1-CB 3.86Å; F674-L730 HydrophobicContact CE1-CD1 4.21Å; F674-L730 HydrophobicContact CZ-CB 3.98Å; Y677-L730 HydrophobicContact CD2-CD2 3.9Å; Y677-L730 HydrophobicContact CE2-CD2 4.49Å; Y677-L730 HydrophobicContact CG-CD2 4.3Å; I721-L730 HydrophobicContact CD1-CD2 4.18Å; I721-L730 HydrophobicContact CD1-CG 4.44Å; W727-L730 HydrophobicContact CB-CD1 4.22Å; W727-L730 HydrophobicContact CE3-CD1 4.1Å; W727-L730 HydrophobicContact CE3-CG 4.43Å; W727-L730 WeakPolarHBondContact O-CB 3.49Å; W727-L730 WeakPolarHBondContact O-CD1 3.43Å; W727-L730 VanDerWaalsContact O-CG 3.25Å; W727-L730 WeakPolarHBondContact O-CG 3.36Å; W727-L730 PolarHBondContact O-N 3.46Å; W727-L730 VanDerWaalsContact O-N 3.16Å; S728-L730 VanDerWaalsContact C-N 3.29Å; S728-L730 PolarHBondContact O-N 2.78Å; L730-L732 VanDerWaalsContact C-N 3.33Å; L730-L732 PolarHBondContact O-N 3.18Å; L730-Q733 WeakPolarHBondContact O-CB 3.48Å; L730-Q733 PolarHBondContact O-N 3.24Å; L730-A734 WeakPolarHBondContact O-CB 3.38Å; L730-A734 PolarHBondContact O-N 3.43Å
731	N	94	Very high	93.8	Very high	104 Å²	104	53.5 Å²	53.5	56%	0.556	28%	0.28	S	S	*	.	H	α-helix	trans	-66.2	-33.5	175.4	-70.7	-19.7	0	0	0	112.9	F674 L729 T735	F674-N731 WeakPolarHBondContact CE2-OD1 3.07Å; F674-N731 VanDerWaalsContact CZ-OD1 3.3Å; F674-N731 WeakPolarHBondContact CZ-OD1 3.44Å; L729-N731 PolarHBondContact O-N 3.07Å; N731-T735 PolarHBondContact O-N 3.27Å; N731-T735 VanDerWaalsContact O-N 3.16Å; N731-T735 PolarHBondContact O-OG1 3Å
732	L	94.9	Very high	93.6	Very high	69 Å²	69	53.4 Å²	53.4	36%	0.361	28%	0.28	S	S	.	.	H	α-helix	trans	-73.4	-41.1	174.6	-172.3	66.9	0	0	0	110.5	V717 L729 L730 T735 F736	V717-L732 HydrophobicContact CG1-CB 4.5Å; V717-L732 HydrophobicContact CG1-CD2 4.48Å; V717-L732 HydrophobicContact CG2-CD2 3.96Å; V717-L732 HydrophobicContact CG2-CG 4.31Å; L729-L732 HydrophobicContact CD2-CD2 4.36Å; L729-L732 WeakPolarHBondContact O-CA 3.35Å; L729-L732 WeakPolarHBondContact O-CB 3.41Å; L729-L732 PolarHBondContact O-N 3Å; L730-L732 VanDerWaalsContact C-N 3.33Å; L730-L732 PolarHBondContact O-N 3.18Å; L732-T735 PolarHBondContact O-N 3.5Å; L732-F736 HydrophobicContact CD1-CD2 4.26Å; L732-F736 HydrophobicContact CD1-CE1 4.07Å; L732-F736 HydrophobicContact CD1-CE2 3.67Å; L732-F736 HydrophobicContact CD1-CZ 3.56Å; L732-F736 HydrophobicContact CD2-CE2 4.12Å; L732-F736 HydrophobicContact CG-CD2 4.06Å; L732-F736 HydrophobicContact CG-CE2 3.74Å; L732-F736 HydrophobicContact CG-CZ 4.19Å; L732-F736 PolarHBondContact O-N 3Å
733	Q	95.3	Very high	93.5	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.019	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-45.9	172.9	-171.1	-177.1	6.7	0	0	111.4	F673 V717 D718 I721 L729 L730 T735 F736 S737	F673-Q733 HydrophobicContact CE2-CB 4.46Å; F673-Q733 HydrophobicContact CE2-CG 4.01Å; F673-Q733 HydrophobicContact CZ-CB 4.1Å; F673-Q733 HydrophobicContact CZ-CG 4.03Å; V717-Q733 HydrophobicContact CG1-CB 3.93Å; D718-Q733 PolarHBondContact OD1-NE2 3.35Å; I721-Q733 HydrophobicContact CD1-CB 3.97Å; I721-Q733 HydrophobicContact CD1-CG 4.47Å; L729-Q733 PolarHBondContact O-N 2.84Å; L730-Q733 WeakPolarHBondContact O-CB 3.48Å; L730-Q733 PolarHBondContact O-N 3.24Å; Q733-T735 VanDerWaalsContact C-N 3.31Å; Q733-T735 PolarHBondContact O-N 3.15Å; Q733-F736 PolarHBondContact O-N 3.16Å; Q733-S737 VanDerWaalsContact O-CB 3.24Å; Q733-S737 WeakPolarHBondContact O-CB 3.37Å; Q733-S737 PolarHBondContact O-N 3.27Å; Q733-S737 PolarHBondContact O-OG 3.04Å
734	A	94.9	Very high	93.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-55.6	-48.5	174.3	0	0	0	0	0	110.9	F673 L730 F736 T738 V739	F673-A734 HydrophobicContact CB-CB 3.93Å; F673-A734 HydrophobicContact CD1-CB 3.45Å; F673-A734 VanDerWaalsContact CD1-CB 3.45Å; F673-A734 HydrophobicContact CD2-CB 4.12Å; F673-A734 HydrophobicContact CE1-CB 3.85Å; F673-A734 HydrophobicContact CE2-CB 4.46Å; F673-A734 HydrophobicContact CG-CB 3.59Å; F673-A734 HydrophobicContact CZ-CB 4.32Å; L730-A734 WeakPolarHBondContact O-CB 3.38Å; L730-A734 PolarHBondContact O-N 3.43Å; A734-F736 PolarHBondContact O-N 3.13Å; A734-T738 PolarHBondContact O-N 3.37Å; A734-T738 PolarHBondContact O-OG1 3.13Å; A734-V739 PolarHBondContact O-N 3.44Å
735	T	94.7	Very high	93.1	Very high	55 Å²	55	42.5 Å²	42.5	34%	0.337	23%	0.23	S	C	.	.	I	π-helix	trans	-60.4	-47.8	-178.1	-59.8	0	0	0	0	112.1	N731 L732 Q733 I740	N731-T735 PolarHBondContact O-N 3.27Å; N731-T735 VanDerWaalsContact O-N 3.16Å; N731-T735 PolarHBondContact O-OG1 3Å; L732-T735 PolarHBondContact O-N 3.5Å; Q733-T735 VanDerWaalsContact C-N 3.31Å; Q733-T735 PolarHBondContact O-N 3.15Å; T735-I740 HydrophobicContact CG2-CD1 3.81Å; T735-I740 HydrophobicContact CG2-CG1 4.2Å; T735-I740 WeakPolarHBondContact O-CB 3.44Å; T735-I740 WeakPolarHBondContact O-CG1 3.24Å; T735-I740 PolarHBondContact O-N 3.05Å
736	F	95.8	Very high	92.8	Very high	49 Å²	49	40.7 Å²	40.7	22%	0.215	21%	0.212	C	C	.	.	I	π-helix	trans	-80.4	-36.6	-177.7	-66.6	-17.2	0	0	0	114.2	F710 V717 L732 Q733 A734 I740 P741	F710-F736 CarbonylContact C-O 3.26Å; F710-F736 VanDerWaalsContact C-O 3.25Å; F710-F736 AromaticContact CD1-CD1 3.91Å; F710-F736 HydrophobicContact CD1-CD1 3.91Å; F710-F736 HydrophobicContact CD1-CE1 4.42Å; F710-F736 HydrophobicContact CE1-CD1 4.24Å; F710-F736 HydrophobicContact CE1-CE1 4.32Å; F710-F736 VanDerWaalsContact O-O 3.09Å; V717-F736 HydrophobicContact CG2-CD2 4.08Å; V717-F736 HydrophobicContact CG2-CE2 4.32Å; L732-F736 HydrophobicContact CD1-CD2 4.26Å; L732-F736 HydrophobicContact CD1-CE1 4.07Å; L732-F736 HydrophobicContact CD1-CE2 3.67Å; L732-F736 HydrophobicContact CD1-CZ 3.56Å; L732-F736 HydrophobicContact CD2-CE2 4.12Å; L732-F736 HydrophobicContact CG-CD2 4.06Å; L732-F736 HydrophobicContact CG-CE2 3.74Å; L732-F736 HydrophobicContact CG-CZ 4.19Å; L732-F736 PolarHBondContact O-N 3Å; Q733-F736 PolarHBondContact O-N 3.16Å; A734-F736 PolarHBondContact O-N 3.13Å; F736-I740 HydrophobicContact CD1-CD1 4.33Å; F736-P741 WeakPolarHBondContact O-CD 3.43Å; F736-P741 WeakPolarHBondContact O-CG 3.35Å
737	S	94.3	Very high	92.4	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.028	21%	0.209	C	C	.	.	I	π-helix	trans	-91.9	-23.5	-174.3	70.8	0	0	0	0	114.6	V684 Q733	V684-S737 WeakPolarHBondContact CG1-O 3.19Å; Q733-S737 VanDerWaalsContact O-CB 3.24Å; Q733-S737 WeakPolarHBondContact O-CB 3.37Å; Q733-S737 PolarHBondContact O-N 3.27Å; Q733-S737 PolarHBondContact O-OG 3.04Å
738	T	92.9	Very high	91.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-124.6	-57	-179.8	71.8	0	0	0	0	112.8	F673 V680 P681 V684 A734 T742	F673-T738 HydrophobicContact CB-CG2 4.12Å; F673-T738 HydrophobicContact CD2-CG2 3.81Å; F673-T738 HydrophobicContact CG-CG2 4.44Å; V680-T738 HydrophobicContact CG1-CG2 3.82Å; P681-T738 HydrophobicContact CG-CG2 4.49Å; V684-T738 HydrophobicContact CG2-CG2 4.13Å; A734-T738 PolarHBondContact O-N 3.37Å; A734-T738 PolarHBondContact O-OG1 3.13Å; T738-T742 VanDerWaalsContact O-CB 3.24Å; T738-T742 WeakPolarHBondContact O-CB 3.37Å; T738-T742 WeakPolarHBondContact O-CG2 3.47Å; T738-T742 PolarHBondContact O-N 3.17Å; T738-T742 PolarHBondContact O-OG1 3.15Å
739	V	93	Very high	91.3	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.042	19%	0.186	C	C	.	.	I	π-helix	trans	-65.8	-51.8	-166	-175.6	0	0	0	0	112.1	L666 R669 A670 A734 T742 E743	L666-V739 HydrophobicContact CD1-CG1 3.63Å; L666-V739 HydrophobicContact CG-CG1 4.5Å; R669-V739 HydrophobicContact CB-CG1 4.4Å; R669-V739 HydrophobicContact CB-CG2 4.26Å; A670-V739 HydrophobicContact CB-CG2 4.42Å; A734-V739 PolarHBondContact O-N 3.44Å; V739-T742 PolarHBondContact O-OG1 3.47Å; V739-E743 PolarHBondContact O-N 2.93Å
740	I	93	Very high	90.5	Very high	48 Å²	48	41.3 Å²	41.3	25%	0.246	20%	0.202	C	C	.	.	H	α-helix	trans	-68.7	-50.2	179.6	-64.3	172.2	0	0	0	111.8	F710 T735 F736 T742 E743 L744	F710-I740 HydrophobicContact CB-CG2 4.33Å; F710-I740 HydrophobicContact CD1-CB 4.49Å; F710-I740 HydrophobicContact CD1-CD1 4.04Å; F710-I740 HydrophobicContact CD1-CG2 4.12Å; F710-I740 HydrophobicContact CD2-CG2 3.45Å; F710-I740 VanDerWaalsContact CD2-CG2 3.45Å; F710-I740 HydrophobicContact CE1-CD1 3.81Å; F710-I740 HydrophobicContact CE1-CG2 4.31Å; F710-I740 HydrophobicContact CE2-CG2 3.67Å; F710-I740 HydrophobicContact CG-CB 4.32Å; F710-I740 HydrophobicContact CG-CG2 3.7Å; F710-I740 HydrophobicContact CZ-CD1 4.24Å; F710-I740 HydrophobicContact CZ-CG2 4.09Å; T735-I740 HydrophobicContact CG2-CD1 3.81Å; T735-I740 HydrophobicContact CG2-CG1 4.2Å; T735-I740 WeakPolarHBondContact O-CB 3.44Å; T735-I740 WeakPolarHBondContact O-CG1 3.24Å; T735-I740 PolarHBondContact O-N 3.05Å; F736-I740 HydrophobicContact CD1-CD1 4.33Å; I740-T742 VanDerWaalsContact C-N 3.26Å; I740-T742 PolarHBondContact O-N 2.86Å; I740-E743 PolarHBondContact O-N 3.32Å; I740-L744 HydrophobicContact CG2-CD1 3.69Å; I740-L744 HydrophobicContact CG2-CG 4.16Å; I740-L744 WeakPolarHBondContact O-CG 3.23Å; I740-L744 PolarHBondContact O-N 3.44Å
741	P	93.3	Very high	89.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-32.8	178.7	-26.6	35.5	0	0	0	114.2	V684 A707 F710 I711 F736 M745	V684-P741 HydrophobicContact CG1-CB 4.12Å; A707-P741 HydrophobicContact CB-CB 4.18Å; F710-P741 HydrophobicContact CB-CG 4.02Å; I711-P741 HydrophobicContact CD1-CB 4.13Å; I711-P741 HydrophobicContact CD1-CG 4.41Å; I711-P741 HydrophobicContact CG1-CB 3.99Å; I711-P741 HydrophobicContact CG1-CG 3.72Å; F736-P741 WeakPolarHBondContact O-CD 3.43Å; F736-P741 WeakPolarHBondContact O-CG 3.35Å; P741-M745 VanDerWaalsContact O-CB 3.26Å; P741-M745 WeakPolarHBondContact O-CB 3.46Å; P741-M745 WeakPolarHBondContact O-CG 3.43Å; P741-M745 PolarHBondContact O-N 3.26Å; P741-M745 VanDerWaalsContact O-N 3.08Å
742	T	91.3	Very high	89.1	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-79.9	-29.7	-179.2	59.4	0	0	0	0	113	L654 F655 V684 T738 V739 I740 M745 K746	L654-T742 HydrophobicContact CB-CG2 3.74Å; L654-T742 HydrophobicContact CD1-CG2 4.3Å; F655-T742 HydrophobicContact CD1-CG2 3.94Å; F655-T742 HydrophobicContact CE1-CG2 3.67Å; F655-T742 HydrophobicContact CE2-CG2 4.46Å; F655-T742 HydrophobicContact CG-CG2 4.46Å; F655-T742 HydrophobicContact CZ-CG2 3.96Å; V684-T742 HydrophobicContact CG1-CG2 3.94Å; V684-T742 HydrophobicContact CG2-CG2 3.83Å; T738-T742 VanDerWaalsContact O-CB 3.24Å; T738-T742 WeakPolarHBondContact O-CB 3.37Å; T738-T742 WeakPolarHBondContact O-CG2 3.47Å; T738-T742 PolarHBondContact O-N 3.17Å; T738-T742 PolarHBondContact O-OG1 3.15Å; V739-T742 PolarHBondContact O-OG1 3.47Å; I740-T742 VanDerWaalsContact C-N 3.26Å; I740-T742 PolarHBondContact O-N 2.86Å; T742-M745 CarbonylContact O-C 3.55Å; T742-K746 WeakPolarHBondContact O-CA 3.48Å; T742-K746 WeakPolarHBondContact O-CB 3.32Å; T742-K746 PolarHBondContact O-N 3.37Å
743	E	89.2	Confident	88.6	Confident	96 Å²	96	43.4 Å²	43.4	45%	0.449	22%	0.219	S	C	.	.	H	α-helix	trans	-74.5	-42	170.9	-169.2	68.2	168.9	0	0	111.9	R669 V739 I740 M745 K746	R669-E743 IonicContact CZ-OE2 2.64Å; R669-E743 IonicContact NH1-OE2 2.82Å; R669-E743 PolarHBondContact NH1-OE2 3.32Å; R669-E743 IonicContact NH2-OE1 2.64Å; R669-E743 IonicContact NH2-OE2 3.83Å; R669-E743 PolarHBondContact NH2-OE2 2.96Å; V739-E743 PolarHBondContact O-N 2.93Å; I740-E743 PolarHBondContact O-N 3.32Å; E743-M745 PolarHBondContact O-N 3.08Å; E743-K746 WeakPolarHBondContact O-CB 3.2Å; E743-K746 PolarHBondContact O-N 3.18Å; E743-K746 WeakPolarHBondContact OE2-CD 3.43Å
744	L	89.7	Confident	88.1	Confident	44 Å²	44	44.7 Å²	44.7	23%	0.23	23%	0.228	C	C	.	.	H	α-helix	trans	-59.7	-33.7	172.8	-70.7	172.7	0	0	0	112.3	T693 E706 A707 F710 I740	T693-L744 WeakPolarHBondContact CG2-O 3.49Å; E706-L744 HydrophobicContact CB-CD1 4Å; E706-L744 HydrophobicContact CG-CD1 3.65Å; E706-L744 HydrophobicContact CG-CD2 4.48Å; A707-L744 HydrophobicContact CB-CB 4.35Å; A707-L744 HydrophobicContact CB-CD1 4.31Å; F710-L744 HydrophobicContact CD2-CD1 4.01Å; F710-L744 HydrophobicContact CE2-CD1 4.4Å; I740-L744 HydrophobicContact CG2-CD1 3.69Å; I740-L744 HydrophobicContact CG2-CG 4.16Å; I740-L744 WeakPolarHBondContact O-CG 3.23Å; I740-L744 PolarHBondContact O-N 3.44Å
745	M	88.6	Confident	87.8	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	18.8	180	-63.4	-56	-50.5	0	0	114.2	F655 Y688 C691 T693 A703 L704 A707 P741 T742 E743 G747	F655-M745 HydrophobicContact CD1-CB 4.28Å; F655-M745 HydrophobicContact CE1-CB 4.06Å; Y688-M745 HydrophobicContact CD2-CG 4.1Å; C691-M745 HydrophobicContact CB-CB 4.1Å; C691-M745 HydrophobicContact CB-CE 3.92Å; C691-M745 VanDerWaalsContact CB-O 3.27Å; C691-M745 WeakPolarHBondContact CB-O 3.36Å; T693-M745 VanDerWaalsContact CG2-C 3.4Å; T693-M745 HydrophobicContact CG2-CE 4.16Å; A703-M745 HydrophobicContact CB-SD 4.09Å; L704-M745 HydrophobicContact CD2-CE 3.47Å; L704-M745 VanDerWaalsContact CD2-CE 3.47Å; L704-M745 HydrophobicContact CD2-SD 3.74Å; L704-M745 HydrophobicContact CG-CE 3.83Å; L704-M745 HydrophobicContact CG-SD 3.9Å; A707-M745 HydrophobicContact CB-CG 3.81Å; A707-M745 HydrophobicContact CB-SD 4.47Å; P741-M745 VanDerWaalsContact O-CB 3.26Å; P741-M745 WeakPolarHBondContact O-CB 3.46Å; P741-M745 WeakPolarHBondContact O-CG 3.43Å; P741-M745 PolarHBondContact O-N 3.26Å; P741-M745 VanDerWaalsContact O-N 3.08Å; T742-M745 CarbonylContact O-C 3.55Å; E743-M745 PolarHBondContact O-N 3.08Å; M745-G747 PolarHBondContact O-N 3.11Å
