A0A3Q0KMV1_SCHMA Loading...

BRCT domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMV1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,183 aa.

						>A0A3Q0KMV1_SCHMA|A0A3Q0KMV1
MDSTDSELCGCESSNFIPSSESDPPPPVSYHVAECKPGDIRTQECDVNTENPPAFVVSDTMVSADCSFESSNPAQNQRSLTQADDFRDLSKENSDPSEFKRLDCSPISNSLTPCSKHTLGVLTNDLKLSAPHNRIRKSLGHTDNLFIKAPNQAMRLSEPLSAHKINGFHSADSCNSPFLSGFESRSSSLARLPNSASILNSSDGGGEEGDLSVMHDHENPSPTESDSLMKNKNVQLIAKKTSELVENEVTESVESILAVSLSAVVYRMDNTNEVVFDNRFNVKVNDANLKAAYKWVQINSAKLIGELSVSMKPSSCITDQIQAKSTSDSILSTSPPTTDSSNANVLSSKSLFSSTSMSVSNSDSIQRKADDNQCNDNHGLFKSPGRTSSSGSELFIPRPKNKLSVGEFVGAKCPVRASTTSSSSSDLFIPRSANKRIRELKDERECESSTTLNAAQKSAESNLLRLSLLPSSFSSNNKSTHDFTHRSSLTLVNETPSEDTTNESPHYTNTETNQFVKQTDTDLISDSPSTTTSTIKTSVTENEDITLTSTKLTPGEQWVYGKWKTEKNYYAGKIYPSESGTRCFVIFEDGTRARIKQSDLVVVYLLPVGAEVSAELKDDNEYWGDCVIQAHSGDSERPYKVLCRTTNEVYFLRRGQVSIHESEVDNLKKRQLLPSNSCEIPISIENENKINMNNSITKICASPEVSLSNLVFDKRKSRPKVYRSSWVTPMKQLTTVKNDTDDQHCITLPSKLTLSSHLRKRYKNQFRRKLPTTSVRINRSRNRSGSSSECSSLAKKQRLSDLFSDDENLLTQPMSLQTPVSKTETSYKKNNSNQIVSKRIQSSPSPKSRGSIGLLRSLSHNLNIPIPSPTVFHGWTIILTGGAKNYNSNESIDRNLLEQLIIACGGEIALEINPSLLNRRYGCESPELDDSFHQKKSQCSHFVALVSTDCCRTLKYFQALATLGSVPLLRIDWLLDSCREDAKTYNNESSFEENRNWPLYLLRAYPGRYELPRGFISGSSEPISWWSVPVRYRSPAYQTIPSPSLFDHFGDWADNGTNYRLVAIVTNDLKVFGPGWLNILSLACGSNNQSDESGDSSNRIPLIHLSEISQKLSDLFPSVRCRSKASEKKVNFVLVDKNHINQSAFAFMKTLPIEMVTCDYFIHSLICGHLVNPKSSPYFSPIV
					

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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	47.5	Very low	40.7	Very low	233 Å²	233	132 Å²	132	100%	1.148	79%	0.785	S	S	*	*				0	90.5	0	-79	174.8	157.9	0	0	106.9
2	D	39.3	Very low	40	Very low	154 Å²	154	136.9 Å²	136.9	82%	0.824	79%	0.794	S	S	*	*			trans	58.1	134.4	131	-48.7	7.8	0	0	0	120.8
3	S	46.9	Very low	39.4	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	79%	0.791	S	S	*	*			trans	72.9	117.3	160.8	-64.8	0	0	0	0	118.4
4	T	44.4	Very low	39.1	Very low	114 Å²	114	131.8 Å²	131.8	70%	0.699	78%	0.781	S	S	*	*				71.9	135.9	52.4	71.7	0	0	0	0	112.8
5	D	45.3	Very low	38.6	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	79%	0.787	S	S	*	*			cis	-158.3	163	1.9	-114.4	-16.6	0	0	0	111.7
6	S	42.2	Very low	38.4	Very low	96 Å²	96	137 Å²	137	67%	0.671	79%	0.789	S	S	*	*			trans	56.2	144.9	144.8	-62.4	0	0	0	0	121.3
7	E	41.5	Very low	38.2	Very low	163 Å²	163	137.8 Å²	137.8	76%	0.762	79%	0.788	S	S	*	*			cis	-160.4	179.1	-2.1	-129	180	161.4	0	0	112.4
8	L	38	Very low	38.2	Very low	156 Å²	156	135.8 Å²	135.8	82%	0.817	78%	0.781	S	S	*	*			trans	67.6	70.9	159.8	-69.1	160.7	0	0	0	117.9
9	C	33.9	Very low	37.9	Very low	114 Å²	114	135 Å²	135	77%	0.77	78%	0.784	S	S	*	*			trans	-47.5	160.4	139.2	-107.5	0	0	0	0	111.9
10	G	34.5	Very low	38	Very low	73 Å²	73	133 Å²	133	75%	0.753	78%	0.778	S	S	*	*			cis	174.6	-161.8	5.6	0	0	0	0	0	107.7
11	C	34.6	Very low	37.7	Very low	111 Å²	111	136.1 Å²	136.1	75%	0.75	79%	0.785	S	S	*	*			cis	-164.1	105.7	-15.2	-115.2	0	0	0	0	106.3
12	E	31.6	Very low	37.4	Very low	191 Å²	191	130.1 Å²	130.1	89%	0.893	77%	0.766	S	S	*	*			trans	-71	143.4	156.9	-62.2	-177.1	152.6	0	0	108.1
13	S	32.7	Very low	37.7	Very low	108 Å²	108	130.1 Å²	130.1	76%	0.755	77%	0.766	S	S	*	*			trans	164.8	163.1	134.4	51.3	0	0	0	0	114.7
14	S	34.8	Very low	38.3	Very low	94 Å²	94	130.5 Å²	130.5	66%	0.657	77%	0.766	S	S	*	*			trans	76.7	114.9	152.3	73.4	0	0	0	0	118.8
15	N	32.1	Very low	38.9	Very low	162 Å²	162	130.6 Å²	130.6	87%	0.866	77%	0.769	S	S	*	*			trans	-67.2	137.1	153.7	-51.3	-86.5	0	0	0	108.7
16	F	34.7	Very low	39	Very low	185 Å²	185	129.4 Å²	129.4	81%	0.811	77%	0.769	S	S	*	*			trans	-133.3	125.7	155	-104	-85.9	0	0	0	109.2
17	I	34.9	Very low	39.4	Very low	151 Å²	151	130.9 Å²	130.9	77%	0.774	78%	0.776	S	S	*	*			trans	-104	120.7	164.3	-61.8	170.6	0	0	0	106.5
18	P	39	Very low	39.4	Very low	102 Å²	102	128.3 Å²	128.3	66%	0.662	77%	0.771	S	S	*	*			trans	-108	126.1	149.1	32.6	-24.3	0	0	0	109.5
19	S	32.7	Very low	39.5	Very low	120 Å²	120	125.6 Å²	125.6	84%	0.839	77%	0.765	S	S	*	*			trans	-76.3	121	166.1	-56.5	0	0	0	0	108.9
20	S	39.2	Very low	39.5	Very low	95 Å²	95	129.7 Å²	129.7	66%	0.664	77%	0.765	S	S	*	*			trans	-152.6	90.4	169.7	57.1	0	0	0	0	111.4
21	E	32.6	Very low	39.7	Very low	198 Å²	198	134.8 Å²	134.8	93%	0.925	77%	0.769	S	S	*	*			trans	-4.4	117.7	135.8	-170	165.3	-156.1	0	0	115.2
22	S	40.2	Very low	39.7	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	77%	0.772	S	S	*	*			trans	-160.8	142	169.8	-73.1	0	0	0	0	108.9
23	D	46.6	Very low	40	Very low	153 Å²	153	130.9 Å²	130.9	82%	0.818	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-63.5	153	-159.2	-63.5	-79.9	0	0	0	116.8
24	P	58.9	Low	40	Very low	111 Å²	111	134.9 Å²	134.9	72%	0.721	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-63.7	140.8	159.9	30.5	-34.2	0	0	0	109.9
25	P	57.3	Low	40.1	Very low	116 Å²	116	136.3 Å²	136.3	75%	0.753	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-62.2	143.9	178.5	26.2	-34.4	0	0	0	111.1
26	P	47.9	Very low	40.5	Very low	111 Å²	111	138.2 Å²	138.2	72%	0.721	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.1	147.9	-176.4	26.5	-35	0	0	0	111.7	V28	P26-V28 PolarHBondContact O-N 3.33Å
27	P	50.2	Low	40.4	Very low	126 Å²	126	136 Å²	136	82%	0.818	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-64.8	118.4	178.5	27	-33.9	0	0	0	110.4	S29	P27-S29 PolarHBondContact O-N 2.7Å
28	V	40.3	Very low	40.4	Very low	110 Å²	110	131.8 Å²	131.8	67%	0.667	78%	0.778	S	S	*	*			trans	-67.9	105.7	178	-179.6	0	0	0	0	109.5	P26 Y30	P26-V28 PolarHBondContact O-N 3.33Å; V28-Y30 HydrophobicContact CB-CE2 4.21Å; V28-Y30 HydrophobicContact CG1-CD2 3.96Å; V28-Y30 HydrophobicContact CG1-CE2 3.57Å; V28-Y30 PolarHBondContact O-N 3.48Å
29	S	40.3	Very low	40.3	Very low	98 Å²	98	134.2 Å²	134.2	69%	0.685	79%	0.785	S	S	*	*			trans	-73.9	92	176.9	55.9	0	0	0	0	111.1	P27 H31	P27-S29 PolarHBondContact O-N 2.7Å; S29-H31 PolarHBondContact O-N 2.77Å
30	Y	35	Very low	40.3	Very low	200 Å²	200	135.2 Å²	135.2	78%	0.784	78%	0.78	S	S	*	*			trans	-70.6	109.5	166.4	-77.6	-83.6	0	0	0	109.9	V28 V32	V28-Y30 HydrophobicContact CB-CE2 4.21Å; V28-Y30 HydrophobicContact CG1-CD2 3.96Å; V28-Y30 HydrophobicContact CG1-CE2 3.57Å; V28-Y30 PolarHBondContact O-N 3.48Å; Y30-V32 PolarHBondContact O-N 3.43Å
31	H	37.6	Very low	40.1	Very low	181 Å²	181	142.1 Å²	142.1	84%	0.838	79%	0.791	S	S	*	*			trans	-64.3	105.2	168.9	-82.3	-83.8	0	0	0	109.8	S29 A33	S29-H31 PolarHBondContact O-N 2.77Å; H31-A33 PolarHBondContact O-N 2.78Å
32	V	36.3	Very low	40.1	Very low	133 Å²	133	138.6 Å²	138.6	81%	0.806	78%	0.783	S	S	*	*			trans	-73.4	103.1	162.5	179.9	0	0	0	0	107.1	Y30 E34	Y30-V32 PolarHBondContact O-N 3.43Å; V32-E34 PolarHBondContact O-N 3.26Å
33	A	37.4	Very low	39.8	Very low	86 Å²	86	139.7 Å²	139.7	71%	0.711	78%	0.776	S	S	*	*			trans	-74.7	117.3	170.7	0	0	0	0	0	109.2	H31 C35	H31-A33 PolarHBondContact O-N 2.78Å; A33-C35 PolarHBondContact O-N 3.24Å
34	E	32.7	Very low	39.1	Very low	193 Å²	193	138.8 Å²	138.8	90%	0.902	77%	0.767	S	S	*	*			trans	-68	113.8	173.9	-64.6	-173.8	132	0	0	110.5	V32	V32-E34 PolarHBondContact O-N 3.26Å
35	C	35.2	Very low	37.9	Very low	123 Å²	123	135.6 Å²	135.6	83%	0.831	75%	0.747	S	S	*	*			trans	-124.2	140.2	166.6	-87.5	0	0	0	0	110.1	A33	A33-C35 PolarHBondContact O-N 3.24Å
36	K	40.9	Very low	36.8	Very low	202 Å²	202	137.9 Å²	137.9	88%	0.878	75%	0.753	S	S	*	*			trans	-82.9	147.7	-163.7	-62.2	173.1	-177.3	174.5	0	112.1
37	P	32.6	Very low	36.3	Very low	139 Å²	139	139 Å²	139	90%	0.903	76%	0.758	S	S	*	*			trans	-78	121.7	175	30.8	-33	0	0	0	111.6
38	G	35.3	Very low	35.4	Very low	63 Å²	63	139.9 Å²	139.9	65%	0.649	76%	0.755	S	S	*	*			trans	141	98.8	165.6	0	0	0	0	0	114.8
39	D	36.3	Very low	35.1	Very low	153 Å²	153	140.3 Å²	140.3	82%	0.818	76%	0.758	S	S	*	*				-178.6	103.8	125.6	-94.7	-22.2	0	0	0	112.9
40	I	33.6	Very low	34.9	Very low	141 Å²	141	144.6 Å²	144.6	72%	0.723	77%	0.767	S	S	*	*			trans	23.4	120	131.2	-55.8	163.3	0	0	0	115.9
41	R	34.6	Very low	35	Very low	240 Å²	240	142 Å²	142	91%	0.906	77%	0.768	S	S	*	*				-172.2	163.3	65.9	-141.4	156.6	-167.9	154.8	1	113
42	T	32.2	Very low	35	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	76%	0.763	S	S	*	*			trans	-104	144	-177.6	40.8	0	0	0	0	114.9
43	Q	33.5	Very low	35.1	Very low	132 Å²	132	138.6 Å²	138.6	62%	0.617	76%	0.764	S	S	*	*			trans	-160.1	119.6	166.5	-72.9	-155.8	-80.6	0	0	113.6	S364 I365	Q43-S364 VanDerWaalsContact CB-C 3.5Å; Q43-S364 VanDerWaalsContact CB-O 3.31Å; Q43-S364 WeakPolarHBondContact CB-O 3.45Å; Q43-S364 VanDerWaalsContact CD-O 3.23Å; Q43-S364 WeakPolarHBondContact CG-O 3.38Å; Q43-S364 PolarHBondContact NE2-O 2.83Å; Q43-I365 VanDerWaalsContact C-N 3.34Å; Q43-I365 VanDerWaalsContact CB-C 3.49Å; Q43-I365 WeakPolarHBondContact CB-O 2.99Å
44	E	33	Very low	34.7	Very low	133 Å²	133	138.7 Å²	138.7	62%	0.621	76%	0.764	S	S	*	*			trans	-90.9	-121.3	178.2	-55.3	173.8	133.5	0	0	115.8	D363 I365 Q366	E44-D363 WeakPolarHBondContact OE2-CA 3.47Å; E44-D363 PolarHBondContact OE2-N 2.92Å; E44-I365 CarbonylContact O-C 3.57Å; E44-I365 WeakPolarHBondContact O-CA 3.5Å; E44-I365 PolarHBondContact O-N 3Å; E44-Q366 PolarHBondContact O-N 3.31Å
45	C	33.2	Very low	34.7	Very low	45 Å²	45	139.2 Å²	139.2	30%	0.304	76%	0.764	S	S	.	*			trans	124.8	109.2	153.4	-161.8	0	0	0	0	116.5	S364 I365	C45-S364 VanDerWaalsContact CA-CB 3.45Å; C45-I365 HydrophobicContact CB-CB 4.26Å; C45-I365 HydrophobicContact CB-CG1 3.81Å
46	D	34	Very low	34.6	Very low	163 Å²	163	138.9 Å²	138.9	87%	0.872	76%	0.758	S	S	*	*			trans	-103.5	154.5	169.2	-84.1	-40.3	0	0	0	112.4
47	V	37.3	Very low	34.1	Very low	136 Å²	136	135.4 Å²	135.4	82%	0.824	75%	0.753	S	S	*	*			trans	-141	141.7	166.3	-178.4	0	0	0	0	110.7
48	N	32.6	Very low	34	Very low	144 Å²	144	133.4 Å²	133.4	77%	0.77	74%	0.743	S	S	*	*			trans	-84.4	141.9	-169.4	-70.4	-55.7	0	0	0	115.5
49	T	32.9	Very low	33.7	Very low	119 Å²	119	137.6 Å²	137.6	73%	0.73	75%	0.75	S	S	*	*				44	133.7	118.4	-43.6	0	0	0	0	122.4
50	E	36.5	Very low	33.6	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	75%	0.754	S	S	*	*			trans	-138.4	175.2	151.7	-121.8	-178.8	-170.7	0	0	112.5
51	N	36.4	Very low	33.3	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	76%	0.761	S	S	*	*			trans	-101.4	159.5	-150.3	-75.2	-71.3	0	0	0	117.8
52	P	38.5	Very low	33.2	Very low	114 Å²	114	134 Å²	134	74%	0.74	76%	0.757	S	S	*	*			trans	-99.2	161.8	177.1	39.1	-35.6	0	0	0	114.9
53	P	37.7	Very low	33	Very low	128 Å²	128	133.5 Å²	133.5	83%	0.831	76%	0.759	S	S	*	*			trans	-104.9	163.5	161.7	37.8	-30.6	0	0	0	112.8
54	A	29.1	Very low	33	Very low	87 Å²	87	131.7 Å²	131.7	72%	0.719	77%	0.767	S	S	*	*			trans	-130.3	138.7	-177.4	0	0	0	0	0	114
55	F	33.6	Very low	32.8	Very low	205 Å²	205	133 Å²	133	90%	0.899	78%	0.778	S	S	*	*			trans	-140.5	135.3	160.5	-87.4	-96.5	0	0	0	107
56	V	31.7	Very low	32.7	Very low	115 Å²	115	136.8 Å²	136.8	70%	0.697	80%	0.804	S	S	*	*			cis	101.2	96	24.9	177.8	0	0	0	0	113.3
57	V	32.2	Very low	32.4	Very low	129 Å²	129	134.5 Å²	134.5	78%	0.782	80%	0.8	S	S	*	*			trans	93	140.4	141.5	167.1	0	0	0	0	122
58	S	30.6	Very low	32.2	Very low	97 Å²	97	138 Å²	138	68%	0.678	81%	0.805	S	S	*	*			trans	78.6	105.8	159.1	-76.9	0	0	0	0	122.5
59	D	28.9	Very low	32.1	Very low	151 Å²	151	139.6 Å²	139.6	81%	0.807	81%	0.808	S	S	*	*				17.1	120.5	120.1	-52.8	-21.6	0	0	0	119.3
60	T	32.7	Very low	31.9	Very low	147 Å²	147	139 Å²	139	90%	0.902	81%	0.808	S	S	*	*				-157.2	162.3	123	-7.5	0	0	0	0	112
61	M	28.2	Very low	31.8	Very low	174 Å²	174	135.7 Å²	135.7	86%	0.857	81%	0.805	S	S	*	*			trans	-79.7	155.5	178.6	-61.6	178.9	-83.4	0	0	112.3
62	V	33.2	Very low	31.6	Very low	138 Å²	138	136.2 Å²	136.2	84%	0.836	81%	0.808	S	S	*	*				-174.4	138.3	119.5	143.2	0	0	0	0	109.9
63	S	28.1	Very low	31.3	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	81%	0.813	S	S	*	*			trans	-81.8	146.5	173.5	-52.6	0	0	0	0	111.6
64	A	32.3	Very low	30.8	Very low	95 Å²	95	135.2 Å²	135.2	79%	0.785	81%	0.809	S	S	*	*			trans	-141.3	95	166.6	0	0	0	0	0	110.5
65	D	29.3	Very low	30.8	Very low	160 Å²	160	139.2 Å²	139.2	86%	0.856	81%	0.813	S	S	*	*			trans	-69.8	125	165.5	-70.1	-64.4	0	0	0	109.6
66	C	31.2	Very low	30.5	Very low	125 Å²	125	136.2 Å²	136.2	85%	0.845	81%	0.807	S	S	*	*			trans	-147.8	101.3	167.6	-97.8	0	0	0	0	110.6
67	S	27.1	Very low	30.2	Very low	114 Å²	114	140 Å²	140	80%	0.797	82%	0.817	S	S	*	*			trans	-71.3	138.7	169	53	0	0	0	0	111.4
68	F	33.8	Very low	29.9	Very low	211 Å²	211	145.8 Å²	145.8	93%	0.925	82%	0.824	S	S	*	*			trans	-143.9	140.3	159.4	-113.5	-80.6	0	0	0	112
69	E	30.3	Very low	29.9	Very low	177 Å²	177	146.1 Å²	146.1	83%	0.827	83%	0.827	S	S	*	*			trans	-86.3	160	-179.5	-81.5	-166.8	106.6	0	0	113.9
70	S	29.4	Very low	29.8	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	83%	0.83	S	S	*	*			trans	-21.7	145.2	170.1	61.2	0	0	0	0	119.9
71	S	33.5	Very low	30	Very low	117 Å²	117	142.8 Å²	142.8	82%	0.818	81%	0.805	S	S	*	*				-148.3	129.1	126.2	41.6	0	0	0	0	111.8
72	N	32.9	Very low	30.6	Very low	159 Å²	159	136.4 Å²	136.4	85%	0.85	77%	0.773	S	S	*	*			trans	-97.9	154.4	172.1	-90.2	-12.9	0	0	0	110
73	P	32	Very low	30.7	Very low	128 Å²	128	130.6 Å²	130.6	83%	0.831	74%	0.74	S	S	*	*				-109.6	172.6	128.3	33.8	-31.4	0	0	0	111.4
74	A	27.7	Very low	31.2	Very low	92 Å²	92	127.7 Å²	127.7	76%	0.76	72%	0.715	S	S	*	*			trans	-114.7	-176.6	-159.9	0	0	0	0	0	115.1
75	Q	28.6	Very low	31.7	Very low	172 Å²	172	126.8 Å²	126.8	80%	0.804	70%	0.697	S	S	*	*			trans	96	114.7	165.6	-61.3	-175.1	-74.9	0	0	119.4
76	N	26	Very low	32.3	Very low	141 Å²	141	121.8 Å²	121.8	75%	0.754	67%	0.668	S	S	*	*			trans	69.9	60.3	132	-59.9	2.7	0	0	0	120.5
77	Q	26.8	Very low	32.7	Very low	195 Å²	195	122 Å²	122	91%	0.911	65%	0.651	S	S	*	*			trans	-137.2	122.8	136.2	-67.8	-166.5	-0.1	0	0	110.4
78	R	26.5	Very low	33.3	Very low	250 Å²	250	120.8 Å²	120.8	94%	0.943	64%	0.635	S	S	*	*			trans	-95.2	109.7	163.3	-91.4	-169	179.6	177.4	1.9	107.8	L80	R78-L80 PolarHBondContact O-N 2.66Å
79	S	29.1	Very low	33.6	Very low	104 Å²	104	114.8 Å²	114.8	73%	0.727	61%	0.612	S	S	*	*			trans	-73.8	118.3	159	39	0	0	0	0	108.7
80	L	27.9	Very low	33.9	Very low	167 Å²	167	110.6 Å²	110.6	87%	0.874	60%	0.603	S	S	*	*			trans	-58.9	134.5	169	-81.3	155.2	0	0	0	109.1	R78	R78-L80 PolarHBondContact O-N 2.66Å
81	T	35.5	Very low	34.3	Very low	61 Å²	61	112.4 Å²	112.4	37%	0.374	60%	0.598	S	S	.	*			trans	-122.2	148.4	179.4	64.9	0	0	0	0	111.8	A83 D84	T81-A83 PolarHBondContact O-N 2.88Å; T81-D84 PolarHBondContact N-OD2 3.26Å; T81-D84 WeakPolarHBondContact O-CB 3.43Å; T81-D84 PolarHBondContact O-N 3.33Å; T81-D84 PolarHBondContact OG1-OD2 3.09Å
82	Q	41.7	Very low	34.3	Very low	41 Å²	41	115 Å²	115	19%	0.192	60%	0.597	C	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	0.4	-179.8	-153.6	160	17.4	0	0	113.6	C1158	Q82-C1158 VanDerWaalsContact CD-SG 3.52Å; Q82-C1158 PolarHBondContact NE2-SG 3.4Å
83	A	36.2	Very low	34.4	Very low	16 Å²	16	115 Å²	115	13%	0.132	60%	0.596	C	S	.	*	T	Hydrogen-bonded Turn	trans	-85.8	-16.3	168.8	0	0	0	0	0	113.4	T81 D85 F86	T81-A83 PolarHBondContact O-N 2.88Å; A83-D85 VanDerWaalsContact C-N 3.33Å; A83-F86 PolarHBondContact O-N 2.91Å; A83-F86 VanDerWaalsContact O-N 3.16Å
84	D	37.3	Very low	34.4	Very low	51 Å²	51	114.6 Å²	114.6	27%	0.273	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-70.1	-32.6	178.7	-62.5	-56.8	0	0	0	111.1	T81 F86 R87 D88	T81-D84 PolarHBondContact N-OD2 3.26Å; T81-D84 WeakPolarHBondContact O-CB 3.43Å; T81-D84 PolarHBondContact O-N 3.33Å; T81-D84 PolarHBondContact OG1-OD2 3.09Å; D84-F86 PolarHBondContact O-N 3.49Å; D84-F86 VanDerWaalsContact O-N 3.09Å; D84-R87 PolarHBondContact O-N 3.45Å; D84-D88 PolarHBondContact O-N 3.05Å
85	D	43.5	Very low	34.8	Very low	75 Å²	75	117.8 Å²	117.8	40%	0.401	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-48	-32	166.2	-92.3	5.1	0	0	0	113.2	A83 L954	A83-D85 VanDerWaalsContact C-N 3.33Å; D85-L954 HydrophobicContact CB-CD2 3.71Å; D85-L954 VanDerWaalsContact O-CD2 3.32Å; D85-L954 WeakPolarHBondContact O-CD2 3.32Å
86	F	40.9	Very low	34.9	Very low	55 Å²	55	115.5 Å²	115.5	24%	0.241	60%	0.601	C	S	.	*	G	3₁₀ helix	trans	-93.4	-1.5	-179.8	-70.3	-91.7	0	0	0	113.9	A83 D84 Y956 V1071 F1072	A83-F86 PolarHBondContact O-N 2.91Å; A83-F86 VanDerWaalsContact O-N 3.16Å; D84-F86 PolarHBondContact O-N 3.49Å; D84-F86 VanDerWaalsContact O-N 3.09Å; F86-Y956 HydrophobicContact CE1-CD1 4.45Å; F86-Y956 AromaticContact CE1-CD2 3.92Å; F86-Y956 HydrophobicContact CE1-CD2 3.92Å; F86-Y956 HydrophobicContact CE1-CE2 4.33Å; F86-Y956 HydrophobicContact CE1-CG 4.01Å; F86-Y956 AromaticContact CZ-CD2 3.91Å; F86-Y956 HydrophobicContact CZ-CD2 3.91Å; F86-Y956 HydrophobicContact CZ-CG 4.16Å; F86-V1071 HydrophobicContact CB-CG1 3.82Å; F86-V1071 HydrophobicContact CD1-CG1 3.73Å; F86-V1071 HydrophobicContact CG-CG1 4Å; F86-F1072 AromaticContact CE2-CD2 3.79Å; F86-F1072 HydrophobicContact CE2-CD2 3.79Å; F86-F1072 HydrophobicContact CZ-CD2 4.33Å
87	R	39.9	Very low	35	Very low	130 Å²	130	113.5 Å²	113.5	49%	0.491	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.5	-27.5	-170	-65.5	-177	-178	-167.7	4.3	115.1	D84 L89 S90 D1068	D84-R87 PolarHBondContact O-N 3.45Å; R87-L89 VanDerWaalsContact C-N 3.33Å; R87-L89 PolarHBondContact O-N 2.71Å; R87-S90 PolarHBondContact O-N 2.87Å; R87-S90 PolarHBondContact O-OG 3.12Å; R87-D1068 IonicContact CZ-OD2 2.62Å; R87-D1068 IonicContact NE-OD2 2.59Å; R87-D1068 IonicContact NH2-OD2 3.84Å; R87-D1068 PolarHBondContact NH2-OD2 3.39Å
88	D	39.7	Very low	35.4	Very low	88 Å²	88	112.5 Å²	112.5	47%	0.471	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-80.2	-5	-169.1	-85.6	-15.2	0	0	0	115.9	D84 S90 K91	D84-D88 PolarHBondContact O-N 3.05Å; D88-S90 PolarHBondContact O-N 3.06Å; D88-K91 PolarHBondContact O-N 2.94Å; D88-K91 IonicContact OD1-NZ 3.84Å; D88-K91 PolarHBondContact OD1-NZ 3.46Å
89	L	39.9	Very low	35.6	Very low	85 Å²	85	109.6 Å²	109.6	45%	0.445	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-69	7.6	167.2	-65.7	179.5	0	0	0	114.3	R87 L954	R87-L89 VanDerWaalsContact C-N 3.33Å; R87-L89 PolarHBondContact O-N 2.71Å; L89-L954 HydrophobicContact CD1-CD1 4.17Å
90	S	36.9	Very low	35.8	Very low	90 Å²	90	113.9 Å²	113.9	63%	0.629	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-107.2	3.7	-180	62	0	0	0	0	114.7	R87 D88	R87-S90 PolarHBondContact O-N 2.87Å; R87-S90 PolarHBondContact O-OG 3.12Å; D88-S90 PolarHBondContact O-N 3.06Å
91	K	37.8	Very low	35.9	Very low	144 Å²	144	117.1 Å²	117.1	63%	0.626	59%	0.594	S	S	*	*			trans	-137.4	47.8	-167.3	-55.9	-174.1	-155.1	119.1	0	116.1	D88	D88-K91 PolarHBondContact O-N 2.94Å; D88-K91 IonicContact OD1-NZ 3.84Å; D88-K91 PolarHBondContact OD1-NZ 3.46Å
92	E	34.5	Very low	35.6	Very low	172 Å²	172	118.3 Å²	118.3	80%	0.804	60%	0.598	S	S	*	*	S	Bend	trans	-109.3	134.3	158.4	-74.8	-172.8	125	0	0	109.7
93	N	33.4	Very low	35	Very low	157 Å²	157	122.5 Å²	122.5	84%	0.84	62%	0.621	S	S	*	*	S	Bend	trans	85.8	73	-171	-50.6	-70.2	0	0	0	117.3
94	S	33.3	Very low	34.7	Very low	121 Å²	121	125.6 Å²	125.6	85%	0.846	64%	0.642	S	S	*	*			trans	-162.3	117.5	149.1	-78.3	0	0	0	0	110.9
95	D	35.9	Very low	34.3	Very low	159 Å²	159	127.5 Å²	127.5	85%	0.85	66%	0.659	S	S	*	*			trans	-73.8	138.6	174.7	-105.4	-43.4	0	0	0	112.1
96	P	29.7	Very low	34.1	Very low	124 Å²	124	129.7 Å²	129.7	81%	0.805	68%	0.677	S	S	*	*			trans	-105.7	69.2	-173.7	39.7	-35	0	0	0	114.7
97	S	29.8	Very low	33.5	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	71%	0.707	S	S	*	*			trans	-153.3	144	172.9	57.7	0	0	0	0	114.6
98	E	33.3	Very low	32.9	Very low	174 Å²	174	133.3 Å²	133.3	81%	0.813	71%	0.714	S	S	*	*			trans	63.1	119.6	179.3	-44.4	-163	137.5	0	0	114.8
99	F	31.2	Very low	32.4	Very low	190 Å²	190	136 Å²	136	83%	0.833	73%	0.728	S	S	*	*			cis	-148.4	179.2	40.7	-113.1	-93.2	0	0	0	113.4
100	K	33.9	Very low	31.8	Very low	194 Å²	194	136.5 Å²	136.5	84%	0.843	74%	0.739	S	S	*	*			trans	-98.6	132	-174.3	-63.4	169	-178.9	167.5	0	114.1
101	R	29	Very low	31.6	Very low	235 Å²	235	140.1 Å²	140.1	89%	0.887	75%	0.75	S	S	*	*			trans	32.8	155.4	146.4	-58.4	-177.7	171.5	172.5	-3.4	122.4
102	L	29.4	Very low	31.3	Very low	86 Å²	86	139.4 Å²	139.4	45%	0.45	76%	0.758	S	S	.	*			trans	79.6	69.1	162.5	-47.7	172.5	0	0	0	116.3	L816 T818	L102-L816 HydrophobicContact CB-CD2 3.43Å; L102-L816 VanDerWaalsContact CB-CD2 3.43Å; L102-L816 HydrophobicContact CD1-CD2 3.63Å; L102-L816 HydrophobicContact CG-CD2 4.17Å; L102-T818 WeakPolarHBondContact CA-OG1 3.47Å; L102-T818 VanDerWaalsContact CD2-OG1 3.3Å; L102-T818 WeakPolarHBondContact CD2-OG1 3.2Å
103	D	30.6	Very low	31.5	Very low	128 Å²	128	136.3 Å²	136.3	68%	0.684	75%	0.753	S	S	*	*				61.4	146.7	51.6	-166.6	22.6	0	0	0	113.9	Q817 T818	D103-Q817 CarbonylContact O-C 3.54Å; D103-Q817 VanDerWaalsContact O-O 3.08Å; D103-T818 HydrophobicContact CB-CG2 3.83Å; D103-T818 WeakPolarHBondContact O-CB 3.48Å; D103-T818 WeakPolarHBondContact O-CG2 3.46Å; D103-T818 PolarHBondContact O-OG1 2.92Å
104	C	28.5	Very low	31.5	Very low	82 Å²	82	134.3 Å²	134.3	55%	0.554	75%	0.75	S	S	*	*			trans	-157.9	-166.7	-167.1	-154	0	0	0	0	115.7	Q817	C104-Q817 PolarHBondContact SG-O 3.04Å
105	S	30.2	Very low	31.6	Very low	90 Å²	90	132.7 Å²	132.7	63%	0.629	74%	0.739	S	S	*	*			trans	-160.4	168.3	178.7	-75.1	0	0	0	0	112.3
106	P	38.4	Very low	31.7	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	73%	0.734	S	S	*	*			trans	-117.4	-179	-154.1	43.4	-35.4	0	0	0	116.6
107	I	27.8	Very low	32	Very low	171 Å²	171	134.2 Å²	134.2	88%	0.877	73%	0.727	S	S	*	*			trans	-147.4	153.5	154.5	-108.1	160.8	0	0	0	111.1
108	S	27.1	Very low	32.2	Very low	90 Å²	90	135.2 Å²	135.2	63%	0.629	73%	0.729	S	S	*	*			trans	-91.6	166.9	-176.7	59.5	0	0	0	0	114.2
109	N	29	Very low	32.2	Very low	146 Å²	146	134.6 Å²	134.6	78%	0.781	73%	0.731	S	S	*	*			trans	151.6	149.3	133.9	-74.8	-14.1	0	0	0	111
110	S	28.1	Very low	32.3	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	72%	0.722	S	S	*	*			cis	-173	-166.2	-22.7	57.1	0	0	0	0	107.9
111	L	31.9	Very low	32.3	Very low	165 Å²	165	125.3 Å²	125.3	86%	0.864	72%	0.718	S	S	*	*			trans	95.2	81.6	169	-55.2	172.1	0	0	0	119.1
112	T	33.2	Very low	32.6	Very low	129 Å²	129	120.8 Å²	120.8	79%	0.791	71%	0.711	S	S	*	*			trans	-73.7	-167.8	142.3	54.3	0	0	0	0	110.4
113	P	38.3	Very low	32.8	Very low	108 Å²	108	121.7 Å²	121.7	70%	0.701	72%	0.72	S	S	*	*			cis	-129.2	179	-2.6	28.2	-2.3	0	0	0	114
114	C	33	Very low	33	Very low	114 Å²	114	122.1 Å²	122.1	77%	0.77	72%	0.722	S	S	*	*				165.7	160.8	90.8	-100.3	0	0	0	0	109
115	S	35.8	Very low	33.2	Very low	88 Å²	88	124.6 Å²	124.6	62%	0.615	73%	0.73	S	S	*	*			cis	-171.9	159.5	-9.5	57.8	0	0	0	0	112.4
116	K	36.4	Very low	33.3	Very low	171 Å²	171	126.9 Å²	126.9	74%	0.743	73%	0.734	S	S	*	*			trans	73.4	156.2	147.8	-78	162.8	169.3	-169.6	0	118.7
117	H	36.7	Very low	33	Very low	144 Å²	144	129 Å²	129	67%	0.667	73%	0.731	S	S	*	*			cis	-152.2	144.3	7.6	-126.4	-56.5	0	0	0	113.9
118	T	35	Very low	33.1	Very low	118 Å²	118	128.1 Å²	128.1	72%	0.724	73%	0.727	S	S	*	*			trans	71	158.3	145.1	-51	0	0	0	0	121
119	L	31.7	Very low	33.2	Very low	162 Å²	162	128.3 Å²	128.3	85%	0.848	73%	0.729	S	S	*	*				-176.9	142.8	-59.2	-129	164.3	0	0	0	110.3
120	G	34.6	Very low	33.3	Very low	63 Å²	63	126 Å²	126	65%	0.649	73%	0.73	S	S	*	*			trans	156.1	116.5	163.6	0	0	0	0	0	113.3
121	V	33.7	Very low	34.1	Very low	126 Å²	126	127 Å²	127	76%	0.764	73%	0.734	S	S	*	*				80.7	122.5	56.2	168.1	0	0	0	0	111.2
122	L	34.3	Very low	34.3	Very low	139 Å²	139	127.9 Å²	127.9	73%	0.728	73%	0.733	S	S	*	*			cis	-158.1	130.3	-3	-103.1	173.9	0	0	0	111.2
123	T	34	Very low	34.3	Very low	106 Å²	106	128.2 Å²	128.2	65%	0.65	73%	0.731	S	S	*	*				44.9	153.1	128.7	61.9	0	0	0	0	126.9
124	N	36.2	Very low	34	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	74%	0.737	S	S	*	*			trans	100	91.5	144.6	-70.3	-3.9	0	0	0	122.4
125	D	31.7	Very low	34	Very low	135 Å²	135	134.3 Å²	134.3	72%	0.722	73%	0.731	S	S	*	*				75.8	148.6	102.9	-113.8	-25.8	0	0	0	125.1
126	L	33.4	Very low	33.9	Very low	137 Å²	137	140.6 Å²	140.6	72%	0.717	74%	0.742	S	S	*	*			trans	65.6	155	158.2	-61.2	165.2	0	0	0	119.4
127	K	30.4	Very low	33.8	Very low	166 Å²	166	141.6 Å²	141.6	72%	0.722	75%	0.746	S	S	*	*			cis	-172.1	158.3	-38.7	-136.1	-172.9	-160.3	168.2	0	108.6
128	L	31	Very low	33.5	Very low	152 Å²	152	139.6 Å²	139.6	80%	0.796	75%	0.748	S	S	*	*			trans	65.4	162.7	159.7	-60.5	161.4	0	0	0	116.9
129	S	28.6	Very low	33.5	Very low	95 Å²	95	142.2 Å²	142.2	66%	0.664	76%	0.757	S	S	*	*			cis	-169.4	149.9	-34.7	56.3	0	0	0	0	112.6
130	A	31.7	Very low	33.6	Very low	97 Å²	97	137.3 Å²	137.3	80%	0.802	75%	0.746	S	S	*	*			trans	73.7	147.8	153.6	0	0	0	0	0	120.4
131	P	44.1	Very low	33.5	Very low	115 Å²	115	142.9 Å²	142.9	75%	0.747	76%	0.755	S	S	*	*			trans	-111.9	178	179.6	42.8	-35	0	0	0	113.4
132	H	36.5	Very low	33.4	Very low	184 Å²	184	141.7 Å²	141.7	85%	0.852	75%	0.748	S	S	*	*			trans	-155.9	153.7	153.3	-124.5	-87.8	0	0	0	115.6
133	N	32.4	Very low	33.3	Very low	137 Å²	137	141.2 Å²	141.2	73%	0.733	75%	0.746	S	S	*	*			trans	-79.5	155.5	-179	-64	-77.7	0	0	0	114.1
134	R	32.3	Very low	33	Very low	224 Å²	224	142.4 Å²	142.4	85%	0.845	75%	0.748	S	S	*	*				166.2	125.8	109.4	-90.5	-177.2	166.1	169.7	-2.3	118.2
135	I	32.7	Very low	32.7	Very low	126 Å²	126	142.3 Å²	142.3	65%	0.646	75%	0.747	S	S	*	*				53.7	114.4	123.9	-53.5	169.2	0	0	0	121.5
136	R	35.1	Very low	32.5	Very low	219 Å²	219	144 Å²	144	83%	0.826	75%	0.748	S	S	*	*				179.2	135.9	111.7	-108.4	123.9	-159.1	-128.3	5.9	110.3
137	K	32.7	Very low	32.2	Very low	192 Å²	192	143.9 Å²	143.9	84%	0.835	75%	0.747	S	S	*	*				48.1	138.2	97.6	-62.6	-168.4	175.1	-168.1	0	114.4
138	S	31.7	Very low	32.2	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	75%	0.754	S	S	*	*			cis	-168.5	-165.4	-4	41.9	0	0	0	0	107.5
139	L	33.7	Very low	32.2	Very low	172 Å²	172	142.7 Å²	142.7	90%	0.901	75%	0.753	S	S	*	*			cis	-165.9	163.4	15.1	-167.1	69.5	0	0	0	110.2
140	G	33.8	Very low	32.5	Very low	60 Å²	60	143.9 Å²	143.9	62%	0.619	76%	0.758	S	S	*	*			trans	108.7	133.3	166.8	0	0	0	0	0	114.4
141	H	34.4	Very low	32.4	Very low	180 Å²	180	147.3 Å²	147.3	83%	0.833	76%	0.763	S	S	*	*				76.1	131.6	50.8	-83.4	47.6	0	0	0	114.2
142	T	31.2	Very low	31.9	Very low	101 Å²	101	151.4 Å²	151.4	62%	0.62	77%	0.773	S	S	*	*			cis	-164.6	161.6	-13.6	7.3	0	0	0	0	109.4
143	D	31.4	Very low	31.6	Very low	129 Å²	129	147.4 Å²	147.4	69%	0.69	77%	0.771	S	S	*	*			trans	59.9	118.3	142.9	-66.2	9.8	0	0	0	123.6
144	N	29.1	Very low	31.7	Very low	131 Å²	131	149.7 Å²	149.7	70%	0.701	78%	0.78	S	S	*	*				86.4	139.9	121.3	-76.7	-35.7	0	0	0	124.7
145	L	28.1	Very low	31.6	Very low	134 Å²	134	149.6 Å²	149.6	70%	0.702	78%	0.779	S	S	*	*			trans	71.6	127.1	148.8	-91.6	78.1	0	0	0	122.6
146	F	28.6	Very low	31.4	Very low	170 Å²	170	151.3 Å²	151.3	75%	0.746	79%	0.789	S	S	*	*			trans	83.7	113.8	136.5	-88.2	-135.6	0	0	0	122.8
147	I	26.9	Very low	31.3	Very low	135 Å²	135	146.4 Å²	146.4	69%	0.692	79%	0.788	S	S	*	*				42	102.9	128.3	-45	177.8	0	0	0	118
148	K	30.7	Very low	31.1	Very low	198 Å²	198	145.9 Å²	145.9	86%	0.861	79%	0.789	S	S	*	*				-171	139	119.9	-109.9	166.6	-177.1	172.9	0	113.4
149	A	30.4	Very low	31.4	Very low	94 Å²	94	145.3 Å²	145.3	78%	0.777	78%	0.782	S	S	*	*			trans	-93.9	153.2	152.4	0	0	0	0	0	109.3
150	P	35.3	Very low	31.2	Very low	120 Å²	120	145 Å²	145	78%	0.779	78%	0.781	S	S	*	*			trans	-133.8	120.5	151	33.7	-19.1	0	0	0	112.5
151	N	30	Very low	31.2	Very low	169 Å²	169	147 Å²	147	90%	0.904	79%	0.786	S	S	*	*			trans	-79.8	130.2	152.5	-84.3	-29.5	0	0	0	108.3
152	Q	34	Very low	31	Very low	202 Å²	202	142.6 Å²	142.6	94%	0.944	78%	0.78	S	S	*	*			trans	-155.1	151.5	158.4	-116.2	174.4	27.7	0	0	111
153	A	30	Very low	31.3	Very low	99 Å²	99	146.1 Å²	146.1	82%	0.818	79%	0.789	S	S	*	*			trans	-132.2	150.6	-169.4	0	0	0	0	0	112.2
154	M	34	Very low	31.3	Very low	186 Å²	186	148.5 Å²	148.5	92%	0.916	79%	0.793	S	S	*	*			trans	-151.6	106.2	174.6	-159.2	168.5	-177	0	0	107.3
155	R	29.4	Very low	31.5	Very low	221 Å²	221	148.1 Å²	148.1	83%	0.834	79%	0.79	S	S	*	*				83.4	115.4	62.2	-91.4	-167	166.8	177.9	-2.1	115
156	L	29.6	Very low	31.7	Very low	163 Å²	163	148.5 Å²	148.5	85%	0.853	79%	0.793	S	S	*	*			trans	70.9	143.4	154.8	-51.3	168.1	0	0	0	114.9
157	S	32.4	Very low	31.6	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	79%	0.791	S	S	*	*			cis	-153.7	154.1	32.3	54.1	0	0	0	0	115.8
158	E	29.3	Very low	31.9	Very low	180 Å²	180	145.2 Å²	145.2	84%	0.841	79%	0.793	S	S	*	*			trans	-98.6	-165.2	163.7	-130.2	-170.9	-159.1	0	0	109.1
159	P	37.2	Very low	32.1	Very low	91 Å²	91	143.3 Å²	143.3	59%	0.591	79%	0.787	S	S	*	*			cis	-141.7	-163.2	-10.7	31.1	-4.8	0	0	0	116
160	L	30.4	Very low	32.1	Very low	165 Å²	165	143.3 Å²	143.3	86%	0.864	78%	0.781	S	S	*	*			trans	75.4	154.9	161.7	-55.5	169.7	0	0	0	117.5
161	S	33.5	Very low	32	Very low	104 Å²	104	141.7 Å²	141.7	73%	0.727	78%	0.778	S	S	*	*			cis	-140	155.9	-1.2	56.9	0	0	0	0	108.9
162	A	30	Very low	32.2	Very low	86 Å²	86	140.2 Å²	140.2	71%	0.711	77%	0.77	S	S	*	*			cis	88.5	88	34.4	0	0	0	0	0	116.7
163	H	37.2	Very low	32	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.815	76%	0.755	S	S	*	*			trans	-159.1	127.9	155.1	-99.3	-87.1	0	0	0	107.7
164	K	31	Very low	32.2	Very low	178 Å²	178	135.5 Å²	135.5	77%	0.774	75%	0.752	S	S	*	*			cis	76.3	114.7	37.4	-145.4	-156.7	-179.9	179.5	0	110.5
165	I	34.5	Very low	32.3	Very low	123 Å²	123	133.7 Å²	133.7	63%	0.631	75%	0.746	S	S	*	*				-169.3	155.7	69.1	-83.7	175.2	0	0	0	111
166	N	31	Very low	32.3	Very low	143 Å²	143	127.6 Å²	127.6	77%	0.765	74%	0.738	S	S	*	*			trans	13	158.3	156.1	-47.4	-3.2	0	0	0	121.3
167	G	28.1	Very low	32.8	Very low	68 Å²	68	124.1 Å²	124.1	70%	0.701	73%	0.725	S	S	*	*			cis	157.4	164.4	13.5	0	0	0	0	0	106.8
168	F	32.4	Very low	32.9	Very low	167 Å²	167	127.2 Å²	127.2	73%	0.732	72%	0.724	S	S	*	*				170.1	148.4	68.1	-121.5	-104.7	0	0	0	109
169	H	34.4	Very low	33.2	Very low	159 Å²	159	125.6 Å²	125.6	74%	0.736	72%	0.72	S	S	*	*			trans	43.7	156.2	150.5	-71.7	-15.7	0	0	0	123.5
170	S	31.7	Very low	33	Very low	93 Å²	93	126.7 Å²	126.7	65%	0.65	73%	0.73	S	S	*	*			cis	-173.2	158.1	-17.2	-98.1	0	0	0	0	111.9
171	A	31.2	Very low	33.1	Very low	87 Å²	87	121.8 Å²	121.8	72%	0.719	72%	0.72	S	S	*	*			trans	62.2	162.6	152.2	0	0	0	0	0	118.4
172	D	35.4	Very low	33.2	Very low	137 Å²	137	126.3 Å²	126.3	73%	0.733	73%	0.726	S	S	*	*			cis	-131.9	145.4	-0.8	-98	-62.3	0	0	0	108.2