746	K	86.4	Confident	87.5	Confident	41 Å²	41	47.5 Å²	47.5	18%	0.178	24%	0.236	C	C	.	.			trans	-68.7	128.1	-176	-155.6	-159.8	-162.3	-162.8	0	112.3	D657 T693 T742 E743	D657-K746 HydrophobicContact CB-CD 4.2Å; D657-K746 HydrophobicContact CB-CG 4.23Å; D657-K746 WeakPolarHBondContact OD1-CD 3.45Å; D657-K746 WeakPolarHBondContact OD1-CE 3.34Å; D657-K746 IonicContact OD1-NZ 3.54Å; D657-K746 PolarHBondContact OD1-NZ 2.88Å; T693-K746 WeakPolarHBondContact CG2-O 3.37Å; T742-K746 WeakPolarHBondContact O-CA 3.48Å; T742-K746 WeakPolarHBondContact O-CB 3.32Å; T742-K746 PolarHBondContact O-N 3.37Å; E743-K746 WeakPolarHBondContact O-CB 3.2Å; E743-K746 PolarHBondContact O-N 3.18Å; E743-K746 WeakPolarHBondContact OE2-CD 3.43Å
747	G	83.7	Confident	87.1	Confident	18 Å²	18	46.9 Å²	46.9	19%	0.186	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	162.1	-126.1	179.1	0	0	0	0	0	113.5	F655 D657 M745	F655-G747 PolarHBondContact O-N 3.32Å; D657-G747 PolarHBondContact N-O 2.85Å; M745-G747 PolarHBondContact O-N 3.11Å
748	Y	82.7	Confident	86.8	Confident	159 Å²	159	52.2 Å²	52.2	62%	0.624	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.8	-178.5	-176.5	-93.9	0	0	0	112.4	V692 K750	V692-Y748 WeakPolarHBondContact CB-O 3.44Å; V692-Y748 PolarHBondContact N-O 3.4Å; V692-Y748 PolarHBondContact O-N 3Å; Y748-K750 PolarHBondContact O-N 3Å
749	L	81.6	Confident	86.1	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.058	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.6	173.1	-174.9	74.6	0	0	0	111.3	N687 H690 C691 G751 I753	N687-L749 HydrophobicContact CB-CD1 4.43Å; H690-L749 HydrophobicContact CB-CD1 3.85Å; C691-L749 VanDerWaalsContact SG-CD1 3.56Å; L749-G751 VanDerWaalsContact C-N 3.35Å; L749-G751 PolarHBondContact O-N 3.3Å; L749-I753 HydrophobicContact CD2-CD1 4.13Å; L749-I753 HydrophobicContact CD2-CG1 3.34Å
750	K	78	Confident	85.4	Confident	133 Å²	133	57.2 Å²	57.2	58%	0.578	30%	0.296	S	S	*	.			trans	-73.3	81.6	174	-79.8	167.9	165.2	168	0	112	H690 V692 Y748	H690-K750 WeakPolarHBondContact O-CB 3.46Å; H690-K750 PolarHBondContact O-N 3.22Å; V692-K750 HydrophobicContact CG2-CD 3.54Å; V692-K750 HydrophobicContact CG2-CG 3.66Å; Y748-K750 PolarHBondContact O-N 3Å
751	G	76.1	Confident	85	Confident	47 Å²	47	61.2 Å²	61.2	49%	0.485	31%	0.312	S	S	.	.	S	Bend	trans	124.5	-141.9	162.5	0	0	0	0	0	114.8	L749	L749-G751 VanDerWaalsContact C-N 3.35Å; L749-G751 PolarHBondContact O-N 3.3Å
752	Q	81.4	Confident	84.5	Confident	180 Å²	180	64.9 Å²	64.9	84%	0.841	33%	0.331	S	S	*	.	S	Bend	trans	-97.4	152.2	169.4	-61.5	-170.9	-85.6	0	0	109.1	S754	Q752-S754 PolarHBondContact O-N 3.49Å
753	I	84.5	Confident	83.6	Confident	15 Å²	15	65.6 Å²	65.6	8%	0.077	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-67.8	122.6	177.9	-72.9	164.9	0	0	0	108.8	F648 T651 R652 F683 N687 L749	F648-I753 HydrophobicContact CD1-CB 4.15Å; F648-I753 HydrophobicContact CD1-CG2 3.8Å; F648-I753 HydrophobicContact CE1-CG2 4.33Å; F648-I753 WeakPolarHBondContact O-CD1 3.16Å; T651-I753 HydrophobicContact CG2-CD1 4.18Å; T651-I753 HydrophobicContact CG2-CG2 4.22Å; R652-I753 HydrophobicContact CB-CD1 3.68Å; F683-I753 HydrophobicContact CD1-CG2 3.72Å; F683-I753 HydrophobicContact CE1-CG2 3.92Å; N687-I753 WeakPolarHBondContact OD1-CA 3.32Å; L749-I753 HydrophobicContact CD2-CD1 4.13Å; L749-I753 HydrophobicContact CD2-CG1 3.34Å
754	S	85.9	Confident	83.2	Confident	32 Å²	32	66 Å²	66	22%	0.224	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-73	142.3	172.8	33	0	0	0	0	110	E686 N687 Q752	E686-S754 WeakPolarHBondContact CG-OG 3.44Å; N687-S754 PolarHBondContact ND2-O 2.97Å; N687-S754 PolarHBondContact OD1-N 3.42Å; N687-S754 PolarHBondContact OD1-OG 2.91Å; N687-S754 VanDerWaalsContact OD1-OG 3.14Å; Q752-S754 PolarHBondContact O-N 3.49Å
755	F	87.6	Confident	82.9	Confident	111 Å²	111	68.1 Å²	68.1	49%	0.487	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-75.6	140.5	165.8	-178.4	-86.9	0	0	0	108.8	F648 F683 A757 F759	F648-F755 HydrophobicContact CZ-CB 4.43Å; F648-F755 HydrophobicContact CZ-CD2 4.2Å; F683-F755 HydrophobicContact CE2-CD2 4.12Å; F683-F755 HydrophobicContact CE2-CE2 4.21Å; F683-F755 AromaticContact CZ-CD2 3.65Å; F683-F755 HydrophobicContact CZ-CD2 3.65Å; F683-F755 HydrophobicContact CZ-CE2 4.16Å; F683-F755 HydrophobicContact CZ-CG 4.46Å; F755-A757 PolarHBondContact O-N 2.91Å; F755-F759 AromaticContact CE1-CD2 3.8Å; F755-F759 HydrophobicContact CE1-CD2 3.8Å; F755-F759 HydrophobicContact CE1-CE2 4.43Å; F755-F759 HydrophobicContact CZ-CD2 4.02Å; F755-F759 HydrophobicContact CZ-CE2 4.26Å
756	P	87.7	Confident	82.4	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.013	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-55.6	121	-175.6	-27.5	35.8	0	0	0	113.5	L682 F683 W758 F759	L682-P756 VanDerWaalsContact C-CG 3.49Å; L682-P756 HydrophobicContact CB-CB 3.87Å; L682-P756 HydrophobicContact CB-CG 3.71Å; F683-P756 HydrophobicContact CD2-CG 3.75Å; F683-P756 HydrophobicContact CE2-CG 4.11Å; F683-P756 HydrophobicContact CG-CG 4.02Å; P756-W758 PolarHBondContact O-N 3.45Å; P756-F759 HydrophobicContact CB-CD2 4.23Å; P756-F759 HydrophobicContact CB-CE2 4.27Å
757	A	88.1	Confident	82.4	Confident	36 Å²	36	71.1 Å²	71.1	30%	0.298	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.1	176.2	0	0	0	0	0	112.2	E686 F755 F759 G760 K761	E686-A757 WeakPolarHBondContact OE2-CB 3.19Å; E686-A757 PolarHBondContact OE2-N 3.17Å; F755-A757 PolarHBondContact O-N 2.91Å; A757-F759 PolarHBondContact O-N 2.95Å; A757-G760 PolarHBondContact O-N 3Å; A757-K761 HydrophobicContact CB-CD 4.47Å; A757-K761 WeakPolarHBondContact O-CG 3.49Å; A757-K761 PolarHBondContact O-N 3.28Å
758	W	88.4	Confident	82.4	Confident	117 Å²	117	71.7 Å²	71.7	44%	0.443	37%	0.37	S	S	.	.	H	α-helix	trans	-50.5	-49.7	178.2	-175	92.9	0	0	0	112.5	L682 P756 G760 K761 N762	L682-W758 HydrophobicContact CD1-CE3 4.26Å; L682-W758 HydrophobicContact CD2-CB 4.38Å; L682-W758 HydrophobicContact CD2-CD2 4.33Å; L682-W758 HydrophobicContact CD2-CG 4.18Å; P756-W758 PolarHBondContact O-N 3.45Å; W758-G760 PolarHBondContact O-N 3.39Å; W758-K761 WeakPolarHBondContact O-CB 3.49Å; W758-K761 PolarHBondContact O-N 3.37Å; W758-K761 VanDerWaalsContact O-N 3.13Å; W758-N762 HydrophobicContact CE3-CB 4.42Å; W758-N762 HydrophobicContact CH2-CB 4.3Å; W758-N762 HydrophobicContact CZ2-CB 4.4Å; W758-N762 HydrophobicContact CZ3-CB 4.32Å; W758-N762 WeakPolarHBondContact O-CB 3.35Å; W758-N762 PolarHBondContact O-N 2.83Å
759	F	78.5	Confident	82.6	Confident	60 Å²	60	69 Å²	69	26%	0.263	36%	0.362	S	S	.	.	H	α-helix	trans	-55.8	-50.2	180	-66.9	-76.4	0	0	0	113.1	L679 L682 F755 P756 A757 K761 N762 S763	L679-F759 HydrophobicContact CD2-CE1 4.5Å; L679-F759 HydrophobicContact CD2-CE2 3.8Å; L679-F759 HydrophobicContact CD2-CZ 3.41Å; L679-F759 VanDerWaalsContact CD2-CZ 3.41Å; L682-F759 HydrophobicContact CD1-CE1 4.3Å; L682-F759 HydrophobicContact CD1-CE2 3.58Å; L682-F759 HydrophobicContact CD1-CZ 3.39Å; F755-F759 AromaticContact CE1-CD2 3.8Å; F755-F759 HydrophobicContact CE1-CD2 3.8Å; F755-F759 HydrophobicContact CE1-CE2 4.43Å; F755-F759 HydrophobicContact CZ-CD2 4.02Å; F755-F759 HydrophobicContact CZ-CE2 4.26Å; P756-F759 HydrophobicContact CB-CD2 4.23Å; P756-F759 HydrophobicContact CB-CE2 4.27Å; A757-F759 PolarHBondContact O-N 2.95Å; F759-K761 VanDerWaalsContact C-N 3.3Å; F759-K761 PolarHBondContact O-N 3.41Å; F759-N762 PolarHBondContact O-N 2.91Å; F759-S763 PolarHBondContact O-N 2.98Å
760	G	76.8	Confident	82.6	Confident	52 Å²	52	73.8 Å²	73.8	54%	0.536	38%	0.379	S	S	.	.	H	α-helix	trans	-68.5	-27.8	179.7	0	0	0	0	0	113.5	A757 W758 K764	A757-G760 PolarHBondContact O-N 3Å; W758-G760 PolarHBondContact O-N 3.39Å; G760-K764 WeakPolarHBondContact O-CB 3.24Å; G760-K764 PolarHBondContact O-N 3.11Å
761	K	86.1	Confident	82.9	Confident	132 Å²	132	69.1 Å²	69.1	57%	0.574	36%	0.359	S	S	*	.	H	α-helix	trans	-71.8	-45.9	170.6	-69.7	167.3	-177	168.9	0	110.6	A757 W758 F759 K764 T765	A757-K761 HydrophobicContact CB-CD 4.47Å; A757-K761 WeakPolarHBondContact O-CG 3.49Å; A757-K761 PolarHBondContact O-N 3.28Å; W758-K761 WeakPolarHBondContact O-CB 3.49Å; W758-K761 PolarHBondContact O-N 3.37Å; W758-K761 VanDerWaalsContact O-N 3.13Å; F759-K761 VanDerWaalsContact C-N 3.3Å; F759-K761 PolarHBondContact O-N 3.41Å; K761-K764 WeakPolarHBondContact O-CB 3.39Å; K761-K764 PolarHBondContact O-N 2.96Å; K761-T765 PolarHBondContact O-N 2.89Å; K761-T765 PolarHBondContact O-OG1 3.16Å; K761-T765 VanDerWaalsContact O-OG1 3.11Å
762	N	81.9	Confident	83.6	Confident	77 Å²	77	67.5 Å²	67.5	41%	0.412	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-48.9	-176.4	-163	45	0	0	0	112.4	W758 F759 K764 T765 G766	W758-N762 HydrophobicContact CE3-CB 4.42Å; W758-N762 HydrophobicContact CH2-CB 4.3Å; W758-N762 HydrophobicContact CZ2-CB 4.4Å; W758-N762 HydrophobicContact CZ3-CB 4.32Å; W758-N762 WeakPolarHBondContact O-CB 3.35Å; W758-N762 PolarHBondContact O-N 2.83Å; F759-N762 PolarHBondContact O-N 2.91Å; N762-K764 VanDerWaalsContact C-N 3.32Å; N762-K764 PolarHBondContact O-N 3.33Å; N762-T765 WeakPolarHBondContact O-CB 3.32Å; N762-T765 PolarHBondContact O-N 3.37Å; N762-T765 VanDerWaalsContact O-N 3.16Å; N762-G766 PolarHBondContact O-N 3.19Å
763	S	72.7	Confident	83.8	Confident	15 Å²	15	63 Å²	63	11%	0.105	32%	0.318	C	S	.	.	H	α-helix	trans	-59.9	-40.6	172.2	158.8	0	0	0	0	111.7	F759 T765 G766 R767 D911	F759-S763 PolarHBondContact O-N 2.98Å; S763-T765 VanDerWaalsContact C-N 3.33Å; S763-T765 PolarHBondContact O-N 3.33Å; S763-G766 PolarHBondContact O-N 3.22Å; S763-R767 WeakPolarHBondContact O-CB 3.39Å; S763-R767 PolarHBondContact O-N 3.17Å; S763-D911 PolarHBondContact OG-OD1 3.41Å; S763-D911 VanDerWaalsContact OG-OD1 3.13Å
764	K	80.4	Confident	83.8	Confident	103 Å²	103	67.6 Å²	67.6	45%	0.448	34%	0.339	S	S	.	.	H	α-helix	trans	-60.3	-43.4	175.4	-168.7	-172	178	-159.6	0	111.3	G760 K761 N762 L768	G760-K764 WeakPolarHBondContact O-CB 3.24Å; G760-K764 PolarHBondContact O-N 3.11Å; K761-K764 WeakPolarHBondContact O-CB 3.39Å; K761-K764 PolarHBondContact O-N 2.96Å; N762-K764 VanDerWaalsContact C-N 3.32Å; N762-K764 PolarHBondContact O-N 3.33Å; K764-L768 HydrophobicContact CD-CD1 4.46Å; K764-L768 HydrophobicContact CG-CD1 4.2Å; K764-L768 HydrophobicContact CG-CG 4.4Å; K764-L768 WeakPolarHBondContact O-CB 3.28Å; K764-L768 WeakPolarHBondContact O-CG 3.48Å; K764-L768 PolarHBondContact O-N 2.77Å
765	T	83.3	Confident	83.9	Confident	90 Å²	90	66 Å²	66	55%	0.552	33%	0.329	S	S	*	.	H	α-helix	trans	-61	-52.7	176.1	-57.9	0	0	0	0	111.2	K761 N762 S763 R767 L768 F769	K761-T765 PolarHBondContact O-N 2.89Å; K761-T765 PolarHBondContact O-OG1 3.16Å; K761-T765 VanDerWaalsContact O-OG1 3.11Å; N762-T765 WeakPolarHBondContact O-CB 3.32Å; N762-T765 PolarHBondContact O-N 3.37Å; N762-T765 VanDerWaalsContact O-N 3.16Å; S763-T765 VanDerWaalsContact C-N 3.33Å; S763-T765 PolarHBondContact O-N 3.33Å; T765-R767 VanDerWaalsContact C-N 3.32Å; T765-R767 PolarHBondContact O-N 3.22Å; T765-L768 PolarHBondContact O-N 3.11Å; T765-F769 WeakPolarHBondContact O-CB 3.45Å; T765-F769 PolarHBondContact O-N 3.25Å
766	G	78.1	Confident	84.1	Confident	31 Å²	31	63.5 Å²	63.5	32%	0.32	32%	0.318	S	S	.	.	H	α-helix	trans	-62.7	-33.7	-179.8	0	0	0	0	0	113.8	N762 S763 R770	N762-G766 PolarHBondContact O-N 3.19Å; S763-G766 PolarHBondContact O-N 3.22Å; G766-R770 PolarHBondContact O-N 2.93Å; G766-R770 PolarHBondContact O-NE 3.44Å; G766-R770 PolarHBondContact O-NH2 3.11Å
767	R	85.9	Confident	84	Confident	73 Å²	73	68.6 Å²	68.6	28%	0.275	35%	0.345	S	S	.	.	H	α-helix	trans	-66.9	-50.3	170.9	-174.4	-167.9	58.6	110.2	0.5	111.8	S763 T765 F769 R770 Q771 E833	S763-R767 WeakPolarHBondContact O-CB 3.39Å; S763-R767 PolarHBondContact O-N 3.17Å; T765-R767 VanDerWaalsContact C-N 3.32Å; T765-R767 PolarHBondContact O-N 3.22Å; R767-F769 VanDerWaalsContact C-N 3.3Å; R767-F769 PolarHBondContact O-N 2.94Å; R767-R770 PolarHBondContact O-N 2.75Å; R767-Q771 VanDerWaalsContact NH1-OE1 3.08Å; R767-Q771 WeakPolarHBondContact O-CG 3.47Å; R767-Q771 PolarHBondContact O-N 3.06Å; R767-Q771 VanDerWaalsContact O-N 3.11Å; R767-E833 IonicContact CZ-OE1 2.66Å; R767-E833 IonicContact CZ-OE2 2.81Å; R767-E833 IonicContact NH1-OE1 2.8Å; R767-E833 IonicContact NH1-OE2 2.69Å; R767-E833 PolarHBondContact NH1-OE2 2.94Å; R767-E833 VanDerWaalsContact NH2-CD 3.31Å; R767-E833 IonicContact NH2-OE1 2.87Å; R767-E833 PolarHBondContact NH2-OE1 3.47Å; R767-E833 IonicContact NH2-OE2 3.72Å; R767-E833 PolarHBondContact NH2-OE2 2.76Å
768	L	85	Confident	83.9	Confident	30 Å²	30	68.1 Å²	68.1	16%	0.157	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-36.4	179.3	-73.8	-179.3	0	0	0	112.2	K764 T765 Q771 L772 E833 L834	K764-L768 HydrophobicContact CD-CD1 4.46Å; K764-L768 HydrophobicContact CG-CD1 4.2Å; K764-L768 HydrophobicContact CG-CG 4.4Å; K764-L768 WeakPolarHBondContact O-CB 3.28Å; K764-L768 WeakPolarHBondContact O-CG 3.48Å; K764-L768 PolarHBondContact O-N 2.77Å; T765-L768 PolarHBondContact O-N 3.11Å; L768-Q771 PolarHBondContact O-N 3.43Å; L768-L772 VanDerWaalsContact O-CB 3.3Å; L768-L772 WeakPolarHBondContact O-CB 3.45Å; L768-L772 PolarHBondContact O-N 3.33Å; L768-E833 HydrophobicContact CD2-CG 4.07Å; L768-L834 HydrophobicContact CB-CD2 4.15Å; L768-L834 HydrophobicContact CD1-CD2 4.49Å; L768-L834 HydrophobicContact CD2-CD2 4.05Å; L768-L834 HydrophobicContact CG-CD2 4.46Å
769	F	86.6	Confident	83.8	Confident	103 Å²	103	62.6 Å²	62.6	45%	0.452	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-44.8	177.4	-172.9	-108.1	0	0	0	112	T765 R767 Q771 L772 Q773 T787	T765-F769 WeakPolarHBondContact O-CB 3.45Å; T765-F769 PolarHBondContact O-N 3.25Å; R767-F769 VanDerWaalsContact C-N 3.3Å; R767-F769 PolarHBondContact O-N 2.94Å; F769-Q771 VanDerWaalsContact C-N 3.35Å; F769-Q771 PolarHBondContact O-N 3.3Å; F769-L772 CarbonylContact O-C 3.59Å; F769-L772 WeakPolarHBondContact O-CB 3.32Å; F769-L772 PolarHBondContact O-N 2.71Å; F769-Q773 HydrophobicContact CD1-CG 4.29Å; F769-Q773 VanDerWaalsContact CE1-CD 3.43Å; F769-Q773 HydrophobicContact CE1-CG 4.02Å; F769-Q773 HydrophobicContact CZ-CG 4.23Å; F769-Q773 WeakPolarHBondContact O-CG 3.34Å; F769-Q773 PolarHBondContact O-N 3.38Å; F769-T787 HydrophobicContact CE2-CG2 4.01Å
770	R	82.3	Confident	84.2	Confident	111 Å²	111	62.5 Å²	62.5	42%	0.419	32%	0.322	S	S	.	.	H	α-helix	trans	-62.1	-39.4	173.3	-76.1	170.8	-68.4	173.8	1.5	112.7	G766 R767 L772 Q773 Q774 D911	G766-R770 PolarHBondContact O-N 2.93Å; G766-R770 PolarHBondContact O-NE 3.44Å; G766-R770 PolarHBondContact O-NH2 3.11Å; R767-R770 PolarHBondContact O-N 2.75Å; R770-L772 VanDerWaalsContact C-N 3.35Å; R770-Q773 PolarHBondContact O-N 3Å; R770-Q774 WeakPolarHBondContact O-CG 3.47Å; R770-Q774 PolarHBondContact O-N 2.94Å; R770-D911 IonicContact CZ-OD2 3.3Å; R770-D911 IonicContact NH1-OD2 2.65Å; R770-D911 PolarHBondContact NH1-OD2 2.94Å; R770-D911 IonicContact NH2-OD1 3.69Å; R770-D911 PolarHBondContact NH2-OD1 3.01Å; R770-D911 IonicContact NH2-OD2 2.71Å; R770-D911 PolarHBondContact NH2-OD2 3.45Å
771	Q	84.6	Confident	84.6	Confident	35 Å²	35	64.8 Å²	64.8	16%	0.164	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-38.6	174.2	-69.5	179.2	-111.8	0	0	111.9	R767 L768 F769 Q774 L775 T830	R767-Q771 VanDerWaalsContact NH1-OE1 3.08Å; R767-Q771 WeakPolarHBondContact O-CG 3.47Å; R767-Q771 PolarHBondContact O-N 3.06Å; R767-Q771 VanDerWaalsContact O-N 3.11Å; L768-Q771 PolarHBondContact O-N 3.43Å; F769-Q771 VanDerWaalsContact C-N 3.35Å; F769-Q771 PolarHBondContact O-N 3.3Å; Q771-Q774 PolarHBondContact O-N 3.26Å; Q771-L775 PolarHBondContact O-N 2.86Å; Q771-T830 HydrophobicContact CB-CG2 3.71Å; Q771-T830 PolarHBondContact NE2-OG1 3.02Å
772	L	88.8	Confident	84.6	Confident	13 Å²	13	62.7 Å²	62.7	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-69.5	-36.1	175.5	174.9	66.3	0	0	0	112.4	L768 F769 R770 L775 H776 T787 I790 C791 L834	L768-L772 VanDerWaalsContact O-CB 3.3Å; L768-L772 WeakPolarHBondContact O-CB 3.45Å; L768-L772 PolarHBondContact O-N 3.33Å; F769-L772 CarbonylContact O-C 3.59Å; F769-L772 WeakPolarHBondContact O-CB 3.32Å; F769-L772 PolarHBondContact O-N 2.71Å; R770-L772 VanDerWaalsContact C-N 3.35Å; L772-L775 PolarHBondContact O-N 3.18Å; L772-H776 WeakPolarHBondContact O-CB 3.38Å; L772-H776 PolarHBondContact O-N 2.89Å; L772-T787 HydrophobicContact CD2-CG2 3.78Å; L772-T787 HydrophobicContact CG-CG2 3.69Å; L772-I790 HydrophobicContact CD1-CG2 3.96Å; L772-C791 HydrophobicContact CD1-CB 3.89Å; L772-C791 HydrophobicContact CD2-CB 3.71Å; L772-C791 HydrophobicContact CG-CB 4.46Å; L772-L834 HydrophobicContact CB-CD1 4.26Å; L772-L834 HydrophobicContact CD1-CD1 4.06Å
773	Q	86.8	Confident	84.7	Confident	85 Å²	85	59.7 Å²	59.7	40%	0.397	30%	0.298	S	S	.	.	H	α-helix	trans	-65	-40.5	171.1	-73.2	175.4	-54.9	0	0	112	F769 R770 H776 L777 T787	F769-Q773 HydrophobicContact CD1-CG 4.29Å; F769-Q773 VanDerWaalsContact CE1-CD 3.43Å; F769-Q773 HydrophobicContact CE1-CG 4.02Å; F769-Q773 HydrophobicContact CZ-CG 4.23Å; F769-Q773 WeakPolarHBondContact O-CG 3.34Å; F769-Q773 PolarHBondContact O-N 3.38Å; R770-Q773 PolarHBondContact O-N 3Å; Q773-H776 PolarHBondContact O-N 2.65Å; Q773-L777 WeakPolarHBondContact O-CB 3.43Å; Q773-L777 PolarHBondContact O-N 3.2Å; Q773-T787 HydrophobicContact CG-CG2 4.34Å
774	Q	84.8	Confident	85.2	Confident	111 Å²	111	65.2 Å²	65.2	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-47.8	173	-74.6	177.6	-21.9	0	0	111.4	R770 Q771 H776 L777 H778	R770-Q774 WeakPolarHBondContact O-CG 3.47Å; R770-Q774 PolarHBondContact O-N 2.94Å; Q771-Q774 PolarHBondContact O-N 3.26Å; Q774-H776 VanDerWaalsContact C-N 3.33Å; Q774-H776 PolarHBondContact O-N 2.66Å; Q774-L777 PolarHBondContact O-N 3.45Å; Q774-L777 VanDerWaalsContact O-N 3.15Å; Q774-H778 VanDerWaalsContact O-CG 3.22Å; Q774-H778 PolarHBondContact O-N 3Å; Q774-H778 PolarHBondContact O-ND1 3.17Å
775	L	88.3	Confident	85.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-57.4	-45.2	175.3	175.6	66.1	0	0	0	112	Q771 L772 H778 T779 I790 V795 D827 I831 L834	Q771-L775 PolarHBondContact O-N 2.86Å; L772-L775 PolarHBondContact O-N 3.18Å; L775-H778 PolarHBondContact O-N 2.8Å; L775-T779 HydrophobicContact CD1-CG2 4.01Å; L775-T779 WeakPolarHBondContact O-CB 3.14Å; L775-T779 WeakPolarHBondContact O-CG2 3.3Å; L775-T779 PolarHBondContact O-N 2.99Å; L775-T779 PolarHBondContact O-OG1 2.91Å; L775-I790 HydrophobicContact CD2-CG2 4.14Å; L775-V795 HydrophobicContact CD2-CG2 4.05Å; L775-D827 HydrophobicContact CD1-CB 3.95Å; L775-I831 HydrophobicContact CD1-CD1 3.97Å; L775-I831 HydrophobicContact CD1-CG1 4.09Å; L775-I831 HydrophobicContact CD2-CD1 4.1Å; L775-I831 HydrophobicContact CD2-CG1 3.64Å; L775-L834 HydrophobicContact CD2-CD1 4.35Å
776	H	90.1	Very high	85.8	Confident	57 Å²	57	60.4 Å²	60.4	26%	0.264	31%	0.314	S	S	.	.	H	α-helix	trans	-59.7	-45	175	168.2	71.6	0	0	0	111.8	L772 Q773 Q774 T779 S780 A785 I790	L772-H776 WeakPolarHBondContact O-CB 3.38Å; L772-H776 PolarHBondContact O-N 2.89Å; Q773-H776 PolarHBondContact O-N 2.65Å; Q774-H776 VanDerWaalsContact C-N 3.33Å; Q774-H776 PolarHBondContact O-N 2.66Å; H776-T779 PolarHBondContact O-N 3.19Å; H776-S780 WeakPolarHBondContact O-CA 3.41Å; H776-S780 WeakPolarHBondContact O-CB 3.15Å; H776-S780 PolarHBondContact O-N 3.06Å; H776-A785 PolarHBondContact CE1-O 3.09Å; H776-A785 PolarHBondContact ND1-O 3.28Å; H776-A785 VanDerWaalsContact ND1-O 3.12Å; H776-I790 HydrophobicContact CB-CD1 3.82Å; H776-I790 VanDerWaalsContact ND1-CD1 3.33Å; H776-I790 WeakPolarHBondContact ND1-CD1 3.35Å
777	L	86.6	Confident	86.3	Confident	110 Å²	110	60.5 Å²	60.5	58%	0.576	31%	0.309	S	S	*	.	H	α-helix	trans	-63.6	-41.7	176.9	-178.9	65.3	0	0	0	112.5	Q773 Q774 S780	Q773-L777 WeakPolarHBondContact O-CB 3.43Å; Q773-L777 PolarHBondContact O-N 3.2Å; Q774-L777 PolarHBondContact O-N 3.45Å; Q774-L777 VanDerWaalsContact O-N 3.15Å; L777-S780 PolarHBondContact O-OG 3.44Å
778	H	86.3	Confident	86.5	Confident	26 Å²	26	59.4 Å²	59.4	12%	0.12	32%	0.315	C	S	.	.	H	α-helix	trans	-69.8	-37.9	179.4	-60.6	162.3	0	0	0	111.8	Q774 L775 D827 Y868	Q774-H778 VanDerWaalsContact O-CG 3.22Å; Q774-H778 PolarHBondContact O-N 3Å; Q774-H778 PolarHBondContact O-ND1 3.17Å; L775-H778 PolarHBondContact O-N 2.8Å; H778-D827 IonicContact CE1-OD1 3.81Å; H778-D827 IonicContact CE1-OD2 3.74Å; H778-D827 IonicContact CG-OD2 2.76Å; H778-D827 VanDerWaalsContact ND1-CG 3.27Å; H778-D827 IonicContact ND1-OD1 3.61Å; H778-D827 PolarHBondContact ND1-OD1 3.24Å; H778-D827 IonicContact ND1-OD2 2.97Å; H778-D827 PolarHBondContact ND1-OD2 2.99Å; H778-Y868 HydrophobicContact CB-CD1 4.36Å; H778-Y868 HydrophobicContact CB-CE1 3.62Å; H778-Y868 AromaticContact CD2-CD1 3.57Å; H778-Y868 AromaticContact CD2-CD2 3.77Å; H778-Y868 AromaticContact CD2-CE1 3.47Å; H778-Y868 VanDerWaalsContact CD2-CE1 3.47Å; H778-Y868 WeakPolarHBondContact CD2-CE1 3.3Å; H778-Y868 AromaticContact CD2-CE2 3.66Å; H778-Y868 AromaticContact CD2-CG 3.71Å; H778-Y868 AromaticContact CD2-CZ 3.5Å; H778-Y868 AromaticContact CE1-CE2 3.84Å; H778-Y868 AromaticContact CG-CE1 3.54Å; H778-Y868 AromaticContact CG-CE2 3.99Å; H778-Y868 AromaticContact CG-CZ 3.45Å; H778-Y868 VanDerWaalsContact CG-CZ 3.45Å; H778-Y868 AromaticContact ND1-CZ 3.79Å; H778-Y868 AromaticContact NE2-CD2 3.67Å; H778-Y868 AromaticContact NE2-CE2 3.58Å; H778-Y868 AromaticContact NE2-CZ 3.89Å
779	T	86.7	Confident	86.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-87	-3.3	179.7	57.9	0	0	0	0	114.3	L775 H776 I781 H782 S783 M798 M823	L775-T779 HydrophobicContact CD1-CG2 4.01Å; L775-T779 WeakPolarHBondContact O-CB 3.14Å; L775-T779 WeakPolarHBondContact O-CG2 3.3Å; L775-T779 PolarHBondContact O-N 2.99Å; L775-T779 PolarHBondContact O-OG1 2.91Å; H776-T779 PolarHBondContact O-N 3.19Å; T779-I781 PolarHBondContact O-N 3.36Å; T779-I781 VanDerWaalsContact O-N 3.13Å; T779-H782 CarbonylContact O-C 3.56Å; T779-H782 PolarHBondContact O-N 2.71Å; T779-S783 PolarHBondContact O-N 3.38Å; T779-S783 PolarHBondContact O-OG 3.35Å; T779-S783 PolarHBondContact OG1-OG 3.44Å; T779-M798 HydrophobicContact CG2-CE 4.37Å; T779-M823 HydrophobicContact CG2-CG 4.17Å
780	S	86.8	Confident	87	Confident	58 Å²	58	55 Å²	55	41%	0.406	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.2	-173.7	70.3	0	0	0	0	114.4	H776 L777 H782	H776-S780 WeakPolarHBondContact O-CA 3.41Å; H776-S780 WeakPolarHBondContact O-CB 3.15Å; H776-S780 PolarHBondContact O-N 3.06Å; L777-S780 PolarHBondContact O-OG 3.44Å; S780-H782 VanDerWaalsContact C-N 3.3Å
781	I	85.5	Confident	87.3	Confident	101 Å²	101	52 Å²	52	52%	0.518	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.7	175.5	-63.1	170.2	0	0	0	110.9	T779 P867	T779-I781 PolarHBondContact O-N 3.36Å; T779-I781 VanDerWaalsContact O-N 3.13Å; I781-P867 HydrophobicContact CD1-CB 3.74Å; I781-P867 HydrophobicContact CD1-CG 3.66Å
782	H	85.6	Confident	87.5	Confident	87 Å²	87	56.3 Å²	56.3	40%	0.403	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-2.2	-173	-56.1	-74.7	0	0	0	113.5	T779 S780 Y821 D822	T779-H782 CarbonylContact O-C 3.56Å; T779-H782 PolarHBondContact O-N 2.71Å; S780-H782 VanDerWaalsContact C-N 3.3Å; H782-Y821 HydrophobicContact CB-CD1 3.76Å; H782-Y821 HydrophobicContact CB-CE1 4.21Å; H782-D822 IonicContact CD2-OD2 3.5Å; H782-D822 IonicContact CE1-OD2 3.08Å; H782-D822 IonicContact NE2-OD2 3.36Å; H782-D822 PolarHBondContact NE2-OD2 3.18Å
783	S	83.2	Confident	87.6	Confident	15 Å²	15	60.5 Å²	60.5	11%	0.105	34%	0.341	C	S	.	.			trans	-143.2	129.6	-179.4	64.8	0	0	0	0	111.8	T779 A785	T779-S783 PolarHBondContact O-N 3.38Å; T779-S783 PolarHBondContact O-OG 3.35Å; T779-S783 PolarHBondContact OG1-OG 3.44Å; S783-A785 VanDerWaalsContact C-N 3.31Å; S783-A785 PolarHBondContact O-N 3.28Å
784	S	84.3	Confident	87.8	Confident	131 Å²	131	60.7 Å²	60.7	92%	0.916	34%	0.339	S	S	*	.			trans	-97.6	33.4	179.2	66.3	0	0	0	0	112.2
785	A	86.2	Confident	88	Confident	10 Å²	10	55.5 Å²	55.5	8%	0.083	32%	0.315	C	S	.	.			trans	-106.2	144.5	-171.8	0	0	0	0	0	111.1	H776 S783 I790 Y794	H776-A785 PolarHBondContact CE1-O 3.09Å; H776-A785 PolarHBondContact ND1-O 3.28Å; H776-A785 VanDerWaalsContact ND1-O 3.12Å; S783-A785 VanDerWaalsContact C-N 3.31Å; S783-A785 PolarHBondContact O-N 3.28Å; A785-I790 HydrophobicContact CB-CD1 4.39Å; A785-I790 HydrophobicContact CB-CG1 3.76Å; A785-Y794 HydrophobicContact CB-CD2 4.13Å; A785-Y794 HydrophobicContact CB-CE2 3.46Å; A785-Y794 VanDerWaalsContact CB-CE2 3.46Å
786	D	90	Very high	88.1	Confident	82 Å²	82	57.6 Å²	57.6	44%	0.439	33%	0.326	S	S	.	.			trans	-74.6	171.3	176.7	89.4	-60.1	0	0	0	111.6	A788 S789 I790	D786-A788 PolarHBondContact O-N 3.36Å; D786-A788 WeakPolarHBondContact OD2-CB 3.3Å; D786-A788 PolarHBondContact OD2-N 3.11Å; D786-S789 PolarHBondContact O-N 3.35Å; D786-S789 VanDerWaalsContact OD1-CB 3.24Å; D786-S789 WeakPolarHBondContact OD1-CB 3.47Å; D786-S789 PolarHBondContact OD1-N 3.43Å; D786-S789 PolarHBondContact OD1-OG 3.41Å; D786-I790 WeakPolarHBondContact O-CG1 3.42Å; D786-I790 PolarHBondContact O-N 3.41Å
787	T	88.5	Confident	88.1	Confident	33 Å²	33	61.5 Å²	61.5	20%	0.202	34%	0.344	C	S	.	.	H	α-helix	trans	-59.8	-30.9	-179.4	-42.4	0	0	0	0	112.6	F769 L772 Q773 C791	F769-T787 HydrophobicContact CE2-CG2 4.01Å; L772-T787 HydrophobicContact CD2-CG2 3.78Å; L772-T787 HydrophobicContact CG-CG2 3.69Å; Q773-T787 HydrophobicContact CG-CG2 4.34Å; T787-C791 PolarHBondContact O-N 2.95Å
788	A	90.4	Very high	88.3	Confident	50 Å²	50	57.1 Å²	57.1	41%	0.413	32%	0.321	S	S	.	.	H	α-helix	trans	-74.5	-50.6	177.1	0	0	0	0	0	112.4	D786 I790 C791 L792	D786-A788 PolarHBondContact O-N 3.36Å; D786-A788 WeakPolarHBondContact OD2-CB 3.3Å; D786-A788 PolarHBondContact OD2-N 3.11Å; A788-I790 VanDerWaalsContact C-N 3.31Å; A788-I790 PolarHBondContact O-N 3.01Å; A788-C791 WeakPolarHBondContact O-CB 3.17Å; A788-C791 PolarHBondContact O-N 3Å; A788-L792 WeakPolarHBondContact O-CG 3.31Å; A788-L792 PolarHBondContact O-N 2.87Å
789	S	90.8	Very high	88.5	Confident	40 Å²	40	56.5 Å²	56.5	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-37.4	179.3	-54.9	0	0	0	0	111.7	D786 C791 L792 D793 Y794	D786-S789 PolarHBondContact O-N 3.35Å; D786-S789 VanDerWaalsContact OD1-CB 3.24Å; D786-S789 WeakPolarHBondContact OD1-CB 3.47Å; D786-S789 PolarHBondContact OD1-N 3.43Å; D786-S789 PolarHBondContact OD1-OG 3.41Å; S789-C791 VanDerWaalsContact C-N 3.27Å; S789-C791 PolarHBondContact O-N 3.43Å; S789-L792 PolarHBondContact O-N 3Å; S789-D793 WeakPolarHBondContact CA-OD2 3.5Å; S789-D793 WeakPolarHBondContact CB-OD2 3.41Å; S789-D793 WeakPolarHBondContact O-CB 3.32Å; S789-D793 PolarHBondContact O-N 2.9Å; S789-Y794 PolarHBondContact O-N 3.38Å