173	S	29.9	Very low	33.4	Very low	89 Å²	89	130.3 Å²	130.3	62%	0.622	73%	0.73	S	S	*	*				65.6	137.6	63.9	109.5	0	0	0	0	113.8
174	C	34.1	Very low	33.3	Very low	113 Å²	113	126.2 Å²	126.2	76%	0.764	72%	0.722	S	S	*	*			cis	-116.4	-156	-3.3	-68.3	0	0	0	0	109.5
175	N	35.1	Very low	33.4	Very low	148 Å²	148	128.3 Å²	128.3	79%	0.791	73%	0.725	S	S	*	*			cis	-156	-164.7	8.2	-156.6	-4.6	0	0	0	112.3
176	S	30.9	Very low	33.2	Very low	94 Å²	94	127.2 Å²	127.2	66%	0.657	73%	0.728	S	S	*	*			trans	-158.9	-162.5	-165.3	68.2	0	0	0	0	110
177	P	40.5	Very low	33.1	Very low	90 Å²	90	125 Å²	125	58%	0.584	72%	0.724	S	S	*	*			cis	-134.2	-177.5	-16	37.6	-19.2	0	0	0	114.1
178	F	33.5	Very low	33	Very low	180 Å²	180	126.6 Å²	126.6	79%	0.789	72%	0.724	S	S	*	*				170.3	137	114.8	-95.8	-62.7	0	0	0	115
179	L	36.5	Very low	32.9	Very low	147 Å²	147	125.8 Å²	125.8	77%	0.77	73%	0.727	S	S	*	*			trans	56.7	102.7	156.7	-55.8	-176.4	0	0	0	118.8
180	S	32.9	Very low	32.6	Very low	113 Å²	113	122.3 Å²	122.3	79%	0.79	73%	0.725	S	S	*	*				83.2	133.2	72.8	71.4	0	0	0	0	114.9
181	G	32.2	Very low	32.5	Very low	63 Å²	63	129.4 Å²	129.4	65%	0.649	74%	0.738	S	S	*	*			cis	-177.6	-165.3	3	0	0	0	0	0	113
182	F	35.7	Very low	32.4	Very low	198 Å²	198	132 Å²	132	87%	0.868	74%	0.739	S	S	*	*			trans	68.7	115.6	-169.1	-61	-81.8	0	0	0	113.9
183	E	33.4	Very low	32.3	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.794	74%	0.743	S	S	*	*				60.6	126.7	54.3	-56.6	-163.5	132.8	0	0	112
184	S	34.5	Very low	32.2	Very low	91 Å²	91	133.4 Å²	133.4	64%	0.636	75%	0.746	S	S	*	*			cis	-159.6	170.1	27.2	-94.3	0	0	0	0	108.8
185	R	34.1	Very low	31.9	Very low	221 Å²	221	133.3 Å²	133.3	83%	0.834	75%	0.747	S	S	*	*			cis	-163.2	162	-3.1	-117	166.3	-172.4	-163.7	0.7	109.8
186	S	30.7	Very low	31.5	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	75%	0.747	S	S	*	*			trans	30.7	114.3	146.6	-55.8	0	0	0	0	120.4
187	S	27.4	Very low	31.5	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	75%	0.753	S	S	*	*			cis	89.1	117.1	48.4	75.3	0	0	0	0	116.4
188	S	27.5	Very low	30.9	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	76%	0.762	S	S	*	*			trans	55.8	121.3	136.9	67	0	0	0	0	122
189	L	29.8	Very low	30.6	Very low	151 Å²	151	133.1 Å²	133.1	79%	0.791	76%	0.761	S	S	*	*				164.5	121.6	127.8	-106.1	68	0	0	0	105.7
190	A	28.3	Very low	30.4	Very low	85 Å²	85	133.2 Å²	133.2	70%	0.702	76%	0.763	S	S	*	*				65.7	91.3	56	0	0	0	0	0	114.5
191	R	29.9	Very low	30.3	Very low	243 Å²	243	132.4 Å²	132.4	92%	0.917	76%	0.757	S	S	*	*			trans	178.3	145.7	135.2	-97.4	155.3	-172.4	-171.1	1.9	112.9
192	L	27.7	Very low	30.3	Very low	142 Å²	142	133.7 Å²	133.7	74%	0.743	76%	0.756	S	S	*	*			trans	-67.8	164.5	160.9	-67.6	164.5	0	0	0	110.4
193	P	33.2	Very low	30.3	Very low	126 Å²	126	131.7 Å²	131.7	82%	0.818	76%	0.755	S	S	*	*				-126.3	146.5	116.9	35.9	-31.7	0	0	0	113.6
194	N	29.2	Very low	30.4	Very low	129 Å²	129	127.3 Å²	127.3	69%	0.69	76%	0.755	S	S	*	*			trans	-89.8	168	170.9	-71.2	-28.8	0	0	0	111.3
195	S	27.8	Very low	30.5	Very low	110 Å²	110	126.7 Å²	126.7	77%	0.769	76%	0.763	S	S	*	*			trans	71.3	104.2	147.9	-60.1	0	0	0	0	120.6
196	A	26.5	Very low	30.6	Very low	96 Å²	96	119.7 Å²	119.7	79%	0.793	76%	0.759	S	S	*	*				47.3	114.2	115.5	0	0	0	0	0	121.3
197	S	29.7	Very low	31	Very low	112 Å²	112	123.8 Å²	123.8	78%	0.783	77%	0.768	S	S	*	*			trans	-152.4	118.2	141.2	-70.8	0	0	0	0	106.1
198	I	28.5	Very low	31.3	Very low	151 Å²	151	129.1 Å²	129.1	77%	0.774	78%	0.782	S	S	*	*				66	107.3	80.3	-64.2	173.2	0	0	0	112.3
199	L	27.9	Very low	31.6	Very low	149 Å²	149	127.7 Å²	127.7	78%	0.78	78%	0.782	S	S	*	*			trans	38.1	100.2	147.3	-54.6	174.4	0	0	0	118.3
200	N	32	Very low	32	Very low	150 Å²	150	127.7 Å²	127.7	80%	0.802	78%	0.783	S	S	*	*				-154.1	138.3	108.1	-90.6	-41.3	0	0	0	108.1
201	S	31.1	Very low	32.5	Very low	96 Å²	96	131 Å²	131	67%	0.671	79%	0.788	S	S	*	*				71.3	128.3	59.5	-45.1	0	0	0	0	112.5
202	S	31.8	Very low	32.8	Very low	90 Å²	90	124.1 Å²	124.1	63%	0.629	78%	0.777	S	S	*	*			cis	-168.5	175.3	-13.5	58.3	0	0	0	0	110.5
203	D	34.9	Very low	33.4	Very low	156 Å²	156	122.7 Å²	122.7	83%	0.834	77%	0.774	S	S	*	*			trans	61.2	173.1	147.6	-49.7	-35.5	0	0	0	121.9
204	G	35.8	Very low	33.6	Very low	78 Å²	78	123.9 Å²	123.9	80%	0.804	77%	0.771	S	S	*	*			trans	93.7	95.3	-177.4	0	0	0	0	0	112.1
205	G	36.6	Very low	34.2	Very low	77 Å²	77	124.3 Å²	124.3	79%	0.794	77%	0.768	S	S	*	*			cis	99.4	139.2	29.9	0	0	0	0	0	108.9
206	G	36.5	Very low	34.9	Very low	74 Å²	74	124.6 Å²	124.6	76%	0.763	76%	0.761	S	S	*	*			cis	81.5	132.7	28.1	0	0	0	0	0	109.5
207	E	39.2	Very low	35.7	Very low	187 Å²	187	126.7 Å²	126.7	87%	0.874	76%	0.755	S	S	*	*			cis	-152.9	156.6	6.4	-60.4	174.7	140.4	0	0	109.8
208	E	32.9	Very low	36.3	Very low	210 Å²	210	128.4 Å²	128.4	98%	0.981	75%	0.75	S	S	*	*			trans	-131.8	121	152.5	-77.8	-171.5	175	0	0	107.3
209	G	34.7	Very low	37	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	75%	0.75	S	S	*	*			cis	159.2	147.9	-12.4	0	0	0	0	0	110.8
210	D	37.5	Very low	37.6	Very low	151 Å²	151	126 Å²	126	81%	0.807	75%	0.745	S	S	*	*			trans	-162.2	143.9	150.2	-138.4	-24.9	0	0	0	112.1
211	L	38.4	Very low	37.9	Very low	154 Å²	154	124 Å²	124	81%	0.806	74%	0.743	S	S	*	*			trans	58.8	128.8	172.6	-47.6	176.6	0	0	0	118.2
212	S	37	Very low	38.3	Very low	99 Å²	99	124.3 Å²	124.3	69%	0.692	74%	0.743	S	S	*	*			cis	-172.8	168.9	-6.7	49.7	0	0	0	0	111.8
213	V	39.5	Very low	38.6	Very low	113 Å²	113	125.6 Å²	125.6	69%	0.685	75%	0.747	S	S	*	*			trans	83.2	91	161	-167.7	0	0	0	0	119.4
214	M	39	Very low	38.8	Very low	151 Å²	151	126 Å²	126	74%	0.744	74%	0.744	S	S	*	*			trans	64.2	143.7	134.4	-58.9	-170.2	-33	0	0	120.3
215	H	41.6	Very low	38.9	Very low	137 Å²	137	127.3 Å²	127.3	63%	0.634	74%	0.74	S	S	*	*			cis	-159.2	148.3	3.7	-117.3	-58	0	0	0	109.8
216	D	42.7	Very low	39	Very low	117 Å²	117	130.4 Å²	130.4	63%	0.626	74%	0.739	S	S	*	*			trans	63	160.5	140.7	-60.2	-2.8	0	0	0	121.6
217	H	43.2	Very low	39.1	Very low	140 Å²	140	131.4 Å²	131.4	65%	0.648	73%	0.734	S	S	*	*			cis	-154.8	146.1	-16.3	-122.1	-71.9	0	0	0	108.6
218	E	40.9	Very low	38.9	Very low	148 Å²	148	129.1 Å²	129.1	69%	0.692	73%	0.727	S	S	*	*			trans	48.7	137.2	148.2	-73.7	167	-152.4	0	0	122.9
219	N	43.9	Very low	39.1	Very low	145 Å²	145	126.7 Å²	126.7	78%	0.775	72%	0.718	S	S	*	*			cis	119.1	168.3	24.4	-83.6	-33	0	0	0	110.6
220	P	41.2	Very low	39.1	Very low	103 Å²	103	132.8 Å²	132.8	67%	0.669	73%	0.725	S	S	*	*				-142.5	172.5	-72.4	41.4	-22.8	0	0	0	116.8
221	S	36.8	Very low	39	Very low	108 Å²	108	133 Å²	133	76%	0.755	73%	0.726	S	S	*	*			trans	68.7	179.2	146.8	78.9	0	0	0	0	119.8
222	P	40.4	Very low	38.9	Very low	104 Å²	104	134.5 Å²	134.5	68%	0.675	73%	0.726	S	S	*	*				-134.7	-165.6	-50	31.3	-10.3	0	0	0	114.4
223	T	38.6	Very low	38.8	Very low	116 Å²	116	136.1 Å²	136.1	71%	0.712	73%	0.727	S	S	*	*			trans	74.8	153.7	154.8	18.2	0	0	0	0	118.6
224	E	38.3	Very low	38.6	Very low	165 Å²	165	137.4 Å²	137.4	77%	0.771	74%	0.735	S	S	*	*			cis	-161.6	159.8	-2.8	-155.2	157.3	-137.2	0	0	113
225	S	38.9	Very low	38.7	Very low	105 Å²	105	139 Å²	139	73%	0.734	74%	0.74	S	S	*	*			trans	67	160.7	154.5	78.4	0	0	0	0	119.8
226	D	37.7	Very low	38.4	Very low	142 Å²	142	139.7 Å²	139.7	76%	0.759	75%	0.748	S	S	*	*			cis	-155.4	157.4	0.5	-151.3	-8.5	0	0	0	115.3
227	S	38.1	Very low	38	Very low	95 Å²	95	139.7 Å²	139.7	66%	0.664	75%	0.747	S	S	*	*			trans	66.4	152	152.1	80.1	0	0	0	0	121.2
228	L	35.6	Very low	37.6	Very low	140 Å²	140	137 Å²	137	73%	0.733	75%	0.749	S	S	*	*			cis	-158.7	153.3	-16.3	-112.3	167.5	0	0	0	110.8
229	M	36.8	Very low	37.5	Very low	159 Å²	159	138.7 Å²	138.7	78%	0.783	75%	0.754	S	S	*	*			trans	44.7	112.3	165.7	-55.9	-53	-174.4	0	0	118.9
230	K	35.8	Very low	37.1	Very low	197 Å²	197	140.6 Å²	140.6	86%	0.857	76%	0.755	S	S	*	*			cis	50.1	110.3	43.4	-63.5	179.9	178.9	170	0	115.7
231	N	35.2	Very low	36.8	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	75%	0.751	S	S	*	*				-152.2	158	126.9	-134.5	-25.1	0	0	0	115.1
232	K	35.6	Very low	36.8	Very low	184 Å²	184	138.4 Å²	138.4	80%	0.8	74%	0.739	S	S	*	*			trans	-85.1	126.9	-164.8	-56.9	150.4	179.3	174.6	0	111.9
233	N	34.8	Very low	36.5	Very low	134 Å²	134	141.5 Å²	141.5	72%	0.717	74%	0.744	S	S	*	*			trans	-159.9	0.6	157.2	-111.1	-22.1	0	0	0	115.9	Q235	N233-Q235 VanDerWaalsContact C-N 3.31Å; N233-Q235 PolarHBondContact O-N 3.27Å
234	V	36.4	Very low	36.1	Very low	140 Å²	140	143.1 Å²	143.1	85%	0.848	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-0.9	-167.2	-176.6	0	0	0	0	114.1
235	Q	40.2	Very low	36.1	Very low	184 Å²	184	141 Å²	141	86%	0.86	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	2.8	-171.9	-79.6	-175.7	-22.4	0	0	116.6	N233	N233-Q235 VanDerWaalsContact C-N 3.31Å; N233-Q235 PolarHBondContact O-N 3.27Å
236	L	35.5	Very low	36	Very low	151 Å²	151	142.2 Å²	142.2	79%	0.791	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	-18.8	-179	-124.9	80.6	0	0	0	116.4
237	I	33.6	Very low	35.8	Very low	117 Å²	117	142.5 Å²	142.5	60%	0.6	74%	0.741	S	S	*	*	S	Bend	trans	-82.3	-29.5	178.1	-62.5	176.8	0	0	0	111.5	K239 K240 T241	I237-K239 PolarHBondContact O-N 2.98Å; I237-K240 PolarHBondContact O-N 2.89Å; I237-T241 HydrophobicContact CG2-CG2 4.12Å
238	A	35.4	Very low	35.7	Very low	85 Å²	85	146 Å²	146	70%	0.702	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	23.2	-179.5	0	0	0	0	0	115.3
239	K	39.2	Very low	35.7	Very low	183 Å²	183	143.5 Å²	143.5	80%	0.796	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.8	16.7	177.2	-149.4	176.4	-177.2	178.4	0	113.2	I237	I237-K239 PolarHBondContact O-N 2.98Å
240	K	34.8	Very low	35.7	Very low	184 Å²	184	139.1 Å²	139.1	80%	0.8	72%	0.72	S	S	*	*	S	Bend	trans	-147.2	11.3	176.7	-142.2	178.5	-177.7	-179	0	115.5	I237	I237-K240 PolarHBondContact O-N 2.89Å
241	T	35.2	Very low	35.8	Very low	96 Å²	96	134.4 Å²	134.4	59%	0.589	70%	0.701	S	S	*	*	S	Bend	trans	-119.4	13.4	174.4	57.6	0	0	0	0	112.4	I237	I237-T241 HydrophobicContact CG2-CG2 4.12Å
242	S	36.3	Very low	36.2	Very low	70 Å²	70	129.8 Å²	129.8	49%	0.49	68%	0.681	S	S	.	*	S	Bend	trans	-106.4	24.3	-171.8	57.7	0	0	0	0	113.3
243	E	34.5	Very low	36.5	Very low	169 Å²	169	124.7 Å²	124.7	79%	0.79	67%	0.665	S	S	*	*	S	Bend	trans	-136.6	-7.6	-175.3	-70.6	-176.7	123.2	0	0	113.8
244	L	31.2	Very low	36.9	Very low	150 Å²	150	122.1 Å²	122.1	79%	0.785	65%	0.649	S	S	*	*	S	Bend	trans	-143.2	133.9	179.4	-67.6	173.2	0	0	0	110.3
245	V	37.5	Very low	37.1	Very low	121 Å²	121	116.2 Å²	116.2	73%	0.733	61%	0.614	S	S	*	*	S	Bend	trans	72.6	43.7	177.6	-153.5	0	0	0	0	116.4
246	E	36.3	Very low	37	Very low	129 Å²	129	112.3 Å²	112.3	60%	0.603	60%	0.598	S	S	*	*	S	Bend	trans	-108.2	-18.3	163.3	-71.3	-166.9	136.7	0	0	114.5	T250	E246-T250 VanDerWaalsContact O-CG2 3.24Å; E246-T250 WeakPolarHBondContact O-CG2 3.22Å; E246-T250 PolarHBondContact O-OG1 2.86Å
247	N	34.7	Very low	37.2	Very low	148 Å²	148	107.3 Å²	107.3	79%	0.791	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-15	-168.4	-66.9	-3.2	0	0	0	116.2
248	E	35.4	Very low	37.7	Very low	170 Å²	170	104.5 Å²	104.5	79%	0.794	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	-17.5	-169.7	-160	171.1	-146	0	0	113.3
249	V	35.1	Very low	37.8	Very low	87 Å²	87	104.9 Å²	104.9	53%	0.527	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.4	-24.7	176	-177.9	0	0	0	0	111.5	V253	V249-V253 WeakPolarHBondContact O-CG2 3.28Å; V249-V253 PolarHBondContact O-N 2.76Å
250	T	37.7	Very low	37.8	Very low	66 Å²	66	99 Å²	99	41%	0.405	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-53.4	-179.5	35	0	0	0	0	112.1	E246 S252 V253 E254	E246-T250 VanDerWaalsContact O-CG2 3.24Å; E246-T250 WeakPolarHBondContact O-CG2 3.22Å; E246-T250 PolarHBondContact O-OG1 2.86Å; T250-S252 PolarHBondContact O-N 2.82Å; T250-V253 PolarHBondContact O-N 3.25Å; T250-V253 VanDerWaalsContact O-N 3.12Å; T250-E254 WeakPolarHBondContact O-CB 3.36Å; T250-E254 WeakPolarHBondContact O-CG 3.38Å; T250-E254 PolarHBondContact O-N 3.19Å
251	E	38	Very low	38	Very low	98 Å²	98	92.7 Å²	92.7	46%	0.458	52%	0.515	S	S	.	.	H	α-helix	trans	-56	-36.1	177.2	-73.6	-160.1	101.8	0	0	113.2	S255 S422	E251-S255 VanDerWaalsContact O-CB 3.29Å; E251-S255 WeakPolarHBondContact O-CB 2.88Å; E251-S255 PolarHBondContact O-N 3.23Å; E251-S255 PolarHBondContact O-OG 3.19Å; E251-S422 WeakPolarHBondContact OE1-CB 3.26Å; E251-S422 PolarHBondContact OE1-OG 2.84Å
252	S	42.5	Very low	38.1	Very low	60 Å²	60	91.8 Å²	91.8	42%	0.42	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-44.7	178	179.3	0	0	0	0	112.1	T250 S255 I256	T250-S252 PolarHBondContact O-N 2.82Å; S252-S255 PolarHBondContact O-OG 3.3Å; S252-I256 WeakPolarHBondContact O-CB 3.45Å; S252-I256 WeakPolarHBondContact O-CD1 3.3Å; S252-I256 VanDerWaalsContact O-CG1 3.28Å; S252-I256 WeakPolarHBondContact O-CG1 3.46Å; S252-I256 PolarHBondContact O-N 2.87Å
253	V	41.3	Very low	38.1	Very low	76 Å²	76	89.8 Å²	89.8	46%	0.461	50%	0.501	S	S	.	.	H	α-helix	trans	-74.4	-38.8	179.1	174.8	0	0	0	0	111.1	V249 T250 L257	V249-V253 WeakPolarHBondContact O-CG2 3.28Å; V249-V253 PolarHBondContact O-N 2.76Å; T250-V253 PolarHBondContact O-N 3.25Å; T250-V253 VanDerWaalsContact O-N 3.12Å; V253-L257 HydrophobicContact CG1-CD1 3.81Å; V253-L257 HydrophobicContact CG1-CG 4.33Å; V253-L257 VanDerWaalsContact O-CB 3.26Å; V253-L257 WeakPolarHBondContact O-CB 3.26Å; V253-L257 VanDerWaalsContact O-CG 3.28Å; V253-L257 WeakPolarHBondContact O-CG 3.49Å; V253-L257 PolarHBondContact O-N 3.45Å
254	E	43.8	Very low	38.3	Very low	81 Å²	81	83.3 Å²	83.3	38%	0.379	47%	0.473	S	S	.	.	H	α-helix	trans	-66.9	-40.4	177.2	-71.9	-172	147.8	0	0	112.2	T250 L257 A258	T250-E254 WeakPolarHBondContact O-CB 3.36Å; T250-E254 WeakPolarHBondContact O-CG 3.38Å; T250-E254 PolarHBondContact O-N 3.19Å; E254-L257 PolarHBondContact O-N 2.77Å; E254-A258 WeakPolarHBondContact O-CB 3.31Å; E254-A258 PolarHBondContact O-N 2.9Å
255	S	40.4	Very low	38.7	Very low	16 Å²	16	80.1 Å²	80.1	11%	0.112	46%	0.459	C	S	.	.	H	α-helix	trans	-68	-43.1	175.4	51.8	0	0	0	0	112.9	E251 S252 L257 A258 V259 S423	E251-S255 VanDerWaalsContact O-CB 3.29Å; E251-S255 WeakPolarHBondContact O-CB 2.88Å; E251-S255 PolarHBondContact O-N 3.23Å; E251-S255 PolarHBondContact O-OG 3.19Å; S252-S255 PolarHBondContact O-OG 3.3Å; S255-L257 VanDerWaalsContact C-N 3.35Å; S255-L257 PolarHBondContact O-N 3.03Å; S255-A258 PolarHBondContact O-N 3.41Å; S255-V259 WeakPolarHBondContact O-CG2 3Å; S255-V259 PolarHBondContact O-N 2.87Å; S255-S423 WeakPolarHBondContact CB-O 3.09Å
256	I	38.5	Very low	38.8	Very low	102 Å²	102	80.1 Å²	80.1	52%	0.523	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-40.7	175	-68.3	169.9	0	0	0	111	S252 S260	S252-I256 WeakPolarHBondContact O-CB 3.45Å; S252-I256 WeakPolarHBondContact O-CD1 3.3Å; S252-I256 VanDerWaalsContact O-CG1 3.28Å; S252-I256 WeakPolarHBondContact O-CG1 3.46Å; S252-I256 PolarHBondContact O-N 2.87Å; I256-S260 VanDerWaalsContact O-CB 3.28Å; I256-S260 WeakPolarHBondContact O-CB 3.18Å; I256-S260 PolarHBondContact O-N 3.49Å; I256-S260 PolarHBondContact O-OG 3.02Å
257	L	40.7	Very low	38.7	Very low	46 Å²	46	78.6 Å²	78.6	24%	0.241	44%	0.435	C	S	.	.	H	α-helix	trans	-68	-39.8	174.2	-75.9	173.5	0	0	0	112.1	V253 E254 S255 S260 L261	V253-L257 HydrophobicContact CG1-CD1 3.81Å; V253-L257 HydrophobicContact CG1-CG 4.33Å; V253-L257 VanDerWaalsContact O-CB 3.26Å; V253-L257 WeakPolarHBondContact O-CB 3.26Å; V253-L257 VanDerWaalsContact O-CG 3.28Å; V253-L257 WeakPolarHBondContact O-CG 3.49Å; V253-L257 PolarHBondContact O-N 3.45Å; E254-L257 PolarHBondContact O-N 2.77Å; S255-L257 VanDerWaalsContact C-N 3.35Å; S255-L257 PolarHBondContact O-N 3.03Å; L257-S260 PolarHBondContact O-N 3.4Å; L257-L261 HydrophobicContact CB-CD1 4.41Å; L257-L261 WeakPolarHBondContact O-CB 3.3Å; L257-L261 WeakPolarHBondContact O-CG 3.49Å; L257-L261 PolarHBondContact O-N 3.22Å
258	A	42.3	Very low	38.4	Very low	57 Å²	57	78 Å²	78	47%	0.471	43%	0.43	S	S	.	.	H	α-helix	trans	-66.5	-40.9	178.7	0	0	0	0	0	112.3	E254 S255 S262	E254-A258 WeakPolarHBondContact O-CB 3.31Å; E254-A258 PolarHBondContact O-N 2.9Å; S255-A258 PolarHBondContact O-N 3.41Å; A258-S262 VanDerWaalsContact O-CB 3.27Å; A258-S262 WeakPolarHBondContact O-CB 3.49Å; A258-S262 PolarHBondContact O-N 3.33Å; A258-S262 PolarHBondContact O-OG 2.97Å
259	V	38.5	Very low	38.5	Very low	94 Å²	94	74.2 Å²	74.2	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-66.2	-40.6	173.1	173.6	0	0	0	0	110.9	S255 S262 A263	S255-V259 WeakPolarHBondContact O-CG2 3Å; S255-V259 PolarHBondContact O-N 2.87Å; V259-S262 PolarHBondContact O-OG 3.22Å; V259-A263 PolarHBondContact O-N 2.84Å
260	S	39.5	Very low	38.7	Very low	60 Å²	60	78.5 Å²	78.5	42%	0.42	44%	0.435	S	S	.	.	H	α-helix	trans	-70.2	-38.8	177.9	-56.3	0	0	0	0	112.8	I256 L257 V264	I256-S260 VanDerWaalsContact O-CB 3.28Å; I256-S260 WeakPolarHBondContact O-CB 3.18Å; I256-S260 PolarHBondContact O-N 3.49Å; I256-S260 PolarHBondContact O-OG 3.02Å; L257-S260 PolarHBondContact O-N 3.4Å; S260-V264 VanDerWaalsContact O-CG2 3.31Å; S260-V264 WeakPolarHBondContact O-CG2 3.21Å; S260-V264 PolarHBondContact O-N 2.98Å
261	L	39.5	Very low	39	Very low	50 Å²	50	79.6 Å²	79.6	26%	0.262	44%	0.442	S	S	.	.	H	α-helix	trans	-76.8	-36.8	179.7	-72.9	167.9	0	0	0	111.7	L257 A263 V264 V265 W295	L257-L261 HydrophobicContact CB-CD1 4.41Å; L257-L261 WeakPolarHBondContact O-CB 3.3Å; L257-L261 WeakPolarHBondContact O-CG 3.49Å; L257-L261 PolarHBondContact O-N 3.22Å; L261-A263 PolarHBondContact O-N 3.11Å; L261-V264 CarbonylContact O-C 3.4Å; L261-V264 PolarHBondContact O-N 3.3Å; L261-V265 HydrophobicContact CB-CG2 4.4Å; L261-V265 HydrophobicContact CD2-CG2 4.47Å; L261-V265 WeakPolarHBondContact O-CB 3.44Å; L261-V265 VanDerWaalsContact O-CG2 3.26Å; L261-V265 WeakPolarHBondContact O-CG2 3.44Å; L261-V265 PolarHBondContact O-N 3.14Å; L261-W295 HydrophobicContact CD1-CZ3 4.18Å
262	S	36.6	Very low	39	Very low	78 Å²	78	82.2 Å²	82.2	55%	0.545	46%	0.459	S	S	.	.	H	α-helix	trans	-65.1	-23.5	173.3	54.3	0	0	0	0	113.2	A258 V259	A258-S262 VanDerWaalsContact O-CB 3.27Å; A258-S262 WeakPolarHBondContact O-CB 3.49Å; A258-S262 PolarHBondContact O-N 3.33Å; A258-S262 PolarHBondContact O-OG 2.97Å; V259-S262 PolarHBondContact O-OG 3.22Å
263	A	37.2	Very low	38.7	Very low	27 Å²	27	85.6 Å²	85.6	22%	0.223	47%	0.468	C	S	.	.	H	α-helix	trans	-77.7	-27.9	168.5	0	0	0	0	0	113.9	V259 L261 F280	V259-A263 PolarHBondContact O-N 2.84Å; L261-A263 PolarHBondContact O-N 3.11Å; A263-F280 HydrophobicContact CB-CE1 4.05Å; A263-F280 HydrophobicContact CB-CE2 4.22Å; A263-F280 HydrophobicContact CB-CZ 3.85Å; A263-F280 VanDerWaalsContact O-CE2 3.26Å; A263-F280 WeakPolarHBondContact O-CE2 3.32Å
264	V	38.6	Very low	38.7	Very low	33 Å²	33	86 Å²	86	20%	0.2	47%	0.47	C	S	.	.	H	α-helix	trans	-97.8	-31.6	-174.4	168.9	0	0	0	0	113.4	S260 L261 Y266 F276	S260-V264 VanDerWaalsContact O-CG2 3.31Å; S260-V264 WeakPolarHBondContact O-CG2 3.21Å; S260-V264 PolarHBondContact O-N 2.98Å; L261-V264 CarbonylContact O-C 3.4Å; L261-V264 PolarHBondContact O-N 3.3Å; V264-Y266 PolarHBondContact O-N 2.81Å; V264-F276 HydrophobicContact CG1-CD1 3.6Å; V264-F276 HydrophobicContact CG1-CE1 3.71Å; V264-F276 HydrophobicContact CG1-CG 4.48Å
265	V	38.7	Very low	38.5	Very low	83 Å²	83	85 Å²	85	50%	0.503	47%	0.47	S	S	.	.			trans	-81.6	52	179.9	-174.5	0	0	0	0	109.9	L261	L261-V265 HydrophobicContact CB-CG2 4.4Å; L261-V265 HydrophobicContact CD2-CG2 4.47Å; L261-V265 WeakPolarHBondContact O-CB 3.44Å; L261-V265 VanDerWaalsContact O-CG2 3.26Å; L261-V265 WeakPolarHBondContact O-CG2 3.44Å; L261-V265 PolarHBondContact O-N 3.14Å
266	Y	39.1	Very low	38.5	Very low	122 Å²	122	90.1 Å²	90.1	48%	0.478	49%	0.49	S	S	.	.			trans	-95.4	1.9	175.3	-106.7	-76.3	0	0	0	113.7	V264	V264-Y266 PolarHBondContact O-N 2.81Å
267	R	34.7	Very low	38.7	Very low	96 Å²	96	87.8 Å²	87.8	36%	0.362	48%	0.479	S	S	.	.			trans	-138.4	105.6	165.4	-75.4	-170.2	-178.1	172.6	3.1	111.1	V275 Y1037	R267-V275 HydrophobicContact CB-CB 4.49Å; R267-Y1037 PolarHBondContact NH2-OH 2.9Å
268	M	29.4	Very low	38.9	Very low	137 Å²	137	93.1 Å²	93.1	68%	0.675	51%	0.508	S	S	*	.			trans	-120.3	81.9	141.3	-87.1	-174.4	157.5	0	0	106.3
269	D	35.7	Very low	38.9	Very low	89 Å²	89	99 Å²	99	48%	0.476	52%	0.518	S	S	.	.			trans	-71.9	168.1	158.1	-67.7	-48.2	0	0	0	108.2	T271	D269-T271 PolarHBondContact O-N 2.84Å
270	N	39.6	Very low	38.9	Very low	177 Å²	177	99.6 Å²	99.6	95%	0.947	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	30.5	-172	-66.3	-11.7	0	0	0	115.5
271	T	43.6	Very low	38.7	Very low	90 Å²	90	104.5 Å²	104.5	55%	0.552	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-3.5	-177.1	59.4	0	0	0	0	114.2	D269 E273	D269-T271 PolarHBondContact O-N 2.84Å; T271-E273 PolarHBondContact O-N 3.19Å
272	N	39.6	Very low	38.6	Very low	152 Å²	152	107 Å²	107	81%	0.813	55%	0.551	S	S	*	*			trans	60.8	11.3	-173.2	-69.1	-30.8	0	0	0	115.8
273	E	36	Very low	38.8	Very low	131 Å²	131	110.5 Å²	110.5	61%	0.612	56%	0.557	S	S	*	*			trans	-92.8	123.5	-179.8	-66.5	-173.2	144.4	0	0	112.8	T271 V275	T271-E273 PolarHBondContact O-N 3.19Å; E273-V275 PolarHBondContact O-N 3.16Å
274	V	41.4	Very low	39.1	Very low	84 Å²	84	112.7 Å²	112.7	51%	0.509	57%	0.567	S	S	.	*			trans	-85.2	106.8	174.2	179.7	0	0	0	0	109.6	F276	V274-F276 HydrophobicContact CG1-CE2 4.23Å; V274-F276 HydrophobicContact CG1-CZ 4.49Å
275	V	39.2	Very low	39.5	Very low	62 Å²	62	116.5 Å²	116.5	38%	0.376	59%	0.586	S	S	.	*			trans	-102.3	115.1	179.6	-178.5	0	0	0	0	110.4	R267 E273	R267-V275 HydrophobicContact CB-CB 4.49Å; E273-V275 PolarHBondContact O-N 3.16Å
276	F	40.1	Very low	40.1	Very low	122 Å²	122	119 Å²	119	54%	0.535	60%	0.597	S	S	.	*			trans	-74.4	140.8	176.4	-67.6	-95.6	0	0	0	111.9	V264 V274	V264-F276 HydrophobicContact CG1-CD1 3.6Å; V264-F276 HydrophobicContact CG1-CE1 3.71Å; V264-F276 HydrophobicContact CG1-CG 4.48Å; V274-F276 HydrophobicContact CG1-CE2 4.23Å; V274-F276 HydrophobicContact CG1-CZ 4.49Å
277	D	42.1	Very low	40.8	Very low	54 Å²	54	116.6 Å²	116.6	29%	0.289	60%	0.603	S	S	.	*			trans	-96.4	110	174.5	-166.5	-35.9	0	0	0	110.9	R279 F280	D277-R279 PolarHBondContact O-N 3.08Å; D277-R279 VanDerWaalsContact OD1-CB 3.25Å; D277-R279 WeakPolarHBondContact OD1-CB 3.4Å; D277-R279 VanDerWaalsContact OD1-CG 3.27Å; D277-R279 WeakPolarHBondContact OD1-CG 3.21Å; D277-R279 IonicContact OD1-CZ 2.79Å; D277-R279 PolarHBondContact OD1-N 2.96Å; D277-R279 IonicContact OD1-NE 3.47Å; D277-R279 PolarHBondContact OD1-NE 2.67Å; D277-R279 IonicContact OD1-NH2 2.78Å; D277-R279 IonicContact OD2-CZ 3Å; D277-R279 VanDerWaalsContact OD2-CZ 3.27Å; D277-R279 IonicContact OD2-NE 2.69Å; D277-R279 PolarHBondContact OD2-NE 2.86Å; D277-R279 VanDerWaalsContact OD2-NE 3.11Å; D277-R279 IonicContact OD2-NH2 3.65Å; D277-R279 PolarHBondContact OD2-NH2 3.01Å; D277-F280 HydrophobicContact CB-CD2 4.41Å; D277-F280 PolarHBondContact O-N 3.24Å
278	N	44.8	Very low	41.8	Very low	158 Å²	158	116.9 Å²	116.9	85%	0.845	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-4	-178.2	-72.3	-9	0	0	0	114.6	F280	N278-F280 VanDerWaalsContact C-N 3.25Å; N278-F280 PolarHBondContact O-N 2.79Å
279	R	42.5	Very low	43	Very low	180 Å²	180	114 Å²	114	68%	0.679	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-17.4	174.4	-67.9	177.9	-75.7	-169.9	-0.4	113.5	D277	D277-R279 PolarHBondContact O-N 3.08Å; D277-R279 VanDerWaalsContact OD1-CB 3.25Å; D277-R279 WeakPolarHBondContact OD1-CB 3.4Å; D277-R279 VanDerWaalsContact OD1-CG 3.27Å; D277-R279 WeakPolarHBondContact OD1-CG 3.21Å; D277-R279 IonicContact OD1-CZ 2.79Å; D277-R279 PolarHBondContact OD1-N 2.96Å; D277-R279 IonicContact OD1-NE 3.47Å; D277-R279 PolarHBondContact OD1-NE 2.67Å; D277-R279 IonicContact OD1-NH2 2.78Å; D277-R279 IonicContact OD2-CZ 3Å; D277-R279 VanDerWaalsContact OD2-CZ 3.27Å; D277-R279 IonicContact OD2-NE 2.69Å; D277-R279 PolarHBondContact OD2-NE 2.86Å; D277-R279 VanDerWaalsContact OD2-NE 3.11Å; D277-R279 IonicContact OD2-NH2 3.65Å; D277-R279 PolarHBondContact OD2-NH2 3.01Å
280	F	38.1	Very low	44.3	Very low	107 Å²	107	117.6 Å²	117.6	47%	0.469	61%	0.61	S	S	.	*	S	Bend	trans	-88.7	106.2	170.7	-64.4	-74.6	0	0	0	110.2	A263 D277 N278 V282	A263-F280 HydrophobicContact CB-CE1 4.05Å; A263-F280 HydrophobicContact CB-CE2 4.22Å; A263-F280 HydrophobicContact CB-CZ 3.85Å; A263-F280 VanDerWaalsContact O-CE2 3.26Å; A263-F280 WeakPolarHBondContact O-CE2 3.32Å; D277-F280 HydrophobicContact CB-CD2 4.41Å; D277-F280 PolarHBondContact O-N 3.24Å; N278-F280 VanDerWaalsContact C-N 3.25Å; N278-F280 PolarHBondContact O-N 2.79Å; F280-V282 HydrophobicContact CB-CG2 4.21Å; F280-V282 PolarHBondContact O-N 3.04Å
281	N	35.9	Very low	45.3	Very low	162 Å²	162	112 Å²	112	87%	0.866	59%	0.588	S	S	*	*			trans	-77.6	52.8	-174.3	-158.1	-2.3	0	0	0	112.8
282	V	38.7	Very low	45.7	Very low	103 Å²	103	109.2 Å²	109.2	62%	0.624	57%	0.574	S	S	*	*			trans	-94.2	109	-176.1	-176.4	0	0	0	0	109.2	F280 V284	F280-V282 HydrophobicContact CB-CG2 4.21Å; F280-V282 PolarHBondContact O-N 3.04Å; V282-V284 VanDerWaalsContact C-N 3.28Å; V282-V284 HydrophobicContact CB-CG2 4.3Å; V282-V284 HydrophobicContact CG1-CG2 3.7Å; V282-V284 PolarHBondContact O-N 2.96Å
283	K	40.8	Very low	46.6	Very low	151 Å²	151	109.8 Å²	109.8	66%	0.657	57%	0.566	S	S	*	*			trans	-67.1	83.4	169.6	-70.7	177.3	-179.5	170.9	0	109.7	N285 E704	K283-N285 PolarHBondContact O-N 3.45Å; K283-E704 IonicContact NZ-OE1 2.75Å; K283-E704 IonicContact NZ-OE2 3.22Å; K283-E704 PolarHBondContact NZ-OE2 2.85Å
284	V	42.8	Very low	48.1	Very low	73 Å²	73	110 Å²	110	44%	0.442	57%	0.565	S	S	.	*			trans	-80	101.6	174.2	-172	0	0	0	0	109.5	V282 N288 L289	V282-V284 VanDerWaalsContact C-N 3.28Å; V282-V284 HydrophobicContact CB-CG2 4.3Å; V282-V284 HydrophobicContact CG1-CG2 3.7Å; V282-V284 PolarHBondContact O-N 2.96Å; V284-N288 HydrophobicContact CG1-CB 4.07Å; V284-L289 HydrophobicContact CG1-CB 3.82Å; V284-L289 HydrophobicContact CG1-CD1 4.12Å
285	N	45.8	Very low	49.5	Very low	113 Å²	113	109.4 Å²	109.4	60%	0.604	55%	0.554	S	S	*	*			trans	-65.4	148.3	169.7	-70.2	-5	0	0	0	110.7	K283 A287 N288 L289	K283-N285 PolarHBondContact O-N 3.45Å; N285-A287 PolarHBondContact O-N 2.8Å; N285-N288 WeakPolarHBondContact O-CA 3.43Å; N285-N288 WeakPolarHBondContact O-CB 3.26Å; N285-N288 PolarHBondContact O-N 3.24Å; N285-L289 PolarHBondContact O-N 2.83Å
286	D	52.6	Low	50.6	Low	135 Å²	135	109.6 Å²	109.6	72%	0.722	56%	0.555	S	S	*	*	H	α-helix	trans	-50.2	-36.3	-178.2	-78.7	-29.1	0	0	0	114.4	N288 L289 K290	D286-N288 VanDerWaalsContact C-N 3.3Å; D286-N288 PolarHBondContact O-N 2.77Å; D286-L289 PolarHBondContact O-N 2.69Å; D286-K290 WeakPolarHBondContact O-CB 3.36Å; D286-K290 PolarHBondContact O-N 3.12Å
287	A	52.6	Low	51.8	Low	73 Å²	73	109.7 Å²	109.7	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-60.6	-40	176.2	0	0	0	0	0	112.2	N285 A291	N285-A287 PolarHBondContact O-N 2.8Å; A287-A291 VanDerWaalsContact O-CB 3.24Å; A287-A291 WeakPolarHBondContact O-CB 3.4Å; A287-A291 PolarHBondContact O-N 2.86Å
288	N	55.5	Low	53	Low	102 Å²	102	112.7 Å²	112.7	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-75.8	-38.9	177.7	-64.6	1.1	0	0	0	110.9	V284 N285 D286 A291 A292	V284-N288 HydrophobicContact CG1-CB 4.07Å; N285-N288 WeakPolarHBondContact O-CA 3.43Å; N285-N288 WeakPolarHBondContact O-CB 3.26Å; N285-N288 PolarHBondContact O-N 3.24Å; D286-N288 VanDerWaalsContact C-N 3.3Å; D286-N288 PolarHBondContact O-N 2.77Å; N288-A291 PolarHBondContact O-N 2.79Å; N288-A292 WeakPolarHBondContact O-CB 3.32Å; N288-A292 PolarHBondContact O-N 2.79Å
289	L	55.6	Low	54.2	Low	75 Å²	75	106.4 Å²	106.4	39%	0.393	54%	0.538	S	S	.	.	H	α-helix	trans	-61.1	-47	174.8	-168.2	71	0	0	0	110.7	V284 N285 D286 A292 Y293	V284-L289 HydrophobicContact CG1-CB 3.82Å; V284-L289 HydrophobicContact CG1-CD1 4.12Å; N285-L289 PolarHBondContact O-N 2.83Å; D286-L289 PolarHBondContact O-N 2.69Å; L289-A292 PolarHBondContact O-N 3.43Å; L289-Y293 WeakPolarHBondContact O-CB 3.14Å; L289-Y293 PolarHBondContact O-N 3.47Å
290	K	63.9	Low	54.8	Low	165 Å²	165	100.3 Å²	100.3	72%	0.717	52%	0.523	S	S	*	.	H	α-helix	trans	-67.7	-34.3	178.1	-166.5	168.4	-171.9	168.3	0	112.4	D286 K294	D286-K290 WeakPolarHBondContact O-CB 3.36Å; D286-K290 PolarHBondContact O-N 3.12Å; K290-K294 WeakPolarHBondContact O-CB 3.48Å; K290-K294 PolarHBondContact O-N 2.78Å
291	A	58.9	Low	55.6	Low	59 Å²	59	98.7 Å²	98.7	49%	0.488	53%	0.53	S	S	.	.	H	α-helix	trans	-66.2	-46.7	171.7	0	0	0	0	0	111.7	A287 N288 K294 W295	A287-A291 VanDerWaalsContact O-CB 3.24Å; A287-A291 WeakPolarHBondContact O-CB 3.4Å; A287-A291 PolarHBondContact O-N 2.86Å; N288-A291 PolarHBondContact O-N 2.79Å; A291-K294 PolarHBondContact O-N 2.81Å; A291-W295 WeakPolarHBondContact O-CB 3.37Å; A291-W295 PolarHBondContact O-N 2.99Å
292	A	52	Low	57	Low	33 Å²	33	95.6 Å²	95.6	27%	0.273	51%	0.509	S	S	.	.	H	α-helix	trans	-62.9	-47.2	176.9	0	0	0	0	0	111.7	N288 L289 K294 W295 V296	N288-A292 WeakPolarHBondContact O-CB 3.32Å; N288-A292 PolarHBondContact O-N 2.79Å; L289-A292 PolarHBondContact O-N 3.43Å; A292-K294 VanDerWaalsContact C-N 3.32Å; A292-K294 PolarHBondContact O-N 3.22Å; A292-W295 PolarHBondContact O-N 3.01Å; A292-V296 WeakPolarHBondContact O-CB 3.43Å; A292-V296 WeakPolarHBondContact O-CG2 3.27Å; A292-V296 PolarHBondContact O-N 2.93Å
293	Y	60	Low	57.4	Low	163 Å²	163	93.8 Å²	93.8	64%	0.639	50%	0.495	S	S	*	.	H	α-helix	trans	-61.6	-40.3	177.9	-150.2	-83.6	0	0	0	111.7	L289 Q297	L289-Y293 WeakPolarHBondContact O-CB 3.14Å; L289-Y293 PolarHBondContact O-N 3.47Å; Y293-Q297 HydrophobicContact CD1-CG 4.27Å; Y293-Q297 HydrophobicContact CE1-CG 4.4Å; Y293-Q297 WeakPolarHBondContact O-CB 3.49Å; Y293-Q297 WeakPolarHBondContact O-CG 3.15Å; Y293-Q297 PolarHBondContact O-N 3.44Å
294	K	67.7	Low	58.1	Low	135 Å²	135	91.8 Å²	91.8	59%	0.587	49%	0.49	S	S	*	.	H	α-helix	trans	-69.5	-37.6	174.9	-169.3	179.9	-178.7	-173.2	0	112.4	K290 A291 A292 Q297 I298	K290-K294 WeakPolarHBondContact O-CB 3.48Å; K290-K294 PolarHBondContact O-N 2.78Å; A291-K294 PolarHBondContact O-N 2.81Å; A292-K294 VanDerWaalsContact C-N 3.32Å; A292-K294 PolarHBondContact O-N 3.22Å; K294-Q297 PolarHBondContact O-N 3.25Å; K294-I298 HydrophobicContact CD-CD1 4.48Å; K294-I298 HydrophobicContact CG-CD1 3.9Å; K294-I298 HydrophobicContact CG-CG1 4.49Å; K294-I298 WeakPolarHBondContact O-CB 3.24Å; K294-I298 VanDerWaalsContact O-CG1 3.25Å; K294-I298 WeakPolarHBondContact O-CG1 3.39Å; K294-I298 PolarHBondContact O-N 3.14Å