790	I	90.4	Very high	88.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.337	C	S	.	.	I	π-helix	trans	-58.2	-42.4	173.4	-70.9	179	0	0	0	111	L772 L775 H776 A785 D786 A788 Y794 V795	L772-I790 HydrophobicContact CD1-CG2 3.96Å; L775-I790 HydrophobicContact CD2-CG2 4.14Å; H776-I790 HydrophobicContact CB-CD1 3.82Å; H776-I790 VanDerWaalsContact ND1-CD1 3.33Å; H776-I790 WeakPolarHBondContact ND1-CD1 3.35Å; A785-I790 HydrophobicContact CB-CD1 4.39Å; A785-I790 HydrophobicContact CB-CG1 3.76Å; D786-I790 WeakPolarHBondContact O-CG1 3.42Å; D786-I790 PolarHBondContact O-N 3.41Å; A788-I790 VanDerWaalsContact C-N 3.31Å; A788-I790 PolarHBondContact O-N 3.01Å; I790-Y794 HydrophobicContact CG1-CD2 4.38Å; I790-Y794 PolarHBondContact O-N 3.15Å; I790-V795 HydrophobicContact CG2-CG2 4.42Å; I790-V795 VanDerWaalsContact O-CG2 3.29Å; I790-V795 WeakPolarHBondContact O-CG2 3.48Å; I790-V795 PolarHBondContact O-N 2.98Å
791	C	89.4	Confident	88.9	Confident	48 Å²	48	59.1 Å²	59.1	32%	0.324	33%	0.329	S	S	.	.	I	π-helix	trans	-72.2	-32.2	-179.7	-166.7	0	0	0	0	114.2	L772 T787 A788 S789	L772-C791 HydrophobicContact CD1-CB 3.89Å; L772-C791 HydrophobicContact CD2-CB 3.71Å; L772-C791 HydrophobicContact CG-CB 4.46Å; T787-C791 PolarHBondContact O-N 2.95Å; A788-C791 WeakPolarHBondContact O-CB 3.17Å; A788-C791 PolarHBondContact O-N 3Å; S789-C791 VanDerWaalsContact C-N 3.27Å; S789-C791 PolarHBondContact O-N 3.43Å
792	L	89	Confident	89.1	Confident	126 Å²	126	54.4 Å²	54.4	66%	0.66	31%	0.306	S	S	*	.	I	π-helix	trans	-91	-44	-175.4	-66.5	174.6	0	0	0	112.6	A788 S789	A788-L792 WeakPolarHBondContact O-CG 3.31Å; A788-L792 PolarHBondContact O-N 2.87Å; S789-L792 PolarHBondContact O-N 3Å
793	D	90	Very high	89.3	Confident	101 Å²	101	50.5 Å²	50.5	54%	0.54	29%	0.288	S	S	.	.	I	π-helix	trans	-104.7	-45	-167.7	-46.8	-54.7	0	0	0	112.1	S789	S789-D793 WeakPolarHBondContact CA-OD2 3.5Å; S789-D793 WeakPolarHBondContact CB-OD2 3.41Å; S789-D793 WeakPolarHBondContact O-CB 3.32Å; S789-D793 PolarHBondContact O-N 2.9Å
794	Y	90.9	Very high	89.7	Confident	88 Å²	88	51.7 Å²	51.7	35%	0.345	30%	0.298	S	S	.	.	I	π-helix	trans	-85.3	-43.3	-171.3	-67.6	-104.5	0	0	0	113.2	A785 S789 I790 D796 H797 M798	A785-Y794 HydrophobicContact CB-CD2 4.13Å; A785-Y794 HydrophobicContact CB-CE2 3.46Å; A785-Y794 VanDerWaalsContact CB-CE2 3.46Å; S789-Y794 PolarHBondContact O-N 3.38Å; I790-Y794 HydrophobicContact CG1-CD2 4.38Å; I790-Y794 PolarHBondContact O-N 3.15Å; Y794-D796 VanDerWaalsContact C-N 3.35Å; Y794-D796 PolarHBondContact O-N 2.93Å; Y794-H797 PolarHBondContact O-N 3.42Å; Y794-H797 VanDerWaalsContact O-N 3.11Å; Y794-M798 HydrophobicContact CD1-CE 4.24Å; Y794-M798 WeakPolarHBondContact O-CB 3.5Å; Y794-M798 WeakPolarHBondContact O-CG 3.48Å; Y794-M798 PolarHBondContact O-N 3.44Å
795	V	90.1	Very high	90	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-55.3	-45.3	-174.9	157.4	0	0	0	0	112.5	L775 I790 R799 I831 L834	L775-V795 HydrophobicContact CD2-CG2 4.05Å; I790-V795 HydrophobicContact CG2-CG2 4.42Å; I790-V795 VanDerWaalsContact O-CG2 3.29Å; I790-V795 WeakPolarHBondContact O-CG2 3.48Å; I790-V795 PolarHBondContact O-N 2.98Å; V795-R799 WeakPolarHBondContact O-CB 3.47Å; V795-R799 PolarHBondContact O-N 3.46Å; V795-I831 HydrophobicContact CG1-CG2 4.4Å; V795-I831 HydrophobicContact CG2-CG1 4.49Å; V795-L834 HydrophobicContact CG1-CB 3.91Å; V795-L834 HydrophobicContact CG2-CD1 4.18Å
796	D	89	Confident	90.1	Very high	45 Å²	45	47.2 Å²	47.2	24%	0.241	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-38.5	179.9	-106.3	46.9	0	0	0	111.5	Y794 R799 D800	Y794-D796 VanDerWaalsContact C-N 3.35Å; Y794-D796 PolarHBondContact O-N 2.93Å; D796-R799 VanDerWaalsContact CG-CZ 3.47Å; D796-R799 IonicContact OD1-CZ 2.7Å; D796-R799 IonicContact OD1-NH1 2.74Å; D796-R799 PolarHBondContact OD1-NH1 3.4Å; D796-R799 IonicContact OD1-NH2 3.34Å; D796-R799 IonicContact OD2-CZ 2.66Å; D796-R799 IonicContact OD2-NH1 3.42Å; D796-R799 PolarHBondContact OD2-NH1 3.18Å; D796-R799 VanDerWaalsContact OD2-NH1 3.08Å; D796-R799 IonicContact OD2-NH2 3.26Å; D796-R799 PolarHBondContact OD2-NH2 3.45Å; D796-D800 WeakPolarHBondContact O-CB 3.24Å; D796-D800 PolarHBondContact O-N 3.13Å
797	H	90.9	Very high	90	Very high	139 Å²	139	47.4 Å²	47.4	64%	0.644	26%	0.262	S	S	*	.	H	α-helix	trans	-72.3	-42.8	178.1	-169.2	87.5	0	0	0	113.1	Y794 D800 S801	Y794-H797 PolarHBondContact O-N 3.42Å; Y794-H797 VanDerWaalsContact O-N 3.11Å; H797-D800 PolarHBondContact O-N 2.97Å; H797-S801 VanDerWaalsContact O-CB 3.3Å; H797-S801 WeakPolarHBondContact O-CB 3.21Å; H797-S801 PolarHBondContact O-N 3.32Å; H797-S801 PolarHBondContact O-OG 2.9Å
798	M	90	Very high	90	Very high	17 Å²	17	54.9 Å²	54.9	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-48	174.2	-72.5	174.9	168.6	0	0	110.8	T779 Y794 D800 S801 I802 I831	T779-M798 HydrophobicContact CG2-CE 4.37Å; Y794-M798 HydrophobicContact CD1-CE 4.24Å; Y794-M798 WeakPolarHBondContact O-CB 3.5Å; Y794-M798 WeakPolarHBondContact O-CG 3.48Å; Y794-M798 PolarHBondContact O-N 3.44Å; M798-D800 PolarHBondContact O-N 3.38Å; M798-S801 PolarHBondContact O-N 3.07Å; M798-I802 WeakPolarHBondContact O-CG1 3.47Å; M798-I802 PolarHBondContact O-N 2.93Å; M798-I831 HydrophobicContact CB-CD1 3.83Å; M798-I831 HydrophobicContact CG-CD1 4.41Å; M798-I831 HydrophobicContact SD-CD1 3.7Å
799	R	91.1	Very high	89.7	Confident	13 Å²	13	57.5 Å²	57.5	5%	0.049	29%	0.29	C	S	.	.	H	α-helix	trans	-52.8	-54.2	174.4	-179.4	-164.1	73.8	-139.8	-20.7	110.8	V795 D796 S801 I802 M803 I831 M832 G835	V795-R799 WeakPolarHBondContact O-CB 3.47Å; V795-R799 PolarHBondContact O-N 3.46Å; D796-R799 VanDerWaalsContact CG-CZ 3.47Å; D796-R799 IonicContact OD1-CZ 2.7Å; D796-R799 IonicContact OD1-NH1 2.74Å; D796-R799 PolarHBondContact OD1-NH1 3.4Å; D796-R799 IonicContact OD1-NH2 3.34Å; D796-R799 IonicContact OD2-CZ 2.66Å; D796-R799 IonicContact OD2-NH1 3.42Å; D796-R799 PolarHBondContact OD2-NH1 3.18Å; D796-R799 VanDerWaalsContact OD2-NH1 3.08Å; D796-R799 IonicContact OD2-NH2 3.26Å; D796-R799 PolarHBondContact OD2-NH2 3.45Å; R799-S801 PolarHBondContact O-N 2.83Å; R799-I802 PolarHBondContact O-N 2.9Å; R799-M803 HydrophobicContact CG-CG 4.45Å; R799-M803 VanDerWaalsContact O-CB 3.29Å; R799-M803 WeakPolarHBondContact O-CB 3.45Å; R799-M803 WeakPolarHBondContact O-CG 3.31Å; R799-M803 PolarHBondContact O-N 3.47Å; R799-I831 HydrophobicContact CB-CG2 3.75Å; R799-M832 HydrophobicContact CG-SD 4.11Å; R799-G835 PolarHBondContact NH1-O 3.48Å
800	D	90.3	Very high	89.6	Confident	78 Å²	78	57 Å²	57	42%	0.417	29%	0.285	S	S	.	.	H	α-helix	trans	-74	-27.6	-172.3	-72.3	-13.8	0	0	0	112.8	D796 H797 M798 A804	D796-D800 WeakPolarHBondContact O-CB 3.24Å; D796-D800 PolarHBondContact O-N 3.13Å; H797-D800 PolarHBondContact O-N 2.97Å; M798-D800 PolarHBondContact O-N 3.38Å; D800-A804 VanDerWaalsContact O-CB 3.27Å; D800-A804 WeakPolarHBondContact O-CB 3.44Å; D800-A804 PolarHBondContact O-N 2.87Å
801	S	91.5	Very high	89.6	Confident	35 Å²	35	58.1 Å²	58.1	25%	0.245	29%	0.291	C	S	.	.	H	α-helix	trans	-66.6	-50.6	170.7	-60.7	0	0	0	0	112	H797 M798 R799 M803 A804 H805	H797-S801 VanDerWaalsContact O-CB 3.3Å; H797-S801 WeakPolarHBondContact O-CB 3.21Å; H797-S801 PolarHBondContact O-N 3.32Å; H797-S801 PolarHBondContact O-OG 2.9Å; M798-S801 PolarHBondContact O-N 3.07Å; R799-S801 PolarHBondContact O-N 2.83Å; S801-M803 VanDerWaalsContact C-N 3.31Å; S801-M803 PolarHBondContact O-N 2.64Å; S801-A804 WeakPolarHBondContact O-CB 3.44Å; S801-A804 PolarHBondContact O-N 2.81Å; S801-A804 VanDerWaalsContact O-N 3.12Å; S801-H805 PolarHBondContact O-CD2 2.97Å; S801-H805 PolarHBondContact O-N 2.57Å
802	I	90.3	Very high	89.6	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.015	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-45.1	174.9	-66.8	166.2	0	0	0	110	M798 R799 A804 H805 L806 L817 M823 V828 M832	M798-I802 WeakPolarHBondContact O-CG1 3.47Å; M798-I802 PolarHBondContact O-N 2.93Å; R799-I802 PolarHBondContact O-N 2.9Å; I802-A804 VanDerWaalsContact C-N 3.34Å; I802-A804 PolarHBondContact O-N 3.35Å; I802-H805 PolarHBondContact O-N 3.09Å; I802-L806 HydrophobicContact CG2-CD1 3.88Å; I802-L806 HydrophobicContact CG2-CG 4.45Å; I802-L806 WeakPolarHBondContact O-CG 3.01Å; I802-L806 PolarHBondContact O-N 3.36Å; I802-L817 HydrophobicContact CG1-CD2 4.14Å; I802-M823 HydrophobicContact CD1-CE 4.17Å; I802-V828 HydrophobicContact CD1-CG1 4.47Å; I802-M832 HydrophobicContact CG2-CE 4.08Å
803	M	89.3	Confident	89.6	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.025	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-35.1	175.7	-74	-63.6	-53.6	0	0	112.8	R799 S801 L806 N807 M832 P843 L847	R799-M803 HydrophobicContact CG-CG 4.45Å; R799-M803 VanDerWaalsContact O-CB 3.29Å; R799-M803 WeakPolarHBondContact O-CB 3.45Å; R799-M803 WeakPolarHBondContact O-CG 3.31Å; R799-M803 PolarHBondContact O-N 3.47Å; S801-M803 VanDerWaalsContact C-N 3.31Å; S801-M803 PolarHBondContact O-N 2.64Å; M803-L806 PolarHBondContact O-N 2.98Å; M803-N807 VanDerWaalsContact O-CB 3.27Å; M803-N807 WeakPolarHBondContact O-CB 3.14Å; M803-N807 VanDerWaalsContact O-CG 3.23Å; M803-N807 PolarHBondContact O-N 3.02Å; M803-N807 PolarHBondContact O-ND2 3.27Å; M803-M832 HydrophobicContact CG-CE 4.03Å; M803-M832 HydrophobicContact CG-SD 4.41Å; M803-M832 HydrophobicContact SD-CE 3.97Å; M803-M832 HydrophobicContact SD-SD 4.18Å; M803-P843 VanDerWaalsContact CE-C 3.46Å; M803-P843 HydrophobicContact CE-CB 3.89Å; M803-P843 WeakPolarHBondContact CE-O 3.43Å; M803-P843 HydrophobicContact CG-CB 4.11Å; M803-P843 HydrophobicContact SD-CB 4.15Å; M803-L847 HydrophobicContact CE-CD1 3.47Å; M803-L847 VanDerWaalsContact CE-CD1 3.47Å; M803-L847 HydrophobicContact CE-CD2 4.48Å; M803-L847 HydrophobicContact CE-CG 3.71Å; M803-L847 HydrophobicContact SD-CD1 3.6Å; M803-L847 HydrophobicContact SD-CG 4.49Å
804	A	90.7	Very high	89.6	Confident	39 Å²	39	54.6 Å²	54.6	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-65.2	-41	178.1	0	0	0	0	0	112.1	D800 S801 I802 R808	D800-A804 VanDerWaalsContact O-CB 3.27Å; D800-A804 WeakPolarHBondContact O-CB 3.44Å; D800-A804 PolarHBondContact O-N 2.87Å; S801-A804 WeakPolarHBondContact O-CB 3.44Å; S801-A804 PolarHBondContact O-N 2.81Å; S801-A804 VanDerWaalsContact O-N 3.12Å; I802-A804 VanDerWaalsContact C-N 3.34Å; I802-A804 PolarHBondContact O-N 3.35Å; A804-R808 WeakPolarHBondContact O-CG 3.19Å; A804-R808 PolarHBondContact O-N 2.99Å
805	H	90.3	Very high	89.6	Confident	44 Å²	44	51.2 Å²	51.2	20%	0.204	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-45.6	173.6	-74.6	-79.4	0	0	0	112	S801 I802 N807 R808 E809 D810 K813 A814	S801-H805 PolarHBondContact O-CD2 2.97Å; S801-H805 PolarHBondContact O-N 2.57Å; I802-H805 PolarHBondContact O-N 3.09Å; H805-N807 VanDerWaalsContact C-N 3.34Å; H805-N807 PolarHBondContact O-N 3.48Å; H805-R808 WeakPolarHBondContact O-CB 3.25Å; H805-R808 PolarHBondContact O-N 2.97Å; H805-R808 VanDerWaalsContact O-N 3.07Å; H805-E809 PolarHBondContact O-N 3.36Å; H805-D810 PolarHBondContact O-N 3.32Å; H805-D810 VanDerWaalsContact O-N 3.1Å; H805-K813 VanDerWaalsContact ND1-CB 3.33Å; H805-K813 WeakPolarHBondContact ND1-CB 3.47Å; H805-A814 HydrophobicContact CB-CB 3.83Å
806	L	88.8	Confident	89.6	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-35	178	-67.7	175.5	0	0	0	113	I802 M803 R808 E809 V811 A814 L847 T851 F855	I802-L806 HydrophobicContact CG2-CD1 3.88Å; I802-L806 HydrophobicContact CG2-CG 4.45Å; I802-L806 WeakPolarHBondContact O-CG 3.01Å; I802-L806 PolarHBondContact O-N 3.36Å; M803-L806 PolarHBondContact O-N 2.98Å; L806-R808 PolarHBondContact O-N 2.88Å; L806-E809 PolarHBondContact O-N 3.29Å; L806-V811 HydrophobicContact CD2-CG2 4.48Å; L806-A814 HydrophobicContact CD2-CB 3.73Å; L806-A814 HydrophobicContact CG-CB 3.93Å; L806-L847 VanDerWaalsContact C-CD2 3.42Å; L806-L847 HydrophobicContact CB-CD1 3.63Å; L806-L847 HydrophobicContact CB-CD2 3.81Å; L806-L847 HydrophobicContact CB-CG 4.4Å; L806-L847 HydrophobicContact CD1-CD1 3.86Å; L806-L847 HydrophobicContact CG-CD1 4.39Å; L806-L847 WeakPolarHBondContact O-CD2 3.42Å; L806-T851 HydrophobicContact CD2-CG2 4.43Å; L806-F855 HydrophobicContact CD2-CB 3.96Å; L806-F855 HydrophobicContact CD2-CD2 3.83Å; L806-F855 HydrophobicContact CD2-CG 3.93Å
807	N	88.3	Confident	89.7	Confident	86 Å²	86	55 Å²	55	46%	0.46	28%	0.276	S	S	.	.	H	α-helix	trans	-68.7	-20.4	175.5	-78.3	-52.2	0	0	0	112.7	M803 H805 E809 L847	M803-N807 VanDerWaalsContact O-CB 3.27Å; M803-N807 WeakPolarHBondContact O-CB 3.14Å; M803-N807 VanDerWaalsContact O-CG 3.23Å; M803-N807 PolarHBondContact O-N 3.02Å; M803-N807 PolarHBondContact O-ND2 3.27Å; H805-N807 VanDerWaalsContact C-N 3.34Å; H805-N807 PolarHBondContact O-N 3.48Å; N807-E809 VanDerWaalsContact C-N 3.29Å; N807-L847 HydrophobicContact CB-CD2 4.41Å; N807-L847 WeakPolarHBondContact OD1-CD2 3.24Å
808	R	88.1	Confident	89.7	Confident	189 Å²	189	48.4 Å²	48.4	71%	0.713	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	6.3	171.7	-67.5	168.9	173.9	162.2	-2.7	113	A804 H805 L806 D810	A804-R808 WeakPolarHBondContact O-CG 3.19Å; A804-R808 PolarHBondContact O-N 2.99Å; H805-R808 WeakPolarHBondContact O-CB 3.25Å; H805-R808 PolarHBondContact O-N 2.97Å; H805-R808 VanDerWaalsContact O-N 3.07Å; L806-R808 PolarHBondContact O-N 2.88Å; R808-D810 PolarHBondContact O-N 2.83Å; R808-D810 VanDerWaalsContact O-N 3.15Å
809	E	84.9	Confident	89.5	Confident	105 Å²	105	49.5 Å²	49.5	49%	0.491	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	12.5	-167.3	-55	-148.2	145	0	0	115.2	H805 L806 N807 V811 K850 T851	H805-E809 PolarHBondContact O-N 3.36Å; L806-E809 PolarHBondContact O-N 3.29Å; N807-E809 VanDerWaalsContact C-N 3.29Å; E809-V811 VanDerWaalsContact C-N 3.31Å; E809-V811 PolarHBondContact O-N 3.32Å; E809-K850 IonicContact OE2-NZ 3.62Å; E809-T851 PolarHBondContact OE1-OG1 3.49Å