295	W	70.1	Confident	58.5	Low	73 Å²	73	89.9 Å²	89.9	28%	0.277	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-41.9	175.3	-174.6	97.1	0	0	0	111.2	L261 A291 A292 I298 N299 L303	L261-W295 HydrophobicContact CD1-CZ3 4.18Å; A291-W295 WeakPolarHBondContact O-CB 3.37Å; A291-W295 PolarHBondContact O-N 2.99Å; A292-W295 PolarHBondContact O-N 3.01Å; W295-I298 PolarHBondContact O-N 2.86Å; W295-N299 VanDerWaalsContact CE2-ND2 3.3Å; W295-N299 HydrophobicContact CE3-CB 4.49Å; W295-N299 HydrophobicContact CH2-CB 4.45Å; W295-N299 HydrophobicContact CZ2-CB 4.49Å; W295-N299 HydrophobicContact CZ3-CB 4.46Å; W295-N299 PolarHBondContact NE1-ND2 2.7Å; W295-N299 VanDerWaalsContact O-CB 3.31Å; W295-N299 WeakPolarHBondContact O-CB 3.45Å; W295-N299 PolarHBondContact O-N 2.93Å; W295-N299 PolarHBondContact O-ND2 2.75Å; W295-L303 HydrophobicContact CH2-CD1 4.38Å; W295-L303 HydrophobicContact CZ3-CD1 4.01Å
296	V	61.2	Low	58.7	Low	65 Å²	65	89.6 Å²	89.6	39%	0.394	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-40.7	173.9	171.6	0	0	0	0	111.1	A292 S300	A292-V296 WeakPolarHBondContact O-CB 3.43Å; A292-V296 WeakPolarHBondContact O-CG2 3.27Å; A292-V296 PolarHBondContact O-N 2.93Å; V296-S300 VanDerWaalsContact O-CA 3.29Å; V296-S300 WeakPolarHBondContact O-CA 3.18Å; V296-S300 VanDerWaalsContact O-CB 3.22Å; V296-S300 WeakPolarHBondContact O-CB 3.23Å; V296-S300 PolarHBondContact O-N 2.83Å
297	Q	66.2	Low	58.2	Low	125 Å²	125	87.8 Å²	87.8	58%	0.584	47%	0.47	S	S	*	.	H	α-helix	trans	-61.6	-50.6	172.9	-80.8	-176.1	-28.9	0	0	112.1	Y293 K294 N299 S300	Y293-Q297 HydrophobicContact CD1-CG 4.27Å; Y293-Q297 HydrophobicContact CE1-CG 4.4Å; Y293-Q297 WeakPolarHBondContact O-CB 3.49Å; Y293-Q297 WeakPolarHBondContact O-CG 3.15Å; Y293-Q297 PolarHBondContact O-N 3.44Å; K294-Q297 PolarHBondContact O-N 3.25Å; Q297-N299 PolarHBondContact O-N 2.72Å; Q297-S300 WeakPolarHBondContact O-CB 3.39Å; Q297-S300 PolarHBondContact O-N 2.77Å; Q297-S300 PolarHBondContact O-OG 3.33Å
298	I	67.8	Low	57.8	Low	116 Å²	116	87.4 Å²	87.4	60%	0.595	46%	0.463	S	S	*	.	H	α-helix	trans	-61.8	-45	-179.6	-72.2	168.3	0	0	0	111.4	K294 W295	K294-I298 HydrophobicContact CD-CD1 4.48Å; K294-I298 HydrophobicContact CG-CD1 3.9Å; K294-I298 HydrophobicContact CG-CG1 4.49Å; K294-I298 WeakPolarHBondContact O-CB 3.24Å; K294-I298 VanDerWaalsContact O-CG1 3.25Å; K294-I298 WeakPolarHBondContact O-CG1 3.39Å; K294-I298 PolarHBondContact O-N 3.14Å; W295-I298 PolarHBondContact O-N 2.86Å
299	N	69.6	Low	57.3	Low	26 Å²	26	87.6 Å²	87.6	14%	0.139	47%	0.468	C	S	.	.	H	α-helix	trans	-90.3	2.4	-177.5	-64.9	-77.5	0	0	0	113.5	W295 Q297 A301 K302 L303	W295-N299 VanDerWaalsContact CE2-ND2 3.3Å; W295-N299 HydrophobicContact CE3-CB 4.49Å; W295-N299 HydrophobicContact CH2-CB 4.45Å; W295-N299 HydrophobicContact CZ2-CB 4.49Å; W295-N299 HydrophobicContact CZ3-CB 4.46Å; W295-N299 PolarHBondContact NE1-ND2 2.7Å; W295-N299 VanDerWaalsContact O-CB 3.31Å; W295-N299 WeakPolarHBondContact O-CB 3.45Å; W295-N299 PolarHBondContact O-N 2.93Å; W295-N299 PolarHBondContact O-ND2 2.75Å; Q297-N299 PolarHBondContact O-N 2.72Å; N299-A301 VanDerWaalsContact C-N 3.34Å; N299-A301 PolarHBondContact O-N 3.29Å; N299-K302 HydrophobicContact CB-CB 4.43Å; N299-K302 CarbonylContact O-C 3.58Å; N299-K302 WeakPolarHBondContact O-CA 3.36Å; N299-K302 WeakPolarHBondContact O-CB 3.07Å; N299-K302 PolarHBondContact O-N 3.43Å; N299-L303 HydrophobicContact CB-CD1 4.36Å; N299-L303 WeakPolarHBondContact O-CB 3.44Å; N299-L303 PolarHBondContact O-N 2.88Å
300	S	54.7	Low	56.5	Low	52 Å²	52	88.9 Å²	88.9	36%	0.364	48%	0.483	S	S	.	.	H	α-helix	trans	-53.9	-49.9	-179.7	56.5	0	0	0	0	111.8	V296 Q297 K302 L303 I304	V296-S300 VanDerWaalsContact O-CA 3.29Å; V296-S300 WeakPolarHBondContact O-CA 3.18Å; V296-S300 VanDerWaalsContact O-CB 3.22Å; V296-S300 WeakPolarHBondContact O-CB 3.23Å; V296-S300 PolarHBondContact O-N 2.83Å; Q297-S300 WeakPolarHBondContact O-CB 3.39Å; Q297-S300 PolarHBondContact O-N 2.77Å; Q297-S300 PolarHBondContact O-OG 3.33Å; S300-K302 VanDerWaalsContact C-N 3.34Å; S300-K302 PolarHBondContact O-N 2.81Å; S300-L303 PolarHBondContact O-N 2.91Å; S300-I304 VanDerWaalsContact O-CB 3.3Å; S300-I304 WeakPolarHBondContact O-CB 3.18Å; S300-I304 WeakPolarHBondContact O-CD1 3.12Å; S300-I304 WeakPolarHBondContact O-CG1 3.18Å; S300-I304 PolarHBondContact O-N 3.38Å
301	A	56.3	Low	55.1	Low	74 Å²	74	88.6 Å²	88.6	61%	0.612	49%	0.486	S	S	*	.	H	α-helix	trans	-65.9	-32.1	175.9	0	0	0	0	0	113.3	N299 G305	N299-A301 VanDerWaalsContact C-N 3.34Å; N299-A301 PolarHBondContact O-N 3.29Å; A301-G305 PolarHBondContact O-N 2.84Å
302	K	63.2	Low	53.9	Low	97 Å²	97	93.1 Å²	93.1	42%	0.422	50%	0.495	S	S	.	.	H	α-helix	trans	-71	-48.7	176.2	-176.1	-174.4	167.7	-168.9	0	111.1	N299 S300 G305 E306	N299-K302 HydrophobicContact CB-CB 4.43Å; N299-K302 CarbonylContact O-C 3.58Å; N299-K302 WeakPolarHBondContact O-CA 3.36Å; N299-K302 WeakPolarHBondContact O-CB 3.07Å; N299-K302 PolarHBondContact O-N 3.43Å; S300-K302 VanDerWaalsContact C-N 3.34Å; S300-K302 PolarHBondContact O-N 2.81Å; K302-G305 CarbonylContact O-C 3.58Å; K302-G305 WeakPolarHBondContact O-CA 3.33Å; K302-G305 PolarHBondContact O-N 3.2Å; K302-G305 VanDerWaalsContact O-N 3.14Å; K302-E306 WeakPolarHBondContact CE-OE1 3.49Å; K302-E306 IonicContact NZ-OE1 2.81Å; K302-E306 WeakPolarHBondContact O-CB 3.45Å; K302-E306 WeakPolarHBondContact O-CG 3.37Å; K302-E306 PolarHBondContact O-N 3.3Å
303	L	49	Very low	53	Low	64 Å²	64	96.5 Å²	96.5	34%	0.335	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-45.5	175.1	-79.9	162.7	0	0	0	111.6	W295 N299 S300 G305 E306 L307	W295-L303 HydrophobicContact CH2-CD1 4.38Å; W295-L303 HydrophobicContact CZ3-CD1 4.01Å; N299-L303 HydrophobicContact CB-CD1 4.36Å; N299-L303 WeakPolarHBondContact O-CB 3.44Å; N299-L303 PolarHBondContact O-N 2.88Å; S300-L303 PolarHBondContact O-N 2.91Å; L303-G305 VanDerWaalsContact C-N 3.28Å; L303-G305 PolarHBondContact O-N 3.03Å; L303-E306 PolarHBondContact O-N 2.76Å; L303-L307 WeakPolarHBondContact O-CB 3.3Å; L303-L307 WeakPolarHBondContact O-CD1 3.43Å; L303-L307 WeakPolarHBondContact O-CG 3.5Å; L303-L307 PolarHBondContact O-N 3.34Å
304	I	55.5	Low	51.7	Low	110 Å²	110	94.8 Å²	94.8	56%	0.564	53%	0.526	S	S	*	.	H	α-helix	trans	-61.7	-39.4	173.8	-69.9	165.6	0	0	0	110.3	S300 S308	S300-I304 VanDerWaalsContact O-CB 3.3Å; S300-I304 WeakPolarHBondContact O-CB 3.18Å; S300-I304 WeakPolarHBondContact O-CD1 3.12Å; S300-I304 WeakPolarHBondContact O-CG1 3.18Å; S300-I304 PolarHBondContact O-N 3.38Å; I304-S308 WeakPolarHBondContact O-CB 3.44Å; I304-S308 PolarHBondContact O-N 3.29Å; I304-S308 PolarHBondContact O-OG 3.33Å
305	G	50.7	Low	49.9	Very low	33 Å²	33	93.5 Å²	93.5	34%	0.34	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-50.6	174.7	0	0	0	0	0	113.4	A301 K302 L303 S308 V309	A301-G305 PolarHBondContact O-N 2.84Å; K302-G305 CarbonylContact O-C 3.58Å; K302-G305 WeakPolarHBondContact O-CA 3.33Å; K302-G305 PolarHBondContact O-N 3.2Å; K302-G305 VanDerWaalsContact O-N 3.14Å; L303-G305 VanDerWaalsContact C-N 3.28Å; L303-G305 PolarHBondContact O-N 3.03Å; G305-S308 CarbonylContact O-C 3.47Å; G305-S308 PolarHBondContact O-N 2.98Å; G305-V309 WeakPolarHBondContact O-CG2 3.38Å; G305-V309 PolarHBondContact O-N 3.47Å
306	E	49.6	Very low	48.1	Very low	107 Å²	107	95.6 Å²	95.6	50%	0.5	56%	0.558	S	S	.	*	H	α-helix	trans	-68	-39.1	-179.1	-73	171.5	175.3	0	0	111.6	K302 L303 V309 S310	K302-E306 WeakPolarHBondContact CE-OE1 3.49Å; K302-E306 IonicContact NZ-OE1 2.81Å; K302-E306 WeakPolarHBondContact O-CB 3.45Å; K302-E306 WeakPolarHBondContact O-CG 3.37Å; K302-E306 PolarHBondContact O-N 3.3Å; L303-E306 PolarHBondContact O-N 2.76Å; E306-V309 PolarHBondContact O-N 2.87Å; E306-S310 WeakPolarHBondContact O-CB 3.41Å; E306-S310 PolarHBondContact O-N 2.85Å
307	L	42.7	Very low	46.7	Very low	96 Å²	96	100.8 Å²	100.8	50%	0.503	58%	0.582	S	S	.	*	H	α-helix	trans	-65.5	-39.5	169.9	-70.4	167.5	0	0	0	111.7	L303 V309 S310 M311	L303-L307 WeakPolarHBondContact O-CB 3.3Å; L303-L307 WeakPolarHBondContact O-CD1 3.43Å; L303-L307 WeakPolarHBondContact O-CG 3.5Å; L303-L307 PolarHBondContact O-N 3.34Å; L307-V309 PolarHBondContact O-N 3.17Å; L307-S310 CarbonylContact O-C 3.57Å; L307-S310 PolarHBondContact O-N 2.81Å; L307-M311 VanDerWaalsContact O-CB 3.29Å; L307-M311 WeakPolarHBondContact O-CB 3.23Å; L307-M311 PolarHBondContact O-N 2.96Å
308	S	43.6	Very low	45.1	Very low	66 Å²	66	100.6 Å²	100.6	46%	0.462	59%	0.589	S	S	.	*	H	α-helix	trans	-70.1	-17.8	174.7	-61	0	0	0	0	113.5	I304 G305 K312	I304-S308 WeakPolarHBondContact O-CB 3.44Å; I304-S308 PolarHBondContact O-N 3.29Å; I304-S308 PolarHBondContact O-OG 3.33Å; G305-S308 CarbonylContact O-C 3.47Å; G305-S308 PolarHBondContact O-N 2.98Å; S308-K312 WeakPolarHBondContact O-CG 3.3Å
309	V	46	Very low	43.4	Very low	106 Å²	106	101.7 Å²	101.7	64%	0.642	60%	0.597	S	S	*	*	H	α-helix	trans	-85.6	-39.2	169.4	169.8	0	0	0	0	110.4	G305 E306 L307 M311	G305-V309 WeakPolarHBondContact O-CG2 3.38Å; G305-V309 PolarHBondContact O-N 3.47Å; E306-V309 PolarHBondContact O-N 2.87Å; L307-V309 PolarHBondContact O-N 3.17Å; V309-M311 VanDerWaalsContact C-N 3.35Å
310	S	37.6	Very low	41.7	Very low	102 Å²	102	109.4 Å²	109.4	71%	0.713	63%	0.632	S	S	*	*	H	α-helix	trans	-73.9	-19.9	176.2	-170.2	0	0	0	0	114.4	E306 L307	E306-S310 WeakPolarHBondContact O-CB 3.41Å; E306-S310 PolarHBondContact O-N 2.85Å; L307-S310 CarbonylContact O-C 3.57Å; L307-S310 PolarHBondContact O-N 2.81Å
311	M	35.8	Very low	40.7	Very low	159 Å²	159	115 Å²	115	78%	0.783	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	10.9	176.8	-68.4	-171.1	150.4	0	0	113.1	L307 V309 P313	L307-M311 VanDerWaalsContact O-CB 3.29Å; L307-M311 WeakPolarHBondContact O-CB 3.23Å; L307-M311 PolarHBondContact O-N 2.96Å; V309-M311 VanDerWaalsContact C-N 3.35Å; M311-P313 WeakPolarHBondContact O-CD 3.34Å
312	K	32.4	Very low	39.7	Very low	154 Å²	154	120.1 Å²	120.1	67%	0.67	67%	0.667	S	S	*	*	S	Bend	trans	-73.4	123.7	165.6	-101.3	171.6	-178.6	-179.8	0	109.2	S308	S308-K312 WeakPolarHBondContact O-CG 3.3Å
313	P	33	Very low	38.2	Very low	104 Å²	104	119.9 Å²	119.9	68%	0.675	68%	0.683	S	S	*	*			trans	-61.1	144.9	168.3	27.5	-33.8	0	0	0	109.5	M311 S315	M311-P313 WeakPolarHBondContact O-CD 3.34Å; P313-S315 PolarHBondContact O-N 3.42Å; P313-S315 PolarHBondContact O-OG 3.03Å
314	S	33.4	Very low	37.5	Very low	126 Å²	126	126.5 Å²	126.5	88%	0.881	71%	0.709	S	S	*	*			trans	-76.6	63.5	-173.1	39.2	0	0	0	0	113.2	C316	S314-C316 VanDerWaalsContact C-N 3.33Å; S314-C316 PolarHBondContact O-N 2.86Å
315	S	30.5	Very low	36.5	Very low	108 Å²	108	126.1 Å²	126.1	76%	0.755	72%	0.716	S	S	*	*			trans	-81.7	63.9	179.4	49.4	0	0	0	0	113.6	P313	P313-S315 PolarHBondContact O-N 3.42Å; P313-S315 PolarHBondContact O-OG 3.03Å
316	C	32.4	Very low	35.7	Very low	117 Å²	117	129.9 Å²	129.9	79%	0.791	73%	0.733	S	S	*	*			trans	-157.2	88.8	167.7	-110.4	0	0	0	0	113.2	S314	S314-C316 VanDerWaalsContact C-N 3.33Å; S314-C316 PolarHBondContact O-N 2.86Å
317	I	31	Very low	35.1	Very low	175 Å²	175	129.1 Å²	129.1	90%	0.897	74%	0.739	S	S	*	*			trans	-137	100	150	-58.7	-176.9	0	0	0	107.8
318	T	31.5	Very low	34.8	Very low	120 Å²	120	131.3 Å²	131.3	74%	0.736	75%	0.752	S	S	*	*			trans	-145.4	160.8	170.1	-27.1	0	0	0	0	108.1
319	D	32.4	Very low	34.3	Very low	139 Å²	139	133.3 Å²	133.3	74%	0.743	77%	0.766	S	S	*	*			trans	70.4	85.5	170.1	-59	-11.3	0	0	0	119.4
320	Q	34.3	Very low	33.9	Very low	189 Å²	189	134.8 Å²	134.8	88%	0.883	77%	0.768	S	S	*	*				-161.9	129.1	115.2	-100.3	152.7	88.7	0	0	107.6
321	I	33.6	Very low	33.7	Very low	169 Å²	169	137.4 Å²	137.4	87%	0.867	77%	0.774	S	S	*	*				-151	155.5	74.8	-82.4	160.7	0	0	0	112
322	Q	34.9	Very low	33.6	Very low	182 Å²	182	134.2 Å²	134.2	85%	0.85	77%	0.767	S	S	*	*			trans	-66.7	168.3	178.4	-75.6	169.9	-20.8	0	0	115.6
323	A	32.6	Very low	33.7	Very low	91 Å²	91	133.1 Å²	133.1	75%	0.752	77%	0.773	S	S	*	*			cis	-173.9	-174	-15	0	0	0	0	0	111.3
324	K	33.9	Very low	33.7	Very low	204 Å²	204	133.2 Å²	133.2	89%	0.887	78%	0.776	S	S	*	*			trans	82.5	116.8	-176.2	-63.9	-178	174.8	178.5	0	114.2
325	S	33.7	Very low	34	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	77%	0.771	S	S	*	*				81.1	131.2	50.3	-160	0	0	0	0	111.4
326	T	35.1	Very low	34.6	Very low	112 Å²	112	132.8 Å²	132.8	69%	0.687	77%	0.768	S	S	*	*			cis	-158.3	159.2	24.3	-30.3	0	0	0	0	111.8
327	S	36.8	Very low	34.8	Very low	91 Å²	91	133 Å²	133	64%	0.636	77%	0.766	S	S	*	*			trans	57.8	147.8	148.2	54	0	0	0	0	121.3
328	D	35.4	Very low	35.1	Very low	143 Å²	143	130 Å²	130	77%	0.765	76%	0.756	S	S	*	*			cis	-167.3	147.5	-13	-100.2	-30	0	0	0	111.6
329	S	34	Very low	35.1	Very low	108 Å²	108	131.2 Å²	131.2	76%	0.755	76%	0.758	S	S	*	*			trans	68.9	165.3	152.4	85.6	0	0	0	0	118.4
330	I	37.2	Very low	35.3	Very low	137 Å²	137	129.7 Å²	129.7	70%	0.703	76%	0.758	S	S	*	*			cis	-157.1	140.2	2.4	-142.7	158	0	0	0	111.6
331	L	34.7	Very low	35.4	Very low	157 Å²	157	125.4 Å²	125.4	82%	0.822	75%	0.749	S	S	*	*			trans	56.3	168.4	158.2	-65.9	162	0	0	0	118.4
332	S	31.9	Very low	35.4	Very low	92 Å²	92	124.4 Å²	124.4	64%	0.643	75%	0.745	S	S	*	*			cis	-171.7	168.2	-32.5	-167.9	0	0	0	0	106.5
333	T	35.8	Very low	35.4	Very low	130 Å²	130	120 Å²	120	80%	0.798	74%	0.74	S	S	*	*			cis	-153.2	179.9	16.4	-36.3	0	0	0	0	110.9
334	S	31.8	Very low	35.3	Very low	106 Å²	106	122.9 Å²	122.9	74%	0.741	74%	0.743	S	S	*	*			trans	-75.9	165.2	-173.6	-43	0	0	0	0	118.9
335	P	40.9	Very low	35.2	Very low	119 Å²	119	118.8 Å²	118.8	77%	0.773	74%	0.735	S	S	*	*			trans	-88.3	-158.9	162.7	42.7	-39.4	0	0	0	110.8
336	P	43	Very low	35.1	Very low	107 Å²	107	121.8 Å²	121.8	70%	0.695	74%	0.742	S	S	*	*			cis	-137.1	-167.7	-2	44.6	-26.1	0	0	0	115.3
337	T	36.7	Very low	34.9	Very low	122 Å²	122	121.2 Å²	121.2	75%	0.748	74%	0.742	S	S	*	*				172.4	152.6	124.4	40.5	0	0	0	0	116
338	T	36.5	Very low	34.7	Very low	112 Å²	112	121 Å²	121	69%	0.687	74%	0.741	S	S	*	*			trans	62.5	102.2	148.6	50.5	0	0	0	0	123.6
339	D	32.6	Very low	34.5	Very low	145 Å²	145	123.2 Å²	123.2	78%	0.775	74%	0.744	S	S	*	*				69.2	133.9	107.6	-57.3	-15	0	0	0	126.5
340	S	36.1	Very low	34.5	Very low	106 Å²	106	123.6 Å²	123.6	74%	0.741	75%	0.746	S	S	*	*			trans	94.7	92.2	135	72	0	0	0	0	123
341	S	36.1	Very low	34.3	Very low	99 Å²	99	124.2 Å²	124.2	69%	0.692	75%	0.75	S	S	*	*				83.3	146	119.1	81.3	0	0	0	0	123.2
342	N	34.9	Very low	34.1	Very low	149 Å²	149	126 Å²	126	80%	0.797	75%	0.752	S	S	*	*			trans	69.6	87	144.6	-61.9	-13.4	0	0	0	122.3
343	A	33.1	Very low	34	Very low	88 Å²	88	126.5 Å²	126.5	73%	0.727	76%	0.755	S	S	*	*				70	128.5	112.6	0	0	0	0	0	122.8
344	N	31.6	Very low	33.6	Very low	153 Å²	153	125.5 Å²	125.5	82%	0.818	75%	0.753	S	S	*	*			trans	89.6	125.5	135.6	-82.6	-15.1	0	0	0	123.1
345	V	32.5	Very low	33.4	Very low	118 Å²	118	126.4 Å²	126.4	72%	0.715	76%	0.755	S	S	*	*			trans	95.3	108	132.7	168.8	0	0	0	0	120.7
346	L	31.8	Very low	32.8	Very low	163 Å²	163	125.4 Å²	125.4	85%	0.853	75%	0.751	S	S	*	*			trans	65.2	107.2	142.9	-72.5	176.2	0	0	0	122.7
347	S	29.5	Very low	32	Very low	101 Å²	101	128 Å²	128	71%	0.706	76%	0.755	S	S	*	*				123.3	141.2	106.1	-163.1	0	0	0	0	119.4
348	S	32.7	Very low	31.7	Very low	87 Å²	87	127 Å²	127	61%	0.608	75%	0.753	S	S	*	*			trans	84.4	105.7	149.1	-68.3	0	0	0	0	123.8
349	K	32.2	Very low	31.5	Very low	189 Å²	189	127.2 Å²	127.2	82%	0.822	76%	0.755	S	S	*	*				71.1	101.8	126.2	-58.8	171.7	-174.3	174	0	121.8
350	S	33.4	Very low	31.6	Very low	115 Å²	115	126.1 Å²	126.1	80%	0.804	76%	0.758	S	S	*	*				-176.4	126.1	126.5	29.9	0	0	0	0	108.2
351	L	33.3	Very low	31.5	Very low	151 Å²	151	128.2 Å²	128.2	79%	0.791	76%	0.761	S	S	*	*				91.8	85.3	60.6	-72.7	173.6	0	0	0	114.9
352	F	29.2	Very low	31.4	Very low	194 Å²	194	128 Å²	128	85%	0.851	76%	0.759	S	S	*	*			trans	71.1	149.7	145.7	-73.2	-81.8	0	0	0	124.7
353	S	29.5	Very low	31.4	Very low	103 Å²	103	125.4 Å²	125.4	72%	0.72	75%	0.746	S	S	*	*			trans	96.9	82.3	150.5	-62.1	0	0	0	0	122.4
354	S	27.8	Very low	31.5	Very low	108 Å²	108	122.5 Å²	122.5	76%	0.755	72%	0.72	S	S	*	*				63.5	141.2	112.9	-53.4	0	0	0	0	125.3
355	T	27.3	Very low	31.7	Very low	125 Å²	125	118.1 Å²	118.1	77%	0.767	70%	0.696	S	S	*	*			trans	74	95.8	145.3	36.3	0	0	0	0	122.6
356	S	28.1	Very low	31.8	Very low	99 Å²	99	119 Å²	119	69%	0.692	69%	0.692	S	S	*	*				31.7	140.3	119.5	61.2	0	0	0	0	123.2
357	M	27.8	Very low	32	Very low	161 Å²	161	120.7 Å²	120.7	79%	0.793	69%	0.687	S	S	*	*				175.9	151.5	104.6	-94.9	-164.6	75.7	0	0	115.6
358	S	28.8	Very low	32.2	Very low	101 Å²	101	125 Å²	125	71%	0.706	69%	0.693	S	S	*	*			trans	64.9	165	142.3	65.8	0	0	0	0	122.6
359	V	33.8	Very low	32.2	Very low	117 Å²	117	124.4 Å²	124.4	71%	0.709	69%	0.693	S	S	*	*			cis	-169	157.2	-28	141.6	0	0	0	0	107.2
360	S	33.8	Very low	32.5	Very low	122 Å²	122	122.3 Å²	122.3	85%	0.853	69%	0.691	S	S	*	*			trans	-152.6	144.3	151	-81.8	0	0	0	0	111.6
361	N	34	Very low	32.6	Very low	149 Å²	149	123.1 Å²	123.1	80%	0.797	69%	0.687	S	S	*	*			trans	-136	-175.1	-168	-98.9	28.4	0	0	0	112.6
362	S	33.6	Very low	32.6	Very low	94 Å²	94	121.4 Å²	121.4	66%	0.657	68%	0.678	S	S	*	*			trans	140.3	149.5	143.2	-78.2	0	0	0	0	114.5
363	D	36.6	Very low	32.8	Very low	96 Å²	96	120.1 Å²	120.1	51%	0.513	68%	0.675	S	S	.	*			cis	-176.1	172.2	-12.1	-106.5	-48.5	0	0	0	111.5	E44	E44-D363 WeakPolarHBondContact OE2-CA 3.47Å; E44-D363 PolarHBondContact OE2-N 2.92Å
364	S	33.9	Very low	32.8	Very low	26 Å²	26	120.1 Å²	120.1	18%	0.182	67%	0.674	C	S	.	*			cis	168.7	91.4	3.4	145	0	0	0	0	117	Q43 C45	Q43-S364 VanDerWaalsContact CB-C 3.5Å; Q43-S364 VanDerWaalsContact CB-O 3.31Å; Q43-S364 WeakPolarHBondContact CB-O 3.45Å; Q43-S364 VanDerWaalsContact CD-O 3.23Å; Q43-S364 WeakPolarHBondContact CG-O 3.38Å; Q43-S364 PolarHBondContact NE2-O 2.83Å; C45-S364 VanDerWaalsContact CA-CB 3.45Å
365	I	36.6	Very low	33.1	Very low	62 Å²	62	121.4 Å²	121.4	32%	0.318	67%	0.672	S	S	.	*			trans	111.6	82.4	156.7	-48.4	155	0	0	0	123.6	Q43 E44 C45	Q43-I365 VanDerWaalsContact C-N 3.34Å; Q43-I365 VanDerWaalsContact CB-C 3.49Å; Q43-I365 WeakPolarHBondContact CB-O 2.99Å; E44-I365 CarbonylContact O-C 3.57Å; E44-I365 WeakPolarHBondContact O-CA 3.5Å; E44-I365 PolarHBondContact O-N 3Å; C45-I365 HydrophobicContact CB-CB 4.26Å; C45-I365 HydrophobicContact CB-CG1 3.81Å
366	Q	33.5	Very low	33.4	Very low	135 Å²	135	121.7 Å²	121.7	63%	0.631	67%	0.669	S	S	*	*				61.7	169.1	109.5	-150.4	-174.2	71.8	0	0	126.1	E44	E44-Q366 PolarHBondContact O-N 3.31Å
367	R	35.5	Very low	33.6	Very low	199 Å²	199	122.6 Å²	122.6	75%	0.751	67%	0.666	S	S	*	*			trans	117.9	152.5	151.4	-64.7	170.3	-156.9	-171.1	9	118.2
368	K	34.2	Very low	33.8	Very low	192 Å²	192	123.7 Å²	123.7	84%	0.835	67%	0.669	S	S	*	*			cis	-166.7	168.9	-14.1	-121.4	-164.8	173.1	-159.5	0	112.1
369	A	33.9	Very low	33.9	Very low	74 Å²	74	122.8 Å²	122.8	61%	0.612	68%	0.676	S	S	*	*			trans	71.2	147.6	152.3	0	0	0	0	0	120.6
370	D	37.1	Very low	33.7	Very low	145 Å²	145	124.5 Å²	124.5	78%	0.775	68%	0.68	S	S	*	*			cis	-157.5	159.6	-13.8	-91.1	-23.2	0	0	0	111.3
371	D	36.1	Very low	33.4	Very low	133 Å²	133	126.3 Å²	126.3	71%	0.711	67%	0.673	S	S	*	*			trans	58.6	113.4	146.3	-81.7	21.7	0	0	0	127.5
372	N	33.5	Very low	33.3	Very low	115 Å²	115	127.9 Å²	127.9	62%	0.615	67%	0.673	S	S	*	*				70.5	113.5	117.8	-73.3	-49.4	0	0	0	125.1
373	Q	32.7	Very low	33.1	Very low	166 Å²	166	128.8 Å²	128.8	78%	0.776	68%	0.679	S	S	*	*				85.6	127.7	124.1	-70.3	179.6	37.1	0	0	124.3
374	C	30.1	Very low	32.8	Very low	104 Å²	104	130.5 Å²	130.5	70%	0.703	70%	0.695	S	S	*	*				105.4	131.2	129.5	-96.6	0	0	0	0	122.7
375	N	33.8	Very low	32.5	Very low	135 Å²	135	132.8 Å²	132.8	72%	0.722	72%	0.723	S	S	*	*			trans	80.3	90.6	149.4	-62.4	9.6	0	0	0	121
376	D	33.2	Very low	32.1	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	75%	0.752	S	S	*	*				61.6	118.2	103	-77.8	37	0	0	0	123.1
377	N	32.7	Very low	31.8	Very low	119 Å²	119	141.8 Å²	141.8	64%	0.636	76%	0.764	S	S	*	*				92.2	123.4	127	-69.4	-32.6	0	0	0	122.7
378	H	31.8	Very low	31.4	Very low	183 Å²	183	137 Å²	137	85%	0.847	76%	0.761	S	S	*	*			trans	55.6	102.1	149.5	-59.5	-54.7	0	0	0	120.3
379	G	30.9	Very low	31	Very low	83 Å²	83	133.4 Å²	133.4	86%	0.856	76%	0.76	S	S	*	*			trans	-156.5	92.9	166.2	0	0	0	0	0	112.6
380	L	29.8	Very low	30.7	Very low	153 Å²	153	135.9 Å²	135.9	80%	0.801	77%	0.773	S	S	*	*			trans	-67.4	157.1	-169.6	-85.3	160.1	0	0	0	116.8
381	F	28.1	Very low	30.2	Very low	160 Å²	160	131.9 Å²	131.9	70%	0.702	77%	0.765	S	S	*	*			trans	90.6	112	153	-70.9	-58.9	0	0	0	122.7
382	K	31.1	Very low	29.9	Very low	181 Å²	181	131.1 Å²	131.1	79%	0.787	77%	0.771	S	S	*	*			trans	72	87.3	134.1	-72.1	162.6	-179.5	169.6	0	120.2
383	S	29.2	Very low	29.6	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	78%	0.775	S	S	*	*			trans	-61.2	-179.8	135.5	9	0	0	0	0	112.4
384	P	31.8	Very low	29.6	Very low	131 Å²	131	132.5 Å²	132.5	85%	0.851	78%	0.778	S	S	*	*			cis	-128.3	-174.5	-6.6	38.5	-21.8	0	0	0	113.5
385	G	27.6	Very low	29.6	Very low	75 Å²	75	134.6 Å²	134.6	77%	0.773	78%	0.775	S	S	*	*			trans	150.3	62.5	158	0	0	0	0	0	118.8
386	R	28.1	Very low	29.7	Very low	244 Å²	244	135.7 Å²	135.7	92%	0.921	78%	0.779	S	S	*	*			trans	-112.4	113	158	-83.6	-170.6	173.9	-166.6	-0.9	109.6
387	T	26	Very low	29.6	Very low	142 Å²	142	134.7 Å²	134.7	87%	0.871	78%	0.78	S	S	*	*			trans	-119.5	116.6	164.7	45.6	0	0	0	0	108.6
388	S	28.5	Very low	29.7	Very low	99 Å²	99	139.7 Å²	139.7	69%	0.692	79%	0.79	S	S	*	*			trans	-143.9	127.7	-179.6	-53.7	0	0	0	0	108.6
389	S	25.8	Very low	30	Very low	116 Å²	116	137.4 Å²	137.4	81%	0.811	79%	0.791	S	S	*	*			trans	29.8	112.6	156.6	58	0	0	0	0	119.2
390	S	28	Very low	30.1	Very low	126 Å²	126	142.2 Å²	142.2	88%	0.881	79%	0.788	S	S	*	*				175.4	161.5	105.2	-162	0	0	0	0	110.6
391	G	25.3	Very low	30.3	Very low	60 Å²	60	142.9 Å²	142.9	62%	0.619	79%	0.793	S	S	*	*			trans	-122.7	-178.5	171.8	0	0	0	0	0	112.6
392	S	30	Very low	30.5	Very low	118 Å²	118	144.2 Å²	144.2	83%	0.825	80%	0.799	S	S	*	*			trans	-146.6	115.6	165.3	44.2	0	0	0	0	106.1
393	E	28.1	Very low	30.5	Very low	150 Å²	150	143.5 Å²	143.5	70%	0.701	80%	0.802	S	S	*	*			cis	64.1	59.2	25.9	-56.7	-150.3	143.8	0	0	114.4	F395	E393-F395 HydrophobicContact CB-CD2 3.79Å; E393-F395 HydrophobicContact CB-CE2 3.9Å; E393-F395 HydrophobicContact CG-CD2 4.24Å; E393-F395 HydrophobicContact CG-CE2 3.81Å; E393-F395 PolarHBondContact O-N 3.11Å; E393-F395 VanDerWaalsContact OE1-CE2 3.32Å; E393-F395 WeakPolarHBondContact OE1-CE2 3.38Å
394	L	32.1	Very low	30.6	Very low	160 Å²	160	142.5 Å²	142.5	84%	0.838	80%	0.795	S	S	*	*			trans	-75.5	78.4	155.2	-89.6	169.9	0	0	0	110.1
395	F	30.8	Very low	30.5	Very low	147 Å²	147	143.5 Å²	143.5	65%	0.645	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-78.8	135.1	168.6	-85.2	-134.5	0	0	0	110	E393 P397	E393-F395 HydrophobicContact CB-CD2 3.79Å; E393-F395 HydrophobicContact CB-CE2 3.9Å; E393-F395 HydrophobicContact CG-CD2 4.24Å; E393-F395 HydrophobicContact CG-CE2 3.81Å; E393-F395 PolarHBondContact O-N 3.11Å; E393-F395 VanDerWaalsContact OE1-CE2 3.32Å; E393-F395 WeakPolarHBondContact OE1-CE2 3.38Å; F395-P397 WeakPolarHBondContact O-CD 3.36Å
396	I	34.9	Very low	30.8	Very low	159 Å²	159	143.5 Å²	143.5	82%	0.815	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-71.4	119.6	153.7	-61	177	0	0	0	106.3	R398	I396-R398 PolarHBondContact O-N 3.33Å
397	P	31.5	Very low	30.9	Very low	109 Å²	109	140 Å²	140	71%	0.708	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.7	122.7	-170.3	26.3	-34.1	0	0	0	111	F395 P399	F395-P397 WeakPolarHBondContact O-CD 3.36Å; P397-P399 WeakPolarHBondContact O-CD 3.41Å
398	R	34.8	Very low	31.2	Very low	223 Å²	223	142 Å²	142	84%	0.842	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-82.4	117	165.7	-69	-175.4	179.8	-175.8	0.4	108.7	I396 K400	I396-R398 PolarHBondContact O-N 3.33Å; R398-K400 PolarHBondContact O-N 3.17Å
399	P	38	Very low	31.6	Very low	136 Å²	136	143.1 Å²	143.1	88%	0.883	79%	0.792	S	S	*	*			trans	-65.6	107.8	172	-16.7	31.3	0	0	0	109.4	P397	P397-P399 WeakPolarHBondContact O-CD 3.41Å
400	K	31.9	Very low	31.9	Very low	183 Å²	183	141 Å²	141	80%	0.796	79%	0.789	S	S	*	*			trans	-109.2	105.3	164.8	-80	-175.7	178.2	176.6	0	108	R398	R398-K400 PolarHBondContact O-N 3.17Å
401	N	34.9	Very low	32.2	Very low	168 Å²	168	139.4 Å²	139.4	90%	0.898	78%	0.783	S	S	*	*			trans	-146.4	148.7	153.3	-112.9	-17.9	0	0	0	110.5
402	K	32.3	Very low	32.8	Very low	188 Å²	188	146 Å²	146	82%	0.817	80%	0.795	S	S	*	*			trans	-124.1	138.7	173.4	-61.5	176.2	178.3	179.6	0	107.4
403	L	31	Very low	32.8	Very low	165 Å²	165	146.3 Å²	146.3	86%	0.864	80%	0.796	S	S	*	*				168.6	162.7	124.3	-92.7	158.2	0	0	0	111.9
404	S	31.4	Very low	33	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	80%	0.797	S	S	*	*			trans	15.4	114.3	162.2	50.2	0	0	0	0	118.5
405	V	30.3	Very low	32.7	Very low	153 Å²	153	143.7 Å²	143.7	93%	0.927	80%	0.799	S	S	*	*				67.2	115.1	69.9	177	0	0	0	0	112.6
406	G	32.9	Very low	32.7	Very low	75 Å²	75	147.9 Å²	147.9	77%	0.773	81%	0.81	S	S	*	*			trans	175.3	105.8	174.3	0	0	0	0	0	109.8
407	E	30.2	Very low	32.2	Very low	171 Å²	171	144.6 Å²	144.6	80%	0.799	81%	0.806	S	S	*	*			trans	-74.8	155.5	178.1	-69.6	174.7	93	0	0	112
408	F	32.9	Very low	32	Very low	183 Å²	183	143.2 Å²	143.2	80%	0.803	80%	0.799	S	S	*	*				-171.7	114.2	105.8	-116.5	-98.1	0	0	0	113.9
409	V	36.7	Very low	31.6	Very low	122 Å²	122	139.1 Å²	139.1	74%	0.739	80%	0.799	S	S	*	*			trans	39.4	118.2	139.7	-173.1	0	0	0	0	121.2
410	G	32	Very low	31	Very low	73 Å²	73	138 Å²	138	75%	0.753	79%	0.79	S	S	*	*			trans	116.3	138	139.2	0	0	0	0	0	117.1
411	A	34.8	Very low	30.8	Very low	91 Å²	91	134 Å²	134	75%	0.752	79%	0.785	S	S	*	*			cis	-162.3	160.9	-8.6	0	0	0	0	0	112.9
412	K	36.3	Very low	30.6	Very low	199 Å²	199	129.3 Å²	129.3	87%	0.865	77%	0.766	S	S	*	*			trans	78.8	137.9	162.8	-61.5	-178.7	177.5	176.7	0	120.3
413	C	32	Very low	30.6	Very low	125 Å²	125	123.3 Å²	123.3	85%	0.845	75%	0.747	S	S	*	*			trans	76.5	150	160.6	-64.5	0	0	0	0	118.1
414	P	30.9	Very low	30.6	Very low	113 Å²	113	119.5 Å²	119.5	73%	0.734	73%	0.734	S	S	*	*			trans	-115.7	153.5	-133.2	39.8	-32.8	0	0	0	117.1
415	V	26.7	Very low	30.6	Very low	142 Å²	142	119.3 Å²	119.3	86%	0.861	73%	0.733	S	S	*	*			trans	2.5	112.6	144.4	-173.3	0	0	0	0	116.6
416	R	29.6	Very low	30.6	Very low	235 Å²	235	118.1 Å²	118.1	89%	0.887	72%	0.722	S	S	*	*			trans	-147.3	107.4	140.5	-164.7	171.1	-171.9	162.8	2.5	110.7
417	A	25.5	Very low	30.5	Very low	89 Å²	89	120.7 Å²	120.7	74%	0.736	72%	0.717	S	S	*	*			trans	-109.9	116.1	170.3	0	0	0	0	0	109.4
418	S	26.3	Very low	30.5	Very low	80 Å²	80	120.2 Å²	120.2	56%	0.559	71%	0.713	S	S	*	*			trans	-159.8	127.5	172	-47.8	0	0	0	0	105.1
419	T	27.2	Very low	30.4	Very low	138 Å²	138	117.7 Å²	117.7	85%	0.847	71%	0.706	S	S	*	*			cis	59.3	69.4	16.1	75.1	0	0	0	0	115.8
420	T	26.2	Very low	29.9	Very low	112 Å²	112	117.8 Å²	117.8	69%	0.687	71%	0.709	S	S	*	*			trans	-151	124.4	154.9	32.3	0	0	0	0	103.7
421	S	27.5	Very low	29.8	Very low	99 Å²	99	125.7 Å²	125.7	69%	0.692	72%	0.716	S	S	*	*				60	150.5	78.6	77.7	0	0	0	0	111.5
422	S	29.5	Very low	29.6	Very low	70 Å²	70	127.2 Å²	127.2	49%	0.49	72%	0.721	S	S	.	*				-165.5	167.2	51.3	-79.6	0	0	0	0	108.8	E251	E251-S422 WeakPolarHBondContact OE1-CB 3.26Å; E251-S422 PolarHBondContact OE1-OG 2.84Å
423	S	32.7	Very low	29.3	Very low	62 Å²	62	122.7 Å²	122.7	43%	0.434	72%	0.721	S	S	.	*			cis	-169.8	164.6	-16.9	-170.6	0	0	0	0	105	S255	S255-S423 WeakPolarHBondContact CB-O 3.09Å
424	S	31.7	Very low	29.3	Very low	84 Å²	84	124.4 Å²	124.4	59%	0.587	72%	0.722	S	S	*	*	S	Bend	cis	-138.2	172.8	7	77.6	0	0	0	0	108.7
425	S	31.1	Very low	29.5	Very low	90 Å²	90	127.9 Å²	127.9	63%	0.629	73%	0.725	S	S	*	*	S	Bend	cis	-166.2	144.9	5.9	19.1	0	0	0	0	106.5
426	D	30.8	Very low	29.8	Very low	128 Å²	128	132.3 Å²	132.3	68%	0.684	73%	0.727	S	S	*	*			cis	-151.4	150.9	-3.5	-84.5	-38.4	0	0	0	111.4
427	L	30.7	Very low	30	Very low	128 Å²	128	128.5 Å²	128.5	67%	0.67	72%	0.722	S	S	*	*			trans	22.8	141.1	132.5	-50.1	165.4	0	0	0	119.1
428	F	29.5	Very low	30.4	Very low	162 Å²	162	133.7 Å²	133.7	71%	0.711	72%	0.723	S	S	*	*			cis	-153.1	146.7	37.9	-80.6	-87.5	0	0	0	115
429	I	30.5	Very low	30.6	Very low	129 Å²	129	136.7 Å²	136.7	66%	0.662	73%	0.728	S	S	*	*			trans	48.8	115.7	141.9	-57.7	166.4	0	0	0	119.4	R431	I429-R431 HydrophobicContact CG2-CG 4.48Å
430	P	27.3	Very low	31	Very low	125 Å²	125	137.7 Å²	137.7	81%	0.812	73%	0.727	S	S	*	*			trans	-84	146.7	163	35	-32.8	0	0	0	112.3
431	R	29.9	Very low	31.4	Very low	239 Å²	239	139.9 Å²	139.9	90%	0.902	73%	0.727	S	S	*	*			trans	-136.6	133.6	158	-75.9	-165.6	173.7	-166.4	-1.8	111.1	I429	I429-R431 HydrophobicContact CG2-CG 4.48Å
432	S	29.8	Very low	31.7	Very low	122 Å²	122	140.9 Å²	140.9	85%	0.853	73%	0.725	S	S	*	*			trans	-81.6	140.3	179.5	47.7	0	0	0	0	111.7
433	A	30.1	Very low	32	Very low	104 Å²	104	143.7 Å²	143.7	86%	0.86	73%	0.73	S	S	*	*			trans	-125.7	84.4	170.9	0	0	0	0	0	109.5
434	N	32.4	Very low	32	Very low	162 Å²	162	150.3 Å²	150.3	87%	0.866	75%	0.746	S	S	*	*			trans	-86	156.6	171.7	-153.1	-8.4	0	0	0	110.3
435	K	34.3	Very low	32.1	Very low	185 Å²	185	155 Å²	155	80%	0.804	76%	0.758	S	S	*	*			trans	-84.9	136.8	-166.3	-77	178.8	175.7	174.8	0	114.1
436	R	32.5	Very low	32.1	Very low	236 Å²	236	156 Å²	156	89%	0.891	77%	0.765	S	S	*	*			trans	80.8	161.3	154.6	-66.2	172.7	168.7	-178.2	-4.4	119.8
437	I	34.2	Very low	32.3	Very low	154 Å²	154	158.9 Å²	158.9	79%	0.79	77%	0.774	S	S	*	*			trans	92.4	83.9	162	-45.1	-169.5	0	0	0	117.2
438	R	34.4	Very low	32.3	Very low	199 Å²	199	157.8 Å²	157.8	75%	0.751	78%	0.777	S	S	*	*				48.2	121.3	122.9	-78.5	-165.6	153.2	141.6	0.6	122.6
439	E	30.8	Very low	32.5	Very low	143 Å²	143	154.8 Å²	154.8	67%	0.668	78%	0.776	S	S	*	*				69	146.7	118.8	-62.3	161.9	-160.7	0	0	121.2
440	L	35.8	Very low	32.5	Very low	158 Å²	158	154.7 Å²	154.7	83%	0.827	78%	0.782	S	S	*	*			trans	76.8	148.1	168.3	-53.4	174.6	0	0	0	118.4
441	K	34.2	Very low	32.7	Very low	158 Å²	158	154.9 Å²	154.9	69%	0.687	78%	0.781	S	S	*	*			cis	-169.2	134	-28.6	-174.7	161.2	176.2	176.8	0	111.5
442	D	32.8	Very low	32.7	Very low	121 Å²	121	150.7 Å²	150.7	65%	0.647	78%	0.775	S	S	*	*			trans	51.3	175.5	154.9	-56.8	-3.1	0	0	0	122.7
443	E	36.7	Very low	32.6	Very low	129 Å²	129	151.8 Å²	151.8	60%	0.603	77%	0.771	S	S	*	*			trans	75.7	107.1	171.9	-49.6	-70.3	85.1	0	0	116.1
444	R	32.8	Very low	32.7	Very low	200 Å²	200	151.5 Å²	151.5	76%	0.755	77%	0.769	S	S	*	*				71.5	140.7	91.9	-68.6	-179.3	-136.2	-170.7	17.8	113
445	E	34.4	Very low	32.6	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	77%	0.766	S	S	*	*			cis	-131.3	149.2	21	-68.4	172.4	129.9	0	0	109.7
446	C	29.5	Very low	32.4	Very low	113 Å²	113	147 Å²	147	76%	0.764	76%	0.762	S	S	*	*				77.3	89.8	53.7	-71	0	0	0	0	116.4
447	E	35.9	Very low	32.3	Very low	188 Å²	188	143.9 Å²	143.9	88%	0.879	76%	0.755	S	S	*	*			trans	-176.4	122.8	140	-101.7	169.7	-158.7	0	0	107.2
448	S	29.8	Very low	32.1	Very low	105 Å²	105	142 Å²	142	73%	0.734	76%	0.755	S	S	*	*			cis	72.3	127.8	45	-49.7	0	0	0	0	111.3
449	S	34.1	Very low	31.9	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	76%	0.758	S	S	*	*			cis	-161.7	146.7	27.9	-47	0	0	0	0	115.4
450	T	30.1	Very low	32.1	Very low	127 Å²	127	139 Å²	139	78%	0.779	77%	0.766	S	S	*	*			trans	61.3	160.3	136.1	53	0	0	0	0	126
451	T	32.6	Very low	31.8	Very low	129 Å²	129	135.9 Å²	135.9	79%	0.791	76%	0.758	S	S	*	*			trans	86.4	76.9	147.7	31.1	0	0	0	0	122.6
452	L	29.2	Very low	31.9	Very low	150 Å²	150	134.9 Å²	134.9	79%	0.785	76%	0.76	S	S	*	*				13	145.4	118.2	-76.3	165.1	0	0	0	122.5
453	N	28	Very low	31.9	Very low	145 Å²	145	135.3 Å²	135.3	78%	0.775	76%	0.762	S	S	*	*			trans	91	156.9	144.1	-68.3	-20.4	0	0	0	122
454	A	32.9	Very low	31.6	Very low	99 Å²	99	136.3 Å²	136.3	82%	0.818	77%	0.771	S	S	*	*			trans	67.5	114.4	-174.8	0	0	0	0	0	115.1
455	A	30.2	Very low	31.6	Very low	95 Å²	95	136.3 Å²	136.3	79%	0.785	77%	0.77	S	S	*	*			cis	88.5	113.8	21.1	0	0	0	0	0	117.2
456	Q	29.4	Very low	31.6	Very low	158 Å²	158	134.5 Å²	134.5	74%	0.738	77%	0.766	S	S	*	*			trans	76.6	127.1	156.2	-65.1	-164.1	7.6	0	0	122.8
457	K	30.2	Very low	31.6	Very low	170 Å²	170	132.8 Å²	132.8	74%	0.739	76%	0.755	S	S	*	*			trans	94.3	147.9	134	-80.5	164.5	178.3	154.4	0	122.1
458	S	30.4	Very low	31.4	Very low	113 Å²	113	131.1 Å²	131.1	79%	0.79	75%	0.751	S	S	*	*			trans	55.1	117.8	169.2	37.9	0	0	0	0	116.7
459	A	30.3	Very low	31.6	Very low	97 Å²	97	133.4 Å²	133.4	80%	0.802	76%	0.755	S	S	*	*			cis	78.8	97.9	20.8	0	0	0	0	0	116.7
460	E	34	Very low	31.7	Very low	182 Å²	182	133.8 Å²	133.8	85%	0.85	76%	0.755	S	S	*	*			trans	-156.9	119.6	151	-101.4	170	-156.7	0	0	104.5
461	S	31.4	Very low	31.7	Very low	93 Å²	93	132.7 Å²	132.7	65%	0.65	75%	0.753	S	S	*	*			cis	91.7	143.3	29.5	93.1	0	0	0	0	114.4
462	N	35.1	Very low	31.6	Very low	137 Å²	137	130.4 Å²	130.4	73%	0.733	74%	0.741	S	S	*	*			trans	85.6	146	172.3	-52.2	-45	0	0	0	117.8
463	L	32.2	Very low	31.7	Very low	130 Å²	130	132.7 Å²	132.7	68%	0.681	75%	0.746	S	S	*	*			cis	178.7	134.1	-33.7	-119.8	174.6	0	0	0	107.2
464	L	31.4	Very low	31.8	Very low	151 Å²	151	130.7 Å²	130.7	79%	0.791	74%	0.743	S	S	*	*				-146.6	122.9	126.1	-76.4	-171.7	0	0	0	107.1
465	R	33.6	Very low	31.9	Very low	199 Å²	199	130.8 Å²	130.8	75%	0.751	74%	0.737	S	S	*	*				68.6	130.2	71.9	-98.7	-173.8	171.6	158.7	-1.4	111.6
466	L	33.3	Very low	32	Very low	145 Å²	145	132.8 Å²	132.8	76%	0.759	74%	0.735	S	S	*	*			cis	-145.5	173.6	20.8	-79.8	163.9	0	0	0	109.3
467	S	29.5	Very low	32.3	Very low	77 Å²	77	132.3 Å²	132.3	54%	0.538	74%	0.737	S	S	.	*			cis	179.7	138.4	-32.1	55.7	0	0	0	0	106.1
468	L	32.8	Very low	32.5	Very low	152 Å²	152	133.4 Å²	133.4	80%	0.796	74%	0.742	S	S	*	*				-178.6	127.9	83.8	-77.3	152.2	0	0	0	104.9
469	L	34	Very low	32.8	Very low	154 Å²	154	133.2 Å²	133.2	81%	0.806	74%	0.741	S	S	*	*				80	140.1	62.8	-70.7	176.2	0	0	0	114.5
470	P	36.2	Very low	33	Very low	106 Å²	106	134.2 Å²	134.2	69%	0.688	74%	0.737	S	S	*	*				-143.2	-150.1	-123.5	43.4	-22.5	0	0	0	114.1
471	S	29.9	Very low	33.3	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	73%	0.734	S	S	*	*			trans	77.1	153.3	158.2	80.6	0	0	0	0	116.7
472	S	28.9	Very low	33.3	Very low	80 Å²	80	135.1 Å²	135.1	56%	0.559	74%	0.735	S	S	*	*			cis	-177.5	158.5	-20	47.9	0	0	0	0	110.2
473	F	32.6	Very low	33.3	Very low	199 Å²	199	138.1 Å²	138.1	87%	0.873	74%	0.742	S	S	*	*			trans	62.3	168.1	169.8	-55.2	-68.1	0	0	0	115.1
474	S	29.7	Very low	33.3	Very low	103 Å²	103	137.5 Å²	137.5	72%	0.72	74%	0.743	S	S	*	*			cis	-175.7	127.9	-36.6	175.4	0	0	0	0	107.1
475	S	34.1	Very low	33.6	Very low	100 Å²	100	138.6 Å²	138.6	70%	0.699	74%	0.744	S	S	*	*			trans	153.4	128	145.2	66.4	0	0	0	0	114.2
476	N	32.6	Very low	33.6	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	75%	0.748	S	S	*	*			trans	33.6	119	136	-51.1	-14.1	0	0	0	120.4
477	N	37.1	Very low	33.6	Very low	147 Å²	147	137.2 Å²	137.2	79%	0.786	74%	0.744	S	S	*	*				175.1	106.5	104.9	-87.3	-38.6	0	0	0	115.9
478	K	33.5	Very low	33.8	Very low	193 Å²	193	138.2 Å²	138.2	84%	0.839	75%	0.75	S	S	*	*				55.5	92.6	117.7	-163.6	-177.3	-175.6	-179.8	0	121.9
479	S	36.1	Very low	33.8	Very low	109 Å²	109	138.9 Å²	138.9	76%	0.762	75%	0.754	S	S	*	*			trans	-169.6	113.3	142.4	49.5	0	0	0	0	110.2
480	T	35.6	Very low	33.6	Very low	119 Å²	119	137.2 Å²	137.2	73%	0.73	75%	0.751	S	S	*	*				78	81.7	67.4	61.9	0	0	0	0	116.9
481	H	39.1	Very low	33.3	Very low	170 Å²	170	139.2 Å²	139.2	79%	0.787	75%	0.754	S	S	*	*			trans	172	117.1	131.1	-92.6	-52.6	0	0	0	107.9
482	D	31.3	Very low	33.4	Very low	124 Å²	124	140 Å²	140	66%	0.663	76%	0.755	S	S	*	*				66.3	108	78.1	-65.3	-41.9	0	0	0	114.7
483	F	36.3	Very low	33.4	Very low	200 Å²	200	142.9 Å²	142.9	88%	0.877	76%	0.764	S	S	*	*				-164.7	130.7	107.4	-113.7	-76.2	0	0	0	111.2
484	T	31.5	Very low	33.6	Very low	116 Å²	116	142.3 Å²	142.3	71%	0.712	76%	0.764	S	S	*	*			trans	-117	130.7	-174.5	53	0	0	0	0	113.7
485	H	38.1	Very low	33.8	Very low	175 Å²	175	143.6 Å²	143.6	81%	0.81	77%	0.768	S	S	*	*			trans	-144.7	121.5	152.9	-80.5	-85.1	0	0	0	106.4
486	R	32.6	Very low	33.9	Very low	218 Å²	218	144.9 Å²	144.9	82%	0.823	77%	0.774	S	S	*	*			cis	67.2	118.5	30.9	-147.5	-167.8	178.3	-179.6	0.7	110.8
487	S	34.1	Very low	34	Very low	97 Å²	97	144 Å²	144	68%	0.678	78%	0.778	S	S	*	*			cis	-135.2	165.4	25.9	-50.4	0	0	0	0	110.9
488	S	33	Very low	33.9	Very low	97 Å²	97	145.3 Å²	145.3	68%	0.678	78%	0.779	S	S	*	*			cis	67.7	148	34.2	-33.8	0	0	0	0	113
489	L	33.7	Very low	34.1	Very low	167 Å²	167	142.8 Å²	142.8	87%	0.874	78%	0.775	S	S	*	*			cis	-120.7	-126.2	21.6	-71.6	159.3	0	0	0	114.3
490	T	29.5	Very low	34.1	Very low	119 Å²	119	142.5 Å²	142.5	73%	0.73	77%	0.769	S	S	*	*			trans	-163.3	-175.6	-145.5	-18.4	0	0	0	0	112.5
491	L	29.5	Very low	34.2	Very low	147 Å²	147	142.5 Å²	142.5	77%	0.77	77%	0.769	S	S	*	*			trans	82.3	153.6	161.1	-104.2	58.7	0	0	0	116.8
492	V	31.9	Very low	34	Very low	122 Å²	122	140 Å²	140	74%	0.739	76%	0.762	S	S	*	*			cis	-130.1	162.7	16.3	-171.2	0	0	0	0	112.7
493	N	29.8	Very low	34.2	Very low	141 Å²	141	142.2 Å²	142.2	75%	0.754	77%	0.768	S	S	*	*			trans	-71.9	-179.2	172.1	-51.5	-21.7	0	0	0	111.8
494	E	35.9	Very low	34	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	76%	0.758	S	S	*	*				-153.7	176.4	79.4	-93.9	177.5	173.5	0	0	114.9
495	T	34.5	Very low	34.2	Very low	130 Å²	130	136.8 Å²	136.8	80%	0.798	76%	0.757	S	S	*	*			trans	-91.4	165.4	-162.4	28.6	0	0	0	0	115.8
496	P	37.2	Very low	33.9	Very low	127 Å²	127	135.4 Å²	135.4	83%	0.825	75%	0.751	S	S	*	*			trans	-79.5	170	-176.5	34.7	-38.3	0	0	0	113.7
497	S	34.8	Very low	33.7	Very low	119 Å²	119	133.9 Å²	133.9	83%	0.832	75%	0.746	S	S	*	*			trans	-129.5	136.6	164.3	-168.1	0	0	0	0	109.8
498	E	34.9	Very low	33.5	Very low	174 Å²	174	134.5 Å²	134.5	81%	0.813	75%	0.746	S	S	*	*			trans	-68.4	169.9	155.7	-62.8	165.4	130	0	0	107.7
499	D	35.9	Very low	33.6	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	75%	0.748	S	S	*	*				179.1	167.1	80.8	-145	-22.3	0	0	0	112.2
500	T	37.8	Very low	33.6	Very low	103 Å²	103	133.1 Å²	133.1	63%	0.632	74%	0.736	S	S	*	*			trans	57.1	115.1	159.4	53.6	0	0	0	0	119.3
501	T	36.2	Very low	33.7	Very low	119 Å²	119	135.6 Å²	135.6	73%	0.73	74%	0.739	S	S	*	*				59.1	142.5	74.9	70	0	0	0	0	114.4
502	N	34.8	Very low	33.8	Very low	119 Å²	119	133.3 Å²	133.3	64%	0.636	73%	0.732	S	S	*	*			cis	-163.3	167.9	29.2	-132.7	7.8	0	0	0	111.9
503	E	36.7	Very low	33.8	Very low	169 Å²	169	133.5 Å²	133.5	79%	0.79	73%	0.728	S	S	*	*			trans	61.9	154.1	149.8	-72.1	164	-132.7	0	0	119.6
504	S	31.4	Very low	33.9	Very low	97 Å²	97	133.2 Å²	133.2	68%	0.678	72%	0.722	S	S	*	*			cis	-160.7	145.4	-17.3	179.5	0	0	0	0	109
505	P	35.2	Very low	33.7	Very low	106 Å²	106	132.7 Å²	132.7	69%	0.688	72%	0.718	S	S	*	*			trans	-84.5	157.7	173.6	35.3	-35.7	0	0	0	112.7
506	H	31.6	Very low	33.7	Very low	146 Å²	146	131.5 Å²	131.5	68%	0.676	71%	0.71	S	S	*	*			trans	175.8	154.5	138.3	-103.4	-69.6	0	0	0	115.8
507	Y	30.3	Very low	33.5	Very low	185 Å²	185	134.1 Å²	134.1	73%	0.725	71%	0.708	S	S	*	*			trans	49.7	107.1	153.7	-63.1	-52.5	0	0	0	120
508	T	28.9	Very low	33.3	Very low	110 Å²	110	135.3 Å²	135.3	68%	0.675	70%	0.701	S	S	*	*				68.7	139.1	78.1	66	0	0	0	0	116.6
509	N	34.7	Very low	33.1	Very low	136 Å²	136	132.1 Å²	132.1	73%	0.727	69%	0.693	S	S	*	*				172.1	125.3	124.8	-82.9	-0.5	0	0	0	110.2
510	T	33.5	Very low	32.9	Very low	100 Å²	100	132.1 Å²	132.1	61%	0.613	69%	0.693	S	S	*	*				80.3	103.6	90.7	-50.7	0	0	0	0	111.5
511	E	31.9	Very low	32.5	Very low	171 Å²	171	132.9 Å²	132.9	80%	0.799	70%	0.698	S	S	*	*				59.2	149.1	94.7	-56.1	177.8	134.3	0	0	114
512	T	31.4	Very low	32.3	Very low	99 Å²	99	134.2 Å²	134.2	61%	0.607	70%	0.701	S	S	*	*			cis	-168.7	168	26.9	-18.1	0	0	0	0	111.2
513	N	32.7	Very low	32.1	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	71%	0.708	S	S	*	*			trans	65.5	157	151.2	-64.4	-38.8	0	0	0	119
514	Q	31.3	Very low	31.8	Very low	136 Å²	136	135 Å²	135	64%	0.636	71%	0.708	S	S	*	*			cis	-159.4	148.6	-20.4	-98.9	161.1	29.3	0	0	105.5
515	F	32.2	Very low	31.7	Very low	176 Å²	176	134.7 Å²	134.7	77%	0.772	71%	0.705	S	S	*	*				178.2	121.8	91.7	-108	-103.6	0	0	0	107
516	V	34.1	Very low	31.6	Very low	104 Å²	104	136.6 Å²	136.6	63%	0.63	71%	0.71	S	S	*	*				91.8	118	94.6	163.9	0	0	0	0	116.3
517	K	32.5	Very low	31.5	Very low	182 Å²	182	135 Å²	135	79%	0.791	72%	0.715	S	S	*	*			trans	66.7	153.5	160.6	-72.6	174.3	179.7	-177.4	0	118.8
518	Q	32	Very low	31.7	Very low	145 Å²	145	131.6 Å²	131.6	68%	0.678	72%	0.715	S	S	*	*			cis	-176.1	147.6	-18	176.3	170.5	-9.6	0	0	108.8
519	T	29.4	Very low	31.7	Very low	106 Å²	106	130.8 Å²	130.8	65%	0.65	71%	0.714	S	S	*	*			trans	55.6	110.3	164.9	45.3	0	0	0	0	121.3
520	D	31.6	Very low	31.4	Very low	141 Å²	141	130.2 Å²	130.2	75%	0.754	72%	0.716	S	S	*	*				52.8	132.5	117.1	-51.7	-35	0	0	0	124.6
521	T	30.9	Very low	31.5	Very low	118 Å²	118	132 Å²	132	72%	0.724	73%	0.727	S	S	*	*			trans	71.9	114.9	149	41.6	0	0	0	0	122.1
522	D	32	Very low	31.2	Very low	148 Å²	148	129.4 Å²	129.4	79%	0.791	72%	0.723	S	S	*	*			trans	78	157.3	134.9	-59.7	-15.7	0	0	0	121.9
523	L	30.2	Very low	31.2	Very low	153 Å²	153	130.2 Å²	130.2	80%	0.801	73%	0.733	S	S	*	*			trans	88.6	112.5	171.2	-56	179.7	0	0	0	119.6
524	I	30.9	Very low	30.9	Very low	151 Å²	151	130.3 Å²	130.3	77%	0.774	74%	0.738	S	S	*	*			trans	82.5	151.5	131.2	-65.4	170.7	0	0	0	117.9
525	S	28.9	Very low	30.9	Very low	90 Å²	90	131.7 Å²	131.7	63%	0.629	75%	0.748	S	S	*	*			trans	-82.8	164.9	-178.9	52.1	0	0	0	0	113.1
526	D	31.9	Very low	30.8	Very low	147 Å²	147	132 Å²	132	79%	0.786	75%	0.749	S	S	*	*				177.9	173.8	112.4	-87.9	-4.2	0	0	0	112.4
527	S	29.6	Very low	30.3	Very low	113 Å²	113	133 Å²	133	79%	0.79	76%	0.756	S	S	*	*			trans	-91.8	-173.7	167.8	-57	0	0	0	0	109.1
528	P	35.7	Very low	30.1	Very low	112 Å²	112	129.7 Å²	129.7	73%	0.727	76%	0.755	S	S	*	*			cis	-145.6	-159.9	8.3	39.8	-16	0	0	0	116
529	S	29.4	Very low	30	Very low	93 Å²	93	129 Å²	129	65%	0.65	76%	0.761	S	S	*	*			trans	78.1	110.8	146.3	49.8	0	0	0	0	122.5
530	T	27	Very low	29.9	Very low	125 Å²	125	129.4 Å²	129.4	77%	0.767	76%	0.763	S	S	*	*				69.8	107.7	121.6	-45.4	0	0	0	0	120.7
531	T	35.5	Very low	29.9	Very low	137 Å²	137	131 Å²	131	84%	0.84	77%	0.766	S	S	*	*				-152.2	134.7	129	-61.6	0	0	0	0	109.7
532	T	26.7	Very low	29.8	Very low	116 Å²	116	131.6 Å²	131.6	71%	0.712	77%	0.765	S	S	*	*			trans	-90.3	138.2	179.4	-52.9	0	0	0	0	111.4
533	S	31.5	Very low	29.7	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	77%	0.768	S	S	*	*			trans	-155.7	122.5	162.8	-83.5	0	0	0	0	112.3
534	T	25.4	Very low	29.5	Very low	127 Å²	127	131.3 Å²	131.3	78%	0.779	76%	0.758	S	S	*	*			trans	-99	118.4	-176.3	-56.9	0	0	0	0	110.9
535	I	31.8	Very low	29.4	Very low	165 Å²	165	131 Å²	131	85%	0.846	76%	0.757	S	S	*	*			trans	-123.7	148.3	165.1	-64	-175.5	0	0	0	109.4
536	K	29.5	Very low	29.3	Very low	182 Å²	182	131 Å²	131	79%	0.791	75%	0.753	S	S	*	*			trans	-96.2	149	-166.8	-62.6	168.6	-177.7	169.2	0	112.4
537	T	24.4	Very low	29.3	Very low	127 Å²	127	131.1 Å²	131.1	78%	0.779	75%	0.753	S	S	*	*			trans	20.4	114.2	138.8	-41.6	0	0	0	0	118.3	V539	T537-V539 HydrophobicContact CG2-CG2 4.04Å
538	S	29	Very low	29.2	Very low	112 Å²	112	130.6 Å²	130.6	78%	0.783	75%	0.745	S	S	*	*			trans	-128.5	153.9	140.4	44.6	0	0	0	0	108.5
539	V	28.1	Very low	28.9	Very low	130 Å²	130	130 Å²	130	79%	0.788	74%	0.744	S	S	*	*			trans	-130	92.2	-173.2	177.6	0	0	0	0	109	T537	T537-V539 HydrophobicContact CG2-CG2 4.04Å
540	T	28	Very low	29	Very low	114 Å²	114	130.7 Å²	130.7	70%	0.699	74%	0.744	S	S	*	*			trans	-163.3	147.6	169.3	27.6	0	0	0	0	105.3
541	E	32.6	Very low	29.1	Very low	174 Å²	174	134.4 Å²	134.4	81%	0.813	75%	0.75	S	S	*	*			cis	-139.3	173.7	7.4	-116.4	142	-133.5	0	0	110.5	E543	E541-E543 PolarHBondContact O-N 3.09Å
542	N	27.2	Very low	29	Very low	132 Å²	132	131.1 Å²	131.1	71%	0.706	73%	0.726	S	S	*	*			trans	-74.8	120.1	-179.8	-63.5	8.3	0	0	0	111.4	D544	N542-D544 VanDerWaalsContact C-N 3.32Å; N542-D544 WeakPolarHBondContact CB-OD2 3.36Å; N542-D544 PolarHBondContact ND2-OD2 3.18Å; N542-D544 PolarHBondContact O-N 3.03Å
543	E	30.7	Very low	29.6	Very low	182 Å²	182	130.3 Å²	130.3	85%	0.85	72%	0.722	S	S	*	*			trans	-88.6	82.4	138.8	-76.6	-160.7	155.7	0	0	108.2	E541 I545	E541-E543 PolarHBondContact O-N 3.09Å; E543-I545 PolarHBondContact O-N 2.91Å
544	D	26.9	Very low	30	Very low	113 Å²	113	131.4 Å²	131.4	60%	0.604	73%	0.726	S	S	*	*			trans	-63.4	91.5	161.8	-87.6	-60.8	0	0	0	108.1	N542 T546	N542-D544 VanDerWaalsContact C-N 3.32Å; N542-D544 WeakPolarHBondContact CB-OD2 3.36Å; N542-D544 PolarHBondContact ND2-OD2 3.18Å; N542-D544 PolarHBondContact O-N 3.03Å; D544-T546 PolarHBondContact O-N 3.32Å; D544-T546 PolarHBondContact O-OG1 2.95Å
545	I	28.9	Very low	31.6	Very low	145 Å²	145	126.6 Å²	126.6	74%	0.744	70%	0.702	S	S	*	*			trans	-68.3	71.3	160.6	-53.1	-177.6	0	0	0	107.2	E543 L547	E543-I545 PolarHBondContact O-N 2.91Å; I545-L547 PolarHBondContact O-N 3.36Å
546	T	26.9	Very low	33.4	Very low	90 Å²	90	121.2 Å²	121.2	55%	0.552	67%	0.673	S	S	*	*			trans	-52.3	125.2	170.2	-58.5	0	0	0	0	106.1	D544 T548	D544-T546 PolarHBondContact O-N 3.32Å; D544-T546 PolarHBondContact O-OG1 2.95Å; T546-T548 HydrophobicContact CG2-CG2 4.06Å; T546-T548 PolarHBondContact O-N 2.9Å; T546-T548 PolarHBondContact O-OG1 2.88Å
547	L	30.8	Very low	36	Very low	148 Å²	148	116.4 Å²	116.4	78%	0.775	65%	0.653	S	S	*	*			trans	-68	70.9	174.7	-77.3	165.6	0	0	0	109.3	I545 S549	I545-L547 PolarHBondContact O-N 3.36Å; L547-S549 PolarHBondContact O-N 3.03Å
548	T	27.8	Very low	39.1	Very low	103 Å²	103	113.1 Å²	113.1	63%	0.632	63%	0.627	S	S	*	*			trans	-66.4	117.5	-176.3	31.7	0	0	0	0	107.8	T546 T550	T546-T548 HydrophobicContact CG2-CG2 4.06Å; T546-T548 PolarHBondContact O-N 2.9Å; T546-T548 PolarHBondContact O-OG1 2.88Å; T548-T550 PolarHBondContact O-N 3.25Å
549	S	29.3	Very low	42.1	Very low	100 Å²	100	107.8 Å²	107.8	70%	0.699	59%	0.59	S	S	*	*			trans	-57.7	105.6	-177.1	-175.7	0	0	0	0	109.8	L547 K551	L547-S549 PolarHBondContact O-N 3.03Å; S549-K551 PolarHBondContact O-N 2.81Å
550	T	32.1	Very low	45.2	Very low	107 Å²	107	101.6 Å²	101.6	66%	0.656	55%	0.552	S	S	*	*			trans	-75.6	66	-177.7	35.7	0	0	0	0	111	T548 L552	T548-T550 PolarHBondContact O-N 3.25Å; T550-L552 VanDerWaalsContact C-N 3.31Å; T550-L552 PolarHBondContact O-N 3.32Å; T550-L552 VanDerWaalsContact O-N 3.09Å
551	K	28.3	Very low	48.3	Very low	203 Å²	203	96.2 Å²	96.2	88%	0.883	52%	0.519	S	S	*	.			trans	41.3	54.1	165.2	-156.3	172.8	-174.3	176.1	0	113.3	S549 T553	S549-K551 PolarHBondContact O-N 2.81Å; K551-T553 PolarHBondContact O-N 3.2Å
552	L	34	Very low	51.1	Low	67 Å²	67	89.6 Å²	89.6	35%	0.351	49%	0.487	S	S	.	.			trans	-49.8	128.7	-178.3	-68.6	167.6	0	0	0	110.9	T550	T550-L552 VanDerWaalsContact C-N 3.31Å; T550-L552 PolarHBondContact O-N 3.32Å; T550-L552 VanDerWaalsContact O-N 3.09Å
553	T	38.9	Very low	53.5	Low	100 Å²	100	84.4 Å²	84.4	61%	0.613	46%	0.458	S	S	*	.			trans	-56.6	127.2	166	-12.9	0	0	0	0	107.9	K551 G555 E556	K551-T553 PolarHBondContact O-N 3.2Å; T553-G555 VanDerWaalsContact C-N 3.31Å; T553-G555 PolarHBondContact O-N 2.96Å; T553-E556 PolarHBondContact O-N 2.95Å
554	P	39.9	Very low	55.5	Low	138 Å²	138	81.8 Å²	81.8	90%	0.896	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	87.6	-175	27.5	-34.7	0	0	0	110.2
555	G	59.2	Low	57.6	Low	27 Å²	27	82.3 Å²	82.3	28%	0.278	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	154.6	-9.5	-170.4	0	0	0	0	0	116.4	T553 P576	T553-G555 VanDerWaalsContact C-N 3.31Å; T553-G555 PolarHBondContact O-N 2.96Å; G555-P576 WeakPolarHBondContact O-CD 3.48Å
556	E	70	Confident	60	Low	52 Å²	52	76.9 Å²	76.9	24%	0.243	42%	0.423	C	S	.	.			trans	-133.7	115.8	179	-65	-166.2	142.4	0	0	113	T553 K573 Y575	T553-E556 PolarHBondContact O-N 2.95Å; E556-K573 HydrophobicContact CG-CD 4.49Å; E556-K573 IonicContact OE1-NZ 3.87Å; E556-K573 PolarHBondContact OE1-NZ 3.29Å; E556-K573 WeakPolarHBondContact OE2-CE 3.4Å; E556-K573 IonicContact OE2-NZ 3.66Å; E556-K573 PolarHBondContact OE2-NZ 2.65Å; E556-Y575 HydrophobicContact CG-CD1 4.09Å; E556-Y575 HydrophobicContact CG-CE1 3.63Å; E556-Y575 WeakPolarHBondContact OE1-CE1 3.42Å; E556-Y575 PolarHBondContact OE1-OH 2.86Å
557	Q	82.7	Confident	62.9	Low	80 Å²	80	78.9 Å²	78.9	37%	0.374	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120.9	173.1	-167.3	67.9	26.5	0	0	110.6	K573 I574 V602	Q557-K573 CarbonylContact O-C 3.18Å; Q557-K573 WeakPolarHBondContact O-CA 3.39Å; Q557-I574 HydrophobicContact CB-CB 4.48Å; Q557-I574 PolarHBondContact N-O 2.67Å; Q557-I574 PolarHBondContact O-N 2.94Å; Q557-V602 HydrophobicContact CG-CG1 3.74Å; Q557-V602 VanDerWaalsContact NE2-CG1 3.27Å
558	W	90.1	Very high	65.8	Low	59 Å²	59	72.3 Å²	72.3	22%	0.223	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	135.4	173.6	-63.4	110.3	0	0	0	111.5	K573 E588 Y604	W558-K573 HydrophobicContact CD2-CG 4.19Å; W558-K573 HydrophobicContact CE3-CD 4.21Å; W558-K573 HydrophobicContact CE3-CG 3.41Å; W558-K573 VanDerWaalsContact CE3-CG 3.41Å; W558-K573 HydrophobicContact CH2-CD 4.38Å; W558-K573 HydrophobicContact CH2-CG 4.38Å; W558-K573 HydrophobicContact CZ3-CD 3.98Å; W558-K573 HydrophobicContact CZ3-CG 3.52Å; W558-E588 WeakPolarHBondContact CZ3-OE1 3.35Å; W558-Y604 HydrophobicContact CB-CD2 4.04Å; W558-Y604 AromaticContact CD1-CD2 3.44Å; W558-Y604 VanDerWaalsContact CD1-CD2 3.44Å; W558-Y604 AromaticContact CD1-CE2 3.96Å; W558-Y604 HydrophobicContact CD2-CD2 4.06Å; W558-Y604 HydrophobicContact CD2-CE2 4.18Å; W558-Y604 AromaticContact CE2-CE2 3.8Å; W558-Y604 AromaticContact CG-CD2 3.62Å; W558-Y604 HydrophobicContact CG-CD2 3.62Å; W558-Y604 HydrophobicContact CG-CE2 4.21Å; W558-Y604 HydrophobicContact CZ2-CE2 4.23Å; W558-Y604 AromaticContact NE1-CD2 3.71Å; W558-Y604 AromaticContact NE1-CE2 3.72Å
559	V	92.4	Very high	68.9	Low	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	162.2	-178.2	-62.4	0	0	0	0	113.1	G572 I574 V585 L600 V601 V602	V559-G572 PolarHBondContact N-O 2.9Å; V559-G572 PolarHBondContact O-N 3.09Å; V559-I574 HydrophobicContact CB-CD1 4.42Å; V559-I574 HydrophobicContact CG1-CD1 3.6Å; V559-I574 HydrophobicContact CG1-CG1 4.09Å; V559-I574 HydrophobicContact CG2-CD1 4.08Å; V559-I574 HydrophobicContact CG2-CG1 3.94Å; V559-V585 HydrophobicContact CG2-CG1 4.08Å; V559-L600 HydrophobicContact CG2-CD2 4.38Å; V559-V601 WeakPolarHBondContact CA-O 3.49Å; V559-V602 HydrophobicContact CG1-CG1 4.49Å; V559-V602 HydrophobicContact CG1-CG2 4.1Å
560	Y	94	Very high	71.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.3	159.5	-87.5	-94.6	0	0	0	109.1	Y570 A571 V601 V603 L606 Y639 R654 V657 I659	Y560-Y570 CarbonylContact C-O 3.3Å; Y560-Y570 VanDerWaalsContact CA-O 3.3Å; Y560-Y570 WeakPolarHBondContact CA-O 3.34Å; Y560-A571 HydrophobicContact CE1-CB 4.1Å; Y560-V601 PolarHBondContact N-O 3.48Å; Y560-V601 PolarHBondContact O-N 2.66Å; Y560-V603 HydrophobicContact CD2-CG2 3.89Å; Y560-V603 HydrophobicContact CE2-CG2 4.46Å; Y560-L606 HydrophobicContact CD1-CD1 4.35Å; Y560-L606 HydrophobicContact CD2-CD2 4.13Å; Y560-L606 HydrophobicContact CD2-CG 4.25Å; Y560-L606 HydrophobicContact CE1-CD1 3.77Å; Y560-L606 HydrophobicContact CE1-CG 4.21Å; Y560-L606 HydrophobicContact CE2-CD1 4.25Å; Y560-L606 HydrophobicContact CE2-CD2 4.2Å; Y560-L606 HydrophobicContact CE2-CG 3.8Å; Y560-L606 HydrophobicContact CG-CD2 4.3Å; Y560-Y639 WeakPolarHBondContact OH-CE2 3.26Å; Y560-Y639 PolarHBondContact OH-OH 3.2Å; Y560-R654 HydrophobicContact CE2-CG 4.14Å; Y560-R654 WeakPolarHBondContact OH-CG 3.08Å; Y560-R654 PolarHBondContact OH-O 3.49Å; Y560-V657 WeakPolarHBondContact CE1-O 3.45Å; Y560-I659 HydrophobicContact CD1-CG2 4.36Å
561	G	91.7	Very high	74.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.3	-176.6	0	0	0	0	0	113.4	Y569 Y570 F587	G561-Y569 WeakPolarHBondContact O-CA 3.4Å; G561-Y570 PolarHBondContact N-O 3.3Å; G561-Y570 PolarHBondContact O-N 2.86Å; G561-F587 WeakPolarHBondContact O-CE1 3.35Å
562	K	91.1	Very high	78	Confident	36 Å²	36	48.6 Å²	48.6	16%	0.157	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.2	175.7	-172.9	-170.6	-177.4	-173.3	0	110.9	E566 Y569 D599 E661	K562-E566 WeakPolarHBondContact CE-O 3.45Å; K562-E566 WeakPolarHBondContact CG-O 3.44Å; K562-Y569 HydrophobicContact CB-CD1 3.72Å; K562-Y569 HydrophobicContact CB-CD2 4.1Å; K562-Y569 HydrophobicContact CB-CE1 3.71Å; K562-Y569 HydrophobicContact CB-CE2 4.08Å; K562-Y569 HydrophobicContact CB-CG 3.92Å; K562-Y569 HydrophobicContact CD-CE2 4.05Å; K562-Y569 HydrophobicContact CG-CD2 4.36Å; K562-Y569 HydrophobicContact CG-CE2 4.22Å; K562-D599 HydrophobicContact CB-CB 4.24Å; K562-D599 PolarHBondContact N-O 2.92Å; K562-E661 WeakPolarHBondContact CE-OE2 3.37Å; K562-E661 IonicContact NZ-OE1 3.81Å; K562-E661 PolarHBondContact NZ-OE1 2.89Å; K562-E661 IonicContact NZ-OE2 2.79Å; K562-E661 PolarHBondContact NZ-OE2 3.19Å
563	W	79.1	Confident	80.7	Confident	23 Å²	23	47.6 Å²	47.6	9%	0.087	25%	0.249	C	C	.	.			trans	-82.6	140.2	172.1	-158.9	-94.2	0	0	0	110.8	T565 E566 F587 A593 F712 D713	W563-T565 PolarHBondContact O-N 3.41Å; W563-E566 HydrophobicContact CB-CB 4.29Å; W563-E566 HydrophobicContact CB-CG 4.36Å; W563-E566 PolarHBondContact O-N 2.83Å; W563-E566 VanDerWaalsContact O-O 3.12Å; W563-F587 HydrophobicContact CE3-CD2 4.33Å; W563-F587 AromaticContact CE3-CE2 3.55Å; W563-F587 HydrophobicContact CE3-CE2 3.55Å; W563-F587 HydrophobicContact CE3-CZ 4.11Å; W563-F587 HydrophobicContact CZ3-CD2 4.05Å; W563-F587 AromaticContact CZ3-CE2 3.56Å; W563-F587 HydrophobicContact CZ3-CE2 3.56Å; W563-A593 HydrophobicContact CE3-CB 4.21Å; W563-A593 HydrophobicContact CH2-CB 3.69Å; W563-A593 HydrophobicContact CZ3-CB 3.49Å; W563-A593 VanDerWaalsContact CZ3-CB 3.49Å; W563-F712 HydrophobicContact CH2-CB 4.42Å; W563-F712 HydrophobicContact CZ2-CB 4.08Å; W563-D713 WeakPolarHBondContact CH2-O 3.22Å; W563-D713 WeakPolarHBondContact CZ2-O 3.46Å
564	K	71.4	Confident	83	Confident	127 Å²	127	43.3 Å²	43.3	55%	0.552	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-31	-169.8	-72.8	178.3	-179.6	167.3	0	115.7	F712	K564-F712 VanDerWaalsContact NZ-CE2 3.34Å
565	T	71	Confident	84.7	Confident	124 Å²	124	40.9 Å²	40.9	76%	0.761	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100	-2.1	-177.5	50.4	0	0	0	0	113.7	W563	W563-T565 PolarHBondContact O-N 3.41Å
566	E	80.6	Confident	84.8	Confident	30 Å²	30	43.1 Å²	43.1	14%	0.14	21%	0.205	C	C	.	.			trans	-122.7	144.9	-170.8	-59.3	-165.4	-174.9	0	0	112.3	K562 W563 N568 Y570	K562-E566 WeakPolarHBondContact CE-O 3.45Å; K562-E566 WeakPolarHBondContact CG-O 3.44Å; W563-E566 HydrophobicContact CB-CB 4.29Å; W563-E566 HydrophobicContact CB-CG 4.36Å; W563-E566 PolarHBondContact O-N 2.83Å; W563-E566 VanDerWaalsContact O-O 3.12Å; E566-N568 PolarHBondContact O-N 2.92Å; E566-Y570 VanDerWaalsContact OE2-CE2 3.29Å; E566-Y570 WeakPolarHBondContact OE2-CE2 3.29Å; E566-Y570 VanDerWaalsContact OE2-CZ 3.31Å; E566-Y570 PolarHBondContact OE2-OH 3.34Å
567	K	87.9	Confident	84.1	Confident	133 Å²	133	44.4 Å²	44.4	58%	0.578	22%	0.22	S	C	*	.	S	Bend	trans	-85.8	13.5	176.7	-59	-171.3	-178.6	-176.6	0	113.8	H660 E661	K567-H660 VanDerWaalsContact CB-NE2 3.31Å; K567-H660 WeakPolarHBondContact CB-NE2 3.38Å; K567-H660 CarbonylContact O-C 3.5Å; K567-H660 WeakPolarHBondContact O-CA 2.97Å; K567-H660 PolarHBondContact O-CD2 2.88Å; K567-H660 VanDerWaalsContact O-CD2 3.23Å; K567-E661 HydrophobicContact CB-CB 4.37Å; K567-E661 WeakPolarHBondContact O-CB 3.32Å; K567-E661 PolarHBondContact O-N 3.47Å
568	N	90.1	Very high	82.7	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.053	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.9	-177.9	-65.7	-75.7	0	0	0	110.5	E566 Y570 I659 H660 Y722	E566-N568 PolarHBondContact O-N 2.92Å; N568-Y570 HydrophobicContact CB-CE2 4.08Å; N568-Y570 WeakPolarHBondContact O-CE2 3.35Å; N568-I659 CarbonylContact C-O 3.58Å; N568-I659 WeakPolarHBondContact CA-O 3.47Å; N568-H660 WeakPolarHBondContact OD1-CA 3.43Å; N568-Y722 PolarHBondContact ND2-OH 2.79Å; N568-Y722 VanDerWaalsContact ND2-OH 3.11Å; N568-Y722 PolarHBondContact OD1-OH 3.28Å
569	Y	93.2	Very high	80.8	Confident	9 Å²	9	50.7 Å²	50.7	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.3	172.1	-63.9	-116	0	0	0	108.9	G561 K562 V601 S658 I659 E661 V664	G561-Y569 WeakPolarHBondContact O-CA 3.4Å; K562-Y569 HydrophobicContact CB-CD1 3.72Å; K562-Y569 HydrophobicContact CB-CD2 4.1Å; K562-Y569 HydrophobicContact CB-CE1 3.71Å; K562-Y569 HydrophobicContact CB-CE2 4.08Å; K562-Y569 HydrophobicContact CB-CG 3.92Å; K562-Y569 HydrophobicContact CD-CE2 4.05Å; K562-Y569 HydrophobicContact CG-CD2 4.36Å; K562-Y569 HydrophobicContact CG-CE2 4.22Å; Y569-V601 HydrophobicContact CD1-CG2 3.9Å; Y569-V601 HydrophobicContact CE1-CG2 3.84Å; Y569-S658 WeakPolarHBondContact O-CA 3.47Å; Y569-S658 WeakPolarHBondContact O-CB 3.49Å; Y569-I659 PolarHBondContact N-O 2.61Å; Y569-I659 PolarHBondContact O-N 2.64Å; Y569-I659 VanDerWaalsContact O-N 3.09Å; Y569-E661 HydrophobicContact CE2-CB 4.14Å; Y569-E661 HydrophobicContact CE2-CG 4.48Å; Y569-V664 HydrophobicContact CD2-CB 4.48Å; Y569-V664 HydrophobicContact CD2-CG2 3.69Å; Y569-V664 HydrophobicContact CE2-CB 4.16Å; Y569-V664 HydrophobicContact CE2-CG1 4.28Å; Y569-V664 HydrophobicContact CE2-CG2 3.87Å; Y569-V664 HydrophobicContact CG-CG2 4.2Å
570	Y	93.3	Very high	79.3	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.4	-174	-58.4	-88	0	0	0	112.5	Y560 G561 E566 N568 F587 Y622 R715 K720	Y560-Y570 CarbonylContact C-O 3.3Å; Y560-Y570 VanDerWaalsContact CA-O 3.3Å; Y560-Y570 WeakPolarHBondContact CA-O 3.34Å; G561-Y570 PolarHBondContact N-O 3.3Å; G561-Y570 PolarHBondContact O-N 2.86Å; E566-Y570 VanDerWaalsContact OE2-CE2 3.29Å; E566-Y570 WeakPolarHBondContact OE2-CE2 3.29Å; E566-Y570 VanDerWaalsContact OE2-CZ 3.31Å; E566-Y570 PolarHBondContact OE2-OH 3.34Å; N568-Y570 HydrophobicContact CB-CE2 4.08Å; N568-Y570 WeakPolarHBondContact O-CE2 3.35Å; Y570-F587 WeakPolarHBondContact O-CE1 3.48Å; Y570-Y622 AromaticContact CE1-CE2 3.82Å; Y570-Y622 HydrophobicContact CE1-CE2 3.82Å; Y570-Y622 AromaticContact CE1-CZ 3.99Å; Y570-R715 VanDerWaalsContact CG-NH1 3.25Å; Y570-K720 PolarHBondContact OH-NZ 2.96Å
571	A	93.9	Very high	78.1	Confident	2 Å²	2	59 Å²	59	2%	0.017	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	133.8	-179.6	0	0	0	0	0	113.7	Y560 F587 E588 R654	Y560-A571 HydrophobicContact CE1-CB 4.1Å; A571-F587 WeakPolarHBondContact O-CD1 3.48Å; A571-E588 HydrophobicContact CB-CG 4.21Å; A571-E588 PolarHBondContact O-N 3.44Å; A571-R654 HydrophobicContact CB-CB 4.36Å; A571-R654 HydrophobicContact CB-CG 3.88Å
572	G	93	Very high	77.5	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	-172.5	174.6	0	0	0	0	0	113.5	V559 I586	V559-G572 PolarHBondContact N-O 2.9Å; V559-G572 PolarHBondContact O-N 3.09Å; G572-I586 CarbonylContact C-O 3.42Å; G572-I586 WeakPolarHBondContact CA-O 3.43Å
573	K	91	Very high	77	Confident	46 Å²	46	63.4 Å²	63.4	20%	0.2	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	148.2	175.5	-69.2	-174.3	-179.9	-172.8	0	111.3	E556 Q557 W558 Y575 V585 I586	E556-K573 HydrophobicContact CG-CD 4.49Å; E556-K573 IonicContact OE1-NZ 3.87Å; E556-K573 PolarHBondContact OE1-NZ 3.29Å; E556-K573 WeakPolarHBondContact OE2-CE 3.4Å; E556-K573 IonicContact OE2-NZ 3.66Å; E556-K573 PolarHBondContact OE2-NZ 2.65Å; Q557-K573 CarbonylContact O-C 3.18Å; Q557-K573 WeakPolarHBondContact O-CA 3.39Å; W558-K573 HydrophobicContact CD2-CG 4.19Å; W558-K573 HydrophobicContact CE3-CD 4.21Å; W558-K573 HydrophobicContact CE3-CG 3.41Å; W558-K573 VanDerWaalsContact CE3-CG 3.41Å; W558-K573 HydrophobicContact CH2-CD 4.38Å; W558-K573 HydrophobicContact CH2-CG 4.38Å; W558-K573 HydrophobicContact CZ3-CD 3.98Å; W558-K573 HydrophobicContact CZ3-CG 3.52Å; K573-Y575 HydrophobicContact CB-CE2 4.26Å; K573-V585 WeakPolarHBondContact O-CA 3.42Å; K573-I586 PolarHBondContact N-O 2.61Å; K573-I586 PolarHBondContact O-N 2.77Å
574	I	88.4	Confident	77.2	Confident	10 Å²	10	65.8 Å²	65.8	5%	0.051	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.5	164	-66.1	171.8	0	0	0	108.8	Q557 V559 C583 V585 L600 I680	Q557-I574 HydrophobicContact CB-CB 4.48Å; Q557-I574 PolarHBondContact N-O 2.67Å; Q557-I574 PolarHBondContact O-N 2.94Å; V559-I574 HydrophobicContact CB-CD1 4.42Å; V559-I574 HydrophobicContact CG1-CD1 3.6Å; V559-I574 HydrophobicContact CG1-CG1 4.09Å; V559-I574 HydrophobicContact CG2-CD1 4.08Å; V559-I574 HydrophobicContact CG2-CG1 3.94Å; I574-C583 HydrophobicContact CD1-CB 3.83Å; I574-C583 HydrophobicContact CG1-CB 4.33Å; I574-C583 HydrophobicContact CG2-CB 4.25Å; I574-V585 HydrophobicContact CD1-CG2 4.26Å; I574-V585 HydrophobicContact CG1-CG2 3.83Å; I574-L600 HydrophobicContact CD1-CD1 3.67Å; I574-L600 HydrophobicContact CD1-CD2 4.41Å; I574-I680 HydrophobicContact CD1-CD1 4.47Å