810	D	89.1	Confident	89.4	Confident	31 Å²	31	51.8 Å²	51.8	17%	0.166	27%	0.268	C	S	.	.			trans	-82.5	75.5	-179.6	-166.3	-18.2	0	0	0	110.9	H805 R808 T812 K813 A814	H805-D810 PolarHBondContact O-N 3.32Å; H805-D810 VanDerWaalsContact O-N 3.1Å; R808-D810 PolarHBondContact O-N 2.83Å; R808-D810 VanDerWaalsContact O-N 3.15Å; D810-T812 PolarHBondContact O-N 3.08Å; D810-T812 PolarHBondContact OD1-OG1 3.4Å; D810-K813 PolarHBondContact OD1-N 3.33Å; D810-K813 VanDerWaalsContact OD2-CD 3.31Å; D810-K813 WeakPolarHBondContact OD2-CD 3.33Å; D810-K813 WeakPolarHBondContact OD2-CG 3.39Å; D810-K813 IonicContact OD2-NZ 2.63Å; D810-K813 PolarHBondContact OD2-NZ 3.42Å; D810-A814 WeakPolarHBondContact O-CB 3.49Å; D810-A814 PolarHBondContact O-N 2.91Å
811	V	89	Confident	89.2	Confident	23 Å²	23	52.1 Å²	52.1	14%	0.139	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-30.4	179	172	0	0	0	0	112.1	L806 E809 L815 T851 A854 F855 A858	L806-V811 HydrophobicContact CD2-CG2 4.48Å; E809-V811 VanDerWaalsContact C-N 3.31Å; E809-V811 PolarHBondContact O-N 3.32Å; V811-L815 WeakPolarHBondContact O-CB 3.44Å; V811-L815 PolarHBondContact O-N 3.08Å; V811-L815 VanDerWaalsContact O-N 3.14Å; V811-T851 HydrophobicContact CG2-CG2 4.05Å; V811-A854 HydrophobicContact CG2-CB 3.97Å; V811-F855 HydrophobicContact CG1-CB 4.21Å; V811-F855 HydrophobicContact CG1-CD2 4.42Å; V811-A858 HydrophobicContact CG1-CB 3.79Å
812	T	89.4	Confident	89	Confident	94 Å²	94	51.2 Å²	51.2	58%	0.577	26%	0.257	S	S	*	.	H	α-helix	trans	-61.4	-64	175.4	21.6	0	0	0	0	111.1	D810 A814 L815 D816	D810-T812 PolarHBondContact O-N 3.08Å; D810-T812 PolarHBondContact OD1-OG1 3.4Å; T812-A814 PolarHBondContact O-N 2.86Å; T812-A814 VanDerWaalsContact O-N 3.16Å; T812-L815 WeakPolarHBondContact O-CA 3.33Å; T812-L815 WeakPolarHBondContact O-CB 3.44Å; T812-L815 PolarHBondContact O-N 3.13Å; T812-D816 VanDerWaalsContact C-OD2 3.31Å; T812-D816 PolarHBondContact O-N 3.28Å
813	K	89.9	Confident	88.8	Confident	106 Å²	106	51.2 Å²	51.2	46%	0.461	26%	0.257	S	S	.	.	H	α-helix	trans	-63.8	-27.7	-178.2	-64.6	-168.9	-167.1	80	0	113.3	H805 D810 L815 D816 L817	H805-K813 VanDerWaalsContact ND1-CB 3.33Å; H805-K813 WeakPolarHBondContact ND1-CB 3.47Å; D810-K813 PolarHBondContact OD1-N 3.33Å; D810-K813 VanDerWaalsContact OD2-CD 3.31Å; D810-K813 WeakPolarHBondContact OD2-CD 3.33Å; D810-K813 WeakPolarHBondContact OD2-CG 3.39Å; D810-K813 IonicContact OD2-NZ 2.63Å; D810-K813 PolarHBondContact OD2-NZ 3.42Å; K813-L815 VanDerWaalsContact C-N 3.34Å; K813-D816 WeakPolarHBondContact CA-OD2 3.41Å; K813-D816 PolarHBondContact N-OD2 3.33Å; K813-L817 VanDerWaalsContact O-CB 3.24Å; K813-L817 WeakPolarHBondContact O-CB 3.16Å; K813-L817 PolarHBondContact O-N 2.77Å
814	A	90.2	Very high	88.7	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-36.3	171.4	0	0	0	0	0	112.7	H805 L806 D810 T812 C818 F855	H805-A814 HydrophobicContact CB-CB 3.83Å; L806-A814 HydrophobicContact CD2-CB 3.73Å; L806-A814 HydrophobicContact CG-CB 3.93Å; D810-A814 WeakPolarHBondContact O-CB 3.49Å; D810-A814 PolarHBondContact O-N 2.91Å; T812-A814 PolarHBondContact O-N 2.86Å; T812-A814 VanDerWaalsContact O-N 3.16Å; A814-C818 PolarHBondContact O-N 3.5Å; A814-C818 PolarHBondContact O-SG 3.14Å; A814-F855 HydrophobicContact CB-CD2 4.19Å; A814-F855 HydrophobicContact CB-CE2 4.01Å
815	L	90.8	Very high	88.4	Confident	17 Å²	17	52.1 Å²	52.1	9%	0.089	26%	0.256	C	S	.	.	H	α-helix	trans	-76.5	-43.7	175.1	179.2	63.7	0	0	0	111.4	V811 T812 K813 L817 C818 Q819 A858 F859	V811-L815 WeakPolarHBondContact O-CB 3.44Å; V811-L815 PolarHBondContact O-N 3.08Å; V811-L815 VanDerWaalsContact O-N 3.14Å; T812-L815 WeakPolarHBondContact O-CA 3.33Å; T812-L815 WeakPolarHBondContact O-CB 3.44Å; T812-L815 PolarHBondContact O-N 3.13Å; K813-L815 VanDerWaalsContact C-N 3.34Å; L815-L817 VanDerWaalsContact C-N 3.26Å; L815-L817 PolarHBondContact O-N 2.99Å; L815-C818 WeakPolarHBondContact O-CB 3.49Å; L815-C818 PolarHBondContact O-N 3Å; L815-Q819 HydrophobicContact CD1-CG 4.45Å; L815-Q819 WeakPolarHBondContact O-CG 3.45Å; L815-Q819 PolarHBondContact O-N 2.72Å; L815-A858 HydrophobicContact CD2-CB 3.89Å; L815-F859 HydrophobicContact CD1-CB 4.25Å; L815-F859 HydrophobicContact CD1-CD2 3.57Å; L815-F859 HydrophobicContact CD1-CE2 4.09Å; L815-F859 HydrophobicContact CD1-CG 4.14Å
816	D	90.5	Very high	88.1	Confident	84 Å²	84	55 Å²	55	45%	0.449	27%	0.273	S	S	.	.	H	α-helix	trans	-57.4	-42.1	178.2	-52.4	-30.5	0	0	0	110.6	T812 K813 C818 Q819 S820	T812-D816 VanDerWaalsContact C-OD2 3.31Å; T812-D816 PolarHBondContact O-N 3.28Å; K813-D816 WeakPolarHBondContact CA-OD2 3.41Å; K813-D816 PolarHBondContact N-OD2 3.33Å; D816-C818 PolarHBondContact O-N 3.48Å; D816-Q819 PolarHBondContact O-N 3.29Å; D816-S820 PolarHBondContact O-N 2.85Å
817	L	90.6	Very high	88	Confident	43 Å²	43	55 Å²	55	23%	0.225	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-33.6	174.6	-177.4	66	0	0	0	113.4	I802 K813 L815 S820 Y821	I802-L817 HydrophobicContact CG1-CD2 4.14Å; K813-L817 VanDerWaalsContact O-CB 3.24Å; K813-L817 WeakPolarHBondContact O-CB 3.16Å; K813-L817 PolarHBondContact O-N 2.77Å; L815-L817 VanDerWaalsContact C-N 3.26Å; L815-L817 PolarHBondContact O-N 2.99Å; L817-S820 PolarHBondContact O-OG 3.32Å; L817-Y821 HydrophobicContact CD1-CD2 4.3Å; L817-Y821 HydrophobicContact CD1-CE2 3.93Å; L817-Y821 WeakPolarHBondContact O-CD2 3.47Å
818	C	89.9	Confident	88	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-71.4	-37.9	174.3	-63.6	0	0	0	0	110.9	A814 L815 D816 Y821 D822 M823 V828 F859	A814-C818 PolarHBondContact O-N 3.5Å; A814-C818 PolarHBondContact O-SG 3.14Å; L815-C818 WeakPolarHBondContact O-CB 3.49Å; L815-C818 PolarHBondContact O-N 3Å; D816-C818 PolarHBondContact O-N 3.48Å; C818-Y821 PolarHBondContact O-N 3.16Å; C818-D822 PolarHBondContact O-N 2.92Å; C818-M823 HydrophobicContact CB-CB 4.4Å; C818-M823 WeakPolarHBondContact O-CB 3.41Å; C818-M823 PolarHBondContact O-N 2.99Å; C818-V828 HydrophobicContact CB-CG2 4.43Å; C818-F859 HydrophobicContact CB-CE2 4.43Å
819	Q	87.5	Confident	87.9	Confident	40 Å²	40	46.2 Å²	46.2	19%	0.187	24%	0.24	C	C	.	.	H	α-helix	trans	-70.1	-36	178.5	-70.8	176.6	10.8	0	0	112.2	L815 D816 Y821 D822 S862 H864	L815-Q819 HydrophobicContact CD1-CG 4.45Å; L815-Q819 WeakPolarHBondContact O-CG 3.45Å; L815-Q819 PolarHBondContact O-N 2.72Å; D816-Q819 PolarHBondContact O-N 3.29Å; Q819-Y821 PolarHBondContact O-N 3.02Å; Q819-Y821 VanDerWaalsContact O-N 3.13Å; Q819-D822 PolarHBondContact O-N 3.09Å; Q819-S862 PolarHBondContact NE2-OG 3.21Å; Q819-H864 HydrophobicContact CG-CB 4.07Å
820	S	88.3	Confident	88	Confident	61 Å²	61	41.6 Å²	41.6	43%	0.427	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.2	176.7	66.3	0	0	0	0	114.9	D816 L817	D816-S820 PolarHBondContact O-N 2.85Å; L817-S820 PolarHBondContact O-OG 3.32Å
821	Y	86.9	Confident	88	Confident	86 Å²	86	40.1 Å²	40.1	34%	0.337	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	14.8	173.2	-73.9	-74.9	0	0	0	112.6	H782 L817 C818 Q819 M823	H782-Y821 HydrophobicContact CB-CD1 3.76Å; H782-Y821 HydrophobicContact CB-CE1 4.21Å; L817-Y821 HydrophobicContact CD1-CD2 4.3Å; L817-Y821 HydrophobicContact CD1-CE2 3.93Å; L817-Y821 WeakPolarHBondContact O-CD2 3.47Å; C818-Y821 PolarHBondContact O-N 3.16Å; Q819-Y821 PolarHBondContact O-N 3.02Å; Q819-Y821 VanDerWaalsContact O-N 3.13Å; Y821-M823 PolarHBondContact O-N 3.19Å; Y821-M823 VanDerWaalsContact O-N 3.15Å
822	D	86.2	Confident	88	Confident	16 Å²	16	39.8 Å²	39.8	9%	0.086	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	33.8	-176.7	-76.8	-56.7	0	0	0	114.1	H782 C818 Q819 H864 L866 P867 Y868	H782-D822 IonicContact CD2-OD2 3.5Å; H782-D822 IonicContact CE1-OD2 3.08Å; H782-D822 IonicContact NE2-OD2 3.36Å; H782-D822 PolarHBondContact NE2-OD2 3.18Å; C818-D822 PolarHBondContact O-N 2.92Å; Q819-D822 PolarHBondContact O-N 3.09Å; D822-H864 IonicContact OD1-CE1 3.46Å; D822-H864 PolarHBondContact OD1-CE1 3.25Å; D822-L866 HydrophobicContact CB-CD2 4.45Å; D822-P867 HydrophobicContact CB-CG 4.48Å; D822-P867 VanDerWaalsContact CG-CD 3.43Å; D822-P867 WeakPolarHBondContact OD1-CD 3.33Å; D822-Y868 HydrophobicContact CB-CE1 4.49Å; D822-Y868 VanDerWaalsContact O-CE1 3.3Å; D822-Y868 WeakPolarHBondContact O-CE1 3.47Å; D822-Y868 PolarHBondContact O-OH 2.98Å
823	M	87	Confident	87.8	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	20%	0.196	C	C	.	.			trans	-84	134	-177	-63.6	171.7	58.6	0	0	112.4	T779 I802 C818 Y821 D827 V828 I831 F859	T779-M823 HydrophobicContact CG2-CG 4.17Å; I802-M823 HydrophobicContact CD1-CE 4.17Å; C818-M823 HydrophobicContact CB-CB 4.4Å; C818-M823 WeakPolarHBondContact O-CB 3.41Å; C818-M823 PolarHBondContact O-N 2.99Å; Y821-M823 PolarHBondContact O-N 3.19Å; Y821-M823 VanDerWaalsContact O-N 3.15Å; M823-D827 HydrophobicContact CB-CB 4.24Å; M823-D827 HydrophobicContact CE-CB 4.31Å; M823-V828 HydrophobicContact CE-CG2 3.77Å; M823-I831 HydrophobicContact CE-CD1 3.48Å; M823-I831 VanDerWaalsContact CE-CD1 3.48Å; M823-I831 HydrophobicContact CE-CG1 4.47Å; M823-I831 HydrophobicContact SD-CD1 4.49Å; M823-F859 WeakPolarHBondContact O-CZ 3.45Å
824	S	85.4	Confident	87.7	Confident	22 Å²	22	34.9 Å²	34.9	15%	0.154	18%	0.182	C	C	.	.			trans	-76	168.8	167.3	81.9	0	0	0	0	112.1	D826 D827 V828 F859 Y868	S824-D826 PolarHBondContact O-N 2.74Å; S824-D826 PolarHBondContact OG-N 3.44Å; S824-D827 WeakPolarHBondContact CA-OD2 3.19Å; S824-D827 WeakPolarHBondContact CB-OD2 3.29Å; S824-D827 PolarHBondContact N-OD2 3.13Å; S824-D827 WeakPolarHBondContact O-CB 3.44Å; S824-D827 PolarHBondContact O-N 3.1Å; S824-D827 PolarHBondContact OG-N 2.99Å; S824-D827 VanDerWaalsContact OG-N 3.17Å; S824-D827 PolarHBondContact OG-OD2 3.12Å; S824-V828 PolarHBondContact O-N 3.44Å; S824-F859 VanDerWaalsContact C-CZ 3.47Å; S824-Y868 PolarHBondContact N-OH 2.81Å
825	K	85	Confident	87.4	Confident	41 Å²	41	35.1 Å²	35.1	18%	0.178	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-26.5	173.6	-153.8	-149.6	104.8	-52.6	0	112.8	D829 F859	K825-D829 IonicContact NZ-OD2 3.84Å; K825-D829 PolarHBondContact NZ-OD2 3.31Å; K825-D829 PolarHBondContact O-N 3.14Å; K825-F859 HydrophobicContact CB-CD1 3.68Å; K825-F859 HydrophobicContact CB-CD2 4.24Å; K825-F859 HydrophobicContact CB-CE1 3.87Å; K825-F859 HydrophobicContact CB-CE2 4.39Å; K825-F859 HydrophobicContact CB-CG 3.92Å; K825-F859 HydrophobicContact CB-CZ 4.25Å; K825-F859 HydrophobicContact CG-CB 4.2Å; K825-F859 HydrophobicContact CG-CD1 4.09Å; K825-F859 HydrophobicContact CG-CD2 4.26Å; K825-F859 HydrophobicContact CG-CG 3.88Å
826	D	83.5	Confident	87.1	Confident	105 Å²	105	37.1 Å²	37.1	56%	0.561	20%	0.196	S	C	*	.	H	α-helix	trans	-90	-20	-174.9	-64	-15.4	0	0	0	110.7	S824 T830	S824-D826 PolarHBondContact O-N 2.74Å; S824-D826 PolarHBondContact OG-N 3.44Å; D826-T830 VanDerWaalsContact O-CB 3.23Å; D826-T830 WeakPolarHBondContact O-CB 3.49Å; D826-T830 PolarHBondContact O-N 3.25Å; D826-T830 PolarHBondContact O-OG1 3.05Å
827	D	87.6	Confident	86.8	Confident	4 Å²	4	40 Å²	40	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-67	-42.9	162.5	-61.7	-61	0	0	0	111.5	L775 H778 M823 S824 T830 I831	L775-D827 HydrophobicContact CD1-CB 3.95Å; H778-D827 IonicContact CE1-OD1 3.81Å; H778-D827 IonicContact CE1-OD2 3.74Å; H778-D827 IonicContact CG-OD2 2.76Å; H778-D827 VanDerWaalsContact ND1-CG 3.27Å; H778-D827 IonicContact ND1-OD1 3.61Å; H778-D827 PolarHBondContact ND1-OD1 3.24Å; H778-D827 IonicContact ND1-OD2 2.97Å; H778-D827 PolarHBondContact ND1-OD2 2.99Å; M823-D827 HydrophobicContact CB-CB 4.24Å; M823-D827 HydrophobicContact CE-CB 4.31Å; S824-D827 WeakPolarHBondContact CA-OD2 3.19Å; S824-D827 WeakPolarHBondContact CB-OD2 3.29Å; S824-D827 PolarHBondContact N-OD2 3.13Å; S824-D827 WeakPolarHBondContact O-CB 3.44Å; S824-D827 PolarHBondContact O-N 3.1Å; S824-D827 PolarHBondContact OG-N 2.99Å; S824-D827 VanDerWaalsContact OG-N 3.17Å; S824-D827 PolarHBondContact OG-OD2 3.12Å; D827-T830 CarbonylContact O-C 3.57Å; D827-T830 WeakPolarHBondContact O-CA 3.47Å; D827-T830 WeakPolarHBondContact O-CB 3.36Å; D827-T830 PolarHBondContact O-N 3.26Å; D827-T830 VanDerWaalsContact O-N 3.13Å; D827-I831 WeakPolarHBondContact O-CG1 3.33Å; D827-I831 PolarHBondContact O-N 2.94Å
828	V	88.7	Confident	86.2	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-45.2	175.4	-179.1	0	0	0	0	111.2	I802 C818 M823 S824 T830 I831 M832 F855	I802-V828 HydrophobicContact CD1-CG1 4.47Å; C818-V828 HydrophobicContact CB-CG2 4.43Å; M823-V828 HydrophobicContact CE-CG2 3.77Å; S824-V828 PolarHBondContact O-N 3.44Å; V828-T830 VanDerWaalsContact C-N 3.25Å; V828-T830 PolarHBondContact O-N 2.9Å; V828-I831 PolarHBondContact O-N 3.45Å; V828-M832 HydrophobicContact CG1-CE 4.42Å; V828-M832 WeakPolarHBondContact O-CG 3.49Å; V828-M832 PolarHBondContact O-N 3.12Å; V828-M832 VanDerWaalsContact O-N 3.16Å; V828-F855 HydrophobicContact CG1-CE1 4.06Å; V828-F855 HydrophobicContact CG1-CZ 4.24Å
829	D	86.3	Confident	85.7	Confident	85 Å²	85	51.5 Å²	51.5	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-64.4	-31.3	174.4	-79.6	-23.8	0	0	0	111.7	K825 E833	K825-D829 IonicContact NZ-OD2 3.84Å; K825-D829 PolarHBondContact NZ-OD2 3.31Å; K825-D829 PolarHBondContact O-N 3.14Å; D829-E833 PolarHBondContact O-N 3.13Å; D829-E833 VanDerWaalsContact O-N 3.14Å