575	Y	74.1	Confident	78	Confident	86 Å²	86	59.8 Å²	59.8	34%	0.337	33%	0.33	S	S	.	.			trans	-104.4	138.9	167.5	-61	-89	0	0	0	108.5	E556 K573 S577 I586	E556-Y575 HydrophobicContact CG-CD1 4.09Å; E556-Y575 HydrophobicContact CG-CE1 3.63Å; E556-Y575 WeakPolarHBondContact OE1-CE1 3.42Å; E556-Y575 PolarHBondContact OE1-OH 2.86Å; K573-Y575 HydrophobicContact CB-CE2 4.26Å; Y575-S577 PolarHBondContact O-N 2.82Å; Y575-I586 HydrophobicContact CD2-CD1 4.29Å; Y575-I586 HydrophobicContact CD2-CG1 4.46Å; Y575-I586 HydrophobicContact CE2-CB 4.46Å; Y575-I586 HydrophobicContact CE2-CD1 3.8Å; Y575-I586 HydrophobicContact CE2-CG1 4.12Å
576	P	61.5	Low	78.9	Confident	75 Å²	75	56 Å²	56	49%	0.487	31%	0.305	S	S	.	.			trans	-76.8	92.3	-179.9	30.9	-33.6	0	0	0	110.6	G555	G555-P576 WeakPolarHBondContact O-CD 3.48Å
577	S	55.9	Low	79.4	Confident	78 Å²	78	54.7 Å²	54.7	55%	0.545	30%	0.299	S	S	.	.			trans	-143.2	144.4	168.6	62.8	0	0	0	0	112.4	Y575	Y575-S577 PolarHBondContact O-N 2.82Å
578	E	53	Low	79.5	Confident	152 Å²	152	52.2 Å²	52.2	71%	0.71	29%	0.289	S	S	*	.	S	Bend	trans	56.3	113.8	177.2	-60.4	-171.6	156.2	0	0	117	G580 R594	E578-G580 PolarHBondContact O-N 3.43Å; E578-R594 IonicContact OE2-NH2 2.73Å; E578-R594 PolarHBondContact OE2-NH2 2.69Å
579	S	50.8	Low	79.2	Confident	120 Å²	120	54.8 Å²	54.8	84%	0.839	30%	0.303	S	S	*	.			trans	-59.2	114.6	172.9	52.7	0	0	0	0	112.3
580	G	60.8	Low	78.7	Confident	57 Å²	57	56.6 Å²	56.6	59%	0.588	33%	0.325	S	S	*	.	S	Bend	trans	-174.3	164.4	175.5	0	0	0	0	0	113.7	E578 R582	E578-G580 PolarHBondContact O-N 3.43Å; G580-R582 PolarHBondContact O-N 3.14Å
581	T	68.6	Low	78.2	Confident	117 Å²	117	57.4 Å²	57.4	72%	0.718	33%	0.33	S	S	*	.	S	Bend	trans	-71.6	8.1	-176.7	56.6	0	0	0	0	114.9
582	R	78.2	Confident	77.9	Confident	111 Å²	111	63.8 Å²	63.8	42%	0.419	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	119	178.4	-58.2	-177.5	-168.6	161.2	5	110.4	G580 R594 I595 K596	G580-R582 PolarHBondContact O-N 3.14Å; R582-R594 HydrophobicContact CB-CB 4.13Å; R582-I595 CarbonylContact C-O 3.25Å; R582-I595 WeakPolarHBondContact CA-O 3.31Å; R582-I595 WeakPolarHBondContact CB-O 3.33Å; R582-K596 HydrophobicContact CG-CG 4.35Å
583	C	80.4	Confident	77.5	Confident	18 Å²	18	64 Å²	64	12%	0.122	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	146.5	178.2	-43.8	0	0	0	0	110.1	I574 R594 I595 L600 I680	I574-C583 HydrophobicContact CD1-CB 3.83Å; I574-C583 HydrophobicContact CG1-CB 4.33Å; I574-C583 HydrophobicContact CG2-CB 4.25Å; C583-R594 CarbonylContact O-C 3.58Å; C583-R594 WeakPolarHBondContact O-CA 2.93Å; C583-I595 PolarHBondContact N-O 3.05Å; C583-I595 PolarHBondContact O-N 2.83Å; C583-L600 HydrophobicContact CB-CD1 4.06Å; C583-I680 VanDerWaalsContact SG-CD1 3.58Å
584	F	85.2	Confident	77.3	Confident	73 Å²	73	66.6 Å²	66.6	32%	0.32	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	118.9	171.4	-167.9	-102.4	0	0	0	109.9	I586 R592 R594	F584-I586 HydrophobicContact CD1-CG1 4.26Å; F584-I586 HydrophobicContact CE1-CD1 4.13Å; F584-I586 HydrophobicContact CE1-CG1 3.85Å; F584-R592 HydrophobicContact CE1-CB 4.46Å; F584-R592 HydrophobicContact CE2-CB 4.34Å; F584-R592 HydrophobicContact CZ-CB 3.82Å; F584-R592 HydrophobicContact CZ-CG 4.34Å; F584-R594 HydrophobicContact CD2-CG 3.98Å
585	V	88	Confident	77.2	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132	-179.3	-175	0	0	0	0	109.3	V559 K573 I574 F587 R592 A593 I595 L600	V559-V585 HydrophobicContact CG2-CG1 4.08Å; K573-V585 WeakPolarHBondContact O-CA 3.42Å; I574-V585 HydrophobicContact CD1-CG2 4.26Å; I574-V585 HydrophobicContact CG1-CG2 3.83Å; V585-F587 HydrophobicContact CG1-CD1 4.49Å; V585-F587 HydrophobicContact CG1-CD2 4.45Å; V585-F587 HydrophobicContact CG1-CE1 4.4Å; V585-F587 HydrophobicContact CG1-CE2 4.34Å; V585-F587 HydrophobicContact CG1-CZ 4.35Å; V585-R592 WeakPolarHBondContact O-CA 3Å; V585-A593 PolarHBondContact N-O 3.31Å; V585-A593 PolarHBondContact O-N 3.07Å; V585-I595 HydrophobicContact CB-CD1 3.89Å; V585-I595 HydrophobicContact CB-CG1 4.24Å; V585-I595 HydrophobicContact CG1-CD1 4.28Å; V585-I595 HydrophobicContact CG2-CB 4.06Å; V585-I595 HydrophobicContact CG2-CD1 3.75Å; V585-I595 HydrophobicContact CG2-CG1 3.89Å; V585-L600 HydrophobicContact CG2-CD2 3.83Å
586	I	89.6	Confident	77.8	Confident	44 Å²	44	67.6 Å²	67.6	23%	0.226	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.5	164.5	-53.6	-169.9	0	0	0	107.3	G572 K573 Y575 F584 R592	G572-I586 CarbonylContact C-O 3.42Å; G572-I586 WeakPolarHBondContact CA-O 3.43Å; K573-I586 PolarHBondContact N-O 2.61Å; K573-I586 PolarHBondContact O-N 2.77Å; Y575-I586 HydrophobicContact CD2-CD1 4.29Å; Y575-I586 HydrophobicContact CD2-CG1 4.46Å; Y575-I586 HydrophobicContact CE2-CB 4.46Å; Y575-I586 HydrophobicContact CE2-CD1 3.8Å; Y575-I586 HydrophobicContact CE2-CG1 4.12Å; F584-I586 HydrophobicContact CD1-CG1 4.26Å; F584-I586 HydrophobicContact CE1-CD1 4.13Å; F584-I586 HydrophobicContact CE1-CG1 3.85Å; I586-R592 HydrophobicContact CG1-CG 4.19Å; I586-R592 HydrophobicContact CG2-CG 4.37Å
587	F	90.7	Very high	78.7	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.018	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	158.9	177.6	-71.1	-80.2	0	0	0	111.6	G561 W563 Y570 A571 V585 D589 G590 T591 A593 I595 R715	G561-F587 WeakPolarHBondContact O-CE1 3.35Å; W563-F587 HydrophobicContact CE3-CD2 4.33Å; W563-F587 AromaticContact CE3-CE2 3.55Å; W563-F587 HydrophobicContact CE3-CE2 3.55Å; W563-F587 HydrophobicContact CE3-CZ 4.11Å; W563-F587 HydrophobicContact CZ3-CD2 4.05Å; W563-F587 AromaticContact CZ3-CE2 3.56Å; W563-F587 HydrophobicContact CZ3-CE2 3.56Å; Y570-F587 WeakPolarHBondContact O-CE1 3.48Å; A571-F587 WeakPolarHBondContact O-CD1 3.48Å; V585-F587 HydrophobicContact CG1-CD1 4.49Å; V585-F587 HydrophobicContact CG1-CD2 4.45Å; V585-F587 HydrophobicContact CG1-CE1 4.4Å; V585-F587 HydrophobicContact CG1-CE2 4.34Å; V585-F587 HydrophobicContact CG1-CZ 4.35Å; F587-D589 WeakPolarHBondContact CB-OD1 3.35Å; F587-D589 PolarHBondContact O-N 2.52Å; F587-D589 VanDerWaalsContact O-N 3.14Å; F587-G590 PolarHBondContact O-N 3.27Å; F587-T591 WeakPolarHBondContact CD2-OG1 3.38Å; F587-T591 PolarHBondContact N-O 2.71Å; F587-A593 HydrophobicContact CE2-CB 4.43Å; F587-I595 HydrophobicContact CE1-CD1 4.41Å; F587-I595 HydrophobicContact CE2-CD1 3.72Å; F587-I595 HydrophobicContact CZ-CD1 3.37Å; F587-R715 VanDerWaalsContact CD1-NH1 3.27Å
588	E	89.4	Confident	80.1	Confident	81 Å²	81	66 Å²	66	38%	0.379	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-7.2	179.2	-64.2	-159.2	149.4	0	0	114.6	W558 A571 R654 G655	W558-E588 WeakPolarHBondContact CZ3-OE1 3.35Å; A571-E588 HydrophobicContact CB-CG 4.21Å; A571-E588 PolarHBondContact O-N 3.44Å; E588-R654 IonicContact OE1-CZ 3.01Å; E588-R654 IonicContact OE1-NH1 2.77Å; E588-R654 PolarHBondContact OE1-NH1 2.77Å; E588-R654 IonicContact OE1-NH2 3.1Å; E588-R654 PolarHBondContact OE1-NH2 3.48Å; E588-R654 IonicContact OE2-CZ 2.67Å; E588-R654 IonicContact OE2-NH1 3.8Å; E588-R654 IonicContact OE2-NH2 3.87Å; E588-G655 WeakPolarHBondContact OE2-CA 3.5Å; E588-G655 PolarHBondContact OE2-N 2.77Å
589	D	83.9	Confident	81.8	Confident	64 Å²	64	60.4 Å²	60.4	34%	0.342	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	13.7	167.8	72.2	-9.6	0	0	0	113.5	F587 T591 R715	F587-D589 WeakPolarHBondContact CB-OD1 3.35Å; F587-D589 PolarHBondContact O-N 2.52Å; F587-D589 VanDerWaalsContact O-N 3.14Å; D589-T591 VanDerWaalsContact C-N 3.27Å; D589-T591 PolarHBondContact O-N 2.77Å; D589-T591 WeakPolarHBondContact OD1-CB 3.04Å; D589-T591 WeakPolarHBondContact OD1-CG2 3.44Å; D589-T591 PolarHBondContact OD1-N 2.89Å; D589-T591 PolarHBondContact OD1-OG1 3.11Å; D589-R715 IonicContact OD1-CZ 2.73Å; D589-R715 IonicContact OD1-NE 2.74Å; D589-R715 IonicContact OD1-NH2 3.13Å; D589-R715 PolarHBondContact OD1-NH2 2.79Å; D589-R715 IonicContact OD2-CZ 3.85Å; D589-R715 IonicContact OD2-NE 2.84Å; D589-R715 PolarHBondContact OD2-NE 3.38Å; D589-R715 IonicContact OD2-NH2 3.87Å; D589-R715 PolarHBondContact OD2-NH2 3.23Å
590	G	83.6	Confident	83.6	Confident	47 Å²	47	55 Å²	55	49%	0.485	29%	0.291	S	S	.	.	S	Bend	trans	83.7	-13.1	178.1	0	0	0	0	0	115.1	F587	F587-G590 PolarHBondContact O-N 3.27Å
591	T	83.2	Confident	85	Confident	21 Å²	21	52.6 Å²	52.6	13%	0.129	26%	0.264	C	S	.	.			trans	-68.8	147.7	-177.8	62.1	0	0	0	0	112.4	F587 D589 R715	F587-T591 WeakPolarHBondContact CD2-OG1 3.38Å; F587-T591 PolarHBondContact N-O 2.71Å; D589-T591 VanDerWaalsContact C-N 3.27Å; D589-T591 PolarHBondContact O-N 2.77Å; D589-T591 WeakPolarHBondContact OD1-CB 3.04Å; D589-T591 WeakPolarHBondContact OD1-CG2 3.44Å; D589-T591 PolarHBondContact OD1-N 2.89Å; D589-T591 PolarHBondContact OD1-OG1 3.11Å; T591-R715 HydrophobicContact CG2-CB 4.16Å; T591-R715 HydrophobicContact CG2-CG 4.18Å
592	R	86.8	Confident	86	Confident	135 Å²	135	48.6 Å²	48.6	51%	0.509	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.3	-171.4	-53.2	-174.3	-174.4	177.9	0.8	112.3	F584 V585 I586	F584-R592 HydrophobicContact CE1-CB 4.46Å; F584-R592 HydrophobicContact CE2-CB 4.34Å; F584-R592 HydrophobicContact CZ-CB 3.82Å; F584-R592 HydrophobicContact CZ-CG 4.34Å; V585-R592 WeakPolarHBondContact O-CA 3Å; I586-R592 HydrophobicContact CG1-CG 4.19Å; I586-R592 HydrophobicContact CG2-CG 4.37Å
593	A	84.7	Confident	86.5	Confident	5 Å²	5	44.3 Å²	44.3	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	147.6	178.9	0	0	0	0	0	115.2	W563 V585 F587 I595 F712	W563-A593 HydrophobicContact CE3-CB 4.21Å; W563-A593 HydrophobicContact CH2-CB 3.69Å; W563-A593 HydrophobicContact CZ3-CB 3.49Å; W563-A593 VanDerWaalsContact CZ3-CB 3.49Å; V585-A593 PolarHBondContact N-O 3.31Å; V585-A593 PolarHBondContact O-N 3.07Å; F587-A593 HydrophobicContact CE2-CB 4.43Å; A593-I595 HydrophobicContact CB-CD1 4.32Å; A593-I595 HydrophobicContact CB-CG1 3.82Å; A593-I595 PolarHBondContact O-N 3.11Å; A593-F712 HydrophobicContact CB-CD1 3.89Å; A593-F712 HydrophobicContact CB-CE1 4.43Å
594	R	86	Confident	87	Confident	101 Å²	101	47.5 Å²	47.5	38%	0.381	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	93.7	162.7	-70.4	-174.6	170.1	-177.8	-12.9	110.8	E578 R582 C583 F584 F712	E578-R594 IonicContact OE2-NH2 2.73Å; E578-R594 PolarHBondContact OE2-NH2 2.69Å; R582-R594 HydrophobicContact CB-CB 4.13Å; C583-R594 CarbonylContact O-C 3.58Å; C583-R594 WeakPolarHBondContact O-CA 2.93Å; F584-R594 HydrophobicContact CD2-CG 3.98Å; R594-F712 HydrophobicContact CB-CE1 3.97Å; R594-F712 HydrophobicContact CB-CZ 4.36Å; R594-F712 WeakPolarHBondContact O-CE1 3.31Å
595	I	86.6	Confident	87.3	Confident	9 Å²	9	45.2 Å²	45.2	5%	0.046	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	142.2	-175.5	-54.4	-170.3	0	0	0	110	R582 C583 V585 F587 A593 D599 L600	R582-I595 CarbonylContact C-O 3.25Å; R582-I595 WeakPolarHBondContact CA-O 3.31Å; R582-I595 WeakPolarHBondContact CB-O 3.33Å; C583-I595 PolarHBondContact N-O 3.05Å; C583-I595 PolarHBondContact O-N 2.83Å; V585-I595 HydrophobicContact CB-CD1 3.89Å; V585-I595 HydrophobicContact CB-CG1 4.24Å; V585-I595 HydrophobicContact CG1-CD1 4.28Å; V585-I595 HydrophobicContact CG2-CB 4.06Å; V585-I595 HydrophobicContact CG2-CD1 3.75Å; V585-I595 HydrophobicContact CG2-CG1 3.89Å; F587-I595 HydrophobicContact CE1-CD1 4.41Å; F587-I595 HydrophobicContact CE2-CD1 3.72Å; F587-I595 HydrophobicContact CZ-CD1 3.37Å; A593-I595 HydrophobicContact CB-CD1 4.32Å; A593-I595 HydrophobicContact CB-CG1 3.82Å; A593-I595 PolarHBondContact O-N 3.11Å; I595-D599 HydrophobicContact CG2-CB 3.61Å; I595-L600 HydrophobicContact CB-CD2 4.07Å; I595-L600 HydrophobicContact CD1-CD2 4.44Å; I595-L600 HydrophobicContact CG2-CD2 3.74Å; I595-L600 HydrophobicContact CG2-CG 4.06Å
596	K	85.9	Confident	87.6	Confident	107 Å²	107	45.3 Å²	45.3	47%	0.465	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	150.1	175.5	-63	179.5	179.6	175.6	0	110.6	R582 S598 D599	R582-K596 HydrophobicContact CG-CG 4.35Å; K596-S598 WeakPolarHBondContact CB-OG 3.29Å; K596-S598 PolarHBondContact O-N 2.8Å; K596-D599 HydrophobicContact CB-CB 4.27Å; K596-D599 WeakPolarHBondContact CB-OD2 3.43Å; K596-D599 PolarHBondContact O-N 3.05Å
597	Q	82.2	Confident	87.7	Confident	60 Å²	60	44.3 Å²	44.3	28%	0.28	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-55.9	-33.1	174.3	-148.5	172.8	-6.2	0	0	113.2	D599 S677 C678	Q597-D599 VanDerWaalsContact C-N 3.28Å; Q597-D599 PolarHBondContact O-N 3.42Å; Q597-S677 WeakPolarHBondContact O-CB 3.36Å; Q597-C678 PolarHBondContact NE2-O 3.02Å
598	S	83.6	Confident	87.7	Confident	60 Å²	60	47.7 Å²	47.7	42%	0.42	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-64.5	-28	173.3	55.9	0	0	0	0	114.6	K596 L600	K596-S598 WeakPolarHBondContact CB-OG 3.29Å; K596-S598 PolarHBondContact O-N 2.8Å; S598-L600 VanDerWaalsContact C-N 3.28Å; S598-L600 PolarHBondContact O-N 3.06Å
599	D	88.9	Confident	87.7	Confident	34 Å²	34	45.9 Å²	45.9	18%	0.182	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-98.1	19.4	-169.1	-54.9	-8.8	0	0	0	110.3	K562 I595 K596 Q597	K562-D599 HydrophobicContact CB-CB 4.24Å; K562-D599 PolarHBondContact N-O 2.92Å; I595-D599 HydrophobicContact CG2-CB 3.61Å; K596-D599 HydrophobicContact CB-CB 4.27Å; K596-D599 WeakPolarHBondContact CB-OD2 3.43Å; K596-D599 PolarHBondContact O-N 3.05Å; Q597-D599 VanDerWaalsContact C-N 3.28Å; Q597-D599 PolarHBondContact O-N 3.42Å
600	L	89.1	Confident	88.1	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	146	-178.5	-63.6	173.5	0	0	0	111.3	V559 I574 C583 V585 I595 S598	V559-L600 HydrophobicContact CG2-CD2 4.38Å; I574-L600 HydrophobicContact CD1-CD1 3.67Å; I574-L600 HydrophobicContact CD1-CD2 4.41Å; C583-L600 HydrophobicContact CB-CD1 4.06Å; V585-L600 HydrophobicContact CG2-CD2 3.83Å; I595-L600 HydrophobicContact CB-CD2 4.07Å; I595-L600 HydrophobicContact CD1-CD2 4.44Å; I595-L600 HydrophobicContact CG2-CD2 3.74Å; I595-L600 HydrophobicContact CG2-CG 4.06Å; S598-L600 VanDerWaalsContact C-N 3.28Å; S598-L600 PolarHBondContact O-N 3.06Å
601	V	90.3	Very high	88.5	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.03	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	115.3	167.8	179.7	0	0	0	0	107.3	V559 Y560 Y569 V603 V664 L673	V559-V601 WeakPolarHBondContact CA-O 3.49Å; Y560-V601 PolarHBondContact N-O 3.48Å; Y560-V601 PolarHBondContact O-N 2.66Å; Y569-V601 HydrophobicContact CD1-CG2 3.9Å; Y569-V601 HydrophobicContact CE1-CG2 3.84Å; V601-V603 HydrophobicContact CG1-CG1 4.18Å; V601-V603 HydrophobicContact CG1-CG2 4.01Å; V601-V603 PolarHBondContact O-N 2.94Å; V601-V664 HydrophobicContact CG2-CG1 3.7Å; V601-L673 HydrophobicContact CG1-CD1 4.03Å; V601-L673 HydrophobicContact CG1-CD2 3.86Å; V601-L673 HydrophobicContact CG1-CG 4.38Å
602	V	89.1	Confident	89	Confident	33 Å²	33	41.9 Å²	41.9	20%	0.2	21%	0.213	C	C	.	.			trans	-88.6	89	-176.1	-174.8	0	0	0	0	109.5	Q557 V559 C678	Q557-V602 HydrophobicContact CG-CG1 3.74Å; Q557-V602 VanDerWaalsContact NE2-CG1 3.27Å; V559-V602 HydrophobicContact CG1-CG1 4.49Å; V559-V602 HydrophobicContact CG1-CG2 4.1Å; V602-C678 HydrophobicContact CG2-CB 4.42Å
603	V	90	Very high	89.2	Confident	22 Å²	22	35.5 Å²	35.5	13%	0.133	19%	0.189	C	C	.	.			trans	-145.1	146	175.5	-64.7	0	0	0	0	110.8	Y560 V601 L606 L673 P674	Y560-V603 HydrophobicContact CD2-CG2 3.89Å; Y560-V603 HydrophobicContact CE2-CG2 4.46Å; V601-V603 HydrophobicContact CG1-CG1 4.18Å; V601-V603 HydrophobicContact CG1-CG2 4.01Å; V601-V603 PolarHBondContact O-N 2.94Å; V603-L606 HydrophobicContact CG2-CD2 4.23Å; V603-L673 HydrophobicContact CG1-CD2 3.78Å; V603-L673 HydrophobicContact CG2-CD2 4.35Å; V603-P674 HydrophobicContact CG1-CG 4.45Å
604	Y	89.5	Confident	89.6	Confident	85 Å²	85	35.3 Å²	35.3	33%	0.333	19%	0.187	S	C	.	.	S	Bend	trans	-77.8	-38.7	170.4	179.6	-119.4	0	0	0	112.2	W558 R654	W558-Y604 HydrophobicContact CB-CD2 4.04Å; W558-Y604 AromaticContact CD1-CD2 3.44Å; W558-Y604 VanDerWaalsContact CD1-CD2 3.44Å; W558-Y604 AromaticContact CD1-CE2 3.96Å; W558-Y604 HydrophobicContact CD2-CD2 4.06Å; W558-Y604 HydrophobicContact CD2-CE2 4.18Å; W558-Y604 AromaticContact CE2-CE2 3.8Å; W558-Y604 AromaticContact CG-CD2 3.62Å; W558-Y604 HydrophobicContact CG-CD2 3.62Å; W558-Y604 HydrophobicContact CG-CE2 4.21Å; W558-Y604 HydrophobicContact CZ2-CE2 4.23Å; W558-Y604 AromaticContact NE1-CD2 3.71Å; W558-Y604 AromaticContact NE1-CE2 3.72Å; Y604-R654 WeakPolarHBondContact O-CD 3.24Å
605	L	92.5	Very high	89.7	Confident	25 Å²	25	31.1 Å²	31.1	13%	0.131	17%	0.172	C	C	.	.	S	Bend	trans	-133.2	146.2	173.8	-63.8	175.4	0	0	0	110.5	H631 P638 Y639	L605-H631 HydrophobicContact CD1-CB 4.26Å; L605-P638 HydrophobicContact CD1-CB 4.15Å; L605-P638 HydrophobicContact CD2-CB 3.69Å; L605-P638 HydrophobicContact CD2-CG 3.63Å; L605-Y639 HydrophobicContact CB-CE1 4.08Å; L605-Y639 HydrophobicContact CD2-CD1 4.45Å; L605-Y639 HydrophobicContact CD2-CE1 3.8Å; L605-Y639 HydrophobicContact CD2-CE2 4.43Å; L605-Y639 HydrophobicContact CG-CE1 4.48Å
606	L	93	Very high	89.6	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-73.8	143	170.4	-65.4	171	0	0	0	109.9	Y560 V603 V612 I628 H631 Y639 V657 I659	Y560-L606 HydrophobicContact CD1-CD1 4.35Å; Y560-L606 HydrophobicContact CD2-CD2 4.13Å; Y560-L606 HydrophobicContact CD2-CG 4.25Å; Y560-L606 HydrophobicContact CE1-CD1 3.77Å; Y560-L606 HydrophobicContact CE1-CG 4.21Å; Y560-L606 HydrophobicContact CE2-CD1 4.25Å; Y560-L606 HydrophobicContact CE2-CD2 4.2Å; Y560-L606 HydrophobicContact CE2-CG 3.8Å; Y560-L606 HydrophobicContact CG-CD2 4.3Å; V603-L606 HydrophobicContact CG2-CD2 4.23Å; L606-V612 HydrophobicContact CD1-CG1 4.04Å; L606-I628 HydrophobicContact CB-CD1 3.59Å; L606-I628 HydrophobicContact CD1-CD1 4.5Å; L606-H631 PolarHBondContact O-CE1 3.09Å; L606-H631 PolarHBondContact O-NE2 3.14Å; L606-Y639 HydrophobicContact CB-CE1 4.28Å; L606-Y639 PolarHBondContact N-OH 2.8Å; L606-V657 HydrophobicContact CD1-CG1 4.25Å; L606-I659 HydrophobicContact CD1-CB 3.88Å; L606-I659 HydrophobicContact CD1-CD1 4.37Å; L606-I659 HydrophobicContact CD1-CG2 3.99Å; L606-I659 HydrophobicContact CD2-CB 4.5Å; L606-I659 HydrophobicContact CD2-CD1 4.1Å; L606-I659 HydrophobicContact CD2-CG2 3.96Å
607	P	92.7	Very high	89.2	Confident	23 Å²	23	31.4 Å²	31.4	15%	0.149	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-64.8	151.2	-173.6	26.4	-35.3	0	0	0	112.9	A610 L667 L672	P607-A610 HydrophobicContact CG-CB 4.39Å; P607-A610 WeakPolarHBondContact O-CB 3.49Å; P607-A610 PolarHBondContact O-N 3.27Å; P607-L667 HydrophobicContact CG-CD1 3.84Å; P607-L667 HydrophobicContact CG-CD2 3.89Å; P607-L667 HydrophobicContact CG-CG 4.4Å; P607-L672 HydrophobicContact CB-CB 4.34Å; P607-L672 HydrophobicContact CG-CB 4.09Å
608	V	90.9	Very high	88.7	Confident	76 Å²	76	35.7 Å²	35.7	46%	0.461	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	141	172.2	178.8	0	0	0	0	109.8	A610 I628 Q629	V608-A610 VanDerWaalsContact C-N 3.32Å; V608-I628 HydrophobicContact CG2-CG2 4.34Å; V608-Q629 VanDerWaalsContact CG1-O 3.28Å; V608-Q629 WeakPolarHBondContact CG1-O 3.28Å
609	G	88.8	Confident	88	Confident	42 Å²	42	37.7 Å²	37.7	43%	0.433	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-5.1	-173.4	0	0	0	0	0	115.2	I628	G609-I628 PolarHBondContact N-O 3.12Å
610	A	91.8	Very high	86.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.215	C	C	.	.			trans	-65.4	135.5	174.4	0	0	0	0	0	112.3	P607 V608 V612 V627 I628 I659 L667	P607-A610 HydrophobicContact CG-CB 4.39Å; P607-A610 WeakPolarHBondContact O-CB 3.49Å; P607-A610 PolarHBondContact O-N 3.27Å; V608-A610 VanDerWaalsContact C-N 3.32Å; A610-V612 HydrophobicContact CB-CG1 4.33Å; A610-V627 WeakPolarHBondContact O-CA 3.44Å; A610-I628 HydrophobicContact CB-CD1 4.31Å; A610-I628 PolarHBondContact O-N 3.02Å; A610-I628 VanDerWaalsContact O-N 3.14Å; A610-I659 HydrophobicContact CB-CD1 4.44Å; A610-L667 HydrophobicContact CB-CD1 3.79Å; A610-L667 HydrophobicContact CB-CD2 4.46Å
611	E	92.7	Very high	86.3	Confident	48 Å²	48	42.2 Å²	42.2	22%	0.224	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	121.2	170.1	-55.9	-166.6	145.1	0	0	110.1	R644 E663 W726	E611-R644 IonicContact OE1-CZ 3.97Å; E611-R644 IonicContact OE1-NH1 2.61Å; E611-R644 PolarHBondContact OE1-NH1 2.77Å; E611-R644 IonicContact OE1-NH2 2.7Å; E611-R644 PolarHBondContact OE1-NH2 3.19Å; E611-E663 HydrophobicContact CB-CG 4.07Å; E611-W726 HydrophobicContact CB-CH2 4.27Å
612	V	93.5	Very high	85.8	Confident	1 Å²	1	42 Å²	42	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	156.9	-170.3	-68	0	0	0	0	111.6	L606 A610 C626 I628 V641 V657 I659	L606-V612 HydrophobicContact CD1-CG1 4.04Å; A610-V612 HydrophobicContact CB-CG1 4.33Å; V612-C626 HydrophobicContact CG2-CB 4.17Å; V612-C626 PolarHBondContact N-O 3.18Å; V612-C626 WeakPolarHBondContact O-CB 3.41Å; V612-I628 HydrophobicContact CG1-CD1 3.98Å; V612-I628 HydrophobicContact CG1-CG1 4.07Å; V612-I628 HydrophobicContact CG2-CG1 4.03Å; V612-V641 HydrophobicContact CG2-CG1 4.26Å; V612-V657 HydrophobicContact CB-CG1 3.79Å; V612-V657 HydrophobicContact CG1-CG1 3.86Å; V612-V657 HydrophobicContact CG2-CG1 4.01Å; V612-I659 HydrophobicContact CG1-CB 4.46Å
613	S	92	Very high	85.4	Confident	1 Å²	1	43 Å²	43	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	120.2	168.5	-62.1	0	0	0	0	109.1	Y622 W623 S658	S613-Y622 VanDerWaalsContact O-CD1 3.23Å; S613-Y622 WeakPolarHBondContact O-CD1 3.34Å; S613-W623 CarbonylContact C-O 3.5Å; S613-W623 VanDerWaalsContact CA-O 3.3Å; S613-W623 WeakPolarHBondContact CA-O 3.22Å; S613-S658 PolarHBondContact N-O 2.94Å; S613-S658 PolarHBondContact O-N 2.7Å; S613-S658 PolarHBondContact O-OG 3.48Å
614	A	91.6	Very high	84.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.1	-165.9	0	0	0	0	0	113.4	L616 Y622 W623 C626 V641 L652 Q656	A614-L616 HydrophobicContact CB-CD2 3.77Å; A614-L616 HydrophobicContact CB-CG 4.49Å; A614-L616 PolarHBondContact O-N 2.95Å; A614-Y622 WeakPolarHBondContact O-CA 3.28Å; A614-W623 PolarHBondContact N-O 2.86Å; A614-W623 PolarHBondContact O-N 3.18Å; A614-C626 HydrophobicContact CB-CB 3.99Å; A614-V641 HydrophobicContact CB-CG1 4.22Å; A614-L652 HydrophobicContact CB-CD1 3.75Å; A614-Q656 WeakPolarHBondContact CA-O 3.48Å
615	E	89.1	Confident	84.7	Confident	13 Å²	13	39.1 Å²	39.1	6%	0.061	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	89.3	175.5	-179.6	172	-136.5	0	0	109.7	K617 N620 Y622 Q656 R718	E615-K617 WeakPolarHBondContact CG-O 3.05Å; E615-N620 WeakPolarHBondContact OE1-CA 3.45Å; E615-Y622 HydrophobicContact CB-CD1 4.22Å; E615-Y622 HydrophobicContact CB-CE1 4.17Å; E615-Q656 HydrophobicContact CB-CB 4.1Å; E615-Q656 HydrophobicContact CB-CG 4.46Å; E615-Q656 PolarHBondContact N-O 3.48Å; E615-R718 VanDerWaalsContact CD-CZ 3.47Å; E615-R718 IonicContact OE1-CZ 3.94Å; E615-R718 IonicContact OE1-NE 3.19Å; E615-R718 IonicContact OE1-NH1 3.81Å; E615-R718 PolarHBondContact OE1-NH1 2.85Å; E615-R718 VanDerWaalsContact OE1-NH1 3.11Å; E615-R718 IonicContact OE1-NH2 3.17Å; E615-R718 PolarHBondContact OE1-NH2 3.43Å; E615-R718 IonicContact OE2-CZ 2.72Å; E615-R718 IonicContact OE2-NH1 2.7Å; E615-R718 PolarHBondContact OE2-NH1 2.81Å; E615-R718 IonicContact OE2-NH2 2.75Å; E615-R718 PolarHBondContact OE2-NH2 3.14Å
616	L	84.4	Confident	84.7	Confident	18 Å²	18	38 Å²	38	9%	0.094	21%	0.205	C	C	.	.			trans	-82.8	-11.2	-175.1	-53.8	-174.6	0	0	0	114	A614 W623 C643 Y650 L652	A614-L616 HydrophobicContact CB-CD2 3.77Å; A614-L616 HydrophobicContact CB-CG 4.49Å; A614-L616 PolarHBondContact O-N 2.95Å; L616-W623 HydrophobicContact CB-CG 4.36Å; L616-W623 HydrophobicContact CD1-CB 3.73Å; L616-W623 HydrophobicContact CD1-CD2 4.14Å; L616-W623 HydrophobicContact CD1-CG 3.69Å; L616-W623 HydrophobicContact CG-CB 3.95Å; L616-W623 HydrophobicContact CG-CG 3.92Å; L616-C643 HydrophobicContact CD1-CB 3.85Å; L616-Y650 HydrophobicContact CB-CD1 4.34Å; L616-Y650 HydrophobicContact CB-CE1 4.01Å; L616-Y650 HydrophobicContact CB-CE2 4.47Å; L616-Y650 HydrophobicContact CD1-CD2 4.35Å; L616-Y650 HydrophobicContact CD1-CE2 3.9Å; L616-Y650 HydrophobicContact CD2-CD1 4.21Å; L616-Y650 HydrophobicContact CD2-CD2 3.76Å; L616-Y650 HydrophobicContact CD2-CE2 4.12Å; L616-Y650 HydrophobicContact CD2-CG 3.8Å; L616-Y650 HydrophobicContact CG-CE2 4.38Å; L616-L652 HydrophobicContact CD2-CD1 4.08Å
617	K	78.2	Confident	84.7	Confident	105 Å²	105	39 Å²	39	46%	0.457	21%	0.211	S	C	.	.	S	Bend	trans	-143.6	156.6	-177.2	-61.1	-175.1	-177.2	179.9	0	110.3	E615 D619	E615-K617 WeakPolarHBondContact CG-O 3.05Å; K617-D619 HydrophobicContact CB-CB 4.31Å; K617-D619 WeakPolarHBondContact CB-OD2 3.43Å; K617-D619 WeakPolarHBondContact CD-OD2 3.29Å; K617-D619 PolarHBondContact O-N 2.92Å
618	D	71.2	Confident	84.8	Confident	149 Å²	149	38 Å²	38	80%	0.797	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-1.8	177	-56.6	-42.5	0	0	0	113.7	N620	D618-N620 PolarHBondContact O-N 2.85Å; D618-N620 PolarHBondContact O-ND2 3.09Å; D618-N620 VanDerWaalsContact O-ND2 3.09Å
619	D	69.2	Low	84.8	Confident	103 Å²	103	38.6 Å²	38.6	55%	0.551	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-1.2	179	-56.2	-40.8	0	0	0	114	K617 E621	K617-D619 HydrophobicContact CB-CB 4.31Å; K617-D619 WeakPolarHBondContact CB-OD2 3.43Å; K617-D619 WeakPolarHBondContact CD-OD2 3.29Å; K617-D619 PolarHBondContact O-N 2.92Å; D619-E621 HydrophobicContact CB-CG 4.42Å; D619-E621 PolarHBondContact O-N 3.05Å
620	N	66.4	Low	85	Confident	75 Å²	75	38 Å²	38	40%	0.401	19%	0.193	S	C	.	.	S	Bend	trans	63.6	20	-175.5	-75.5	-103.4	0	0	0	115.2	E615 D618 R718	E615-N620 WeakPolarHBondContact OE1-CA 3.45Å; D618-N620 PolarHBondContact O-N 2.85Å; D618-N620 PolarHBondContact O-ND2 3.09Å; D618-N620 VanDerWaalsContact O-ND2 3.09Å; N620-R718 HydrophobicContact CB-CG 4.35Å; N620-R718 VanDerWaalsContact O-CB 3.29Å; N620-R718 WeakPolarHBondContact O-CB 3.48Å; N620-R718 WeakPolarHBondContact O-CG 3.19Å; N620-R718 PolarHBondContact OD1-NE 2.82Å; N620-R718 PolarHBondContact OD1-NH2 2.93Å
621	E	75.3	Confident	85	Confident	62 Å²	62	41.2 Å²	41.2	29%	0.29	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-97.6	133.7	175.9	-59.6	-153.2	116.5	0	0	112.9	D619 P719 V721	D619-E621 HydrophobicContact CB-CG 4.42Å; D619-E621 PolarHBondContact O-N 3.05Å; E621-P719 WeakPolarHBondContact CA-O 3.26Å; E621-P719 HydrophobicContact CG-CB 4.15Å; E621-V721 WeakPolarHBondContact OE2-CG2 3.47Å
622	Y	79.5	Confident	84.7	Confident	1 Å²	1	40.4 Å²	40.4	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124.6	169.5	-74.9	-79.8	0	0	0	111.4	Y570 S613 A614 E615 G655 Q656 R718 P719 K720 V721	Y570-Y622 AromaticContact CE1-CE2 3.82Å; Y570-Y622 HydrophobicContact CE1-CE2 3.82Å; Y570-Y622 AromaticContact CE1-CZ 3.99Å; S613-Y622 VanDerWaalsContact O-CD1 3.23Å; S613-Y622 WeakPolarHBondContact O-CD1 3.34Å; A614-Y622 WeakPolarHBondContact O-CA 3.28Å; E615-Y622 HydrophobicContact CB-CD1 4.22Å; E615-Y622 HydrophobicContact CB-CE1 4.17Å; Y622-G655 PolarHBondContact OH-O 3.01Å; Y622-G655 VanDerWaalsContact OH-O 3.11Å; Y622-Q656 WeakPolarHBondContact CE1-O 3.21Å; Y622-R718 HydrophobicContact CD2-CB 3.78Å; Y622-R718 HydrophobicContact CE2-CB 3.87Å; Y622-R718 HydrophobicContact CE2-CG 4.32Å; Y622-R718 PolarHBondContact OH-NH1 3.04Å; Y622-P719 PolarHBondContact N-O 3.36Å; Y622-K720 WeakPolarHBondContact O-CA 3.4Å; Y622-V721 PolarHBondContact O-N 2.88Å
623	W	81.3	Confident	84.1	Confident	53 Å²	53	44.7 Å²	44.7	20%	0.201	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	118.4	175	-69.9	67.8	0	0	0	109.6	S613 A614 L616 D625	S613-W623 CarbonylContact C-O 3.5Å; S613-W623 VanDerWaalsContact CA-O 3.3Å; S613-W623 WeakPolarHBondContact CA-O 3.22Å; A614-W623 PolarHBondContact N-O 2.86Å; A614-W623 PolarHBondContact O-N 3.18Å; L616-W623 HydrophobicContact CB-CG 4.36Å; L616-W623 HydrophobicContact CD1-CB 3.73Å; L616-W623 HydrophobicContact CD1-CD2 4.14Å; L616-W623 HydrophobicContact CD1-CG 3.69Å; L616-W623 HydrophobicContact CG-CB 3.95Å; L616-W623 HydrophobicContact CG-CG 3.92Å; W623-D625 PolarHBondContact O-N 2.76Å
624	G	79.8	Confident	83.7	Confident	4 Å²	4	48 Å²	48	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	3	-169.9	0	0	0	0	0	116.4	W726	G624-W726 WeakPolarHBondContact O-CZ2 3.37Å
625	D	85.2	Confident	83.2	Confident	22 Å²	22	52.8 Å²	52.8	12%	0.118	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	58.3	-174.3	-153.2	-7.2	0	0	0	110.7	W623 R644 T645 S725	W623-D625 PolarHBondContact O-N 2.76Å; D625-R644 PolarHBondContact O-N 2.99Å; D625-R644 WeakPolarHBondContact OD1-CB 3.18Å; D625-R644 WeakPolarHBondContact OD1-CD 3.26Å; D625-R644 IonicContact OD1-NH1 3.68Å; D625-T645 HydrophobicContact CB-CG2 4.03Å; D625-T645 WeakPolarHBondContact OD2-CG2 3.24Å; D625-S725 WeakPolarHBondContact OD2-CB 3.25Å; D625-S725 PolarHBondContact OD2-OG 3.24Å
626	C	91.8	Very high	83	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.4	-172.1	-74.6	0	0	0	0	111.5	V612 A614 V641 L642	V612-C626 HydrophobicContact CG2-CB 4.17Å; V612-C626 PolarHBondContact N-O 3.18Å; V612-C626 WeakPolarHBondContact O-CB 3.41Å; A614-C626 HydrophobicContact CB-CB 3.99Å; C626-V641 HydrophobicContact CB-CG1 3.65Å; C626-L642 WeakPolarHBondContact CA-O 3.39Å
627	V	93.4	Very high	83.2	Confident	22 Å²	22	60.5 Å²	60.5	13%	0.133	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	136.7	-179.1	-175.1	0	0	0	0	110.1	A610 Q629 V641 L642 R644	A610-V627 WeakPolarHBondContact O-CA 3.44Å; V627-Q629 PolarHBondContact O-N 3.04Å; V627-Q629 VanDerWaalsContact O-N 3.14Å; V627-V641 CarbonylContact O-C 3.59Å; V627-V641 WeakPolarHBondContact O-CA 3.32Å; V627-L642 PolarHBondContact N-O 2.55Å; V627-L642 PolarHBondContact O-N 2.82Å; V627-R644 HydrophobicContact CG2-CG 4.36Å; V627-R644 VanDerWaalsContact CG2-CZ 3.48Å; V627-R644 VanDerWaalsContact CG2-NE 3.34Å
628	I	95.1	Very high	83.9	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	109.8	171.1	-58.8	178.1	0	0	0	108.5	L606 V608 G609 A610 V612 Y639	L606-I628 HydrophobicContact CB-CD1 3.59Å; L606-I628 HydrophobicContact CD1-CD1 4.5Å; V608-I628 HydrophobicContact CG2-CG2 4.34Å; G609-I628 PolarHBondContact N-O 3.12Å; A610-I628 HydrophobicContact CB-CD1 4.31Å; A610-I628 PolarHBondContact O-N 3.02Å; A610-I628 VanDerWaalsContact O-N 3.14Å; V612-I628 HydrophobicContact CG1-CD1 3.98Å; V612-I628 HydrophobicContact CG1-CG1 4.07Å; V612-I628 HydrophobicContact CG2-CG1 4.03Å; I628-Y639 HydrophobicContact CD1-CD1 3.82Å; I628-Y639 HydrophobicContact CD1-CE1 3.68Å; I628-Y639 HydrophobicContact CG1-CD1 4.33Å; I628-Y639 HydrophobicContact CG2-CD1 4.21Å
629	Q	91.6	Very high	85	Confident	88 Å²	88	48.6 Å²	48.6	41%	0.411	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-36.5	178.4	-171.4	-172.5	59.8	0	0	111.6	V608 V627 K640 L642	V608-Q629 VanDerWaalsContact CG1-O 3.28Å; V608-Q629 WeakPolarHBondContact CG1-O 3.28Å; V627-Q629 PolarHBondContact O-N 3.04Å; V627-Q629 VanDerWaalsContact O-N 3.14Å; Q629-K640 PolarHBondContact N-O 3.24Å; Q629-L642 HydrophobicContact CB-CB 4.43Å
630	A	91.9	Very high	86.2	Confident	30 Å²	30	46.9 Å²	46.9	25%	0.248	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	169.5	175.4	0	0	0	0	0	110.3	K640	A630-K640 HydrophobicContact CB-CB 4.22Å; A630-K640 HydrophobicContact CB-CD 4.08Å; A630-K640 PolarHBondContact N-O 2.72Å; A630-K640 WeakPolarHBondContact O-CB 2.85Å; A630-K640 PolarHBondContact O-N 3.27Å
631	H	92.9	Very high	87.4	Confident	68 Å²	68	43.3 Å²	43.3	32%	0.315	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	151.9	157.3	-57.3	150.3	0	0	0	109.7	L605 L606 P638 Y639	L605-H631 HydrophobicContact CD1-CB 4.26Å; L606-H631 PolarHBondContact O-CE1 3.09Å; L606-H631 PolarHBondContact O-NE2 3.14Å; H631-P638 CarbonylContact C-O 3.55Å; H631-P638 WeakPolarHBondContact CA-O 3.17Å; H631-Y639 AromaticContact CD2-CD1 3.91Å
632	S	86.1	Confident	88.2	Confident	30 Å²	30	42.3 Å²	42.3	21%	0.21	24%	0.241	C	C	.	.			trans	-103	160.7	174.2	93.1	0	0	0	0	110.1	D634 R637 P638	S632-D634 PolarHBondContact O-N 3.43Å; S632-D634 WeakPolarHBondContact OG-CB 3.21Å; S632-D634 PolarHBondContact OG-N 3.19Å; S632-D634 PolarHBondContact OG-O 3.06Å; S632-R637 PolarHBondContact OG-O 3.24Å; S632-P638 PolarHBondContact N-O 3Å
633	G	81.1	Confident	88.8	Confident	91 Å²	91	42.3 Å²	42.3	94%	0.938	24%	0.241	S	C	*	.	S	Bend	trans	-77.3	-3	169.9	0	0	0	0	0	114.2	S635	G633-S635 PolarHBondContact O-N 3.06Å
634	D	83.1	Confident	89.1	Confident	70 Å²	70	45.6 Å²	45.6	37%	0.374	25%	0.253	S	S	.	.			trans	-83.3	111.8	176.7	176.8	4.6	0	0	0	109.6	S632 E636 R637 P638	S632-D634 PolarHBondContact O-N 3.43Å; S632-D634 WeakPolarHBondContact OG-CB 3.21Å; S632-D634 PolarHBondContact OG-N 3.19Å; S632-D634 PolarHBondContact OG-O 3.06Å; D634-E636 PolarHBondContact O-N 2.98Å; D634-E636 WeakPolarHBondContact OD1-CA 3.28Å; D634-E636 VanDerWaalsContact OD1-CB 3.26Å; D634-E636 WeakPolarHBondContact OD1-CB 3.38Å; D634-E636 PolarHBondContact OD1-N 2.93Å; D634-R637 CarbonylContact O-C 3.5Å; D634-R637 PolarHBondContact O-N 3.21Å; D634-R637 PolarHBondContact OD1-N 2.83Å; D634-R637 WeakPolarHBondContact OD2-CB 3.42Å; D634-R637 PolarHBondContact OD2-N 2.66Å; D634-P638 VanDerWaalsContact O-CA 3.26Å; D634-P638 WeakPolarHBondContact O-CA 3.17Å; D634-P638 VanDerWaalsContact O-N 3.07Å
635	S	80.7	Confident	89.3	Confident	101 Å²	101	48 Å²	48	71%	0.706	27%	0.267	S	S	*	.	S	Bend	trans	-66	-20.6	178.3	56.8	0	0	0	0	113.7	G633	G633-S635 PolarHBondContact O-N 3.06Å
636	E	85.4	Confident	89.3	Confident	89 Å²	89	50 Å²	50	42%	0.416	28%	0.281	S	S	.	.	S	Bend	trans	-77	-44.1	171.7	-159.5	-159.1	100	0	0	110.8	D634 P638 R653	D634-E636 PolarHBondContact O-N 2.98Å; D634-E636 WeakPolarHBondContact OD1-CA 3.28Å; D634-E636 VanDerWaalsContact OD1-CB 3.26Å; D634-E636 WeakPolarHBondContact OD1-CB 3.38Å; D634-E636 PolarHBondContact OD1-N 2.93Å; E636-P638 VanDerWaalsContact O-CD 3.3Å; E636-P638 WeakPolarHBondContact O-CD 3.2Å; E636-R653 VanDerWaalsContact CD-NE 3.33Å; E636-R653 HydrophobicContact CG-CG 4.45Å; E636-R653 VanDerWaalsContact O-CA 3.32Å; E636-R653 WeakPolarHBondContact O-CA 3.3Å; E636-R653 WeakPolarHBondContact O-CB 3.33Å; E636-R653 VanDerWaalsContact O-CG 3.26Å; E636-R653 WeakPolarHBondContact O-CG 3.42Å; E636-R653 IonicContact OE1-CZ 2.69Å; E636-R653 IonicContact OE1-NE 3.12Å; E636-R653 PolarHBondContact OE1-NE 2.82Å; E636-R653 IonicContact OE1-NH2 3.2Å; E636-R653 PolarHBondContact OE1-NH2 2.97Å; E636-R653 IonicContact OE2-CZ 3.67Å; E636-R653 IonicContact OE2-NH2 3.96Å; E636-R653 PolarHBondContact OE2-NH2 2.93Å; E636-R653 VanDerWaalsContact OE2-NH2 3.12Å
637	R	88.8	Confident	89.1	Confident	104 Å²	104	56 Å²	56	39%	0.392	31%	0.313	S	S	.	.	S	Bend	trans	-122.1	63.9	-175.2	-58.8	170.5	178.8	-124.9	5	112.6	S632 D634 Y639 F651 L652 R653	S632-R637 PolarHBondContact OG-O 3.24Å; D634-R637 CarbonylContact O-C 3.5Å; D634-R637 PolarHBondContact O-N 3.21Å; D634-R637 PolarHBondContact OD1-N 2.83Å; D634-R637 WeakPolarHBondContact OD2-CB 3.42Å; D634-R637 PolarHBondContact OD2-N 2.66Å; R637-Y639 PolarHBondContact O-N 3.12Å; R637-Y639 VanDerWaalsContact O-N 3.11Å; R637-F651 HydrophobicContact CB-CB 4.41Å; R637-F651 PolarHBondContact NH1-O 2.95Å; R637-L652 CarbonylContact C-O 3.59Å; R637-L652 VanDerWaalsContact C-O 3.3Å; R637-L652 VanDerWaalsContact CA-O 3.31Å; R637-L652 WeakPolarHBondContact CA-O 3.36Å; R637-R653 HydrophobicContact CG-CG 4.05Å
638	P	92.4	Very high	89	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.032	33%	0.328	C	S	.	.			trans	-72.2	-7.1	-169	29.9	-38.1	0	0	0	114.5	L605 H631 S632 D634 E636	L605-P638 HydrophobicContact CD1-CB 4.15Å; L605-P638 HydrophobicContact CD2-CB 3.69Å; L605-P638 HydrophobicContact CD2-CG 3.63Å; H631-P638 CarbonylContact C-O 3.55Å; H631-P638 WeakPolarHBondContact CA-O 3.17Å; S632-P638 PolarHBondContact N-O 3Å; D634-P638 VanDerWaalsContact O-CA 3.26Å; D634-P638 WeakPolarHBondContact O-CA 3.17Å; D634-P638 VanDerWaalsContact O-N 3.07Å; E636-P638 VanDerWaalsContact O-CD 3.3Å; E636-P638 WeakPolarHBondContact O-CD 3.2Å
639	Y	94.1	Very high	88.8	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.4	178.2	-63.9	-57	0	0	0	112.9	Y560 L605 L606 I628 H631 R637 F651 L652 R654 V657	Y560-Y639 WeakPolarHBondContact OH-CE2 3.26Å; Y560-Y639 PolarHBondContact OH-OH 3.2Å; L605-Y639 HydrophobicContact CB-CE1 4.08Å; L605-Y639 HydrophobicContact CD2-CD1 4.45Å; L605-Y639 HydrophobicContact CD2-CE1 3.8Å; L605-Y639 HydrophobicContact CD2-CE2 4.43Å; L605-Y639 HydrophobicContact CG-CE1 4.48Å; L606-Y639 HydrophobicContact CB-CE1 4.28Å; L606-Y639 PolarHBondContact N-OH 2.8Å; I628-Y639 HydrophobicContact CD1-CD1 3.82Å; I628-Y639 HydrophobicContact CD1-CE1 3.68Å; I628-Y639 HydrophobicContact CG1-CD1 4.33Å; I628-Y639 HydrophobicContact CG2-CD1 4.21Å; H631-Y639 AromaticContact CD2-CD1 3.91Å; R637-Y639 PolarHBondContact O-N 3.12Å; R637-Y639 VanDerWaalsContact O-N 3.11Å; Y639-F651 WeakPolarHBondContact O-CA 3.26Å; Y639-L652 PolarHBondContact N-O 3.2Å; Y639-L652 PolarHBondContact O-N 2.9Å; Y639-R654 HydrophobicContact CE2-CB 4.31Å; Y639-R654 HydrophobicContact CE2-CG 3.78Å; Y639-V657 HydrophobicContact CD2-CB 3.76Å; Y639-V657 HydrophobicContact CD2-CG1 4.21Å; Y639-V657 HydrophobicContact CD2-CG2 3.46Å; Y639-V657 VanDerWaalsContact CD2-CG2 3.46Å; Y639-V657 HydrophobicContact CE2-CB 3.75Å; Y639-V657 HydrophobicContact CE2-CG1 4.06Å; Y639-V657 HydrophobicContact CE2-CG2 4.01Å; Y639-V657 HydrophobicContact CG-CG2 4.19Å
640	K	93.5	Very high	88.7	Confident	67 Å²	67	60.9 Å²	60.9	29%	0.291	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	107.6	163.1	-173.1	-172.5	-173.4	-161.3	0	108.2	Q629 A630 V649 F651	Q629-K640 PolarHBondContact N-O 3.24Å; A630-K640 HydrophobicContact CB-CB 4.22Å; A630-K640 HydrophobicContact CB-CD 4.08Å; A630-K640 PolarHBondContact N-O 2.72Å; A630-K640 WeakPolarHBondContact O-CB 2.85Å; A630-K640 PolarHBondContact O-N 3.27Å; K640-V649 HydrophobicContact CD-CG1 4.25Å; K640-V649 HydrophobicContact CG-CG1 3.48Å; K640-V649 VanDerWaalsContact CG-CG1 3.48Å; K640-F651 HydrophobicContact CB-CD1 4.27Å; K640-F651 HydrophobicContact CB-CE1 3.95Å; K640-F651 HydrophobicContact CD-CE1 4.21Å; K640-F651 HydrophobicContact CD-CZ 4.16Å; K640-F651 HydrophobicContact CG-CD1 4.43Å; K640-F651 HydrophobicContact CG-CE1 3.83Å; K640-F651 HydrophobicContact CG-CZ 3.95Å
641	V	93.3	Very high	88.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.5	-170.2	-177.9	0	0	0	0	110.7	V612 A614 C626 V627 V649 Y650 L652 V657	V612-V641 HydrophobicContact CG2-CG1 4.26Å; A614-V641 HydrophobicContact CB-CG1 4.22Å; C626-V641 HydrophobicContact CB-CG1 3.65Å; V627-V641 CarbonylContact O-C 3.59Å; V627-V641 WeakPolarHBondContact O-CA 3.32Å; V641-V649 CarbonylContact O-C 3.3Å; V641-V649 WeakPolarHBondContact O-CA 3.2Å; V641-Y650 PolarHBondContact N-O 3.44Å; V641-Y650 PolarHBondContact O-N 3.27Å; V641-L652 HydrophobicContact CB-CD1 4.15Å; V641-L652 HydrophobicContact CG2-CD1 4Å; V641-V657 HydrophobicContact CG2-CG2 4.33Å
642	L	92.2	Very high	88.7	Confident	41 Å²	41	61.5 Å²	61.5	22%	0.215	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.2	172.5	175.6	64.9	0	0	0	109.6	C626 V627 Q629 V649	C626-L642 WeakPolarHBondContact CA-O 3.39Å; V627-L642 PolarHBondContact N-O 2.55Å; V627-L642 PolarHBondContact O-N 2.82Å; Q629-L642 HydrophobicContact CB-CB 4.43Å; L642-V649 HydrophobicContact CB-CG2 4.5Å; L642-V649 HydrophobicContact CD1-CG2 3.88Å
643	C	90.6	Very high	89	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	114.7	169.4	-179.5	0	0	0	0	109.5	L616 T645 N647 E648 Y650	L616-C643 HydrophobicContact CD1-CB 3.85Å; C643-T645 VanDerWaalsContact C-N 3.26Å; C643-T645 PolarHBondContact O-N 3.21Å; C643-T645 PolarHBondContact SG-OG1 3.01Å; C643-N647 WeakPolarHBondContact O-CA 3.44Å; C643-N647 PolarHBondContact O-N 3.07Å; C643-E648 PolarHBondContact N-O 3.2Å; C643-Y650 HydrophobicContact CB-CD2 4.37Å; C643-Y650 HydrophobicContact CB-CE2 4.05Å
644	R	88.2	Confident	89.5	Confident	122 Å²	122	61.7 Å²	61.7	46%	0.46	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-25.2	-178.2	-73.6	169.5	168.8	165.4	2.9	113.5	E611 D625 V627	E611-R644 IonicContact OE1-CZ 3.97Å; E611-R644 IonicContact OE1-NH1 2.61Å; E611-R644 PolarHBondContact OE1-NH1 2.77Å; E611-R644 IonicContact OE1-NH2 2.7Å; E611-R644 PolarHBondContact OE1-NH2 3.19Å; D625-R644 PolarHBondContact O-N 2.99Å; D625-R644 WeakPolarHBondContact OD1-CB 3.18Å; D625-R644 WeakPolarHBondContact OD1-CD 3.26Å; D625-R644 IonicContact OD1-NH1 3.68Å; V627-R644 HydrophobicContact CG2-CG 4.36Å; V627-R644 VanDerWaalsContact CG2-CZ 3.48Å; V627-R644 VanDerWaalsContact CG2-NE 3.34Å
645	T	84	Confident	89.9	Confident	55 Å²	55	59.2 Å²	59.2	34%	0.337	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-27.6	-177.7	51.1	0	0	0	0	114.5	D625 C643	D625-T645 HydrophobicContact CB-CG2 4.03Å; D625-T645 WeakPolarHBondContact OD2-CG2 3.24Å; C643-T645 VanDerWaalsContact C-N 3.26Å; C643-T645 PolarHBondContact O-N 3.21Å; C643-T645 PolarHBondContact SG-OG1 3.01Å
646	T	85.8	Confident	90.3	Very high	64 Å²	64	56.2 Å²	56.2	39%	0.393	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-14.4	174.4	65	0	0	0	0	113	E648	T646-E648 WeakPolarHBondContact CB-OE2 3.42Å; T646-E648 WeakPolarHBondContact CG2-OE2 3.43Å; T646-E648 PolarHBondContact O-N 3.25Å; T646-E648 WeakPolarHBondContact OG1-CB 3.42Å; T646-E648 PolarHBondContact OG1-N 2.9Å; T646-E648 PolarHBondContact OG1-OE2 3.36Å
647	N	87.7	Confident	90.7	Very high	129 Å²	129	52 Å²	52	69%	0.69	25%	0.246	S	C	*	.			trans	61.4	16.4	-172	-144.9	27.9	0	0	0	114	C643	C643-N647 WeakPolarHBondContact O-CA 3.44Å; C643-N647 PolarHBondContact O-N 3.07Å
648	E	90.1	Very high	90.9	Very high	98 Å²	98	47 Å²	47	46%	0.458	23%	0.227	S	C	.	.			trans	-90.5	154.4	178.3	-62.2	164.4	130.2	0	0	111.7	C643 T646 Y650	C643-E648 PolarHBondContact N-O 3.2Å; T646-E648 WeakPolarHBondContact CB-OE2 3.42Å; T646-E648 WeakPolarHBondContact CG2-OE2 3.43Å; T646-E648 PolarHBondContact O-N 3.25Å; T646-E648 WeakPolarHBondContact OG1-CB 3.42Å; T646-E648 PolarHBondContact OG1-N 2.9Å; T646-E648 PolarHBondContact OG1-OE2 3.36Å; E648-Y650 HydrophobicContact CB-CD2 4.41Å; E648-Y650 HydrophobicContact CB-CE2 3.73Å; E648-Y650 PolarHBondContact OE2-OH 3.33Å
649	V	90.3	Very high	90.9	Very high	59 Å²	59	46.8 Å²	46.8	36%	0.358	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.8	178.5	178	0	0	0	0	110.7	K640 V641 L642	K640-V649 HydrophobicContact CD-CG1 4.25Å; K640-V649 HydrophobicContact CG-CG1 3.48Å; K640-V649 VanDerWaalsContact CG-CG1 3.48Å; V641-V649 CarbonylContact O-C 3.3Å; V641-V649 WeakPolarHBondContact O-CA 3.2Å; L642-V649 HydrophobicContact CB-CG2 4.5Å; L642-V649 HydrophobicContact CD1-CG2 3.88Å
650	Y	91.3	Very high	90.8	Very high	56 Å²	56	48.5 Å²	48.5	22%	0.22	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	143.8	-177.3	-66.5	-98.7	0	0	0	111.4	L616 V641 C643 E648	L616-Y650 HydrophobicContact CB-CD1 4.34Å; L616-Y650 HydrophobicContact CB-CE1 4.01Å; L616-Y650 HydrophobicContact CB-CE2 4.47Å; L616-Y650 HydrophobicContact CD1-CD2 4.35Å; L616-Y650 HydrophobicContact CD1-CE2 3.9Å; L616-Y650 HydrophobicContact CD2-CD1 4.21Å; L616-Y650 HydrophobicContact CD2-CD2 3.76Å; L616-Y650 HydrophobicContact CD2-CE2 4.12Å; L616-Y650 HydrophobicContact CD2-CG 3.8Å; L616-Y650 HydrophobicContact CG-CE2 4.38Å; V641-Y650 PolarHBondContact N-O 3.44Å; V641-Y650 PolarHBondContact O-N 3.27Å; C643-Y650 HydrophobicContact CB-CD2 4.37Å; C643-Y650 HydrophobicContact CB-CE2 4.05Å; E648-Y650 HydrophobicContact CB-CD2 4.41Å; E648-Y650 HydrophobicContact CB-CE2 3.73Å; E648-Y650 PolarHBondContact OE2-OH 3.33Å
651	F	92.6	Very high	90.7	Very high	102 Å²	102	47.9 Å²	47.9	45%	0.447	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	112.5	173	-70.7	-88.5	0	0	0	110	R637 Y639 K640	R637-F651 HydrophobicContact CB-CB 4.41Å; R637-F651 PolarHBondContact NH1-O 2.95Å; Y639-F651 WeakPolarHBondContact O-CA 3.26Å; K640-F651 HydrophobicContact CB-CD1 4.27Å; K640-F651 HydrophobicContact CB-CE1 3.95Å; K640-F651 HydrophobicContact CD-CE1 4.21Å; K640-F651 HydrophobicContact CD-CZ 4.16Å; K640-F651 HydrophobicContact CG-CD1 4.43Å; K640-F651 HydrophobicContact CG-CE1 3.83Å; K640-F651 HydrophobicContact CG-CZ 3.95Å
652	L	91.3	Very high	90.5	Very high	8 Å²	8	50 Å²	50	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144	-163.2	-61.2	179	0	0	0	112.9	A614 L616 R637 Y639 V641 Q656 V657	A614-L652 HydrophobicContact CB-CD1 3.75Å; L616-L652 HydrophobicContact CD2-CD1 4.08Å; R637-L652 CarbonylContact C-O 3.59Å; R637-L652 VanDerWaalsContact C-O 3.3Å; R637-L652 VanDerWaalsContact CA-O 3.31Å; R637-L652 WeakPolarHBondContact CA-O 3.36Å; Y639-L652 PolarHBondContact N-O 3.2Å; Y639-L652 PolarHBondContact O-N 2.9Å; V641-L652 HydrophobicContact CB-CD1 4.15Å; V641-L652 HydrophobicContact CG2-CD1 4Å; L652-Q656 HydrophobicContact CB-CB 4.19Å; L652-V657 HydrophobicContact CB-CG2 4.04Å; L652-V657 HydrophobicContact CD1-CG2 4.05Å
653	R	91.6	Very high	90.4	Very high	118 Å²	118	48.1 Å²	48.1	45%	0.445	24%	0.237	S	C	.	.			trans	-68.9	158.9	171.6	-53.7	-163.5	174.8	162.8	-8.6	111.3	E636 R637 G655 Q656	E636-R653 VanDerWaalsContact CD-NE 3.33Å; E636-R653 HydrophobicContact CG-CG 4.45Å; E636-R653 VanDerWaalsContact O-CA 3.32Å; E636-R653 WeakPolarHBondContact O-CA 3.3Å; E636-R653 WeakPolarHBondContact O-CB 3.33Å; E636-R653 VanDerWaalsContact O-CG 3.26Å; E636-R653 WeakPolarHBondContact O-CG 3.42Å; E636-R653 IonicContact OE1-CZ 2.69Å; E636-R653 IonicContact OE1-NE 3.12Å; E636-R653 PolarHBondContact OE1-NE 2.82Å; E636-R653 IonicContact OE1-NH2 3.2Å; E636-R653 PolarHBondContact OE1-NH2 2.97Å; E636-R653 IonicContact OE2-CZ 3.67Å; E636-R653 IonicContact OE2-NH2 3.96Å; E636-R653 PolarHBondContact OE2-NH2 2.93Å; E636-R653 VanDerWaalsContact OE2-NH2 3.12Å; R637-R653 HydrophobicContact CG-CG 4.05Å; R653-G655 PolarHBondContact O-N 3.31Å; R653-Q656 HydrophobicContact CB-CG 4.2Å; R653-Q656 WeakPolarHBondContact O-CB 3.3Å; R653-Q656 PolarHBondContact O-N 3.29Å
654	R	93	Very high	90.4	Very high	8 Å²	8	48.1 Å²	48.1	3%	0.03	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-60.1	-42.1	-176.8	-159	175.2	80.5	-75.4	-16.6	113.1	Y560 A571 E588 Y604 Y639 Q656 V657	Y560-R654 HydrophobicContact CE2-CG 4.14Å; Y560-R654 WeakPolarHBondContact OH-CG 3.08Å; Y560-R654 PolarHBondContact OH-O 3.49Å; A571-R654 HydrophobicContact CB-CB 4.36Å; A571-R654 HydrophobicContact CB-CG 3.88Å; E588-R654 IonicContact OE1-CZ 3.01Å; E588-R654 IonicContact OE1-NH1 2.77Å; E588-R654 PolarHBondContact OE1-NH1 2.77Å; E588-R654 IonicContact OE1-NH2 3.1Å; E588-R654 PolarHBondContact OE1-NH2 3.48Å; E588-R654 IonicContact OE2-CZ 2.67Å; E588-R654 IonicContact OE2-NH1 3.8Å; E588-R654 IonicContact OE2-NH2 3.87Å; Y604-R654 WeakPolarHBondContact O-CD 3.24Å; Y639-R654 HydrophobicContact CE2-CB 4.31Å; Y639-R654 HydrophobicContact CE2-CG 3.78Å; R654-Q656 VanDerWaalsContact C-N 3.26Å; R654-Q656 PolarHBondContact O-N 2.73Å; R654-V657 PolarHBondContact O-N 3.32Å
655	G	90.4	Very high	90.5	Very high	18 Å²	18	45.6 Å²	45.6	19%	0.186	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-65.2	-16.9	173.4	0	0	0	0	0	116.3	E588 Y622 R653 V657	E588-G655 WeakPolarHBondContact OE2-CA 3.5Å; E588-G655 PolarHBondContact OE2-N 2.77Å; Y622-G655 PolarHBondContact OH-O 3.01Å; Y622-G655 VanDerWaalsContact OH-O 3.11Å; R653-G655 PolarHBondContact O-N 3.31Å; G655-V657 VanDerWaalsContact C-N 3.28Å
656	Q	90.8	Very high	90.8	Very high	37 Å²	37	45.6 Å²	45.6	17%	0.173	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-83.4	-2.8	174	-64.8	-177.3	-73	0	0	112.8	A614 E615 Y622 L652 R653 R654	A614-Q656 WeakPolarHBondContact CA-O 3.48Å; E615-Q656 HydrophobicContact CB-CB 4.1Å; E615-Q656 HydrophobicContact CB-CG 4.46Å; E615-Q656 PolarHBondContact N-O 3.48Å; Y622-Q656 WeakPolarHBondContact CE1-O 3.21Å; L652-Q656 HydrophobicContact CB-CB 4.19Å; R653-Q656 HydrophobicContact CB-CG 4.2Å; R653-Q656 WeakPolarHBondContact O-CB 3.3Å; R653-Q656 PolarHBondContact O-N 3.29Å; R654-Q656 VanDerWaalsContact C-N 3.26Å; R654-Q656 PolarHBondContact O-N 2.73Å
657	V	92.2	Very high	91	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	127.3	-179	180	0	0	0	0	109.9	Y560 L606 V612 Y639 V641 L652 R654 G655	Y560-V657 WeakPolarHBondContact CE1-O 3.45Å; L606-V657 HydrophobicContact CD1-CG1 4.25Å; V612-V657 HydrophobicContact CB-CG1 3.79Å; V612-V657 HydrophobicContact CG1-CG1 3.86Å; V612-V657 HydrophobicContact CG2-CG1 4.01Å; Y639-V657 HydrophobicContact CD2-CB 3.76Å; Y639-V657 HydrophobicContact CD2-CG1 4.21Å; Y639-V657 HydrophobicContact CD2-CG2 3.46Å; Y639-V657 VanDerWaalsContact CD2-CG2 3.46Å; Y639-V657 HydrophobicContact CE2-CB 3.75Å; Y639-V657 HydrophobicContact CE2-CG1 4.06Å; Y639-V657 HydrophobicContact CE2-CG2 4.01Å; Y639-V657 HydrophobicContact CG-CG2 4.19Å; V641-V657 HydrophobicContact CG2-CG2 4.33Å; L652-V657 HydrophobicContact CB-CG2 4.04Å; L652-V657 HydrophobicContact CD1-CG2 4.05Å; R654-V657 PolarHBondContact O-N 3.32Å; G655-V657 VanDerWaalsContact C-N 3.28Å
658	S	92.7	Very high	91.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	153.5	176.5	62.8	0	0	0	0	110.3	Y569 S613	Y569-S658 WeakPolarHBondContact O-CA 3.47Å; Y569-S658 WeakPolarHBondContact O-CB 3.49Å; S613-S658 PolarHBondContact N-O 2.94Å; S613-S658 PolarHBondContact O-N 2.7Å; S613-S658 PolarHBondContact O-OG 3.48Å
659	I	93.2	Very high	90.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135	-177.3	-172.3	168.4	0	0	0	111.4	Y560 N568 Y569 L606 A610 V612 E663 V664 L667	Y560-I659 HydrophobicContact CD1-CG2 4.36Å; N568-I659 CarbonylContact C-O 3.58Å; N568-I659 WeakPolarHBondContact CA-O 3.47Å; Y569-I659 PolarHBondContact N-O 2.61Å; Y569-I659 PolarHBondContact O-N 2.64Å; Y569-I659 VanDerWaalsContact O-N 3.09Å; L606-I659 HydrophobicContact CD1-CB 3.88Å; L606-I659 HydrophobicContact CD1-CD1 4.37Å; L606-I659 HydrophobicContact CD1-CG2 3.99Å; L606-I659 HydrophobicContact CD2-CB 4.5Å; L606-I659 HydrophobicContact CD2-CD1 4.1Å; L606-I659 HydrophobicContact CD2-CG2 3.96Å; A610-I659 HydrophobicContact CB-CD1 4.44Å; V612-I659 HydrophobicContact CG1-CB 4.46Å; I659-E663 HydrophobicContact CD1-CB 4.36Å; I659-E663 HydrophobicContact CD1-CG 4.2Å; I659-E663 HydrophobicContact CG1-CB 4.22Å; I659-V664 HydrophobicContact CB-CG2 4.41Å; I659-V664 HydrophobicContact CD1-CG2 4.1Å; I659-V664 HydrophobicContact CG1-CG2 4Å; I659-V664 HydrophobicContact CG2-CG2 3.66Å; I659-L667 HydrophobicContact CD1-CD1 3.54Å
660	H	92.3	Very high	90.7	Very high	37 Å²	37	44.7 Å²	44.7	17%	0.171	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	145.2	-179	-172.8	-110.2	0	0	0	111.3	K567 N568 S662 E663 V664	K567-H660 VanDerWaalsContact CB-NE2 3.31Å; K567-H660 WeakPolarHBondContact CB-NE2 3.38Å; K567-H660 CarbonylContact O-C 3.5Å; K567-H660 WeakPolarHBondContact O-CA 2.97Å; K567-H660 PolarHBondContact O-CD2 2.88Å; K567-H660 VanDerWaalsContact O-CD2 3.23Å; N568-H660 WeakPolarHBondContact OD1-CA 3.43Å; H660-S662 VanDerWaalsContact C-N 3.26Å; H660-S662 PolarHBondContact ND1-OG 3.09Å; H660-S662 PolarHBondContact O-N 3.1Å; H660-E663 PolarHBondContact O-N 3.17Å; H660-V664 PolarHBondContact O-N 2.75Å
661	E	90.6	Very high	90.3	Very high	54 Å²	54	49.9 Å²	49.9	25%	0.252	23%	0.231	S	C	.	.	H	α-helix	trans	-53	-39	-176.4	173.6	161.6	-131.7	0	0	113.4	K562 K567 Y569 E663 V664 D665	K562-E661 WeakPolarHBondContact CE-OE2 3.37Å; K562-E661 IonicContact NZ-OE1 3.81Å; K562-E661 PolarHBondContact NZ-OE1 2.89Å; K562-E661 IonicContact NZ-OE2 2.79Å; K562-E661 PolarHBondContact NZ-OE2 3.19Å; K567-E661 HydrophobicContact CB-CB 4.37Å; K567-E661 WeakPolarHBondContact O-CB 3.32Å; K567-E661 PolarHBondContact O-N 3.47Å; Y569-E661 HydrophobicContact CE2-CB 4.14Å; Y569-E661 HydrophobicContact CE2-CG 4.48Å; E661-E663 VanDerWaalsContact C-N 3.3Å; E661-E663 PolarHBondContact O-N 2.7Å; E661-V664 PolarHBondContact O-N 3.45Å; E661-D665 PolarHBondContact O-N 3.31Å
662	S	89.6	Confident	89.7	Confident	43 Å²	43	49.4 Å²	49.4	30%	0.301	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-33.7	176.2	61.3	0	0	0	0	113.3	H660 N666	H660-S662 VanDerWaalsContact C-N 3.26Å; H660-S662 PolarHBondContact ND1-OG 3.09Å; H660-S662 PolarHBondContact O-N 3.1Å; S662-N666 PolarHBondContact O-N 3.48Å; S662-N666 PolarHBondContact O-ND2 3.05Å; S662-N666 PolarHBondContact O-OD1 3.38Å
663	E	91.2	Very high	89.3	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.009	23%	0.233	C	C	.	.	H	α-helix	trans	-83.7	-29.9	177.9	-170.1	62.1	-174.6	0	0	111.8	E611 I659 H660 E661 D665 N666 L667 R670	E611-E663 HydrophobicContact CB-CG 4.07Å; I659-E663 HydrophobicContact CD1-CB 4.36Å; I659-E663 HydrophobicContact CD1-CG 4.2Å; I659-E663 HydrophobicContact CG1-CB 4.22Å; H660-E663 PolarHBondContact O-N 3.17Å; E661-E663 VanDerWaalsContact C-N 3.3Å; E661-E663 PolarHBondContact O-N 2.7Å; E663-D665 VanDerWaalsContact C-N 3.29Å; E663-D665 PolarHBondContact O-N 2.73Å; E663-N666 PolarHBondContact O-N 3.42Å; E663-N666 VanDerWaalsContact OE2-CB 3.24Å; E663-N666 WeakPolarHBondContact OE2-CB 3.36Å; E663-N666 PolarHBondContact OE2-ND2 3.29Å; E663-L667 HydrophobicContact CG-CD1 4.17Å; E663-L667 HydrophobicContact CG-CG 4.21Å; E663-L667 WeakPolarHBondContact O-CB 3.49Å; E663-L667 VanDerWaalsContact O-CG 3.23Å; E663-L667 WeakPolarHBondContact O-CG 3.18Å; E663-L667 PolarHBondContact O-N 2.64Å; E663-R670 IonicContact OE1-CZ 3.69Å; E663-R670 IonicContact OE1-NH1 2.64Å; E663-R670 PolarHBondContact OE1-NH1 3.31Å; E663-R670 IonicContact OE2-NH1 2.78Å
664	V	90.8	Very high	88.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-45	165.2	175.3	0	0	0	0	110.5	Y569 V601 I659 H660 E661 L667 K668 L673	Y569-V664 HydrophobicContact CD2-CB 4.48Å; Y569-V664 HydrophobicContact CD2-CG2 3.69Å; Y569-V664 HydrophobicContact CE2-CB 4.16Å; Y569-V664 HydrophobicContact CE2-CG1 4.28Å; Y569-V664 HydrophobicContact CE2-CG2 3.87Å; Y569-V664 HydrophobicContact CG-CG2 4.2Å; V601-V664 HydrophobicContact CG2-CG1 3.7Å; I659-V664 HydrophobicContact CB-CG2 4.41Å; I659-V664 HydrophobicContact CD1-CG2 4.1Å; I659-V664 HydrophobicContact CG1-CG2 4Å; I659-V664 HydrophobicContact CG2-CG2 3.66Å; H660-V664 PolarHBondContact O-N 2.75Å; E661-V664 PolarHBondContact O-N 3.45Å; V664-L667 PolarHBondContact O-N 2.84Å; V664-K668 HydrophobicContact CG1-CD 4.2Å; V664-K668 WeakPolarHBondContact O-CB 3.33Å; V664-K668 WeakPolarHBondContact O-CG 3.36Å; V664-K668 PolarHBondContact O-N 2.87Å; V664-L673 HydrophobicContact CG1-CD1 4.19Å
665	D	89.3	Confident	87	Confident	69 Å²	69	49.7 Å²	49.7	37%	0.369	25%	0.253	S	S	.	.	H	α-helix	trans	-65.6	-37.5	175.3	-76.8	-11.7	0	0	0	112.7	E661 E663 K669	E661-D665 PolarHBondContact O-N 3.31Å; E663-D665 VanDerWaalsContact C-N 3.29Å; E663-D665 PolarHBondContact O-N 2.73Å; D665-K669 WeakPolarHBondContact O-CB 3.18Å; D665-K669 VanDerWaalsContact O-CD 3.27Å; D665-K669 WeakPolarHBondContact O-CD 3.46Å; D665-K669 WeakPolarHBondContact O-CE 3.41Å; D665-K669 WeakPolarHBondContact O-CG 3.48Å; D665-K669 PolarHBondContact O-N 2.97Å
666	N	89.6	Confident	85.4	Confident	56 Å²	56	55.1 Å²	55.1	30%	0.299	28%	0.278	S	S	.	.	H	α-helix	trans	-67.5	-43.7	175.9	-68.9	-21.2	0	0	0	111.9	S662 E663 K669 R670	S662-N666 PolarHBondContact O-N 3.48Å; S662-N666 PolarHBondContact O-ND2 3.05Å; S662-N666 PolarHBondContact O-OD1 3.38Å; E663-N666 PolarHBondContact O-N 3.42Å; E663-N666 VanDerWaalsContact OE2-CB 3.24Å; E663-N666 WeakPolarHBondContact OE2-CB 3.36Å; E663-N666 PolarHBondContact OE2-ND2 3.29Å; N666-K669 WeakPolarHBondContact O-CB 3.35Å; N666-K669 PolarHBondContact O-N 2.87Å; N666-R670 WeakPolarHBondContact O-CB 3.44Å; N666-R670 VanDerWaalsContact O-CG 3.3Å; N666-R670 WeakPolarHBondContact O-CG 3.18Å; N666-R670 PolarHBondContact O-N 3.38Å
667	L	90.6	Very high	83.5	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-68.3	-37.6	178.5	-67.1	170.6	0	0	0	111.8	P607 A610 I659 E663 V664 R670 Q671 L672 L673	P607-L667 HydrophobicContact CG-CD1 3.84Å; P607-L667 HydrophobicContact CG-CD2 3.89Å; P607-L667 HydrophobicContact CG-CG 4.4Å; A610-L667 HydrophobicContact CB-CD1 3.79Å; A610-L667 HydrophobicContact CB-CD2 4.46Å; I659-L667 HydrophobicContact CD1-CD1 3.54Å; E663-L667 HydrophobicContact CG-CD1 4.17Å; E663-L667 HydrophobicContact CG-CG 4.21Å; E663-L667 WeakPolarHBondContact O-CB 3.49Å; E663-L667 VanDerWaalsContact O-CG 3.23Å; E663-L667 WeakPolarHBondContact O-CG 3.18Å; E663-L667 PolarHBondContact O-N 2.64Å; V664-L667 PolarHBondContact O-N 2.84Å; L667-R670 CarbonylContact O-C 3.54Å; L667-R670 PolarHBondContact O-N 3.19Å; L667-Q671 PolarHBondContact O-N 3.24Å; L667-L672 HydrophobicContact CB-CB 4.35Å; L667-L672 HydrophobicContact CD2-CB 4.05Å; L667-L672 HydrophobicContact CD2-CD1 3.8Å; L667-L672 PolarHBondContact O-N 2.97Å; L667-L673 HydrophobicContact CB-CB 4.43Å; L667-L673 HydrophobicContact CB-CD1 3.69Å; L667-L673 HydrophobicContact CB-CG 3.79Å; L667-L673 HydrophobicContact CD1-CD1 3.94Å; L667-L673 HydrophobicContact CD1-CG 4.29Å; L667-L673 HydrophobicContact CG-CD1 4.5Å
668	K	89	Confident	81.3	Confident	48 Å²	48	58.5 Å²	58.5	21%	0.209	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-44.4	168.8	-76.2	177.5	177.3	-179.5	0	111.8	V664 R670 Q671 L673	V664-K668 HydrophobicContact CG1-CD 4.2Å; V664-K668 WeakPolarHBondContact O-CB 3.33Å; V664-K668 WeakPolarHBondContact O-CG 3.36Å; V664-K668 PolarHBondContact O-N 2.87Å; K668-R670 VanDerWaalsContact C-N 3.3Å; K668-R670 PolarHBondContact O-N 2.96Å; K668-Q671 PolarHBondContact O-N 3.29Å; K668-L673 HydrophobicContact CG-CB 4.06Å
669	K	87.6	Confident	78.9	Confident	150 Å²	150	66.9 Å²	66.9	65%	0.652	34%	0.344	S	S	*	.	H	α-helix	trans	-63.3	-33.1	173.8	-69.2	159.5	-159.8	157.3	0	113	D665 N666 Q671	D665-K669 WeakPolarHBondContact O-CB 3.18Å; D665-K669 VanDerWaalsContact O-CD 3.27Å; D665-K669 WeakPolarHBondContact O-CD 3.46Å; D665-K669 WeakPolarHBondContact O-CE 3.41Å; D665-K669 WeakPolarHBondContact O-CG 3.48Å; D665-K669 PolarHBondContact O-N 2.97Å; N666-K669 WeakPolarHBondContact O-CB 3.35Å; N666-K669 PolarHBondContact O-N 2.87Å; K669-Q671 VanDerWaalsContact C-N 3.26Å
670	R	86	Confident	76.8	Confident	131 Å²	131	69.9 Å²	69.9	49%	0.494	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-1.5	172.9	-67.8	172.9	-174.2	143.8	2.3	113.5	E663 N666 L667 K668 L672	E663-R670 IonicContact OE1-CZ 3.69Å; E663-R670 IonicContact OE1-NH1 2.64Å; E663-R670 PolarHBondContact OE1-NH1 3.31Å; E663-R670 IonicContact OE2-NH1 2.78Å; N666-R670 WeakPolarHBondContact O-CB 3.44Å; N666-R670 VanDerWaalsContact O-CG 3.3Å; N666-R670 WeakPolarHBondContact O-CG 3.18Å; N666-R670 PolarHBondContact O-N 3.38Å; L667-R670 CarbonylContact O-C 3.54Å; L667-R670 PolarHBondContact O-N 3.19Å; K668-R670 VanDerWaalsContact C-N 3.3Å; K668-R670 PolarHBondContact O-N 2.96Å; R670-L672 HydrophobicContact CB-CD1 3.93Å; R670-L672 HydrophobicContact CB-CG 3.96Å; R670-L672 PolarHBondContact O-N 2.85Å
671	Q	81.6	Confident	74.3	Confident	166 Å²	166	73.8 Å²	73.8	78%	0.776	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	18.5	-174.4	-50.4	-179.2	24.7	0	0	114.6	L667 K668 K669 L673	L667-Q671 PolarHBondContact O-N 3.24Å; K668-Q671 PolarHBondContact O-N 3.29Å; K669-Q671 VanDerWaalsContact C-N 3.26Å; Q671-L673 VanDerWaalsContact C-N 3.33Å
672	L	80.9	Confident	71.8	Confident	91 Å²	91	75.1 Å²	75.1	48%	0.476	40%	0.396	S	S	.	.	S	Bend	trans	-87.3	-0.4	178	-63.9	174.2	0	0	0	113.4	P607 L667 R670	P607-L672 HydrophobicContact CB-CB 4.34Å; P607-L672 HydrophobicContact CG-CB 4.09Å; L667-L672 HydrophobicContact CB-CB 4.35Å; L667-L672 HydrophobicContact CD2-CB 4.05Å; L667-L672 HydrophobicContact CD2-CD1 3.8Å; L667-L672 PolarHBondContact O-N 2.97Å; R670-L672 HydrophobicContact CB-CD1 3.93Å; R670-L672 HydrophobicContact CB-CG 3.96Å; R670-L672 PolarHBondContact O-N 2.85Å
673	L	83.5	Confident	68.9	Low	7 Å²	7	78.3 Å²	78.3	4%	0.037	42%	0.419	C	S	.	.	S	Bend	trans	-138.1	151.7	170.7	-71.7	178.3	0	0	0	108.9	V601 V603 V664 L667 K668 Q671 S675	V601-L673 HydrophobicContact CG1-CD1 4.03Å; V601-L673 HydrophobicContact CG1-CD2 3.86Å; V601-L673 HydrophobicContact CG1-CG 4.38Å; V603-L673 HydrophobicContact CG1-CD2 3.78Å; V603-L673 HydrophobicContact CG2-CD2 4.35Å; V664-L673 HydrophobicContact CG1-CD1 4.19Å; L667-L673 HydrophobicContact CB-CB 4.43Å; L667-L673 HydrophobicContact CB-CD1 3.69Å; L667-L673 HydrophobicContact CB-CG 3.79Å; L667-L673 HydrophobicContact CD1-CD1 3.94Å; L667-L673 HydrophobicContact CD1-CG 4.29Å; L667-L673 HydrophobicContact CG-CD1 4.5Å; K668-L673 HydrophobicContact CG-CB 4.06Å; Q671-L673 VanDerWaalsContact C-N 3.33Å; L673-S675 PolarHBondContact O-N 2.97Å
674	P	75.9	Confident	66.3	Low	53 Å²	53	83.8 Å²	83.8	34%	0.344	45%	0.447	S	S	.	.			trans	-53.8	122.3	176.2	-26.6	35	0	0	0	112.5	V603 N676	V603-P674 HydrophobicContact CG1-CG 4.45Å; P674-N676 VanDerWaalsContact C-N 3.31Å; P674-N676 PolarHBondContact O-N 3.13Å
675	S	60.2	Low	63.5	Low	81 Å²	81	93 Å²	93	57%	0.566	49%	0.49	S	S	*	.	S	Bend	trans	-64.7	-35.9	-178.7	-50.8	0	0	0	0	112.5	L673	L673-S675 PolarHBondContact O-N 2.97Å