830	T	85.9	Confident	85.4	Confident	9 Å²	9	57.9 Å²	57.9	6%	0.055	28%	0.284	C	S	.	.	H	α-helix	trans	-68.2	-47.4	174.2	-70.7	0	0	0	0	112.6	Q771 D826 D827 V828 M832 E833 L834	Q771-T830 HydrophobicContact CB-CG2 3.71Å; Q771-T830 PolarHBondContact NE2-OG1 3.02Å; D826-T830 VanDerWaalsContact O-CB 3.23Å; D826-T830 WeakPolarHBondContact O-CB 3.49Å; D826-T830 PolarHBondContact O-N 3.25Å; D826-T830 PolarHBondContact O-OG1 3.05Å; D827-T830 CarbonylContact O-C 3.57Å; D827-T830 WeakPolarHBondContact O-CA 3.47Å; D827-T830 WeakPolarHBondContact O-CB 3.36Å; D827-T830 PolarHBondContact O-N 3.26Å; D827-T830 VanDerWaalsContact O-N 3.13Å; V828-T830 VanDerWaalsContact C-N 3.25Å; V828-T830 PolarHBondContact O-N 2.9Å; T830-M832 PolarHBondContact O-N 3.36Å; T830-E833 PolarHBondContact O-N 3.1Å; T830-E833 VanDerWaalsContact O-N 3.08Å; T830-L834 HydrophobicContact CG2-CD1 3.7Å; T830-L834 HydrophobicContact CG2-CG 4.2Å; T830-L834 WeakPolarHBondContact O-CG 3.15Å; T830-L834 PolarHBondContact O-N 3.13Å
831	I	90.1	Very high	84.9	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-38.9	175.2	-73.3	-173.7	0	0	0	110.9	L775 V795 M798 R799 M823 D827 V828 G835	L775-I831 HydrophobicContact CD1-CD1 3.97Å; L775-I831 HydrophobicContact CD1-CG1 4.09Å; L775-I831 HydrophobicContact CD2-CD1 4.1Å; L775-I831 HydrophobicContact CD2-CG1 3.64Å; V795-I831 HydrophobicContact CG1-CG2 4.4Å; V795-I831 HydrophobicContact CG2-CG1 4.49Å; M798-I831 HydrophobicContact CB-CD1 3.83Å; M798-I831 HydrophobicContact CG-CD1 4.41Å; M798-I831 HydrophobicContact SD-CD1 3.7Å; R799-I831 HydrophobicContact CB-CG2 3.75Å; M823-I831 HydrophobicContact CE-CD1 3.48Å; M823-I831 VanDerWaalsContact CE-CD1 3.48Å; M823-I831 HydrophobicContact CE-CG1 4.47Å; M823-I831 HydrophobicContact SD-CD1 4.49Å; D827-I831 WeakPolarHBondContact O-CG1 3.33Å; D827-I831 PolarHBondContact O-N 2.94Å; V828-I831 PolarHBondContact O-N 3.45Å; I831-G835 PolarHBondContact O-N 2.95Å
832	M	87.6	Confident	84.5	Confident	15 Å²	15	62.3 Å²	62.3	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-67.3	-35.5	176.4	-62.9	-75.2	167.8	0	0	112.4	R799 I802 M803 V828 T830 T836	R799-M832 HydrophobicContact CG-SD 4.11Å; I802-M832 HydrophobicContact CG2-CE 4.08Å; M803-M832 HydrophobicContact CG-CE 4.03Å; M803-M832 HydrophobicContact CG-SD 4.41Å; M803-M832 HydrophobicContact SD-CE 3.97Å; M803-M832 HydrophobicContact SD-SD 4.18Å; V828-M832 HydrophobicContact CG1-CE 4.42Å; V828-M832 WeakPolarHBondContact O-CG 3.49Å; V828-M832 PolarHBondContact O-N 3.12Å; V828-M832 VanDerWaalsContact O-N 3.16Å; T830-M832 PolarHBondContact O-N 3.36Å; M832-T836 PolarHBondContact O-OG1 3.03Å
833	E	86.4	Confident	84.1	Confident	68 Å²	68	62.6 Å²	62.6	32%	0.318	30%	0.303	S	S	.	.	H	α-helix	trans	-73.9	-43.6	174.1	-171.1	170.5	-171.6	0	0	112.4	R767 L768 D829 T830 T836	R767-E833 IonicContact CZ-OE1 2.66Å; R767-E833 IonicContact CZ-OE2 2.81Å; R767-E833 IonicContact NH1-OE1 2.8Å; R767-E833 IonicContact NH1-OE2 2.69Å; R767-E833 PolarHBondContact NH1-OE2 2.94Å; R767-E833 VanDerWaalsContact NH2-CD 3.31Å; R767-E833 IonicContact NH2-OE1 2.87Å; R767-E833 PolarHBondContact NH2-OE1 3.47Å; R767-E833 IonicContact NH2-OE2 3.72Å; R767-E833 PolarHBondContact NH2-OE2 2.76Å; L768-E833 HydrophobicContact CD2-CG 4.07Å; D829-E833 PolarHBondContact O-N 3.13Å; D829-E833 VanDerWaalsContact O-N 3.14Å; T830-E833 PolarHBondContact O-N 3.1Å; T830-E833 VanDerWaalsContact O-N 3.08Å; E833-T836 PolarHBondContact O-N 3.22Å
834	L	87.5	Confident	83.7	Confident	30 Å²	30	64.1 Å²	64.1	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-62.6	-47	178.1	-71	170.9	0	0	0	111.5	L768 L772 L775 V795 T830 T836	L768-L834 HydrophobicContact CB-CD2 4.15Å; L768-L834 HydrophobicContact CD1-CD2 4.49Å; L768-L834 HydrophobicContact CD2-CD2 4.05Å; L768-L834 HydrophobicContact CG-CD2 4.46Å; L772-L834 HydrophobicContact CB-CD1 4.26Å; L772-L834 HydrophobicContact CD1-CD1 4.06Å; L775-L834 HydrophobicContact CD2-CD1 4.35Å; V795-L834 HydrophobicContact CG1-CB 3.91Å; V795-L834 HydrophobicContact CG2-CD1 4.18Å; T830-L834 HydrophobicContact CG2-CD1 3.7Å; T830-L834 HydrophobicContact CG2-CG 4.2Å; T830-L834 WeakPolarHBondContact O-CG 3.15Å; T830-L834 PolarHBondContact O-N 3.13Å; L834-T836 PolarHBondContact O-N 3.36Å; L834-T836 VanDerWaalsContact O-N 3.08Å
835	G	83.4	Confident	83.4	Confident	4 Å²	4	66 Å²	66	4%	0.041	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	10.6	178.7	0	0	0	0	0	115.4	R799 I831	R799-G835 PolarHBondContact NH1-O 3.48Å; I831-G835 PolarHBondContact O-N 2.95Å
836	T	85.2	Confident	83.2	Confident	59 Å²	59	71.7 Å²	71.7	36%	0.362	35%	0.349	S	S	.	.			trans	-102.1	92	179.9	-68.1	0	0	0	0	112	M832 E833 L834	M832-T836 PolarHBondContact O-OG1 3.03Å; E833-T836 PolarHBondContact O-N 3.22Å; L834-T836 PolarHBondContact O-N 3.36Å; L834-T836 VanDerWaalsContact O-N 3.08Å
837	W	84.2	Confident	83.2	Confident	145 Å²	145	67.5 Å²	67.5	55%	0.549	33%	0.326	S	S	.	.			trans	-74.9	146.9	176.7	-67.4	88.9	0	0	0	113.5	R840	W837-R840 HydrophobicContact CB-CB 4.49Å; W837-R840 HydrophobicContact CB-CG 4.26Å; W837-R840 PolarHBondContact O-N 3.15Å
838	P	78	Confident	83.1	Confident	98 Å²	98	69.6 Å²	69.6	64%	0.636	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	147.2	171.1	-27	35.7	0	0	0	113.1	R840	P838-R840 PolarHBondContact O-N 2.73Å
839	H	79.7	Confident	82.9	Confident	186 Å²	186	72 Å²	72	86%	0.861	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	-15.6	-176.2	-46.9	-84.3	0	0	0	116.5
840	R	81.3	Confident	83	Confident	175 Å²	175	75 Å²	75	66%	0.66	37%	0.367	S	S	*	.	S	Bend	trans	-75.9	151.7	166.8	-63.5	-166.8	177.8	-176.7	-0.5	110.3	W837 P838	W837-R840 HydrophobicContact CB-CB 4.49Å; W837-R840 HydrophobicContact CB-CG 4.26Å; W837-R840 PolarHBondContact O-N 3.15Å; P838-R840 PolarHBondContact O-N 2.73Å
841	K	76.8	Confident	83.2	Confident	181 Å²	181	75 Å²	75	79%	0.787	37%	0.367	S	S	*	.			trans	-87.4	130	172	-67.6	172.7	-173.4	160.4	0	108.8	P843	K841-P843 WeakPolarHBondContact O-CD 3.34Å
842	D	77.7	Confident	83	Confident	58 Å²	58	75.9 Å²	75.9	31%	0.31	37%	0.371	S	S	.	.			trans	-36.3	116.8	164.9	162.8	27.6	0	0	0	111.4	M844 S845	D842-M844 PolarHBondContact O-N 2.89Å; D842-M844 WeakPolarHBondContact OD1-CA 3.34Å; D842-M844 WeakPolarHBondContact OD1-CB 3.36Å; D842-M844 PolarHBondContact OD1-N 2.91Å; D842-S845 WeakPolarHBondContact O-CB 3.45Å; D842-S845 PolarHBondContact O-N 2.98Å; D842-S845 PolarHBondContact O-OG 2.96Å; D842-S845 PolarHBondContact OD2-N 3.33Å
843	P	79.1	Confident	83	Confident	22 Å²	22	76.9 Å²	76.9	14%	0.143	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-57.9	-36.5	177.6	-27.4	37.5	0	0	0	113	M803 K841 S845 K846	M803-P843 VanDerWaalsContact CE-C 3.46Å; M803-P843 HydrophobicContact CE-CB 3.89Å; M803-P843 WeakPolarHBondContact CE-O 3.43Å; M803-P843 HydrophobicContact CG-CB 4.11Å; M803-P843 HydrophobicContact SD-CB 4.15Å; K841-P843 WeakPolarHBondContact O-CD 3.34Å; P843-S845 PolarHBondContact O-N 3.27Å; P843-S845 VanDerWaalsContact O-N 3.14Å; P843-K846 WeakPolarHBondContact O-CB 3.21Å; P843-K846 PolarHBondContact O-N 3.42Å
844	M	77.5	Confident	83.2	Confident	35 Å²	35	75.3 Å²	75.3	17%	0.172	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-61.8	-21.2	177.1	-174.6	59.3	114.9	0	0	111.1	D842 K846 L847 K852	D842-M844 PolarHBondContact O-N 2.89Å; D842-M844 WeakPolarHBondContact OD1-CA 3.34Å; D842-M844 WeakPolarHBondContact OD1-CB 3.36Å; D842-M844 PolarHBondContact OD1-N 2.91Å; M844-K846 PolarHBondContact O-N 3.13Å; M844-L847 PolarHBondContact O-N 2.95Å; M844-L847 HydrophobicContact SD-CB 4.28Å; M844-L847 HydrophobicContact SD-CD1 3.61Å; M844-K852 HydrophobicContact CE-CG 4.23Å; M844-K852 HydrophobicContact CG-CD 4.22Å; M844-K852 WeakPolarHBondContact O-CE 3.46Å; M844-K852 PolarHBondContact O-NZ 2.89Å; M844-K852 HydrophobicContact SD-CD 3.77Å; M844-K852 WeakPolarHBondContact SD-CE 3.49Å; M844-K852 HydrophobicContact SD-CG 3.68Å
845	S	79.1	Confident	83.3	Confident	61 Å²	61	74.5 Å²	74.5	43%	0.427	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-66.3	-12.1	172.9	118	0	0	0	0	114.1	D842 P843	D842-S845 WeakPolarHBondContact O-CB 3.45Å; D842-S845 PolarHBondContact O-N 2.98Å; D842-S845 PolarHBondContact O-OG 2.96Å; D842-S845 PolarHBondContact OD2-N 3.33Å; P843-S845 PolarHBondContact O-N 3.27Å; P843-S845 VanDerWaalsContact O-N 3.14Å
846	K	81.5	Confident	83.4	Confident	162 Å²	162	76.3 Å²	76.3	70%	0.704	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-83.6	-29	175	-62	175.1	-178	172.3	0	112.8	P843 M844	P843-K846 WeakPolarHBondContact O-CB 3.21Å; P843-K846 PolarHBondContact O-N 3.42Å; M844-K846 PolarHBondContact O-N 3.13Å
847	L	83.2	Confident	83.6	Confident	16 Å²	16	81.9 Å²	81.9	8%	0.084	40%	0.4	C	S	.	.	S	Bend	trans	-78.2	146.4	-171.6	-73	169.6	0	0	0	113.2	M803 L806 N807 M844 K852	M803-L847 HydrophobicContact CE-CD1 3.47Å; M803-L847 VanDerWaalsContact CE-CD1 3.47Å; M803-L847 HydrophobicContact CE-CD2 4.48Å; M803-L847 HydrophobicContact CE-CG 3.71Å; M803-L847 HydrophobicContact SD-CD1 3.6Å; M803-L847 HydrophobicContact SD-CG 4.49Å; L806-L847 VanDerWaalsContact C-CD2 3.42Å; L806-L847 HydrophobicContact CB-CD1 3.63Å; L806-L847 HydrophobicContact CB-CD2 3.81Å; L806-L847 HydrophobicContact CB-CG 4.4Å; L806-L847 HydrophobicContact CD1-CD1 3.86Å; L806-L847 HydrophobicContact CG-CD1 4.39Å; L806-L847 WeakPolarHBondContact O-CD2 3.42Å; N807-L847 HydrophobicContact CB-CD2 4.41Å; N807-L847 WeakPolarHBondContact OD1-CD2 3.24Å; M844-L847 PolarHBondContact O-N 2.95Å; M844-L847 HydrophobicContact SD-CB 4.28Å; M844-L847 HydrophobicContact SD-CD1 3.61Å; L847-K852 HydrophobicContact CB-CG 4.32Å; L847-K852 VanDerWaalsContact O-CE 3.25Å; L847-K852 WeakPolarHBondContact O-CE 3.46Å
848	S	85.3	Confident	83.8	Confident	48 Å²	48	76.3 Å²	76.3	34%	0.336	39%	0.385	S	S	.	.			trans	-67.3	144.6	176.3	98.8	0	0	0	0	111.4	K850 T851 K852	S848-K850 PolarHBondContact O-N 3.35Å; S848-K850 PolarHBondContact OG-N 3.02Å; S848-T851 PolarHBondContact O-N 3.1Å; S848-T851 VanDerWaalsContact O-N 3.1Å; S848-T851 PolarHBondContact OG-N 3.44Å; S848-T851 PolarHBondContact OG-OG1 3.48Å; S848-K852 WeakPolarHBondContact O-CG 3.35Å; S848-K852 PolarHBondContact O-N 3.45Å; S848-K852 VanDerWaalsContact O-N 3.09Å
849	S	85.5	Confident	84.2	Confident	56 Å²	56	73.1 Å²	73.1	39%	0.392	36%	0.361	S	S	.	.	H	α-helix	trans	-66.1	-22.5	176.5	48.3	0	0	0	0	112.8	D176 A853	D176-S849 WeakPolarHBondContact OD1-CB 3.36Å; D176-S849 PolarHBondContact OD1-OG 2.89Å; S849-A853 VanDerWaalsContact O-CB 3.24Å; S849-A853 WeakPolarHBondContact O-CB 3.29Å; S849-A853 PolarHBondContact O-N 2.88Å
850	K	87.8	Confident	84.3	Confident	148 Å²	148	69.9 Å²	69.9	64%	0.643	35%	0.35	S	S	*	.	H	α-helix	trans	-62.8	-48.9	168	179	-163.5	168.3	-148.3	0	110.9	E809 S848 A853 A854	E809-K850 IonicContact OE2-NZ 3.62Å; S848-K850 PolarHBondContact O-N 3.35Å; S848-K850 PolarHBondContact OG-N 3.02Å; K850-A853 PolarHBondContact O-N 3.08Å; K850-A854 WeakPolarHBondContact O-CB 3.39Å; K850-A854 PolarHBondContact O-N 2.88Å
851	T	89.5	Confident	84.5	Confident	7 Å²	7	66.7 Å²	66.7	4%	0.043	35%	0.35	C	S	.	.	H	α-helix	trans	-65.6	-43.9	-178.7	-38.3	0	0	0	0	111.2	L806 E809 V811 S848 A853 A854 F855	L806-T851 HydrophobicContact CD2-CG2 4.43Å; E809-T851 PolarHBondContact OE1-OG1 3.49Å; V811-T851 HydrophobicContact CG2-CG2 4.05Å; S848-T851 PolarHBondContact O-N 3.1Å; S848-T851 VanDerWaalsContact O-N 3.1Å; S848-T851 PolarHBondContact OG-N 3.44Å; S848-T851 PolarHBondContact OG-OG1 3.48Å; T851-A853 PolarHBondContact O-N 2.88Å; T851-A854 PolarHBondContact O-N 3.16Å; T851-F855 PolarHBondContact O-N 3.37Å
852	K	86.7	Confident	84.7	Confident	19 Å²	19	60 Å²	60	8%	0.083	33%	0.326	C	S	.	.	H	α-helix	trans	-58.5	-45.3	174.2	-62.8	178.6	-168.7	-175.7	0	112.4	M844 L847 S848 A854 T856	M844-K852 HydrophobicContact CE-CG 4.23Å; M844-K852 HydrophobicContact CG-CD 4.22Å; M844-K852 WeakPolarHBondContact O-CE 3.46Å; M844-K852 PolarHBondContact O-NZ 2.89Å; M844-K852 HydrophobicContact SD-CD 3.77Å; M844-K852 WeakPolarHBondContact SD-CE 3.49Å; M844-K852 HydrophobicContact SD-CG 3.68Å; L847-K852 HydrophobicContact CB-CG 4.32Å; L847-K852 VanDerWaalsContact O-CE 3.25Å; L847-K852 WeakPolarHBondContact O-CE 3.46Å; S848-K852 WeakPolarHBondContact O-CG 3.35Å; S848-K852 PolarHBondContact O-N 3.45Å; S848-K852 VanDerWaalsContact O-N 3.09Å; K852-A854 VanDerWaalsContact C-N 3.33Å; K852-T856 WeakPolarHBondContact O-CB 3.4Å; K852-T856 PolarHBondContact O-N 3.14Å; K852-T856 PolarHBondContact O-OG1 3.41Å
853	A	88.1	Confident	84.5	Confident	36 Å²	36	63.7 Å²	63.7	30%	0.298	35%	0.351	S	S	.	.	H	α-helix	trans	-68.5	-31.5	178	0	0	0	0	0	112.6	S849 K850 T851 R857	S849-A853 VanDerWaalsContact O-CB 3.24Å; S849-A853 WeakPolarHBondContact O-CB 3.29Å; S849-A853 PolarHBondContact O-N 2.88Å; K850-A853 PolarHBondContact O-N 3.08Å; T851-A853 PolarHBondContact O-N 2.88Å; A853-R857 WeakPolarHBondContact O-CB 3.34Å; A853-R857 WeakPolarHBondContact O-CD 3.3Å; A853-R857 WeakPolarHBondContact O-CG 3.24Å; A853-R857 PolarHBondContact O-N 3.38Å
854	A	89.9	Confident	84.4	Confident	36 Å²	36	66.1 Å²	66.1	30%	0.298	36%	0.36	S	S	.	.	H	α-helix	trans	-68.8	-49.5	173.4	0	0	0	0	0	111.5	V811 K850 T851 K852 T856 R857 A858	V811-A854 HydrophobicContact CG2-CB 3.97Å; K850-A854 WeakPolarHBondContact O-CB 3.39Å; K850-A854 PolarHBondContact O-N 2.88Å; T851-A854 PolarHBondContact O-N 3.16Å; K852-A854 VanDerWaalsContact C-N 3.33Å; A854-T856 PolarHBondContact O-N 3.2Å; A854-R857 WeakPolarHBondContact O-CB 3.41Å; A854-R857 PolarHBondContact O-N 3.42Å; A854-R857 VanDerWaalsContact O-N 3.09Å; A854-A858 PolarHBondContact O-N 2.7Å