676	N	55.7	Low	60.8	Low	131 Å²	131	96.6 Å²	96.6	70%	0.701	51%	0.509	S	S	*	.	S	Bend	trans	-99.4	139.9	-177.1	-65.3	-8.7	0	0	0	110.6	P674 C678	P674-N676 VanDerWaalsContact C-N 3.31Å; P674-N676 PolarHBondContact O-N 3.13Å; N676-C678 PolarHBondContact O-N 3.4Å
677	S	51	Low	58.2	Low	58 Å²	58	101.8 Å²	101.8	41%	0.406	53%	0.532	S	S	.	.			trans	-66	101.1	162.3	51.5	0	0	0	0	108.5	Q597 E679	Q597-S677 WeakPolarHBondContact O-CB 3.36Å; S677-E679 PolarHBondContact O-N 2.83Å
678	C	46.4	Very low	55.6	Low	50 Å²	50	108 Å²	108	34%	0.338	57%	0.565	S	S	.	*			trans	-45.7	125.6	-173	-60.3	0	0	0	0	111.8	Q597 V602 N676 I680	Q597-C678 PolarHBondContact NE2-O 3.02Å; V602-C678 HydrophobicContact CG2-CB 4.42Å; N676-C678 PolarHBondContact O-N 3.4Å; C678-I680 PolarHBondContact O-N 3.35Å; C678-I680 VanDerWaalsContact O-N 3.08Å
679	E	41.9	Very low	53.1	Low	176 Å²	176	116.1 Å²	116.1	82%	0.822	60%	0.6	S	S	*	*			trans	-54.3	113.9	151.9	-66.8	-177.9	159.2	0	0	106.1	S677 P681	S677-E679 PolarHBondContact O-N 2.83Å; E679-P681 WeakPolarHBondContact O-CD 3.3Å
680	I	49	Very low	50.5	Low	64 Å²	64	116.4 Å²	116.4	33%	0.328	61%	0.607	S	S	.	*			trans	-76.8	113.6	178.1	-61.1	177.6	0	0	0	105.5	I574 C583 C678 I682	I574-I680 HydrophobicContact CD1-CD1 4.47Å; C583-I680 VanDerWaalsContact SG-CD1 3.58Å; C678-I680 PolarHBondContact O-N 3.35Å; C678-I680 VanDerWaalsContact O-N 3.08Å; I680-I682 VanDerWaalsContact C-N 3.29Å; I680-I682 HydrophobicContact CG2-CG1 4.2Å; I680-I682 PolarHBondContact O-N 3.42Å
681	P	39.4	Very low	47.9	Very low	118 Å²	118	116 Å²	116	77%	0.766	61%	0.614	S	S	*	*			trans	-75.9	86.7	-177.9	31.7	-33	0	0	0	108.6	E679 S683	E679-P681 WeakPolarHBondContact O-CD 3.3Å; P681-S683 VanDerWaalsContact C-N 3.33Å; P681-S683 PolarHBondContact O-N 3.04Å
682	I	38.6	Very low	45.5	Very low	82 Å²	82	115.8 Å²	115.8	42%	0.421	62%	0.616	S	S	.	*			trans	-73.2	93.2	172.1	-49.9	179.8	0	0	0	107.1	I680 I684	I680-I682 VanDerWaalsContact C-N 3.29Å; I680-I682 HydrophobicContact CG2-CG1 4.2Å; I680-I682 PolarHBondContact O-N 3.42Å; I682-I684 VanDerWaalsContact C-N 3.29Å; I682-I684 HydrophobicContact CG2-CD1 4.27Å; I682-I684 HydrophobicContact CG2-CG1 3.76Å; I682-I684 PolarHBondContact O-N 2.91Å
683	S	29.7	Very low	43.1	Very low	111 Å²	111	117.1 Å²	117.1	78%	0.776	62%	0.623	S	S	*	*			trans	-70.2	82.6	175.6	55.6	0	0	0	0	110.5	P681 E685	P681-S683 VanDerWaalsContact C-N 3.33Å; P681-S683 PolarHBondContact O-N 3.04Å; S683-E685 PolarHBondContact O-N 3.45Å
684	I	35.5	Very low	40.6	Very low	117 Å²	117	124.7 Å²	124.7	60%	0.6	66%	0.664	S	S	*	*			trans	-82.1	94.4	171.3	-52.3	-179.9	0	0	0	108.1	I682 N686	I682-I684 VanDerWaalsContact C-N 3.29Å; I682-I684 HydrophobicContact CG2-CD1 4.27Å; I682-I684 HydrophobicContact CG2-CG1 3.76Å; I682-I684 PolarHBondContact O-N 2.91Å; I684-N686 VanDerWaalsContact C-N 3.31Å; I684-N686 WeakPolarHBondContact CG2-OD1 3.29Å; I684-N686 PolarHBondContact O-N 3.36Å
685	E	33.2	Very low	38.6	Very low	194 Å²	194	125.6 Å²	125.6	91%	0.907	67%	0.672	S	S	*	*			trans	-68.6	90.7	165.8	-71	-169.3	134.1	0	0	109.4	S683 E687	S683-E685 PolarHBondContact O-N 3.45Å; E685-E687 PolarHBondContact O-N 3.49Å; E685-E687 VanDerWaalsContact O-N 3.12Å
686	N	30.6	Very low	37.3	Very low	143 Å²	143	129.3 Å²	129.3	77%	0.765	68%	0.683	S	S	*	*			trans	-78.6	83.3	178.1	-87.8	-42.6	0	0	0	111.4	I684	I684-N686 VanDerWaalsContact C-N 3.31Å; I684-N686 WeakPolarHBondContact CG2-OD1 3.29Å; I684-N686 PolarHBondContact O-N 3.36Å
687	E	36.7	Very low	36.1	Very low	166 Å²	166	128.7 Å²	128.7	78%	0.776	68%	0.684	S	S	*	*			trans	-140.7	150.4	156.7	-86.9	-138.4	170.3	0	0	113.7	E685	E685-E687 PolarHBondContact O-N 3.49Å; E685-E687 VanDerWaalsContact O-N 3.12Å
688	N	36.2	Very low	35.2	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	71%	0.71	S	S	*	*			trans	62	89.2	166.4	-61.1	-52.9	0	0	0	118.2	I690	N688-I690 PolarHBondContact O-N 2.71Å
689	K	34.6	Very low	34.5	Very low	219 Å²	219	140.6 Å²	140.6	95%	0.952	73%	0.728	S	S	*	*			trans	-49.3	107.6	159.3	-66.5	172.8	177.6	173.9	0	111.5
690	I	34.9	Very low	33.8	Very low	156 Å²	156	138 Å²	138	80%	0.8	73%	0.728	S	S	*	*			trans	-116	129.4	157.9	-64	-175.5	0	0	0	109.2	N688 M692	N688-I690 PolarHBondContact O-N 2.71Å; I690-M692 PolarHBondContact O-N 3.19Å
691	N	31.4	Very low	33	Very low	121 Å²	121	139.6 Å²	139.6	65%	0.647	75%	0.751	S	S	*	*			trans	-87.7	84.8	-162.3	-176.8	11.5	0	0	0	112.5	N693	N691-N693 PolarHBondContact O-N 3.43Å; N691-N693 VanDerWaalsContact O-N 3.16Å; N691-N693 WeakPolarHBondContact OD1-CB 3.47Å; N691-N693 PolarHBondContact OD1-N 2.82Å; N691-N693 PolarHBondContact OD1-ND2 2.9Å; N691-N693 PolarHBondContact OD1-OD1 3.39Å
692	M	31.1	Very low	32.6	Very low	162 Å²	162	139.8 Å²	139.8	80%	0.798	76%	0.755	S	S	*	*			trans	-83.8	57.3	166.9	-82.7	-70.7	-171	0	0	111.7	I690 N694	I690-M692 PolarHBondContact O-N 3.19Å; M692-N694 PolarHBondContact O-N 3.39Å
693	N	29.1	Very low	32.6	Very low	120 Å²	120	141.1 Å²	141.1	64%	0.642	77%	0.769	S	S	*	*			trans	-70.8	76.5	171	-93.9	-1.8	0	0	0	111.4	N691	N691-N693 PolarHBondContact O-N 3.43Å; N691-N693 VanDerWaalsContact O-N 3.16Å; N691-N693 WeakPolarHBondContact OD1-CB 3.47Å; N691-N693 PolarHBondContact OD1-N 2.82Å; N691-N693 PolarHBondContact OD1-ND2 2.9Å; N691-N693 PolarHBondContact OD1-OD1 3.39Å
694	N	31.4	Very low	32.7	Very low	166 Å²	166	144.1 Å²	144.1	89%	0.888	77%	0.771	S	S	*	*	S	Bend	trans	-163.8	52.8	149.2	-95.5	-24.6	0	0	0	108.3	M692	M692-N694 PolarHBondContact O-N 3.39Å
695	S	34.7	Very low	32.3	Very low	72 Å²	72	144.5 Å²	144.5	50%	0.503	78%	0.779	S	S	.	*	S	Bend	trans	-157.1	152.9	-174.6	-77.2	0	0	0	0	111.1	T697	S695-T697 PolarHBondContact O-N 2.85Å; S695-T697 PolarHBondContact O-OG1 2.83Å
696	I	32.2	Very low	32.2	Very low	158 Å²	158	140.1 Å²	140.1	81%	0.81	77%	0.769	S	S	*	*	S	Bend	trans	68.3	-21.4	165	-61.8	160.9	0	0	0	116.8	K698	I696-K698 PolarHBondContact O-N 3.34Å
697	T	30.2	Very low	32	Very low	118 Å²	118	141.7 Å²	141.7	72%	0.724	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	12.9	-169.7	50.1	0	0	0	0	118	S695	S695-T697 PolarHBondContact O-N 2.85Å; S695-T697 PolarHBondContact O-OG1 2.83Å
698	K	31.9	Very low	31.7	Very low	217 Å²	217	138 Å²	138	94%	0.943	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-2.4	165.6	-95.4	-172	177.6	-179	0	114.1	I696	I696-K698 PolarHBondContact O-N 3.34Å
699	I	32.8	Very low	31.5	Very low	141 Å²	141	138.8 Å²	138.8	72%	0.723	77%	0.773	S	S	*	*	S	Bend	trans	-106.4	124.4	169.9	-58.5	175.3	0	0	0	106.1
700	C	27.6	Very low	31.3	Very low	121 Å²	121	132.1 Å²	132.1	82%	0.818	75%	0.748	S	S	*	*	S	Bend	trans	60.7	90.7	-178.7	-60.5	0	0	0	0	116.8
701	A	32	Very low	31.2	Very low	98 Å²	98	130.6 Å²	130.6	81%	0.81	75%	0.746	S	S	*	*				169.9	96.1	126.5	0	0	0	0	0	114.6
702	S	30.1	Very low	31.4	Very low	123 Å²	123	127.1 Å²	127.1	86%	0.86	73%	0.725	S	S	*	*	S	Bend	trans	-175.9	142.6	137.6	-82.7	0	0	0	0	109.6
703	P	39.1	Very low	31.8	Very low	110 Å²	110	123.9 Å²	123.9	71%	0.714	71%	0.711	S	S	*	*				-130.4	123.4	-128.9	34.9	-17.6	0	0	0	117.2	V705	P703-V705 HydrophobicContact CB-CG2 4.26Å
704	E	31.6	Very low	32.3	Very low	174 Å²	174	126.1 Å²	126.1	81%	0.813	72%	0.715	S	S	*	*			trans	-122.7	123.1	141.5	-73.2	-179.5	133.8	0	0	106.1	K283	K283-E704 IonicContact NZ-OE1 2.75Å; K283-E704 IonicContact NZ-OE2 3.22Å; K283-E704 PolarHBondContact NZ-OE2 2.85Å
705	V	27.7	Very low	32.6	Very low	125 Å²	125	119.1 Å²	119.1	76%	0.758	68%	0.676	S	S	*	*			trans	-109.2	120.1	-164.1	-179.8	0	0	0	0	111.7	P703	P703-V705 HydrophobicContact CB-CG2 4.26Å
706	S	29.3	Very low	33	Very low	101 Å²	101	123.8 Å²	123.8	71%	0.706	69%	0.687	S	S	*	*			trans	-151.8	68.3	170.1	-157	0	0	0	0	114.5	S708	S706-S708 VanDerWaalsContact C-N 3.3Å; S706-S708 PolarHBondContact O-N 3.35Å; S706-S708 PolarHBondContact O-OG 3.05Å
707	L	27.6	Very low	33.6	Very low	176 Å²	176	119 Å²	119	92%	0.921	67%	0.668	S	S	*	*	S	Bend	trans	43.4	-9.9	144.2	-60.1	175.7	0	0	0	124.2
708	S	30.4	Very low	34.5	Very low	88 Å²	88	115.9 Å²	115.9	62%	0.615	64%	0.643	S	S	*	*			trans	-104.1	-42.3	-158.5	60	0	0	0	0	117.5	S706 L710	S706-S708 VanDerWaalsContact C-N 3.3Å; S706-S708 PolarHBondContact O-N 3.35Å; S706-S708 PolarHBondContact O-OG 3.05Å; S708-L710 PolarHBondContact O-N 2.86Å
709	N	31.2	Very low	34.9	Very low	149 Å²	149	108.9 Å²	108.9	80%	0.797	62%	0.62	S	S	*	*			trans	-80.3	42.2	-160.8	-74.1	-17	0	0	0	116.1	V711	N709-V711 PolarHBondContact O-N 3.31Å
710	L	31.1	Very low	35.6	Very low	78 Å²	78	104.2 Å²	104.2	41%	0.408	59%	0.594	S	S	.	*			trans	-81.3	71.4	169.3	-140.5	174.6	0	0	0	109.3	S708 F712	S708-L710 PolarHBondContact O-N 2.86Å; L710-F712 HydrophobicContact CB-CE2 4.36Å; L710-F712 HydrophobicContact CD2-CD2 4.32Å; L710-F712 HydrophobicContact CD2-CE1 4.42Å; L710-F712 HydrophobicContact CD2-CE2 3.78Å; L710-F712 HydrophobicContact CD2-CZ 3.83Å; L710-F712 HydrophobicContact CG-CE2 4.48Å; L710-F712 WeakPolarHBondContact O-CD2 3.49Å; L710-F712 WeakPolarHBondContact O-CE2 3.42Å; L710-F712 PolarHBondContact O-N 3.44Å; L710-F712 VanDerWaalsContact O-N 3.12Å
711	V	32.5	Very low	36.4	Very low	125 Å²	125	100.7 Å²	100.7	76%	0.758	57%	0.569	S	S	*	*			trans	-70.6	105.5	-178.4	-177.3	0	0	0	0	109.7	N709	N709-V711 PolarHBondContact O-N 3.31Å
712	F	36.6	Very low	36.8	Very low	47 Å²	47	100.5 Å²	100.5	21%	0.206	55%	0.548	C	S	.	.			trans	-80.4	127	167.4	-60.5	-102.6	0	0	0	108.2	W563 K564 A593 R594 L710 K714	W563-F712 HydrophobicContact CH2-CB 4.42Å; W563-F712 HydrophobicContact CZ2-CB 4.08Å; K564-F712 VanDerWaalsContact NZ-CE2 3.34Å; A593-F712 HydrophobicContact CB-CD1 3.89Å; A593-F712 HydrophobicContact CB-CE1 4.43Å; R594-F712 HydrophobicContact CB-CE1 3.97Å; R594-F712 HydrophobicContact CB-CZ 4.36Å; R594-F712 WeakPolarHBondContact O-CE1 3.31Å; L710-F712 HydrophobicContact CB-CE2 4.36Å; L710-F712 HydrophobicContact CD2-CD2 4.32Å; L710-F712 HydrophobicContact CD2-CE1 4.42Å; L710-F712 HydrophobicContact CD2-CE2 3.78Å; L710-F712 HydrophobicContact CD2-CZ 3.83Å; L710-F712 HydrophobicContact CG-CE2 4.48Å; L710-F712 WeakPolarHBondContact O-CD2 3.49Å; L710-F712 WeakPolarHBondContact O-CE2 3.42Å; L710-F712 PolarHBondContact O-N 3.44Å; L710-F712 VanDerWaalsContact O-N 3.12Å; F712-K714 PolarHBondContact O-N 3.34Å
713	D	39.6	Very low	37.1	Very low	94 Å²	94	102.8 Å²	102.8	50%	0.503	54%	0.538	S	S	.	.			trans	-56.7	112.8	171.5	-84.4	-47.4	0	0	0	109.7	W563 R715	W563-D713 WeakPolarHBondContact CH2-O 3.22Å; W563-D713 WeakPolarHBondContact CZ2-O 3.46Å; D713-R715 PolarHBondContact O-N 3Å
714	K	38.9	Very low	36.9	Very low	167 Å²	167	103.4 Å²	103.4	73%	0.726	54%	0.544	S	S	*	.			trans	-66	100.9	175.1	-79.5	-169.4	175.3	-172.1	0	109.1	F712 K716	F712-K714 PolarHBondContact O-N 3.34Å; K714-K716 PolarHBondContact O-N 3.5Å
715	R	38.4	Very low	37	Very low	19 Å²	19	96.8 Å²	96.8	7%	0.072	52%	0.517	C	S	.	.			trans	-45.9	128.1	165.3	-170.9	172.6	-162.3	151.3	6.3	109.3	Y570 F587 D589 T591 D713 S717	Y570-R715 VanDerWaalsContact CG-NH1 3.25Å; F587-R715 VanDerWaalsContact CD1-NH1 3.27Å; D589-R715 IonicContact OD1-CZ 2.73Å; D589-R715 IonicContact OD1-NE 2.74Å; D589-R715 IonicContact OD1-NH2 3.13Å; D589-R715 PolarHBondContact OD1-NH2 2.79Å; D589-R715 IonicContact OD2-CZ 3.85Å; D589-R715 IonicContact OD2-NE 2.84Å; D589-R715 PolarHBondContact OD2-NE 3.38Å; D589-R715 IonicContact OD2-NH2 3.87Å; D589-R715 PolarHBondContact OD2-NH2 3.23Å; T591-R715 HydrophobicContact CG2-CB 4.16Å; T591-R715 HydrophobicContact CG2-CG 4.18Å; D713-R715 PolarHBondContact O-N 3Å; R715-S717 PolarHBondContact O-N 2.86Å; R715-S717 VanDerWaalsContact O-N 3.09Å
716	K	43.2	Very low	37.3	Very low	170 Å²	170	95.6 Å²	95.6	74%	0.739	50%	0.499	S	S	*	.			trans	-60.4	115.7	172.2	-72.8	-173.5	176.5	-175.6	0	107.1	K714 R718	K714-K716 PolarHBondContact O-N 3.5Å; K716-R718 VanDerWaalsContact C-N 3.34Å; K716-R718 PolarHBondContact O-N 2.76Å
717	S	44.5	Very low	37.4	Very low	59 Å²	59	97.2 Å²	97.2	41%	0.413	51%	0.505	S	S	.	.			trans	-68.8	92.5	-178.3	43.7	0	0	0	0	109.5	R715	R715-S717 PolarHBondContact O-N 2.86Å; R715-S717 VanDerWaalsContact O-N 3.09Å
718	R	48.5	Very low	37.6	Very low	51 Å²	51	94.2 Å²	94.2	19%	0.192	49%	0.494	C	S	.	.			trans	-55.5	125.4	178	-81.5	-175	170.4	-178.3	-15.8	110.1	E615 N620 Y622 K716	E615-R718 VanDerWaalsContact CD-CZ 3.47Å; E615-R718 IonicContact OE1-CZ 3.94Å; E615-R718 IonicContact OE1-NE 3.19Å; E615-R718 IonicContact OE1-NH1 3.81Å; E615-R718 PolarHBondContact OE1-NH1 2.85Å; E615-R718 VanDerWaalsContact OE1-NH1 3.11Å; E615-R718 IonicContact OE1-NH2 3.17Å; E615-R718 PolarHBondContact OE1-NH2 3.43Å; E615-R718 IonicContact OE2-CZ 2.72Å; E615-R718 IonicContact OE2-NH1 2.7Å; E615-R718 PolarHBondContact OE2-NH1 2.81Å; E615-R718 IonicContact OE2-NH2 2.75Å; E615-R718 PolarHBondContact OE2-NH2 3.14Å; N620-R718 HydrophobicContact CB-CG 4.35Å; N620-R718 VanDerWaalsContact O-CB 3.29Å; N620-R718 WeakPolarHBondContact O-CB 3.48Å; N620-R718 WeakPolarHBondContact O-CG 3.19Å; N620-R718 PolarHBondContact OD1-NE 2.82Å; N620-R718 PolarHBondContact OD1-NH2 2.93Å; Y622-R718 HydrophobicContact CD2-CB 3.78Å; Y622-R718 HydrophobicContact CE2-CB 3.87Å; Y622-R718 HydrophobicContact CE2-CG 4.32Å; Y622-R718 PolarHBondContact OH-NH1 3.04Å; K716-R718 VanDerWaalsContact C-N 3.34Å; K716-R718 PolarHBondContact O-N 2.76Å
719	P	40.7	Very low	37.5	Very low	71 Å²	71	94.9 Å²	94.9	46%	0.461	50%	0.496	S	S	.	.			trans	-51.7	143.6	178	-26	34	0	0	0	111.3	E621 Y622	E621-P719 WeakPolarHBondContact CA-O 3.26Å; E621-P719 HydrophobicContact CG-CB 4.15Å; Y622-P719 PolarHBondContact N-O 3.36Å
720	K	46.5	Very low	37.4	Very low	42 Å²	42	96.6 Å²	96.6	18%	0.183	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	112.1	177.6	-60.1	-147.1	166.7	48.4	0	109.8	Y570 Y622 Y722	Y570-K720 PolarHBondContact OH-NZ 2.96Å; Y622-K720 WeakPolarHBondContact O-CA 3.4Å; K720-Y722 HydrophobicContact CB-CD2 3.6Å; K720-Y722 HydrophobicContact CB-CE2 3.38Å; K720-Y722 HydrophobicContact CD-CE2 3.76Å; K720-Y722 WeakPolarHBondContact CD-OH 3.48Å; K720-Y722 HydrophobicContact CG-CE2 4.07Å; K720-Y722 PolarHBondContact O-N 3.41Å
721	V	43.8	Very low	37.3	Very low	47 Å²	47	101.4 Å²	101.4	29%	0.285	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	75.7	177.1	-174.3	0	0	0	0	108.5	E621 Y622 R723	E621-V721 WeakPolarHBondContact OE2-CG2 3.47Å; Y622-V721 PolarHBondContact O-N 2.88Å; V721-R723 PolarHBondContact O-N 2.83Å
722	Y	40.6	Very low	37.1	Very low	95 Å²	95	104.9 Å²	104.9	37%	0.373	53%	0.527	S	S	.	.			trans	-75.5	85.6	171	-73.2	-70	0	0	0	109.8	N568 K720 W726	N568-Y722 PolarHBondContact ND2-OH 2.79Å; N568-Y722 VanDerWaalsContact ND2-OH 3.11Å; N568-Y722 PolarHBondContact OD1-OH 3.28Å; K720-Y722 HydrophobicContact CB-CD2 3.6Å; K720-Y722 HydrophobicContact CB-CE2 3.38Å; K720-Y722 HydrophobicContact CD-CE2 3.76Å; K720-Y722 WeakPolarHBondContact CD-OH 3.48Å; K720-Y722 HydrophobicContact CG-CE2 4.07Å; K720-Y722 PolarHBondContact O-N 3.41Å; Y722-W726 AromaticContact CD1-NE1 3.76Å
723	R	37.7	Very low	36.7	Very low	171 Å²	171	110 Å²	110	65%	0.645	56%	0.556	S	S	*	*			trans	-61.9	150.5	160	-83.4	-171.2	169.7	-168.4	-1.6	109.8	V721 S725	V721-R723 PolarHBondContact O-N 2.83Å; R723-S725 PolarHBondContact O-N 2.92Å
724	S	33.9	Very low	36.1	Very low	123 Å²	123	112 Å²	112	86%	0.86	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	31.7	-166.4	59.5	0	0	0	0	115.1	W726	S724-W726 VanDerWaalsContact C-N 3.3Å; S724-W726 PolarHBondContact O-N 3.25Å
725	S	34.8	Very low	35.8	Very low	35 Å²	35	110.9 Å²	110.9	25%	0.245	58%	0.579	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77	-10.1	179.5	36	0	0	0	0	114.1	D625 R723 V727 T728	D625-S725 WeakPolarHBondContact OD2-CB 3.25Å; D625-S725 PolarHBondContact OD2-OG 3.24Å; R723-S725 PolarHBondContact O-N 2.92Å; S725-V727 PolarHBondContact O-N 3.22Å; S725-T728 PolarHBondContact O-N 2.84Å; S725-T728 VanDerWaalsContact O-N 3.09Å; S725-T728 PolarHBondContact O-OG1 3.34Å; S725-T728 VanDerWaalsContact O-OG1 3.14Å
726	W	32.8	Very low	35.4	Very low	99 Å²	99	115.9 Å²	115.9	38%	0.375	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.5	12.4	179.9	-72.9	89.6	0	0	0	116.5	E611 G624 Y722 S724	E611-W726 HydrophobicContact CB-CH2 4.27Å; G624-W726 WeakPolarHBondContact O-CZ2 3.37Å; Y722-W726 AromaticContact CD1-NE1 3.76Å; S724-W726 VanDerWaalsContact C-N 3.3Å; S724-W726 PolarHBondContact O-N 3.25Å
727	V	32.4	Very low	35.1	Very low	135 Å²	135	117.5 Å²	117.5	82%	0.818	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	51.4	165.7	-164	0	0	0	0	110.3	S725 P729	S725-V727 PolarHBondContact O-N 3.22Å; V727-P729 WeakPolarHBondContact O-CD 3.2Å
728	T	31.6	Very low	34.5	Very low	114 Å²	114	120.5 Å²	120.5	70%	0.699	63%	0.63	S	S	*	*			trans	-92.3	106.8	162.7	-57	0	0	0	0	109.3	S725 M730	S725-T728 PolarHBondContact O-N 2.84Å; S725-T728 VanDerWaalsContact O-N 3.09Å; S725-T728 PolarHBondContact O-OG1 3.34Å; S725-T728 VanDerWaalsContact O-OG1 3.14Å; T728-M730 PolarHBondContact O-N 3.37Å
729	P	28.1	Very low	33.9	Very low	101 Å²	101	124.4 Å²	124.4	66%	0.656	66%	0.655	S	S	*	*			trans	-68.6	127.7	177.9	27.7	-33.3	0	0	0	110.3	V727 K731	V727-P729 WeakPolarHBondContact O-CD 3.2Å; P729-K731 PolarHBondContact O-N 3.16Å
730	M	28.9	Very low	33.7	Very low	185 Å²	185	126.2 Å²	126.2	91%	0.911	66%	0.664	S	S	*	*	S	Bend	trans	-70.1	71.4	177.6	-170	-178.6	-178.8	0	0	111.4	T728	T728-M730 PolarHBondContact O-N 3.37Å
731	K	29.4	Very low	33.1	Very low	179 Å²	179	131 Å²	131	78%	0.778	69%	0.692	S	S	*	*			trans	-146.7	60.1	-178	-76	-162.4	172.4	-171.9	0	112.9	P729	P729-K731 PolarHBondContact O-N 3.16Å
732	Q	28.7	Very low	32.8	Very low	198 Å²	198	136 Å²	136	93%	0.925	72%	0.717	S	S	*	*			trans	-156.9	51.1	156.4	-122.2	157.5	85.1	0	0	113.2
733	L	27.2	Very low	32.5	Very low	155 Å²	155	139.5 Å²	139.5	81%	0.812	74%	0.737	S	S	*	*	S	Bend	trans	-117.1	142.6	154.1	-88.8	162	0	0	0	107.3
734	T	28.5	Very low	32.3	Very low	135 Å²	135	140.1 Å²	140.1	83%	0.828	75%	0.747	S	S	*	*			trans	64.2	103.7	-170.4	70.2	0	0	0	0	116
735	T	31.8	Very low	32	Very low	144 Å²	144	140 Å²	140	88%	0.883	74%	0.744	S	S	*	*				-158.6	128.6	121.6	-69.4	0	0	0	0	107.3
736	V	30.7	Very low	31.9	Very low	125 Å²	125	145.4 Å²	145.4	76%	0.758	77%	0.769	S	S	*	*			trans	-85.2	133.6	-177.6	172.3	0	0	0	0	110.2
737	K	35.7	Very low	31.8	Very low	203 Å²	203	146.6 Å²	146.6	88%	0.883	79%	0.788	S	S	*	*			trans	-161	142.3	137.7	-115.6	175.9	-177.7	-171.6	0	113
738	N	32	Very low	31.7	Very low	123 Å²	123	147.9 Å²	147.9	66%	0.658	79%	0.789	S	S	*	*			trans	-70.8	177.4	170.4	-38.5	-5.6	0	0	0	109.6
739	D	35.5	Very low	31.6	Very low	133 Å²	133	148.5 Å²	148.5	71%	0.711	80%	0.795	S	S	*	*			cis	-150.2	164.8	27.9	-81.3	-65	0	0	0	112
740	T	36.9	Very low	31.6	Very low	108 Å²	108	148.5 Å²	148.5	66%	0.663	80%	0.797	S	S	*	*			trans	41.9	120.3	152.7	56.2	0	0	0	0	120.6
741	D	34.7	Very low	31.7	Very low	142 Å²	142	148.4 Å²	148.4	76%	0.759	79%	0.792	S	S	*	*				50.2	133.6	115.8	-47.5	-47.4	0	0	0	118.6
742	D	36.7	Very low	31.8	Very low	153 Å²	153	148.5 Å²	148.5	82%	0.818	80%	0.8	S	S	*	*				-152.9	175	53	-135.8	-33.3	0	0	0	114.6
743	Q	34.2	Very low	31.7	Very low	168 Å²	168	144 Å²	144	79%	0.785	79%	0.786	S	S	*	*			trans	-82.1	139	-177.5	-57.3	170.4	10.8	0	0	112.7
744	H	34.1	Very low	31.7	Very low	184 Å²	184	144.2 Å²	144.2	85%	0.852	79%	0.787	S	S	*	*			trans	-170.5	140.3	135.6	-110.7	-71.5	0	0	0	113.3
745	C	27.2	Very low	31.8	Very low	120 Å²	120	142 Å²	142	81%	0.811	78%	0.777	S	S	*	*			trans	-77.8	131.1	175	-53.2	0	0	0	0	112.1
746	I	32.8	Very low	31.8	Very low	150 Å²	150	140.1 Å²	140.1	77%	0.769	77%	0.77	S	S	*	*			trans	-145.7	118.8	158.8	-87.6	116.1	0	0	0	111.1
747	T	30.3	Very low	31.7	Very low	124 Å²	124	141.5 Å²	141.5	76%	0.761	77%	0.768	S	S	*	*			trans	36.2	130.5	139	-40.5	0	0	0	0	122
748	L	30	Very low	31.7	Very low	162 Å²	162	140.3 Å²	140.3	85%	0.848	77%	0.77	S	S	*	*			trans	-61.9	141	166.3	-68.9	95.5	0	0	0	113.3
749	P	30.7	Very low	31.7	Very low	127 Å²	127	146 Å²	146	83%	0.825	78%	0.782	S	S	*	*			trans	-97.5	108.3	151.1	32.9	-26.5	0	0	0	110.9
750	S	28.5	Very low	31.6	Very low	101 Å²	101	148.9 Å²	148.9	71%	0.706	79%	0.788	S	S	*	*			trans	-71.3	153.3	163.3	65.3	0	0	0	0	111.2
751	K	30.7	Very low	31.3	Very low	182 Å²	182	155.1 Å²	155.1	79%	0.791	80%	0.8	S	S	*	*			trans	60.4	97.3	171.6	-61.8	177.8	177.7	174.9	0	116.4
752	L	30.9	Very low	31.2	Very low	182 Å²	182	160.3 Å²	160.3	95%	0.953	81%	0.81	S	S	*	*			trans	-90	92.3	144.6	-77.7	178	0	0	0	109.4
753	T	27.1	Very low	31	Very low	102 Å²	102	162.2 Å²	162.2	63%	0.626	81%	0.812	S	S	*	*			trans	-87.8	149.7	166.3	-32.2	0	0	0	0	108.9
754	L	27	Very low	30.9	Very low	161 Å²	161	161.4 Å²	161.4	84%	0.843	81%	0.812	S	S	*	*			trans	69.6	154.8	179.4	-59	138.9	0	0	0	112.5
755	S	30.8	Very low	31.1	Very low	88 Å²	88	162.1 Å²	162.1	62%	0.615	82%	0.816	S	S	*	*			cis	-144.4	149.2	31.6	179.1	0	0	0	0	114.8	H757	S755-H757 PolarHBondContact O-N 2.73Å
756	S	30.2	Very low	31.3	Very low	104 Å²	104	166.8 Å²	166.8	73%	0.727	82%	0.823	S	S	*	*			trans	-77.4	35.7	-179.8	52.6	0	0	0	0	113.8
757	H	30.4	Very low	31.4	Very low	155 Å²	155	169.2 Å²	169.2	72%	0.718	82%	0.823	S	S	*	*			trans	-125.5	34.4	-162.1	-82.8	16	0	0	0	116.3	S755	S755-H757 PolarHBondContact O-N 2.73Å
758	L	34.6	Very low	31.5	Very low	178 Å²	178	172.5 Å²	172.5	93%	0.932	82%	0.821	S	S	*	*			trans	-115.9	16	165.2	-73.3	177.7	0	0	0	114.9	K760	L758-K760 VanDerWaalsContact C-N 3.33Å; L758-K760 PolarHBondContact O-N 2.87Å
759	R	33.2	Very low	31.8	Very low	241 Å²	241	173.6 Å²	173.6	91%	0.909	82%	0.819	S	S	*	*	S	Bend	trans	-91.4	38.9	174.1	-154	-177.7	-171.1	-174.7	4.2	113.6
760	K	31.8	Very low	31.9	Very low	194 Å²	194	175.4 Å²	175.4	84%	0.843	82%	0.821	S	S	*	*	S	Bend	trans	-167.8	91.3	175.6	-104.4	166.7	-174	177	0	111.5	L758	L758-K760 VanDerWaalsContact C-N 3.33Å; L758-K760 PolarHBondContact O-N 2.87Å
761	R	31.9	Very low	32.2	Very low	240 Å²	240	175.2 Å²	175.2	91%	0.906	82%	0.817	S	S	*	*			trans	167.9	93.4	156.8	-96.2	164.6	-160.8	-163.1	7.1	109.5
762	Y	32.5	Very low	32.5	Very low	250 Å²	250	172.4 Å²	172.4	98%	0.98	82%	0.816	S	S	*	*	S	Bend	trans	175.2	50.9	150.6	-94.6	-59.3	0	0	0	110.2
763	K	32.1	Very low	32.6	Very low	194 Å²	194	169.4 Å²	169.4	84%	0.843	81%	0.805	S	S	*	*	S	Bend	trans	-141.3	143.5	165.3	-150	177.3	-175.8	-173.4	0	105.5
764	N	32	Very low	32.9	Very low	150 Å²	150	169.9 Å²	169.9	80%	0.802	81%	0.812	S	S	*	*			trans	71.1	88.7	-173.2	-50.8	-11.5	0	0	0	116
765	Q	37.9	Very low	33.5	Very low	200 Å²	200	168 Å²	168	94%	0.935	81%	0.808	S	S	*	*			trans	-163	37	134	-112.7	178.8	41.3	0	0	115
766	F	31.1	Very low	33.6	Very low	218 Å²	218	174.8 Å²	174.8	96%	0.956	82%	0.82	S	S	*	*			trans	-96.6	82.8	166.4	-107.7	-77.9	0	0	0	110.7
767	R	36.4	Very low	34	Very low	201 Å²	201	177.7 Å²	177.7	76%	0.758	83%	0.825	S	S	*	*			trans	-170.4	123	156.5	-109.6	172	-174.5	-166.2	2.5	114.5
768	R	32.7	Very low	34.2	Very low	192 Å²	192	177.6 Å²	177.6	73%	0.725	83%	0.83	S	S	*	*			trans	84.7	124.6	139.7	-71.4	166	175.7	176.8	-3.7	121.9
769	K	34.7	Very low	34.3	Very low	186 Å²	186	181.3 Å²	181.3	81%	0.809	83%	0.832	S	S	*	*			trans	82.9	106.2	153.4	-62	169.4	178.1	-172.5	0	116.9
770	L	33.2	Very low	34.4	Very low	164 Å²	164	174.8 Å²	174.8	86%	0.859	82%	0.823	S	S	*	*				65.2	143.1	70.1	-71.2	168.1	0	0	0	114.3
771	P	36.2	Very low	34.9	Very low	98 Å²	98	177.5 Å²	177.5	64%	0.636	83%	0.828	S	S	*	*			cis	-141.2	-165	-11.1	39.9	-19.4	0	0	0	115.1
772	T	35	Very low	35.1	Very low	123 Å²	123	172.5 Å²	172.5	76%	0.755	82%	0.819	S	S	*	*			trans	67.9	148.1	156	49.1	0	0	0	0	119.1
773	T	34.4	Very low	35.4	Very low	118 Å²	118	172 Å²	172	72%	0.724	82%	0.816	S	S	*	*			cis	-158.6	149.1	1	-1.3	0	0	0	0	113.3
774	S	34.1	Very low	35.8	Very low	112 Å²	112	168.1 Å²	168.1	78%	0.783	81%	0.813	S	S	*	*			trans	65.8	161.9	158	78.7	0	0	0	0	117.8
775	V	39.3	Very low	36.1	Very low	123 Å²	123	164.1 Å²	164.1	75%	0.745	81%	0.807	S	S	*	*			cis	-135.7	112.2	2.8	-179.2	0	0	0	0	107
776	R	31.9	Very low	36	Very low	229 Å²	229	160.3 Å²	160.3	86%	0.864	80%	0.803	S	S	*	*				55.3	108.5	91	-163	-171.4	-157.4	168.3	6.9	116.9
777	I	39.8	Very low	36.5	Very low	165 Å²	165	155.2 Å²	155.2	85%	0.846	79%	0.794	S	S	*	*			trans	-156.8	130.5	136.4	-99.5	150	0	0	0	108.1
778	N	32.7	Very low	36.5	Very low	154 Å²	154	150 Å²	150	82%	0.824	79%	0.788	S	S	*	*			trans	-108.5	148.5	170.4	-72.6	-14.9	0	0	0	108.8
779	R	38.4	Very low	36.7	Very low	255 Å²	255	149 Å²	149	96%	0.962	79%	0.792	S	S	*	*			trans	-150.2	137.7	148.3	-113.7	168.7	-171.5	173	2.9	110.7
780	S	35.4	Very low	36.7	Very low	104 Å²	104	145.7 Å²	145.7	73%	0.727	79%	0.791	S	S	*	*			trans	-124.2	158.2	-175.5	51.9	0	0	0	0	110.5
781	R	40.9	Very low	36.8	Very low	251 Å²	251	142.3 Å²	142.3	95%	0.947	78%	0.781	S	S	*	*			trans	-154.1	156.8	147.1	-121.5	171.6	-178.3	169.5	0.1	112.3
782	N	36.8	Very low	36.5	Very low	136 Å²	136	142.4 Å²	142.4	73%	0.727	78%	0.784	S	S	*	*			trans	-106.3	173.5	-156.3	-47.8	-22.7	0	0	0	112.5
783	R	39.5	Very low	36.5	Very low	240 Å²	240	144.6 Å²	144.6	91%	0.906	79%	0.79	S	S	*	*			trans	111.5	142.6	152.9	-67.2	179.3	174.1	-176.1	-3.4	116
784	S	39.3	Very low	36.3	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	78%	0.784	S	S	*	*			cis	-177	151.2	-24.9	44.4	0	0	0	0	110.9
785	G	37.8	Very low	36.4	Very low	65 Å²	65	145.7 Å²	145.7	67%	0.67	78%	0.784	S	S	*	*			trans	103	113.8	175	0	0	0	0	0	112.4
786	S	37.1	Very low	36.2	Very low	121 Å²	121	148 Å²	148	85%	0.846	78%	0.784	S	S	*	*				77.6	129.3	72.5	65.9	0	0	0	0	112.9
787	S	41.1	Very low	36.3	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	77%	0.772	S	S	*	*			cis	-164.7	-171.4	-13.2	56.7	0	0	0	0	106.1
788	S	36.1	Very low	35.8	Very low	92 Å²	92	145.3 Å²	145.3	64%	0.643	77%	0.769	S	S	*	*			cis	-157	171	-1.6	-10	0	0	0	0	105.4
789	E	36.3	Very low	36	Very low	171 Å²	171	146 Å²	146	80%	0.799	77%	0.771	S	S	*	*			cis	-163	166.7	-8.2	-122.4	170.1	148	0	0	108.1
790	C	34.5	Very low	35.5	Very low	117 Å²	117	138 Å²	138	79%	0.791	76%	0.755	S	S	*	*			trans	59.1	153.9	165.2	-66.3	0	0	0	0	119.2
791	S	35.2	Very low	35.3	Very low	93 Å²	93	139.1 Å²	139.1	65%	0.65	75%	0.753	S	S	*	*			cis	-177.3	111.6	-36.4	46.8	0	0	0	0	104.7
792	S	31.6	Very low	35.2	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	75%	0.745	S	S	*	*				73.7	141.5	61.5	84.4	0	0	0	0	114.8
793	L	33.7	Very low	35.1	Very low	169 Å²	169	136.4 Å²	136.4	89%	0.885	75%	0.748	S	S	*	*			trans	75	149.7	170.2	-53	167.1	0	0	0	117.8
794	A	30.5	Very low	34.8	Very low	73 Å²	73	128.9 Å²	128.9	60%	0.603	73%	0.732	S	S	*	*			cis	-174.2	178.9	-24.9	0	0	0	0	0	111.3
795	K	35.8	Very low	34.5	Very low	181 Å²	181	130 Å²	130	79%	0.787	73%	0.729	S	S	*	*			trans	89.5	116	149.7	-65.4	163.3	-175.1	168.3	0	120.2
796	K	34.8	Very low	34.5	Very low	172 Å²	172	134.1 Å²	134.1	75%	0.748	74%	0.736	S	S	*	*				72.2	153.6	124.9	-64.4	173.9	156.3	-149.1	0	118
797	Q	33.9	Very low	34.3	Very low	128 Å²	128	137.1 Å²	137.1	60%	0.598	74%	0.737	S	S	*	*			cis	-155.2	159	-7.4	-123.8	168	-94.8	0	0	111.6
798	R	30	Very low	34	Very low	209 Å²	209	138.6 Å²	138.6	79%	0.789	74%	0.736	S	S	*	*			trans	15	133.6	149.9	-66.7	176.4	168.3	166.7	-6.7	118.5
799	L	36.3	Very low	33.9	Very low	167 Å²	167	141.3 Å²	141.3	87%	0.874	74%	0.742	S	S	*	*				-157.9	161	70.5	-97.1	168.3	0	0	0	113.6
800	S	28.2	Very low	33.4	Very low	88 Å²	88	140.2 Å²	140.2	62%	0.615	74%	0.741	S	S	*	*			trans	-127.7	166.2	165.6	56.4	0	0	0	0	109.3
801	D	32	Very low	33.4	Very low	128 Å²	128	141 Å²	141	68%	0.684	74%	0.742	S	S	*	*			trans	148.9	173.2	137.3	-70.9	-3	0	0	0	111.6
802	L	37.8	Very low	33.1	Very low	150 Å²	150	145.4 Å²	145.4	79%	0.785	75%	0.753	S	S	*	*			trans	76.4	96.9	-174.4	-43.7	-179.5	0	0	0	113.7
803	F	35.2	Very low	33.4	Very low	180 Å²	180	145.5 Å²	145.5	79%	0.789	75%	0.751	S	S	*	*				71.7	139.1	62.1	-56	-48.1	0	0	0	113.1
804	S	33.2	Very low	33.2	Very low	82 Å²	82	146.6 Å²	146.6	57%	0.573	75%	0.754	S	S	*	*			cis	-167.1	157.6	-7.5	-115.2	0	0	0	0	111.3
805	D	33.5	Very low	33.2	Very low	134 Å²	134	148 Å²	148	72%	0.717	76%	0.759	S	S	*	*			trans	45.6	148	138.2	-44.2	-42.3	0	0	0	120.8
806	D	37.1	Very low	33	Very low	153 Å²	153	144.6 Å²	144.6	82%	0.818	75%	0.749	S	S	*	*			cis	-153.1	162.4	46.1	-97.1	-43.6	0	0	0	114.5
807	E	32.5	Very low	32.8	Very low	183 Å²	183	142.8 Å²	142.8	86%	0.855	74%	0.744	S	S	*	*			trans	-122.9	141.2	161.5	-74.7	-170.6	-174.8	0	0	110.5
808	N	36.5	Very low	32.6	Very low	142 Å²	142	138.5 Å²	138.5	76%	0.759	73%	0.726	S	S	*	*			trans	-173.9	153	162.1	-84.6	-47.9	0	0	0	109
809	L	32.9	Very low	32.9	Very low	148 Å²	148	133.1 Å²	133.1	78%	0.775	72%	0.718	S	S	*	*			cis	-159.3	175.6	-16.7	-115.3	169.9	0	0	0	109.5
810	L	27.3	Very low	32.7	Very low	148 Å²	148	130.9 Å²	130.9	78%	0.775	71%	0.711	S	S	*	*			trans	-94.5	155.6	178	-54.8	84.4	0	0	0	112.4
811	T	32.5	Very low	32.9	Very low	133 Å²	133	131.3 Å²	131.3	82%	0.816	71%	0.714	S	S	*	*				170.2	120.3	117	39.7	0	0	0	0	115.9
812	Q	30.4	Very low	32.9	Very low	187 Å²	187	134.3 Å²	134.3	87%	0.874	72%	0.721	S	S	*	*				49.8	161.7	129.8	-70.1	-92.3	-51	0	0	123.3
813	P	37.3	Very low	32.5	Very low	101 Å²	101	132.8 Å²	132.8	66%	0.656	72%	0.718	S	S	*	*			trans	-127.8	173.2	-152	44.2	-31.4	0	0	0	118.2
814	M	29	Very low	32.1	Very low	192 Å²	192	132 Å²	132	95%	0.946	72%	0.717	S	S	*	*			trans	-160.7	171.8	144.1	-118.9	-176	-67.3	0	0	112.8
815	S	31	Very low	31.9	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	73%	0.725	S	S	*	*			trans	-100.8	-174.8	-171	56.9	0	0	0	0	113.6
816	L	31.5	Very low	31.6	Very low	110 Å²	110	132.7 Å²	132.7	58%	0.576	73%	0.727	S	S	*	*			cis	-168.5	168.6	20.6	-142.4	162.2	0	0	0	110.7	L102	L102-L816 HydrophobicContact CB-CD2 3.43Å; L102-L816 VanDerWaalsContact CB-CD2 3.43Å; L102-L816 HydrophobicContact CD1-CD2 3.63Å; L102-L816 HydrophobicContact CG-CD2 4.17Å
817	Q	30.6	Very low	31.1	Very low	134 Å²	134	136.2 Å²	136.2	63%	0.626	73%	0.731	S	S	*	*			trans	101.5	151.3	146.4	-139.6	163.3	39.3	0	0	120.9	D103 C104	D103-Q817 CarbonylContact O-C 3.54Å; D103-Q817 VanDerWaalsContact O-O 3.08Å; C104-Q817 PolarHBondContact SG-O 3.04Å
818	T	30.9	Very low	31	Very low	38 Å²	38	137 Å²	137	23%	0.233	73%	0.731	C	S	.	*			trans	-141.4	-162.3	-152.3	-14.3	0	0	0	0	111.4	L102 D103	L102-T818 WeakPolarHBondContact CA-OG1 3.47Å; L102-T818 VanDerWaalsContact CD2-OG1 3.3Å; L102-T818 WeakPolarHBondContact CD2-OG1 3.2Å; D103-T818 HydrophobicContact CB-CG2 3.83Å; D103-T818 WeakPolarHBondContact O-CB 3.48Å; D103-T818 WeakPolarHBondContact O-CG2 3.46Å; D103-T818 PolarHBondContact O-OG1 2.92Å
819	P	35.2	Very low	30.6	Very low	96 Å²	96	139.6 Å²	139.6	62%	0.623	74%	0.736	S	S	*	*			cis	-142.8	177.2	-11.5	36.7	-14.5	0	0	0	118.7