855	F	89.4	Confident	84.2	Confident	12 Å²	12	69.8 Å²	69.8	5%	0.053	38%	0.378	C	S	.	.	H	α-helix	trans	-58.4	-46.1	176.4	-178.8	-108.4	0	0	0	112.5	L806 V811 A814 V828 T851 R857 A858 F859	L806-F855 HydrophobicContact CD2-CB 3.96Å; L806-F855 HydrophobicContact CD2-CD2 3.83Å; L806-F855 HydrophobicContact CD2-CG 3.93Å; V811-F855 HydrophobicContact CG1-CB 4.21Å; V811-F855 HydrophobicContact CG1-CD2 4.42Å; A814-F855 HydrophobicContact CB-CD2 4.19Å; A814-F855 HydrophobicContact CB-CE2 4.01Å; V828-F855 HydrophobicContact CG1-CE1 4.06Å; V828-F855 HydrophobicContact CG1-CZ 4.24Å; T851-F855 PolarHBondContact O-N 3.37Å; F855-R857 VanDerWaalsContact C-N 3.27Å; F855-R857 PolarHBondContact O-N 3.03Å; F855-A858 PolarHBondContact O-N 2.95Å; F855-F859 PolarHBondContact O-N 3.15Å
856	T	87	Confident	84.2	Confident	43 Å²	43	68.2 Å²	68.2	26%	0.264	37%	0.365	S	S	.	.	H	α-helix	trans	-58.5	-37.3	174.8	-53.8	0	0	0	0	112.4	K852 A854 N860	K852-T856 WeakPolarHBondContact O-CB 3.4Å; K852-T856 PolarHBondContact O-N 3.14Å; K852-T856 PolarHBondContact O-OG1 3.41Å; A854-T856 PolarHBondContact O-N 3.2Å; T856-N860 WeakPolarHBondContact O-CB 3.41Å; T856-N860 PolarHBondContact O-N 3.07Å; T856-N860 PolarHBondContact O-ND2 2.86Å; T856-N860 PolarHBondContact O-OD1 3.35Å
857	R	87.9	Confident	83.8	Confident	176 Å²	176	64.1 Å²	64.1	66%	0.664	36%	0.355	S	S	*	.	H	α-helix	trans	-73.6	-39.3	176.8	-72.8	167.3	-167.8	-176.8	4.6	112.2	A853 A854 F855 N860 T861	A853-R857 WeakPolarHBondContact O-CB 3.34Å; A853-R857 WeakPolarHBondContact O-CD 3.3Å; A853-R857 WeakPolarHBondContact O-CG 3.24Å; A853-R857 PolarHBondContact O-N 3.38Å; A854-R857 WeakPolarHBondContact O-CB 3.41Å; A854-R857 PolarHBondContact O-N 3.42Å; A854-R857 VanDerWaalsContact O-N 3.09Å; F855-R857 VanDerWaalsContact C-N 3.27Å; F855-R857 PolarHBondContact O-N 3.03Å; R857-N860 CarbonylContact O-C 3.6Å; R857-N860 PolarHBondContact O-N 3.5Å; R857-T861 WeakPolarHBondContact O-CB 3.31Å; R857-T861 PolarHBondContact O-N 3.47Å; R857-T861 PolarHBondContact O-OG1 3.33Å
858	A	88.4	Confident	83.4	Confident	27 Å²	27	66.6 Å²	66.6	22%	0.223	36%	0.364	C	S	.	.	H	α-helix	trans	-60.7	-49.5	178.7	0	0	0	0	0	110.2	V811 L815 A854 F855 N860 T861 S862	V811-A858 HydrophobicContact CG1-CB 3.79Å; L815-A858 HydrophobicContact CD2-CB 3.89Å; A854-A858 PolarHBondContact O-N 2.7Å; F855-A858 PolarHBondContact O-N 2.95Å; A858-N860 PolarHBondContact O-N 3.39Å; A858-T861 PolarHBondContact O-N 3.05Å; A858-S862 PolarHBondContact O-N 3.2Å; A858-S862 PolarHBondContact O-OG 2.94Å
859	F	85.9	Confident	82.6	Confident	31 Å²	31	67.4 Å²	67.4	14%	0.136	36%	0.364	C	S	.	.	H	α-helix	trans	-59.6	-44.7	174.9	-152.3	-67.1	0	0	0	112.4	L815 C818 M823 S824 K825 F855 T861 S862	L815-F859 HydrophobicContact CD1-CB 4.25Å; L815-F859 HydrophobicContact CD1-CD2 3.57Å; L815-F859 HydrophobicContact CD1-CE2 4.09Å; L815-F859 HydrophobicContact CD1-CG 4.14Å; C818-F859 HydrophobicContact CB-CE2 4.43Å; M823-F859 WeakPolarHBondContact O-CZ 3.45Å; S824-F859 VanDerWaalsContact C-CZ 3.47Å; K825-F859 HydrophobicContact CB-CD1 3.68Å; K825-F859 HydrophobicContact CB-CD2 4.24Å; K825-F859 HydrophobicContact CB-CE1 3.87Å; K825-F859 HydrophobicContact CB-CE2 4.39Å; K825-F859 HydrophobicContact CB-CG 3.92Å; K825-F859 HydrophobicContact CB-CZ 4.25Å; K825-F859 HydrophobicContact CG-CB 4.2Å; K825-F859 HydrophobicContact CG-CD1 4.09Å; K825-F859 HydrophobicContact CG-CD2 4.26Å; K825-F859 HydrophobicContact CG-CG 3.88Å; F855-F859 PolarHBondContact O-N 3.15Å; F859-T861 PolarHBondContact O-N 3.41Å; F859-T861 VanDerWaalsContact O-N 3.11Å; F859-S862 PolarHBondContact O-N 2.98Å; F859-S862 PolarHBondContact O-OG 3.1Å
860	N	83.3	Confident	81.4	Confident	118 Å²	118	70.2 Å²	70.2	63%	0.631	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.6	176.5	-69.8	-1.9	0	0	0	114.3	T856 R857 A858	T856-N860 WeakPolarHBondContact O-CB 3.41Å; T856-N860 PolarHBondContact O-N 3.07Å; T856-N860 PolarHBondContact O-ND2 2.86Å; T856-N860 PolarHBondContact O-OD1 3.35Å; R857-N860 CarbonylContact O-C 3.6Å; R857-N860 PolarHBondContact O-N 3.5Å; A858-N860 PolarHBondContact O-N 3.39Å
861	T	85.4	Confident	79.7	Confident	109 Å²	109	68.3 Å²	68.3	67%	0.669	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-23.1	-179.3	-51.7	0	0	0	0	112.2	R857 A858 F859	R857-T861 WeakPolarHBondContact O-CB 3.31Å; R857-T861 PolarHBondContact O-N 3.47Å; R857-T861 PolarHBondContact O-OG1 3.33Å; A858-T861 PolarHBondContact O-N 3.05Å; F859-T861 PolarHBondContact O-N 3.41Å; F859-T861 VanDerWaalsContact O-N 3.11Å
862	S	79.8	Confident	77.7	Confident	39 Å²	39	68.5 Å²	68.5	27%	0.273	38%	0.382	S	S	.	.			trans	-64.7	135.5	177.3	44	0	0	0	0	112.4	Q819 A858 F859 H864	Q819-S862 PolarHBondContact NE2-OG 3.21Å; A858-S862 PolarHBondContact O-N 3.2Å; A858-S862 PolarHBondContact O-OG 2.94Å; F859-S862 PolarHBondContact O-N 2.98Å; F859-S862 PolarHBondContact O-OG 3.1Å; S862-H864 VanDerWaalsContact C-N 3.31Å
863	T	74.4	Confident	75.6	Confident	137 Å²	137	70.2 Å²	70.2	84%	0.84	40%	0.4	S	S	*	.			trans	-97	29.2	176.6	57.3	0	0	0	0	112.1	M865	T863-M865 PolarHBondContact O-N 3.36Å
864	H	76.8	Confident	73.3	Confident	73 Å²	73	72.5 Å²	72.5	34%	0.338	41%	0.411	S	S	.	.			trans	-67.1	122.9	177.5	-162.3	-91.9	0	0	0	109	Q819 D822 S862	Q819-H864 HydrophobicContact CG-CB 4.07Å; D822-H864 IonicContact OD1-CE1 3.46Å; D822-H864 PolarHBondContact OD1-CE1 3.25Å; S862-H864 VanDerWaalsContact C-N 3.31Å
865	M	74	Confident	71	Confident	111 Å²	111	75.2 Å²	75.2	55%	0.547	42%	0.42	S	S	.	.			trans	-91.4	109.1	178.5	-69.6	-95.5	55	0	0	108.1	T863 D869	T863-M865 PolarHBondContact O-N 3.36Å; M865-D869 HydrophobicContact CE-CB 4.47Å; M865-D869 WeakPolarHBondContact CE-OD2 3.35Å
866	L	78.8	Confident	68.6	Low	29 Å²	29	79.4 Å²	79.4	15%	0.152	44%	0.443	C	S	.	.			trans	-76.3	138	-178.1	-61.1	162.7	0	0	0	109.2	D822 Y868 D869	D822-L866 HydrophobicContact CB-CD2 4.45Å; L866-Y868 HydrophobicContact CB-CD1 4.46Å; L866-Y868 HydrophobicContact CB-CD2 4.37Å; L866-Y868 HydrophobicContact CB-CE1 4.04Å; L866-Y868 HydrophobicContact CB-CE2 3.95Å; L866-Y868 HydrophobicContact CD1-CE2 4.04Å; L866-Y868 PolarHBondContact O-N 2.94Å; L866-D869 HydrophobicContact CB-CB 4.3Å; L866-D869 WeakPolarHBondContact O-CB 3.27Å; L866-D869 PolarHBondContact O-N 3.49Å
867	P	72.7	Confident	66.3	Low	75 Å²	75	87.3 Å²	87.3	49%	0.487	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-25	-174.4	-30.7	36.9	0	0	0	115.3	I781 D822	I781-P867 HydrophobicContact CD1-CB 3.74Å; I781-P867 HydrophobicContact CD1-CG 3.66Å; D822-P867 HydrophobicContact CB-CG 4.48Å; D822-P867 VanDerWaalsContact CG-CD 3.43Å; D822-P867 WeakPolarHBondContact OD1-CD 3.33Å
868	Y	75.5	Confident	63.9	Low	69 Å²	69	89.2 Å²	89.2	27%	0.271	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-0.8	179.7	48.3	-93.2	0	0	0	114.5	H778 D822 S824 L866 V870	H778-Y868 HydrophobicContact CB-CD1 4.36Å; H778-Y868 HydrophobicContact CB-CE1 3.62Å; H778-Y868 AromaticContact CD2-CD1 3.57Å; H778-Y868 AromaticContact CD2-CD2 3.77Å; H778-Y868 AromaticContact CD2-CE1 3.47Å; H778-Y868 VanDerWaalsContact CD2-CE1 3.47Å; H778-Y868 WeakPolarHBondContact CD2-CE1 3.3Å; H778-Y868 AromaticContact CD2-CE2 3.66Å; H778-Y868 AromaticContact CD2-CG 3.71Å; H778-Y868 AromaticContact CD2-CZ 3.5Å; H778-Y868 AromaticContact CE1-CE2 3.84Å; H778-Y868 AromaticContact CG-CE1 3.54Å; H778-Y868 AromaticContact CG-CE2 3.99Å; H778-Y868 AromaticContact CG-CZ 3.45Å; H778-Y868 VanDerWaalsContact CG-CZ 3.45Å; H778-Y868 AromaticContact ND1-CZ 3.79Å; H778-Y868 AromaticContact NE2-CD2 3.67Å; H778-Y868 AromaticContact NE2-CE2 3.58Å; H778-Y868 AromaticContact NE2-CZ 3.89Å; D822-Y868 HydrophobicContact CB-CE1 4.49Å; D822-Y868 VanDerWaalsContact O-CE1 3.3Å; D822-Y868 WeakPolarHBondContact O-CE1 3.47Å; D822-Y868 PolarHBondContact O-OH 2.98Å; S824-Y868 PolarHBondContact N-OH 2.81Å; L866-Y868 HydrophobicContact CB-CD1 4.46Å; L866-Y868 HydrophobicContact CB-CD2 4.37Å; L866-Y868 HydrophobicContact CB-CE1 4.04Å; L866-Y868 HydrophobicContact CB-CE2 3.95Å; L866-Y868 HydrophobicContact CD1-CE2 4.04Å; L866-Y868 PolarHBondContact O-N 2.94Å; Y868-V870 PolarHBondContact O-N 3.48Å
869	D	68	Low	61.4	Low	64 Å²	64	95.4 Å²	95.4	34%	0.342	50%	0.497	S	S	.	.			trans	-81.4	49.5	-177.2	-167.9	15.6	0	0	0	113.4	M865 L866 V871 G872	M865-D869 HydrophobicContact CE-CB 4.47Å; M865-D869 WeakPolarHBondContact CE-OD2 3.35Å; L866-D869 HydrophobicContact CB-CB 4.3Å; L866-D869 WeakPolarHBondContact O-CB 3.27Å; L866-D869 PolarHBondContact O-N 3.49Å; D869-V871 PolarHBondContact O-N 2.93Å; D869-V871 VanDerWaalsContact O-N 3.13Å; D869-G872 PolarHBondContact O-N 3.02Å; D869-G872 VanDerWaalsContact O-N 3.13Å; D869-G872 WeakPolarHBondContact OD1-CA 3.39Å; D869-G872 PolarHBondContact OD1-N 3.37Å; D869-G872 VanDerWaalsContact OD1-N 3.13Å
870	V	60.5	Low	59.1	Low	115 Å²	115	104.9 Å²	104.9	70%	0.697	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.2	-175.3	-174.1	0	0	0	0	112.2	Y868	Y868-V870 PolarHBondContact O-N 3.48Å
871	V	52.6	Low	56.6	Low	108 Å²	108	106 Å²	106	66%	0.655	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-30.5	179.6	-173.8	0	0	0	0	112.3	D869 A873 T874 L875	D869-V871 PolarHBondContact O-N 2.93Å; D869-V871 VanDerWaalsContact O-N 3.13Å; V871-A873 PolarHBondContact O-N 3.39Å; V871-T874 PolarHBondContact O-OG1 2.87Å; V871-L875 HydrophobicContact CG1-CD1 4.34Å
872	G	46.6	Very low	54.1	Low	11 Å²	11	106.5 Å²	106.5	11%	0.113	54%	0.542	C	S	.	.	H	α-helix	trans	-66	-34.6	-179.4	0	0	0	0	0	114.2	D869 T874 L875 N876	D869-G872 PolarHBondContact O-N 3.02Å; D869-G872 VanDerWaalsContact O-N 3.13Å; D869-G872 WeakPolarHBondContact OD1-CA 3.39Å; D869-G872 PolarHBondContact OD1-N 3.37Å; D869-G872 VanDerWaalsContact OD1-N 3.13Å; G872-T874 PolarHBondContact O-N 2.72Å; G872-L875 PolarHBondContact O-N 3Å; G872-N876 PolarHBondContact O-N 3.06Å
873	A	42.6	Very low	51.7	Low	55 Å²	55	111.5 Å²	111.5	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-60.2	-40.5	-174.6	0	0	0	0	0	113.9	V871	V871-A873 PolarHBondContact O-N 3.39Å
874	T	40.9	Very low	49.6	Very low	85 Å²	85	112 Å²	112	52%	0.521	57%	0.568	S	S	.	*	H	α-helix	trans	-76.4	-35.3	-176.9	62.7	0	0	0	0	112.6	V871 G872	V871-T874 PolarHBondContact O-OG1 2.87Å; G872-T874 PolarHBondContact O-N 2.72Å
875	L	40.3	Very low	47.4	Very low	93 Å²	93	114.8 Å²	114.8	49%	0.487	59%	0.59	S	S	.	*	H	α-helix	trans	-79.9	-23.5	-175.2	-79.2	164.3	0	0	0	114.2	V871 G872	V871-L875 HydrophobicContact CG1-CD1 4.34Å; G872-L875 PolarHBondContact O-N 3Å
876	N	40.1	Very low	45.4	Very low	100 Å²	100	116.8 Å²	116.8	54%	0.535	60%	0.602	S	S	.	*	H	α-helix	trans	-89.2	-28.7	178.8	-77.5	-30.3	0	0	0	113.6	G872	G872-N876 PolarHBondContact O-N 3.06Å
877	R	38	Very low	43	Very low	208 Å²	208	123.5 Å²	123.5	79%	0.785	64%	0.639	S	S	*	*	H	α-helix	trans	-63.2	-42.5	168.3	-87.4	-172.4	174.6	-174	-0.3	111.9	K879 R880	R877-K879 PolarHBondContact O-N 3.39Å; R877-R880 PolarHBondContact O-N 3.43Å
878	R	36.7	Very low	41.2	Very low	216 Å²	216	125.3 Å²	125.3	82%	0.815	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	8.6	178.8	-78.6	-179.4	163.7	169.7	-4.5	116.2
879	K	37.1	Very low	39.2	Very low	158 Å²	158	127.8 Å²	127.8	69%	0.687	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.7	3.7	177.8	-80.2	174	-173	139	0	114.9	R877	R877-K879 PolarHBondContact O-N 3.39Å
880	R	37.9	Very low	37.2	Very low	229 Å²	229	132.8 Å²	132.8	86%	0.864	69%	0.692	S	S	*	*	S	Bend	trans	-126.5	2	-174.6	-74	-169.1	173.7	-170.3	0.2	115.6	R877	R877-R880 PolarHBondContact O-N 3.43Å
881	L	31	Very low	35.6	Very low	142 Å²	142	134.7 Å²	134.7	74%	0.743	70%	0.698	S	S	*	*	S	Bend	trans	-111.8	136.3	174.1	-70.7	165.1	0	0	0	109.4
882	P	32.4	Very low	34.5	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	70%	0.699	S	S	*	*			trans	-56.7	148.7	161.3	-20.5	33.4	0	0	0	110.2	D884	P882-D884 PolarHBondContact O-N 2.82Å
883	V	28.2	Very low	33.6	Very low	144 Å²	144	141.2 Å²	141.2	87%	0.873	74%	0.736	S	S	*	*	S	Bend	trans	-90.5	92.8	178.5	-179.6	0	0	0	0	108.8
884	D	30.2	Very low	32.8	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	76%	0.755	S	S	*	*			trans	-156.1	149.8	156	-97.7	-41.7	0	0	0	108.7	P882	P882-D884 PolarHBondContact O-N 2.82Å
885	T	31.8	Very low	32.3	Very low	131 Å²	131	150.2 Å²	150.2	80%	0.804	77%	0.773	S	S	*	*	S	Bend	trans	54.1	83.4	178.3	56	0	0	0	0	116.9
886	L	32.5	Very low	31.9	Very low	153 Å²	153	149.1 Å²	149.1	80%	0.801	78%	0.777	S	S	*	*				-173.2	109.9	113.2	-124.4	72.8	0	0	0	111.3	V888	L886-V888 HydrophobicContact CD2-CG2 4.07Å; L886-V888 HydrophobicContact CG-CG2 4.25Å
887	D	26.9	Very low	31.3	Very low	171 Å²	171	150.6 Å²	150.6	91%	0.914	79%	0.785	S	S	*	*			trans	-91.4	112.1	162.5	-74.7	-57.4	0	0	0	109.1
888	V	35.4	Very low	31	Very low	113 Å²	113	144.7 Å²	144.7	69%	0.685	78%	0.781	S	S	*	*			trans	-139	90.6	169.3	-173.6	0	0	0	0	110	L886	L886-V888 HydrophobicContact CD2-CG2 4.07Å; L886-V888 HydrophobicContact CG-CG2 4.25Å
889	V	33.1	Very low	30.9	Very low	121 Å²	121	140.3 Å²	140.3	73%	0.733	78%	0.777	S	S	*	*			trans	33.8	94	131.4	-170.4	0	0	0	0	116.8
890	E	26	Very low	30.6	Very low	169 Å²	169	140 Å²	140	79%	0.79	78%	0.778	S	S	*	*				25.3	122.2	115.7	-172.5	170.3	-117.5	0	0	119
891	N	27.4	Very low	30.2	Very low	154 Å²	154	135.4 Å²	135.4	82%	0.824	77%	0.771	S	S	*	*			trans	173.9	150.7	130.6	-97.3	-62.8	0	0	0	112.6
892	G	29.8	Very low	30.3	Very low	66 Å²	66	136.7 Å²	136.7	68%	0.68	78%	0.777	S	S	*	*			trans	76.4	119.6	175.3	0	0	0	0	0	114.5
893	Q	26.4	Very low	30.3	Very low	191 Å²	191	134.7 Å²	134.7	89%	0.893	77%	0.771	S	S	*	*			cis	64.7	140.5	10.2	-145.9	158.3	-10.4	0	0	114
894	E	26.8	Very low	30.2	Very low	183 Å²	183	135.8 Å²	135.8	86%	0.855	77%	0.766	S	S	*	*			trans	67.7	77.2	-169.5	-57	-173.5	-177.3	0	0	116.3
895	T	30.1	Very low	30.1	Very low	145 Å²	145	136.6 Å²	136.6	89%	0.89	77%	0.771	S	S	*	*			trans	-174	47.4	149.1	19.1	0	0	0	0	112.3
896	A	31.3	Very low	30.1	Very low	70 Å²	70	138.1 Å²	138.1	58%	0.579	77%	0.774	S	S	*	*	S	Bend	trans	-98.8	-45.3	174.4	0	0	0	0	0	112.3	A898	A896-A898 PolarHBondContact O-N 3.3Å
897	D	29.2	Very low	29.9	Very low	132 Å²	132	137.6 Å²	137.6	71%	0.706	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	2.7	-161.8	-45.7	0.9	0	0	0	115.2
898	A	31.3	Very low	30.1	Very low	84 Å²	84	133.4 Å²	133.4	69%	0.694	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-9.9	-173.2	0	0	0	0	0	114.8	A896	A896-A898 PolarHBondContact O-N 3.3Å
899	V	33.3	Very low	30.1	Very low	123 Å²	123	130.7 Å²	130.7	75%	0.745	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	-19.3	-178.4	-176	0	0	0	0	112.2	L901	V899-L901 VanDerWaalsContact C-N 3.34Å; V899-L901 PolarHBondContact O-N 2.82Å
900	E	31.6	Very low	30.5	Very low	151 Å²	151	128.9 Å²	128.9	71%	0.706	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-74.6	-23.5	-176.7	-155.6	156.9	-145	0	0	112.8	L902 A903	E900-L902 VanDerWaalsContact C-N 3.27Å; E900-L902 PolarHBondContact O-N 2.93Å; E900-A903 PolarHBondContact O-N 3.03Å
901	L	30.3	Very low	31.4	Very low	134 Å²	134	122.6 Å²	122.6	70%	0.702	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-78.2	8.3	-178	-75.4	167.8	0	0	0	116	V899	V899-L901 VanDerWaalsContact C-N 3.34Å; V899-L901 PolarHBondContact O-N 2.82Å
902	L	31.7	Very low	32	Very low	168 Å²	168	121.4 Å²	121.4	88%	0.88	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-128.1	15.4	175.5	-67.3	175.6	0	0	0	113	E900	E900-L902 VanDerWaalsContact C-N 3.27Å; E900-L902 PolarHBondContact O-N 2.93Å
903	A	32.2	Very low	32.4	Very low	79 Å²	79	119.9 Å²	119.9	65%	0.653	67%	0.666	S	S	*	*			trans	-110.4	-2.7	177.2	0	0	0	0	0	113.7	E900 D905	E900-A903 PolarHBondContact O-N 3.03Å; A903-D905 VanDerWaalsContact C-N 3.32Å; A903-D905 PolarHBondContact O-N 3.11Å; A903-D905 VanDerWaalsContact O-N 3.1Å
904	E	27.1	Very low	33	Very low	166 Å²	166	113.3 Å²	113.3	78%	0.776	64%	0.639	S	S	*	*	S	Bend	trans	-81	70.3	173	-62.2	-170.3	152.9	0	0	111.1
905	D	28.1	Very low	33.5	Very low	165 Å²	165	106.5 Å²	106.5	88%	0.882	61%	0.614	S	S	*	*	S	Bend	trans	167	72	154.2	-90.9	-20.9	0	0	0	112.5	A903	A903-D905 VanDerWaalsContact C-N 3.32Å; A903-D905 PolarHBondContact O-N 3.11Å; A903-D905 VanDerWaalsContact O-N 3.1Å
906	D	30.8	Very low	34	Very low	163 Å²	163	103.3 Å²	103.3	87%	0.872	59%	0.591	S	S	*	*			trans	-164.7	121.2	148.2	-133.2	-18.9	0	0	0	113.8
907	D	28.3	Very low	34.3	Very low	141 Å²	141	104.3 Å²	104.3	75%	0.754	59%	0.586	S	S	*	*			trans	-103.9	87.8	-172.1	-134.5	-20.7	0	0	0	111.2
908	S	32.9	Very low	34.7	Very low	84 Å²	84	103.6 Å²	103.6	59%	0.587	58%	0.582	S	S	*	*			trans	-153.1	101.5	179.5	-171.7	0	0	0	0	113.6
909	S	34	Very low	35	Very low	56 Å²	56	106.4 Å²	106.4	39%	0.392	58%	0.578	S	S	.	*			trans	-135.5	95	174.8	62.3	0	0	0	0	113.3	R533	R533-S909 VanDerWaalsContact CZ-O 3.29Å; R533-S909 PolarHBondContact NH1-O 3.3Å; R533-S909 PolarHBondContact NH1-OG 3.01Å; R533-S909 PolarHBondContact NH2-O 2.7Å; R533-S909 VanDerWaalsContact NH2-O 3.11Å
910	D	42.3	Very low	35.2	Very low	82 Å²	82	103.4 Å²	103.4	44%	0.439	57%	0.566	S	S	.	*			trans	-129.9	0	177.7	-105.2	-18	0	0	0	114.2
911	D	45.6	Very low	35.4	Very low	37 Å²	37	99.5 Å²	99.5	20%	0.198	56%	0.56	C	S	.	*	H	α-helix	trans	-79.4	-28.8	-164.1	-56	-61.6	0	0	0	115.2	S763 R770 T914 A915	S763-D911 PolarHBondContact OG-OD1 3.41Å; S763-D911 VanDerWaalsContact OG-OD1 3.13Å; R770-D911 IonicContact CZ-OD2 3.3Å; R770-D911 IonicContact NH1-OD2 2.65Å; R770-D911 PolarHBondContact NH1-OD2 2.94Å; R770-D911 IonicContact NH2-OD1 3.69Å; R770-D911 PolarHBondContact NH2-OD1 3.01Å; R770-D911 IonicContact NH2-OD2 2.71Å; R770-D911 PolarHBondContact NH2-OD2 3.45Å; D911-T914 PolarHBondContact O-OG1 3.02Å; D911-A915 PolarHBondContact O-N 2.79Å
912	E	39.1	Very low	35.7	Very low	130 Å²	130	101.5 Å²	101.5	61%	0.607	56%	0.563	S	S	*	*	H	α-helix	trans	-69.4	-39.6	-178.1	-71	-135.2	121.6	0	0	112.9	T914 A915 L916	E912-T914 PolarHBondContact O-N 3.43Å; E912-A915 PolarHBondContact O-N 3.06Å; E912-L916 PolarHBondContact O-N 2.95Å
913	D	38.5	Very low	35.9	Very low	34 Å²	34	98.1 Å²	98.1	18%	0.182	55%	0.549	C	S	.	.	H	α-helix	trans	-70.7	-33	-176.4	-71.2	-73.7	0	0	0	111.7	R533 L917	R533-D913 IonicContact CZ-OD2 3.64Å; R533-D913 IonicContact NE-OD2 4Å; R533-D913 IonicContact NH2-OD2 2.69Å; R533-D913 PolarHBondContact NH2-OD2 3.19Å; D913-L917 WeakPolarHBondContact O-CG 3.33Å; D913-L917 PolarHBondContact O-N 3.12Å; D913-L917 VanDerWaalsContact O-N 3.13Å
914	T	38.8	Very low	36	Very low	53 Å²	53	101.4 Å²	101.4	33%	0.325	55%	0.548	S	S	.	.	H	α-helix	trans	-71	-39.7	172.9	66	0	0	0	0	112	D911 E912 L916 L917 L918	D911-T914 PolarHBondContact O-OG1 3.02Å; E912-T914 PolarHBondContact O-N 3.43Å; T914-L916 VanDerWaalsContact C-N 3.32Å; T914-L916 PolarHBondContact O-N 3.34Å; T914-L917 PolarHBondContact O-N 2.81Å; T914-L918 PolarHBondContact O-N 2.74Å; T914-L918 VanDerWaalsContact O-N 3.07Å
915	A	37.7	Very low	36.2	Very low	39 Å²	39	98.8 Å²	98.8	32%	0.322	55%	0.548	S	S	.	.	H	α-helix	trans	-62.3	-36.7	173.9	0	0	0	0	0	112.7	D911 E912 K919	D911-A915 PolarHBondContact O-N 2.79Å; E912-A915 PolarHBondContact O-N 3.06Å; A915-K919 WeakPolarHBondContact O-CG 3.48Å; A915-K919 PolarHBondContact O-N 3.5Å
916	L	39.4	Very low	36.5	Very low	79 Å²	79	95.5 Å²	95.5	41%	0.414	55%	0.545	S	S	.	.	H	α-helix	trans	-67.6	-40.7	173.2	-79.6	168.8	0	0	0	112.4	E912 T914 K919 A920	E912-L916 PolarHBondContact O-N 2.95Å; T914-L916 VanDerWaalsContact C-N 3.32Å; T914-L916 PolarHBondContact O-N 3.34Å; L916-K919 PolarHBondContact O-N 3.22Å; L916-A920 VanDerWaalsContact O-CB 3.31Å; L916-A920 WeakPolarHBondContact O-CB 3.27Å; L916-A920 PolarHBondContact O-N 3.46Å
917	L	37.8	Very low	36.7	Very low	90 Å²	90	94 Å²	94	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-61.9	-44.5	176.6	-74	164.5	0	0	0	112.2	D913 T914 A920 A921	D913-L917 WeakPolarHBondContact O-CG 3.33Å; D913-L917 PolarHBondContact O-N 3.12Å; D913-L917 VanDerWaalsContact O-N 3.13Å; T914-L917 PolarHBondContact O-N 2.81Å; L917-A920 PolarHBondContact O-N 2.98Å; L917-A921 PolarHBondContact O-N 2.63Å
918	L	38.3	Very low	37	Very low	117 Å²	117	92.1 Å²	92.1	61%	0.613	55%	0.548	S	S	*	.	H	α-helix	trans	-63.6	-40.3	176.5	-78	161.4	0	0	0	112.6	T914 K922	T914-L918 PolarHBondContact O-N 2.74Å; T914-L918 VanDerWaalsContact O-N 3.07Å; L918-K922 PolarHBondContact O-N 3.07Å
919	K	36.8	Very low	37.1	Very low	144 Å²	144	98.3 Å²	98.3	63%	0.626	56%	0.564	S	S	*	*	H	α-helix	trans	-69.6	-37.8	175.4	-72.5	167.4	-177.1	166	0	111.8	A915 L916 A921 K922 V923	A915-K919 WeakPolarHBondContact O-CG 3.48Å; A915-K919 PolarHBondContact O-N 3.5Å; L916-K919 PolarHBondContact O-N 3.22Å; K919-A921 VanDerWaalsContact C-N 3.35Å; K919-A921 PolarHBondContact O-N 3.41Å; K919-K922 PolarHBondContact O-N 2.8Å; K919-V923 VanDerWaalsContact O-CG2 3.28Å; K919-V923 WeakPolarHBondContact O-CG2 3.38Å
920	A	37.1	Very low	37.1	Very low	59 Å²	59	99.2 Å²	99.2	49%	0.488	58%	0.582	S	S	.	*	H	α-helix	trans	-65.4	-34.7	176.2	0	0	0	0	0	113.1	L916 L917	L916-A920 VanDerWaalsContact O-CB 3.31Å; L916-A920 WeakPolarHBondContact O-CB 3.27Å; L916-A920 PolarHBondContact O-N 3.46Å; L917-A920 PolarHBondContact O-N 2.98Å
921	A	36.5	Very low	36.5	Very low	70 Å²	70	105.3 Å²	105.3	58%	0.579	61%	0.605	S	S	*	*	H	α-helix	trans	-68.2	-44.1	176.8	0	0	0	0	0	112.9	L917 K919 V923	L917-A921 PolarHBondContact O-N 2.63Å; K919-A921 VanDerWaalsContact C-N 3.35Å; K919-A921 PolarHBondContact O-N 3.41Å; A921-V923 VanDerWaalsContact C-N 3.3Å; A921-V923 PolarHBondContact O-N 2.96Å
922	K	35.6	Very low	35.9	Very low	176 Å²	176	108.1 Å²	108.1	77%	0.765	63%	0.633	S	S	*	*	H	α-helix	trans	-72.6	-12.5	-176.2	-73.2	-177	177.2	177.2	0	114.8	L918 K919 K924	L918-K922 PolarHBondContact O-N 3.07Å; K919-K922 PolarHBondContact O-N 2.8Å; K922-K924 VanDerWaalsContact C-N 3.25Å; K922-K924 PolarHBondContact O-N 2.79Å
923	V	37.3	Very low	35.8	Very low	96 Å²	96	108.8 Å²	108.8	58%	0.582	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	24.3	-176.1	173.6	0	0	0	0	113.5	K919 A921	K919-V923 VanDerWaalsContact O-CG2 3.28Å; K919-V923 WeakPolarHBondContact O-CG2 3.38Å; A921-V923 VanDerWaalsContact C-N 3.3Å; A921-V923 PolarHBondContact O-N 2.96Å
924	K	33.7	Very low	35.4	Very low	148 Å²	148	111.6 Å²	111.6	64%	0.643	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	20.8	-175.9	-76.3	-171.1	178.1	177.9	0	116.3	K922	K922-K924 VanDerWaalsContact C-N 3.25Å; K922-K924 PolarHBondContact O-N 2.79Å
925	S	30.5	Very low	35.3	Very low	111 Å²	111	118.5 Å²	118.5	78%	0.776	70%	0.7	S	S	*	*			trans	-150.9	100.8	172.3	55.5	0	0	0	0	113.9
926	A	34.5	Very low	35.1	Very low	97 Å²	97	126.8 Å²	126.8	80%	0.802	73%	0.729	S	S	*	*			trans	-151.7	113.9	168.2	0	0	0	0	0	110.3
927	P	36.3	Very low	34.8	Very low	130 Å²	130	126.6 Å²	126.6	84%	0.844	75%	0.746	S	S	*	*			trans	-84.4	131	-179.9	32	-32.6	0	0	0	111.9
928	A	35	Very low	34.6	Very low	103 Å²	103	134.8 Å²	134.8	85%	0.851	77%	0.77	S	S	*	*			trans	-80.4	124.2	175.4	0	0	0	0	0	111.4
929	K	33.9	Very low	34.4	Very low	213 Å²	213	132.9 Å²	132.9	93%	0.926	78%	0.779	S	S	*	*			trans	-82.1	113	169.7	-76.3	-172.5	175.5	-178.8	0	110.6
930	G	33.5	Very low	34.3	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	78%	0.784	S	S	*	*			trans	-79.6	158.9	166.2	0	0	0	0	0	112.5
931	K	30.1	Very low	34.4	Very low	210 Å²	210	133.1 Å²	133.1	91%	0.913	80%	0.801	S	S	*	*			trans	-93.2	173.2	171.8	-80	-175.2	174.5	-179	0	111.6
932	A	32.6	Very low	34.4	Very low	96 Å²	96	139.3 Å²	139.3	79%	0.793	82%	0.815	S	S	*	*			trans	77.6	149.7	179.8	0	0	0	0	0	114.3
933	T	36.7	Very low	34.6	Very low	144 Å²	144	135.2 Å²	135.2	88%	0.883	81%	0.814	S	S	*	*			cis	-122.8	-176.2	7	50.4	0	0	0	0	112.4
934	A	31	Very low	34.7	Very low	93 Å²	93	137 Å²	137	77%	0.769	83%	0.825	S	S	*	*			trans	-122.3	149.9	-173.2	0	0	0	0	0	114
935	K	35.9	Very low	34.8	Very low	198 Å²	198	136 Å²	136	86%	0.861	84%	0.837	S	S	*	*			trans	-166.9	126.2	151.2	-115.1	170.4	-175.7	178	0	114.9
936	K	34.1	Very low	35.3	Very low	214 Å²	214	134.5 Å²	134.5	93%	0.93	84%	0.839	S	S	*	*			trans	29.7	132.5	146.7	-64.3	-174	171.7	-172.7	0	122.6
937	G	33.4	Very low	35.3	Very low	75 Å²	75	141.4 Å²	141.4	77%	0.773	84%	0.844	S	S	*	*			trans	143.3	97.1	157.1	0	0	0	0	0	112
938	R	34	Very low	35.5	Very low	261 Å²	261	145.4 Å²	145.4	99%	0.985	85%	0.849	S	S	*	*				68.1	109.8	74.3	-176.1	-177.5	173.1	-178.1	-2.3	112.4
939	G	34.1	Very low	35.4	Very low	77 Å²	77	150.5 Å²	150.5	79%	0.794	85%	0.851	S	S	*	*			cis	170.2	175.8	-6.6	0	0	0	0	0	113.9
940	G	35.6	Very low	35.6	Very low	72 Å²	72	144.8 Å²	144.8	74%	0.742	84%	0.844	S	S	*	*			trans	90.6	155.7	172.3	0	0	0	0	0	116.6
941	T	37.9	Very low	35.9	Very low	137 Å²	137	147.6 Å²	147.6	84%	0.84	85%	0.846	S	S	*	*			cis	-166.9	159.3	-23.4	-6.6	0	0	0	0	111
942	K	37	Very low	36.2	Very low	199 Å²	199	144 Å²	144	87%	0.865	84%	0.841	S	S	*	*			trans	69.8	121.8	178.7	-56	178.8	179.3	-178.7	0	113.7
943	A	38.6	Very low	36.5	Very low	91 Å²	91	144.4 Å²	144.4	75%	0.752	84%	0.839	S	S	*	*				80.9	135.2	52	0	0	0	0	0	112.2
944	T	39.6	Very low	36.9	Very low	132 Å²	132	148.2 Å²	148.2	81%	0.81	86%	0.861	S	S	*	*			cis	-146.1	161.7	33.3	47.4	0	0	0	0	116
945	S	37.1	Very low	37.1	Very low	127 Å²	127	151 Å²	151	89%	0.888	87%	0.866	S	S	*	*			trans	32.2	136.7	142.6	-153	0	0	0	0	123.6
946	G	41.1	Very low	37.2	Very low	80 Å²	80	148.5 Å²	148.5	83%	0.825	87%	0.866	S	S	*	*			trans	164.4	76.6	165.4	0	0	0	0	0	114.8
947	R	34.3	Very low	37.4	Very low	242 Å²	242	144.9 Å²	144.9	91%	0.913	86%	0.862	S	S	*	*			trans	-132.1	114.7	-176.6	174.1	-176.6	167.3	178.8	-4.5	112.7
948	K	39.5	Very low	37.6	Very low	214 Å²	214	149 Å²	149	93%	0.93	87%	0.868	S	S	*	*			trans	-139.4	144	153.3	-82	-166.8	174.9	-178.3	0	110.9
949	K	33.6	Very low	37.9	Very low	210 Å²	210	142 Å²	142	91%	0.913	86%	0.86	S	S	*	*			trans	-124.2	129.7	167.3	-92	-170.6	171.6	-170.7	0	107.3
950	A	38.8	Very low	38.1	Very low	94 Å²	94	146.3 Å²	146.3	78%	0.777	87%	0.865	S	S	*	*			trans	-152.4	122.4	154.1	0	0	0	0	0	104.3
951	V	39.1	Very low	38.3	Very low	133 Å²	133	151.6 Å²	151.6	81%	0.806	87%	0.874	S	S	*	*				80.2	95.2	54.6	178.6	0	0	0	0	111.7
952	V	36.8	Very low	38.3	Very low	135 Å²	135	152.8 Å²	152.8	82%	0.818	88%	0.876	S	S	*	*			trans	40.2	114.4	138.6	-173.2	0	0	0	0	118.8
953	S	39.3	Very low	38.4	Very low	105 Å²	105	148.9 Å²	148.9	73%	0.734	88%	0.877	S	S	*	*				-172.8	144.6	117.8	50.6	0	0	0	0	110.9
954	V	43.2	Very low	38.4	Very low	224 Å²	224	154.2 Å²	154.2	100%	1.358	89%	0.888	S	S	*	*			trans	67.6	0	-174	-165.1	0	0	0	0	113.7

Retrieved 954 of 954 residues in 388.1 ms (Link to these results)

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