820	V	32.8	Very low	30.5	Very low	120 Å²	120	139.8 Å²	139.8	73%	0.727	74%	0.737	S	S	*	*			trans	62.8	157.4	161.2	-121.9	0	0	0	0	117
821	S	31.8	Very low	30.4	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	74%	0.738	S	S	*	*			cis	-151.7	161.4	16.5	-53.8	0	0	0	0	115.7
822	K	31.2	Very low	30.2	Very low	192 Å²	192	138 Å²	138	84%	0.835	73%	0.732	S	S	*	*			trans	26	144.1	138.5	-53.2	-179.9	-179.5	-172.9	0	119.4
823	T	30.2	Very low	30	Very low	117 Å²	117	136.6 Å²	136.6	72%	0.718	73%	0.73	S	S	*	*				-162.6	172.6	55.9	-59.9	0	0	0	0	112.6
824	E	27.4	Very low	29.7	Very low	163 Å²	163	139.2 Å²	139.2	76%	0.762	73%	0.734	S	S	*	*			trans	-46.7	158.7	176.1	-50.6	151.1	116.8	0	0	115.3
825	T	27.4	Very low	29.7	Very low	121 Å²	121	138.2 Å²	138.2	74%	0.742	73%	0.73	S	S	*	*				-176.8	161.2	69.7	36.9	0	0	0	0	114.1
826	S	29	Very low	29.7	Very low	110 Å²	110	139.7 Å²	139.7	77%	0.769	74%	0.735	S	S	*	*			trans	82	131.7	147.1	80.2	0	0	0	0	121.6
827	Y	25.2	Very low	29.6	Very low	228 Å²	228	139.2 Å²	139.2	89%	0.894	74%	0.74	S	S	*	*			trans	-57.2	135.1	175.5	-54.2	-97.3	0	0	0	115
828	K	30.5	Very low	29.5	Very low	198 Å²	198	141.7 Å²	141.7	86%	0.861	75%	0.749	S	S	*	*			trans	-145.8	110	139.9	-131	166.3	-171	170.9	0	113.8	N830	K828-N830 PolarHBondContact O-N 3.05Å
829	K	27.7	Very low	29.4	Very low	197 Å²	197	149.4 Å²	149.4	86%	0.857	77%	0.774	S	S	*	*			trans	-56.3	114.1	171.3	176.6	-176.6	-178.2	179.4	0	110.1
830	N	31.1	Very low	29	Very low	152 Å²	152	151.9 Å²	151.9	81%	0.813	78%	0.781	S	S	*	*			trans	-139.1	141.1	171.7	-103.6	-18.9	0	0	0	110.7	K828	K828-N830 PolarHBondContact O-N 3.05Å
831	N	26.4	Very low	28.7	Very low	147 Å²	147	154.9 Å²	154.9	79%	0.786	79%	0.787	S	S	*	*			trans	-77.8	139.7	-171.6	-55	-40.4	0	0	0	112.1
832	S	28.5	Very low	28.3	Very low	98 Å²	98	153.8 Å²	153.8	69%	0.685	78%	0.779	S	S	*	*			trans	-155.5	99.7	151.1	-168.5	0	0	0	0	111.5	Q834	S832-Q834 PolarHBondContact O-N 3.48Å
833	N	26.1	Very low	28.1	Very low	157 Å²	157	149.6 Å²	149.6	84%	0.84	77%	0.774	S	S	*	*			trans	-79.3	100.3	174.9	-60.8	-42	0	0	0	109.3
834	Q	30	Very low	28.1	Very low	156 Å²	156	149 Å²	149	73%	0.729	77%	0.772	S	S	*	*			trans	-153	31.5	178.3	-131.5	166.5	111.4	0	0	120.3	S832	S832-Q834 PolarHBondContact O-N 3.48Å
835	I	29.7	Very low	28.2	Very low	171 Å²	171	144.9 Å²	144.9	88%	0.877	76%	0.761	S	S	*	*	S	Bend	trans	-119.9	31.8	149.5	-35.2	-177.4	0	0	0	111.5
836	V	30.3	Very low	28.6	Very low	133 Å²	133	144.5 Å²	144.5	81%	0.806	76%	0.761	S	S	*	*	S	Bend	trans	-105.3	65.5	147.8	-174.9	0	0	0	0	106.2	K838	V836-K838 PolarHBondContact O-N 3.29Å
837	S	30.1	Very low	28.8	Very low	99 Å²	99	148.1 Å²	148.1	69%	0.692	76%	0.763	S	S	*	*			trans	-74.3	110.4	-178.2	-165	0	0	0	0	109.2	R839	S837-R839 PolarHBondContact O-N 3.1Å
838	K	28	Very low	29.4	Very low	187 Å²	187	140.6 Å²	140.6	81%	0.813	74%	0.743	S	S	*	*			trans	-65.4	92	-177.8	-66.3	175.4	178.6	177.4	0	110.5	V836	V836-K838 PolarHBondContact O-N 3.29Å
839	R	28.2	Very low	29.8	Very low	199 Å²	199	142.6 Å²	142.6	75%	0.751	75%	0.745	S	S	*	*			trans	-110.4	38	159	-162.4	171.7	-90.2	-175	-4.6	112.3	S837 Q841	S837-R839 PolarHBondContact O-N 3.1Å; R839-Q841 PolarHBondContact O-N 3.04Å
840	I	27.5	Very low	30.5	Very low	149 Å²	149	135.1 Å²	135.1	76%	0.764	72%	0.724	S	S	*	*			trans	-55.7	130.7	139.5	-52.7	175	0	0	0	105.3
841	Q	26.5	Very low	32	Very low	183 Å²	183	129.7 Å²	129.7	86%	0.855	70%	0.698	S	S	*	*	S	Bend	trans	72.3	63.4	-170.2	-51.3	177.8	-2.7	0	0	116.2	R839	R839-Q841 PolarHBondContact O-N 3.04Å
842	S	24.5	Very low	34	Very low	72 Å²	72	127.2 Å²	127.2	50%	0.503	68%	0.684	S	S	.	*			trans	-149.3	107.3	132.8	-54.6	0	0	0	0	108.8
843	S	25.5	Very low	36.1	Very low	105 Å²	105	124.6 Å²	124.6	73%	0.734	67%	0.673	S	S	*	*			trans	-66.1	136.2	163.1	47.7	0	0	0	0	108.5	S845	S843-S845 PolarHBondContact O-N 3.21Å
844	P	30	Very low	38.6	Very low	103 Å²	103	122.1 Å²	122.1	67%	0.669	66%	0.659	S	S	*	*			trans	-69.5	87.6	169.8	28.9	-32.6	0	0	0	107.9
845	S	30.3	Very low	41.2	Very low	78 Å²	78	114.8 Å²	114.8	55%	0.545	63%	0.625	S	S	.	*			trans	-57.1	130.6	-179.6	71.1	0	0	0	0	109	S843 K847	S843-S845 PolarHBondContact O-N 3.21Å; S845-K847 PolarHBondContact O-N 3.13Å
846	P	35.8	Very low	43.8	Very low	113 Å²	113	114.1 Å²	114.1	73%	0.734	61%	0.611	S	S	*	*	S	Bend	trans	-76.5	63.9	-170.9	30.7	-36.8	0	0	0	111.5
847	K	32.9	Very low	46.3	Very low	186 Å²	186	110.8 Å²	110.8	81%	0.809	59%	0.593	S	S	*	*			trans	-141.8	38.7	-167.4	-65.7	-167.9	176.5	-178.3	0	113	S845	S845-K847 PolarHBondContact O-N 3.13Å
848	S	38.6	Very low	49	Very low	69 Å²	69	106.4 Å²	106.4	48%	0.483	56%	0.562	S	S	.	*			trans	-110	118.3	159.4	179.2	0	0	0	0	109.5	G850 S851	S848-G850 PolarHBondContact O-N 3.05Å; S848-G850 PolarHBondContact OG-N 3.08Å; S848-S851 PolarHBondContact O-N 3.37Å; S848-S851 PolarHBondContact O-OG 3.29Å
849	R	38.6	Very low	51.7	Low	240 Å²	240	97.6 Å²	97.6	91%	0.906	52%	0.524	S	S	*	.	H	α-helix	trans	-62	-18.5	169.7	-88.2	-179	166.7	176.1	-4.7	112.4
850	G	43	Very low	54.4	Low	40 Å²	40	95.4 Å²	95.4	41%	0.412	52%	0.522	S	S	.	.	H	α-helix	trans	-71.7	-36.6	176.7	0	0	0	0	0	114	S848 I852 G853 L854	S848-G850 PolarHBondContact O-N 3.05Å; S848-G850 PolarHBondContact OG-N 3.08Å; G850-I852 PolarHBondContact O-N 2.93Å; G850-G853 PolarHBondContact O-N 3.48Å; G850-G853 VanDerWaalsContact O-N 3.13Å; G850-L854 PolarHBondContact O-N 3.12Å
851	S	60.7	Low	57.1	Low	38 Å²	38	92.9 Å²	92.9	27%	0.266	51%	0.51	S	S	.	.	H	α-helix	trans	-66.3	-38.2	-176.9	60	0	0	0	0	112.2	S848 G853 L854 L855	S848-S851 PolarHBondContact O-N 3.37Å; S848-S851 PolarHBondContact O-OG 3.29Å; S851-G853 VanDerWaalsContact C-N 3.3Å; S851-G853 PolarHBondContact O-N 2.98Å; S851-L854 PolarHBondContact O-N 3.01Å; S851-L855 WeakPolarHBondContact O-CB 3.31Å; S851-L855 WeakPolarHBondContact O-CG 3.37Å; S851-L855 PolarHBondContact O-N 3.29Å
852	I	68.6	Low	59.8	Low	95 Å²	95	85.2 Å²	85.2	49%	0.487	48%	0.475	S	S	.	.	H	α-helix	trans	-65.4	-34.4	174.7	-56.6	175.7	0	0	0	111.2	G850 R856	G850-I852 PolarHBondContact O-N 2.93Å; I852-R856 VanDerWaalsContact O-CB 3.3Å; I852-R856 WeakPolarHBondContact O-CB 3.43Å; I852-R856 PolarHBondContact O-N 3.45Å
853	G	74.1	Confident	62.6	Low	44 Å²	44	87.1 Å²	87.1	45%	0.454	48%	0.48	S	S	.	.	H	α-helix	trans	-65.8	-46.3	174.2	0	0	0	0	0	112.4	G850 S851 R856 S857	G850-G853 PolarHBondContact O-N 3.48Å; G850-G853 VanDerWaalsContact O-N 3.13Å; S851-G853 VanDerWaalsContact C-N 3.3Å; S851-G853 PolarHBondContact O-N 2.98Å; G853-R856 PolarHBondContact O-N 3.19Å; G853-S857 PolarHBondContact O-N 3.2Å; G853-S857 VanDerWaalsContact O-N 3.13Å
854	L	78.5	Confident	65.5	Low	104 Å²	104	82.7 Å²	82.7	55%	0.545	45%	0.448	S	S	.	.	H	α-helix	trans	-63.1	-52.3	174.3	-68.9	170.4	0	0	0	111.2	G850 S851 R856 S857 L858	G850-L854 PolarHBondContact O-N 3.12Å; S851-L854 PolarHBondContact O-N 3.01Å; L854-R856 VanDerWaalsContact C-N 3.27Å; L854-R856 PolarHBondContact O-N 2.76Å; L854-S857 WeakPolarHBondContact O-CA 3.31Å; L854-S857 WeakPolarHBondContact O-CB 3.23Å; L854-S857 PolarHBondContact O-N 3.3Å; L854-L858 VanDerWaalsContact O-CG 3.26Å; L854-L858 WeakPolarHBondContact O-CG 3.32Å; L854-L858 PolarHBondContact O-N 2.79Å
855	L	83.2	Confident	68.2	Low	3 Å²	3	80.8 Å²	80.8	2%	0.016	44%	0.435	C	S	.	.	H	α-helix	trans	-51.5	-44.5	176	-83.1	172.7	0	0	0	112.2	S851 S857 L858 S859 I866 P867 P869 A903	S851-L855 WeakPolarHBondContact O-CB 3.31Å; S851-L855 WeakPolarHBondContact O-CG 3.37Å; S851-L855 PolarHBondContact O-N 3.29Å; L855-S857 PolarHBondContact O-N 3.46Å; L855-L858 PolarHBondContact O-N 2.97Å; L855-S859 WeakPolarHBondContact O-CB 3.5Å; L855-S859 PolarHBondContact O-N 3.14Å; L855-S859 PolarHBondContact O-OG 3.09Å; L855-I866 HydrophobicContact CB-CG2 4.45Å; L855-P867 HydrophobicContact CD2-CG 4.3Å; L855-P869 HydrophobicContact CD1-CB 3.9Å; L855-A903 HydrophobicContact CD2-CB 3.59Å; L855-A903 HydrophobicContact CG-CB 3.92Å
856	R	84	Confident	70.9	Confident	157 Å²	157	80.9 Å²	80.9	59%	0.592	43%	0.429	S	S	*	.	H	α-helix	trans	-62.1	-42.3	176.5	-176.2	178.7	-61.6	173.7	0.9	112.4	I852 G853 L854 H860 I866	I852-R856 VanDerWaalsContact O-CB 3.3Å; I852-R856 WeakPolarHBondContact O-CB 3.43Å; I852-R856 PolarHBondContact O-N 3.45Å; G853-R856 PolarHBondContact O-N 3.19Å; L854-R856 VanDerWaalsContact C-N 3.27Å; L854-R856 PolarHBondContact O-N 2.76Å; R856-H860 WeakPolarHBondContact O-CB 3.27Å; R856-H860 PolarHBondContact O-N 2.83Å; R856-I866 HydrophobicContact CB-CD1 4.13Å; R856-I866 HydrophobicContact CG-CD1 3.98Å
857	S	83.9	Confident	73.3	Confident	62 Å²	62	75.8 Å²	75.8	43%	0.434	40%	0.396	S	S	.	.	H	α-helix	trans	-67.1	-43.5	177.3	-164	0	0	0	0	112.1	G853 L854 L855 H860 N861	G853-S857 PolarHBondContact O-N 3.2Å; G853-S857 VanDerWaalsContact O-N 3.13Å; L854-S857 WeakPolarHBondContact O-CA 3.31Å; L854-S857 WeakPolarHBondContact O-CB 3.23Å; L854-S857 PolarHBondContact O-N 3.3Å; L855-S857 PolarHBondContact O-N 3.46Å; S857-H860 PolarHBondContact O-N 3.34Å; S857-N861 WeakPolarHBondContact O-CB 3.12Å; S857-N861 PolarHBondContact O-N 3Å; S857-N861 PolarHBondContact O-OD1 3.49Å
858	L	85.9	Confident	75.8	Confident	7 Å²	7	67.9 Å²	67.9	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-65.4	-43.3	178.7	-63.8	166.9	0	0	0	111	L854 L855 H860 N861 L862 L896 Q899 L900 A903	L854-L858 VanDerWaalsContact O-CG 3.26Å; L854-L858 WeakPolarHBondContact O-CG 3.32Å; L854-L858 PolarHBondContact O-N 2.79Å; L855-L858 PolarHBondContact O-N 2.97Å; L858-H860 VanDerWaalsContact C-N 3.35Å; L858-H860 PolarHBondContact O-N 3.4Å; L858-N861 PolarHBondContact O-N 3.1Å; L858-L862 WeakPolarHBondContact O-CB 3.35Å; L858-L862 PolarHBondContact O-N 3.2Å; L858-L896 HydrophobicContact CD2-CD1 3.59Å; L858-Q899 HydrophobicContact CD1-CB 4.02Å; L858-Q899 WeakPolarHBondContact CD1-O 3.5Å; L858-Q899 HydrophobicContact CD2-CB 3.64Å; L858-Q899 HydrophobicContact CG-CB 4.5Å; L858-L900 HydrophobicContact CB-CD1 4.4Å; L858-A903 HydrophobicContact CD1-CB 3.74Å
859	S	85.7	Confident	77.9	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.014	36%	0.357	C	S	.	.	H	α-helix	trans	-64	-39.9	177.6	-55.6	0	0	0	0	112	L855 N863 I864 P867	L855-S859 WeakPolarHBondContact O-CB 3.5Å; L855-S859 PolarHBondContact O-N 3.14Å; L855-S859 PolarHBondContact O-OG 3.09Å; S859-N863 PolarHBondContact O-N 3.2Å; S859-N863 VanDerWaalsContact O-N 3.07Å; S859-I864 WeakPolarHBondContact CB-O 3.32Å; S859-I864 PolarHBondContact O-N 3.47Å; S859-P867 WeakPolarHBondContact OG-CD 3.22Å
860	H	84.1	Confident	80.1	Confident	154 Å²	154	59.2 Å²	59.2	71%	0.713	34%	0.336	S	S	*	.	H	α-helix	trans	-63.4	-48	173.5	-177.6	-81.7	0	0	0	111.5	R856 S857 L858 L862 N863	R856-H860 WeakPolarHBondContact O-CB 3.27Å; R856-H860 PolarHBondContact O-N 2.83Å; S857-H860 PolarHBondContact O-N 3.34Å; L858-H860 VanDerWaalsContact C-N 3.35Å; L858-H860 PolarHBondContact O-N 3.4Å; H860-L862 VanDerWaalsContact C-N 3.29Å; H860-L862 PolarHBondContact O-N 3.46Å; H860-N863 PolarHBondContact O-N 3.23Å
861	N	84.9	Confident	82.2	Confident	95 Å²	95	57.8 Å²	57.8	51%	0.508	32%	0.319	S	S	.	.	H	α-helix	trans	-65.8	-29.2	-179.3	-67.7	-0.6	0	0	0	113.2	S857 L858 L896	S857-N861 WeakPolarHBondContact O-CB 3.12Å; S857-N861 PolarHBondContact O-N 3Å; S857-N861 PolarHBondContact O-OD1 3.49Å; L858-N861 PolarHBondContact O-N 3.1Å; N861-L896 HydrophobicContact CB-CD1 3.91Å; N861-L896 HydrophobicContact CB-CD2 3.94Å
862	L	82.2	Confident	83.5	Confident	22 Å²	22	56 Å²	56	12%	0.115	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	3.9	178.1	-68.3	171.4	0	0	0	113.9	L858 H860 I864 I892 L896 L900	L858-L862 WeakPolarHBondContact O-CB 3.35Å; L858-L862 PolarHBondContact O-N 3.2Å; H860-L862 VanDerWaalsContact C-N 3.29Å; H860-L862 PolarHBondContact O-N 3.46Å; L862-I864 VanDerWaalsContact C-N 3.29Å; L862-I864 HydrophobicContact CB-CD1 4.32Å; L862-I864 HydrophobicContact CB-CG1 4.16Å; L862-I864 PolarHBondContact O-N 3.15Å; L862-I892 HydrophobicContact CD2-CG2 3.84Å; L862-L896 HydrophobicContact CD1-CG 4.26Å; L862-L896 HydrophobicContact CD2-CD2 3.51Å; L862-L896 HydrophobicContact CD2-CG 3.97Å; L862-L896 HydrophobicContact CG-CD2 3.79Å; L862-L896 HydrophobicContact CG-CG 3.97Å; L862-L900 HydrophobicContact CD1-CB 4.02Å; L862-L900 HydrophobicContact CD1-CD2 3.67Å; L862-L900 HydrophobicContact CD1-CG 4.27Å
863	N	84.4	Confident	84.1	Confident	112 Å²	112	56 Å²	56	60%	0.599	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	47.4	-176.4	-166	13.4	0	0	0	113	S859 H860	S859-N863 PolarHBondContact O-N 3.2Å; S859-N863 VanDerWaalsContact O-N 3.07Å; H860-N863 PolarHBondContact O-N 3.23Å
864	I	86.7	Confident	84.1	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.067	29%	0.29	C	S	.	.			trans	-117.6	151	174.3	58.4	176.5	0	0	0	110.5	S859 L862 L900 L975 C978 R979	S859-I864 WeakPolarHBondContact CB-O 3.32Å; S859-I864 PolarHBondContact O-N 3.47Å; L862-I864 VanDerWaalsContact C-N 3.29Å; L862-I864 HydrophobicContact CB-CD1 4.32Å; L862-I864 HydrophobicContact CB-CG1 4.16Å; L862-I864 PolarHBondContact O-N 3.15Å; I864-L900 HydrophobicContact CD1-CD1 3.94Å; I864-L900 HydrophobicContact CD1-CD2 3.79Å; I864-L975 HydrophobicContact CG2-CD2 4.26Å; I864-C978 HydrophobicContact CD1-CB 4.06Å; I864-R979 HydrophobicContact CG2-CG 4.31Å
865	P	86.1	Confident	84.2	Confident	62 Å²	62	50 Å²	50	40%	0.403	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-63.2	152.7	166.3	32	-38.3	0	0	0	110.1	P867 R979 A982	P865-P867 VanDerWaalsContact O-CD 3.26Å; P865-P867 WeakPolarHBondContact O-CD 3.13Å; P865-R979 HydrophobicContact CG-CG 4.3Å; P865-A982 HydrophobicContact CB-CB 3.67Å; P865-A982 HydrophobicContact CG-CB 3.61Å
866	I	86.5	Confident	84.1	Confident	81 Å²	81	50 Å²	50	42%	0.415	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-68.2	116.8	-176.6	-55.1	174.8	0	0	0	109.6	L855 R856 A982	L855-I866 HydrophobicContact CB-CG2 4.45Å; R856-I866 HydrophobicContact CB-CD1 4.13Å; R856-I866 HydrophobicContact CG-CD1 3.98Å; I866-A982 VanDerWaalsContact O-CB 3.26Å; I866-A982 WeakPolarHBondContact O-CB 3.31Å
867	P	87.5	Confident	84.1	Confident	6 Å²	6	42.5 Å²	42.5	4%	0.039	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-81.4	167.6	178.2	34.7	-35.2	0	0	0	112	L855 S859 P865 V871 C904 C978	L855-P867 HydrophobicContact CD2-CG 4.3Å; S859-P867 WeakPolarHBondContact OG-CD 3.22Å; P865-P867 VanDerWaalsContact O-CD 3.26Å; P865-P867 WeakPolarHBondContact O-CD 3.13Å; P867-V871 HydrophobicContact CB-CG2 3.84Å; P867-C904 VanDerWaalsContact CG-SG 3.54Å; P867-C978 HydrophobicContact CB-CB 3.9Å; P867-C978 HydrophobicContact CG-CB 4.13Å
868	S	83.9	Confident	83.8	Confident	20 Å²	20	39.7 Å²	39.7	14%	0.14	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-57.9	142.8	164	179.2	0	0	0	0	111.2	T870 V871 D981	S868-T870 PolarHBondContact O-N 3.43Å; S868-T870 PolarHBondContact OG-N 3Å; S868-T870 PolarHBondContact OG-OG1 3.5Å; S868-V871 PolarHBondContact O-N 3.1Å; S868-D981 WeakPolarHBondContact CB-OD2 3.32Å; S868-D981 PolarHBondContact N-OD2 2.84Å
869	P	84.5	Confident	83.5	Confident	52 Å²	52	39.9 Å²	39.9	34%	0.338	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	11.2	169.8	30.1	-37.3	0	0	0	114.3	L855 C904 G905	L855-P869 HydrophobicContact CD1-CB 3.9Å; P869-C904 CarbonylContact C-O 3.35Å; P869-C904 CarbonylContact O-C 3.54Å; P869-C904 VanDerWaalsContact O-C 3.25Å; P869-G905 PolarHBondContact O-N 3.42Å
870	T	84.4	Confident	82.6	Confident	75 Å²	75	40.4 Å²	40.4	46%	0.46	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	7.6	-178	66.7	0	0	0	0	114.7	S868 F872 H873 C904	S868-T870 PolarHBondContact O-N 3.43Å; S868-T870 PolarHBondContact OG-N 3Å; S868-T870 PolarHBondContact OG-OG1 3.5Å; T870-F872 VanDerWaalsContact C-N 3.26Å; T870-F872 PolarHBondContact O-N 3.39Å; T870-H873 VanDerWaalsContact O-CB 3.27Å; T870-H873 WeakPolarHBondContact O-CB 3.31Å; T870-H873 PolarHBondContact O-N 3.13Å; T870-C904 CarbonylContact C-O 3.59Å; T870-C904 VanDerWaalsContact C-O 3.3Å; T870-C904 WeakPolarHBondContact CA-O 3.49Å
871	V	86.4	Confident	81.4	Confident	9 Å²	9	33.8 Å²	33.8	6%	0.055	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-39.9	-176.5	170.5	0	0	0	0	113	P867 S868 C904 D981 P998	P867-V871 HydrophobicContact CB-CG2 3.84Å; S868-V871 PolarHBondContact O-N 3.1Å; V871-C904 HydrophobicContact CB-CB 4.4Å; V871-C904 PolarHBondContact N-O 3.09Å; V871-C904 VanDerWaalsContact N-O 3.16Å; V871-D981 HydrophobicContact CG2-CB 3.54Å; V871-D981 WeakPolarHBondContact CG2-OD2 3.21Å; V871-P998 HydrophobicContact CG1-CG 4.12Å; V871-P998 WeakPolarHBondContact O-CD 3.29Å; V871-P998 VanDerWaalsContact O-CG 3.3Å; V871-P998 WeakPolarHBondContact O-CG 3.19Å
872	F	87.1	Confident	79.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	20	178.2	-60.8	-61.4	0	0	0	112.5	T870 G874 W875 I877 C904 G906 L974 P998	T870-F872 VanDerWaalsContact C-N 3.26Å; T870-F872 PolarHBondContact O-N 3.39Å; F872-G874 PolarHBondContact O-N 2.87Å; F872-W875 HydrophobicContact CB-CB 4.28Å; F872-W875 WeakPolarHBondContact O-CB 3.39Å; F872-W875 PolarHBondContact O-N 3.42Å; F872-I877 HydrophobicContact CB-CD1 4.19Å; F872-I877 HydrophobicContact CD1-CD1 3.7Å; F872-I877 HydrophobicContact CD2-CD1 4.36Å; F872-I877 HydrophobicContact CE1-CD1 4.19Å; F872-I877 HydrophobicContact CG-CD1 3.82Å; F872-C904 HydrophobicContact CD2-CB 3.7Å; F872-C904 HydrophobicContact CE2-CB 4.29Å; F872-C904 PolarHBondContact N-O 3.42Å; F872-G906 WeakPolarHBondContact O-CA 3.33Å; F872-L974 HydrophobicContact CD1-CD2 4.44Å; F872-L974 HydrophobicContact CE1-CD2 3.67Å; F872-L974 HydrophobicContact CE2-CD2 4.24Å; F872-L974 HydrophobicContact CZ-CB 4.14Å; F872-L974 HydrophobicContact CZ-CD2 3.57Å; F872-L974 HydrophobicContact CZ-CG 4.49Å; F872-P998 HydrophobicContact CD1-CB 4.28Å; F872-P998 HydrophobicContact CD1-CG 3.57Å; F872-P998 HydrophobicContact CE1-CB 4.15Å; F872-P998 HydrophobicContact CE1-CG 3.57Å
873	H	82.4	Confident	77.5	Confident	97 Å²	97	30.5 Å²	30.5	45%	0.449	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	124.6	179.2	-166.7	56.8	0	0	0	111.3	T870 G905	T870-H873 VanDerWaalsContact O-CB 3.27Å; T870-H873 WeakPolarHBondContact O-CB 3.31Å; T870-H873 PolarHBondContact O-N 3.13Å; H873-G905 WeakPolarHBondContact CA-O 3.47Å
874	G	73.2	Confident	75.4	Confident	15 Å²	15	31.9 Å²	31.9	16%	0.155	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-3.1	-173.6	0	0	0	0	0	115.2	F872 H941 F942	F872-G874 PolarHBondContact O-N 2.87Å; G874-H941 CarbonylContact O-C 3.59Å; G874-H941 VanDerWaalsContact O-CA 3.25Å; G874-H941 WeakPolarHBondContact O-CA 3.34Å; G874-H941 PolarHBondContact O-CD2 3.41Å; G874-F942 PolarHBondContact O-N 3.46Å
875	W	81.8	Confident	73.1	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.019	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.7	176.3	-68.5	82.7	0	0	0	112	F872 I877 G906 E907 F942 A944 W973 N996 P998 L999 L1002	F872-W875 HydrophobicContact CB-CB 4.28Å; F872-W875 WeakPolarHBondContact O-CB 3.39Å; F872-W875 PolarHBondContact O-N 3.42Å; W875-I877 HydrophobicContact CB-CD1 4.36Å; W875-I877 HydrophobicContact CB-CG1 4.39Å; W875-G906 WeakPolarHBondContact O-CA 3.44Å; W875-E907 PolarHBondContact O-N 2.97Å; W875-F942 WeakPolarHBondContact CA-O 3.06Å; W875-F942 HydrophobicContact CD2-CB 3.53Å; W875-F942 HydrophobicContact CD2-CD2 4.41Å; W875-F942 HydrophobicContact CD2-CG 4.2Å; W875-F942 HydrophobicContact CE3-CB 3.42Å; W875-F942 VanDerWaalsContact CE3-CB 3.42Å; W875-F942 HydrophobicContact CE3-CG 4.36Å; W875-F942 HydrophobicContact CG-CB 4.12Å; W875-F942 HydrophobicContact CH2-CB 4.06Å; W875-F942 HydrophobicContact CH2-CD1 4.42Å; W875-F942 HydrophobicContact CH2-CG 4.25Å; W875-F942 HydrophobicContact CZ2-CB 4.16Å; W875-F942 HydrophobicContact CZ2-CD1 4.47Å; W875-F942 HydrophobicContact CZ2-CD2 4.34Å; W875-F942 HydrophobicContact CZ2-CG 4.08Å; W875-F942 HydrophobicContact CZ3-CB 3.7Å; W875-F942 HydrophobicContact CZ3-CG 4.38Å; W875-A944 HydrophobicContact CE3-CB 4.1Å; W875-A944 HydrophobicContact CZ3-CB 4.05Å; W875-W973 HydrophobicContact CD2-CH2 4.32Å; W875-W973 AromaticContact CE3-CH2 3.75Å; W875-W973 HydrophobicContact CE3-CH2 3.75Å; W875-W973 HydrophobicContact CE3-CZ2 4.11Å; W875-W973 HydrophobicContact CH2-CH2 4.31Å; W875-W973 AromaticContact CH2-CZ2 3.84Å; W875-W973 HydrophobicContact CH2-CZ2 3.84Å; W875-W973 HydrophobicContact CZ2-CZ2 4.28Å; W875-W973 AromaticContact CZ3-CH2 3.75Å; W875-W973 HydrophobicContact CZ3-CH2 3.75Å; W875-W973 AromaticContact CZ3-CZ2 3.75Å; W875-W973 HydrophobicContact CZ3-CZ2 3.75Å; W875-N996 PolarHBondContact NE1-OD1 3.2Å; W875-N996 VanDerWaalsContact NE1-OD1 3.15Å; W875-P998 HydrophobicContact CD2-CB 4.44Å; W875-P998 HydrophobicContact CH2-CB 4.45Å; W875-P998 HydrophobicContact CZ2-CB 3.74Å; W875-L999 HydrophobicContact CZ2-CB 4.04Å; W875-L1002 HydrophobicContact CH2-CD1 4.28Å
876	T	81.4	Confident	70.9	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.025	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	123.7	155.9	-61.4	0	0	0	0	109.1	I878 E907 A909 H941 F942 V943 A944	T876-I878 HydrophobicContact CG2-CG1 4.23Å; T876-E907 CarbonylContact C-O 3.57Å; T876-E907 WeakPolarHBondContact CA-O 3.39Å; T876-A909 HydrophobicContact CG2-CB 3.59Å; T876-H941 PolarHBondContact OG1-CE1 3.26Å; T876-H941 PolarHBondContact OG1-NE2 2.97Å; T876-F942 PolarHBondContact N-O 3.13Å; T876-V943 CarbonylContact O-C 3.17Å; T876-V943 WeakPolarHBondContact O-CA 3.18Å; T876-A944 PolarHBondContact O-N 3.01Å
877	I	82.4	Confident	68.8	Low	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.8	176.8	-68.4	152.8	0	0	0	109.5	F872 W875 L879 I901 E907 I908 A909 A944 V946 W973 L974	F872-I877 HydrophobicContact CB-CD1 4.19Å; F872-I877 HydrophobicContact CD1-CD1 3.7Å; F872-I877 HydrophobicContact CD2-CD1 4.36Å; F872-I877 HydrophobicContact CE1-CD1 4.19Å; F872-I877 HydrophobicContact CG-CD1 3.82Å; W875-I877 HydrophobicContact CB-CD1 4.36Å; W875-I877 HydrophobicContact CB-CG1 4.39Å; I877-L879 HydrophobicContact CG2-CD2 3.9Å; I877-I901 HydrophobicContact CB-CD1 4.13Å; I877-I901 HydrophobicContact CB-CG2 4.34Å; I877-I901 HydrophobicContact CD1-CD1 4.34Å; I877-I901 HydrophobicContact CD1-CG1 4.1Å; I877-I901 HydrophobicContact CD1-CG2 3.81Å; I877-I901 HydrophobicContact CG2-CD1 3.66Å; I877-E907 PolarHBondContact N-O 3.27Å; I877-I908 WeakPolarHBondContact O-CA 3.48Å; I877-A909 PolarHBondContact O-N 3.09Å; I877-A944 HydrophobicContact CG1-CB 4.46Å; I877-V946 HydrophobicContact CG2-CB 4.44Å; I877-V946 HydrophobicContact CG2-CG2 3.87Å; I877-W973 HydrophobicContact CD1-CZ3 4.41Å; I877-W973 HydrophobicContact CG1-CH2 4.5Å; I877-W973 HydrophobicContact CG1-CZ3 4.27Å; I877-L974 HydrophobicContact CD1-CD2 3.63Å; I877-L974 HydrophobicContact CG1-CD2 4.36Å; I877-L974 HydrophobicContact CG2-CD1 4.5Å; I877-L974 HydrophobicContact CG2-CD2 4.36Å
878	I	79.2	Confident	66.5	Low	3 Å²	3	42.1 Å²	42.1	2%	0.015	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	110.1	-175.8	-56.7	-174.2	0	0	0	108	T876 T880 A909 I912 V943 A944 L945 V946 F957	T876-I878 HydrophobicContact CG2-CG1 4.23Å; I878-T880 HydrophobicContact CG2-CG2 3.72Å; I878-A909 HydrophobicContact CD1-CB 4.1Å; I878-A909 HydrophobicContact CG1-CB 4.09Å; I878-A909 WeakPolarHBondContact CG1-O 3.48Å; I878-A909 WeakPolarHBondContact CG2-O 3.42Å; I878-I912 HydrophobicContact CD1-CB 4.4Å; I878-I912 HydrophobicContact CD1-CD1 3.99Å; I878-I912 HydrophobicContact CD1-CG1 3.2Å; I878-V943 HydrophobicContact CD1-CG1 4.25Å; I878-A944 PolarHBondContact N-O 3.29Å; I878-L945 HydrophobicContact CB-CD2 4.05Å; I878-L945 HydrophobicContact CG2-CD2 4Å; I878-V946 PolarHBondContact O-N 3.04Å; I878-F957 HydrophobicContact CG2-CE2 4.16Å; I878-F957 HydrophobicContact CG2-CZ 4.17Å
879	L	79	Confident	64.3	Low	10 Å²	10	50 Å²	50	5%	0.052	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	112.9	179.3	-56.6	-171.7	0	0	0	109.8	I877 R894 L897 E898 I901 V946 L974	I877-L879 HydrophobicContact CG2-CD2 3.9Å; L879-R894 HydrophobicContact CD1-CG 4.18Å; L879-R894 PolarHBondContact O-NH1 3.48Å; L879-R894 PolarHBondContact O-NH2 3.1Å; L879-R894 VanDerWaalsContact O-NH2 3.15Å; L879-L897 HydrophobicContact CD1-CB 4.26Å; L879-L897 HydrophobicContact CD1-CD2 3.95Å; L879-L897 HydrophobicContact CD1-CG 4.07Å; L879-L897 HydrophobicContact CD2-CD2 4.02Å; L879-E898 HydrophobicContact CD1-CG 3.47Å; L879-E898 VanDerWaalsContact CD1-CG 3.47Å; L879-E898 HydrophobicContact CG-CG 4.44Å; L879-I901 HydrophobicContact CD1-CD1 4.46Å; L879-I901 HydrophobicContact CD2-CD1 4.13Å; L879-I901 HydrophobicContact CG-CD1 4.45Å; L879-V946 HydrophobicContact CD2-CB 3.9Å; L879-V946 HydrophobicContact CD2-CG1 4.15Å; L879-L974 HydrophobicContact CD2-CD1 4.3Å
880	T	66.4	Low	62.4	Low	14 Å²	14	54.8 Å²	54.8	9%	0.086	29%	0.291	C	S	.	.			trans	-112.2	3.4	-164.8	55.2	0	0	0	0	115.1	I878 L945 V946 R952 T953 F957	I878-T880 HydrophobicContact CG2-CG2 3.72Å; T880-L945 HydrophobicContact CG2-CD2 3.63Å; T880-V946 PolarHBondContact N-O 3.31Å; T880-V946 PolarHBondContact OG1-O 2.81Å; T880-R952 VanDerWaalsContact O-O 3.08Å; T880-T953 HydrophobicContact CG2-CG2 4.02Å; T880-T953 WeakPolarHBondContact OG1-CG2 3.49Å; T880-F957 HydrophobicContact CG2-CB 4.47Å; T880-F957 HydrophobicContact CG2-CD2 3.41Å; T880-F957 VanDerWaalsContact CG2-CD2 3.41Å; T880-F957 HydrophobicContact CG2-CE2 3.86Å; T880-F957 HydrophobicContact CG2-CG 4.15Å
881	G	58.9	Low	61	Low	15 Å²	15	55 Å²	55	16%	0.155	30%	0.295	C	S	.	.	S	Bend	trans	-154.8	157	174.4	0	0	0	0	0	112.1	A883	G881-A883 PolarHBondContact O-N 3.34Å
882	G	45.6	Very low	59.9	Low	40 Å²	40	55.8 Å²	55.8	41%	0.412	30%	0.299	S	S	.	.			trans	-59	129.9	173.2	0	0	0	0	0	111.3	K884 T948	G882-K884 PolarHBondContact O-N 3.44Å; G882-T948 WeakPolarHBondContact O-CG2 3.45Å; G882-T948 PolarHBondContact O-OG1 3.18Å; G882-T948 VanDerWaalsContact O-OG1 3.1Å
883	A	40.7	Very low	59.1	Low	8 Å²	8	59.9 Å²	59.9	7%	0.066	32%	0.321	C	S	.	.			trans	-79.7	52.5	-163.9	0	0	0	0	0	114.9	G881 N885 S891 I892 I971	G881-A883 PolarHBondContact O-N 3.34Å; A883-N885 PolarHBondContact O-N 3.13Å; A883-S891 CarbonylContact O-C 3.6Å; A883-S891 WeakPolarHBondContact O-CA 3.34Å; A883-I892 HydrophobicContact CB-CB 4.2Å; A883-I892 WeakPolarHBondContact CB-O 3.46Å; A883-I892 PolarHBondContact O-N 2.99Å; A883-I971 HydrophobicContact CB-CD1 3.45Å; A883-I971 VanDerWaalsContact CB-CD1 3.45Å
884	K	39.7	Very low	58.9	Low	140 Å²	140	57.8 Å²	57.8	61%	0.609	31%	0.309	S	S	*	.	B	Isolated β-bridge	trans	-60.8	111.5	163.3	-66.1	-167.5	174.9	-168	0	111	G882 T948	G882-K884 PolarHBondContact O-N 3.44Å; K884-T948 WeakPolarHBondContact O-CG2 3.44Å
885	N	38.5	Very low	59.3	Low	40 Å²	40	60.9 Å²	60.9	21%	0.214	32%	0.322	C	S	.	.			trans	-80.7	127.8	172.3	178.8	8.1	0	0	0	109.3	A883 N887 S888 I892	A883-N885 PolarHBondContact O-N 3.13Å; N885-N887 PolarHBondContact O-N 2.9Å; N885-N887 PolarHBondContact OD1-N 3.29Å; N885-S888 WeakPolarHBondContact CB-OG 3.36Å; N885-S888 PolarHBondContact ND2-OG 3.06Å; N885-S888 PolarHBondContact O-N 2.8Å; N885-I892 HydrophobicContact CB-CD1 4.05Å; N885-I892 HydrophobicContact CB-CG1 4.21Å
886	Y	40.4	Very low	59.4	Low	176 Å²	176	61.9 Å²	61.9	69%	0.69	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.8	177.4	-79.5	-85.6	0	0	0	113.7	T948	Y886-T948 WeakPolarHBondContact CE2-O 3.4Å
887	N	41.7	Very low	59.6	Low	117 Å²	117	61.7 Å²	61.7	63%	0.626	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	2.8	179.1	-69	-70.2	0	0	0	114.7	N885	N885-N887 PolarHBondContact O-N 2.9Å; N885-N887 PolarHBondContact OD1-N 3.29Å
888	S	38.5	Very low	59.8	Low	44 Å²	44	63.7 Å²	63.7	31%	0.308	34%	0.336	S	S	.	.			trans	-149.3	142.1	176.5	53.9	0	0	0	0	111.4	N885 E890	N885-S888 WeakPolarHBondContact CB-OG 3.36Å; N885-S888 PolarHBondContact ND2-OG 3.06Å; N885-S888 PolarHBondContact O-N 2.8Å; S888-E890 PolarHBondContact O-N 2.85Å; S888-E890 PolarHBondContact OG-O 2.65Å
889	N	37.9	Very low	60.1	Low	185 Å²	185	67.5 Å²	67.5	99%	0.989	35%	0.353	S	S	*	.	S	Bend	trans	-65	-16.6	171.1	-79.6	-27.1	0	0	0	112.5
890	E	45	Very low	60.6	Low	154 Å²	154	67 Å²	67	72%	0.72	35%	0.351	S	S	*	.	S	Bend	trans	-76.8	123.9	168.4	-58.4	-177.5	127.5	0	0	110.6	S888	S888-E890 PolarHBondContact O-N 2.85Å; S888-E890 PolarHBondContact OG-O 2.65Å
891	S	54	Low	61.6	Low	79 Å²	79	66.4 Å²	66.4	55%	0.552	35%	0.347	S	S	*	.	B	Isolated β-bridge	trans	-68.6	128.5	158.7	50.2	0	0	0	0	109.3	A883 D893	A883-S891 CarbonylContact O-C 3.6Å; A883-S891 WeakPolarHBondContact O-CA 3.34Å; S891-D893 PolarHBondContact O-N 2.89Å
892	I	63.5	Low	63	Low	26 Å²	26	70.8 Å²	70.8	13%	0.133	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-60.1	132.9	166.4	-65.8	168.5	0	0	0	107	L862 A883 N885 R894 L897 I971 L975	L862-I892 HydrophobicContact CD2-CG2 3.84Å; A883-I892 HydrophobicContact CB-CB 4.2Å; A883-I892 WeakPolarHBondContact CB-O 3.46Å; A883-I892 PolarHBondContact O-N 2.99Å; N885-I892 HydrophobicContact CB-CD1 4.05Å; N885-I892 HydrophobicContact CB-CG1 4.21Å; I892-R894 PolarHBondContact O-N 2.75Å; I892-L897 HydrophobicContact CG2-CB 4.4Å; I892-I971 HydrophobicContact CD1-CG2 4.09Å; I892-L975 HydrophobicContact CD1-CD1 4.15Å
893	D	72.1	Confident	64.9	Low	86 Å²	86	69.8 Å²	69.8	46%	0.46	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-66.3	128.3	174.1	171.4	21	0	0	0	109.7	S891 N895 L896 L897	S891-D893 PolarHBondContact O-N 2.89Å; D893-N895 VanDerWaalsContact C-N 3.28Å; D893-N895 PolarHBondContact O-N 3Å; D893-N895 WeakPolarHBondContact OD1-CB 3.26Å; D893-N895 PolarHBondContact OD1-N 3.22Å; D893-N895 WeakPolarHBondContact OD2-CB 3.28Å; D893-L896 HydrophobicContact CB-CB 3.81Å; D893-L896 WeakPolarHBondContact O-CB 3.49Å; D893-L896 PolarHBondContact O-N 3.28Å; D893-L896 PolarHBondContact OD2-N 2.84Å; D893-L897 PolarHBondContact O-N 3.25Å; D893-L897 VanDerWaalsContact O-N 3.09Å
894	R	77.5	Confident	67.1	Low	52 Å²	52	69.4 Å²	69.4	20%	0.196	35%	0.351	C	S	.	.	H	α-helix	trans	-55.5	-46.1	174.9	178.4	-178.3	172.7	121.3	18.4	110.3	L879 I892 L896 L897 E898	L879-R894 HydrophobicContact CD1-CG 4.18Å; L879-R894 PolarHBondContact O-NH1 3.48Å; L879-R894 PolarHBondContact O-NH2 3.1Å; L879-R894 VanDerWaalsContact O-NH2 3.15Å; I892-R894 PolarHBondContact O-N 2.75Å; R894-L896 VanDerWaalsContact C-N 3.33Å; R894-L896 PolarHBondContact O-N 3.45Å; R894-L897 PolarHBondContact O-N 2.94Å; R894-L897 VanDerWaalsContact O-N 3.13Å; R894-E898 HydrophobicContact CG-CG 4.31Å; R894-E898 IonicContact CZ-OE1 3.33Å; R894-E898 IonicContact NE-OE1 3.11Å; R894-E898 PolarHBondContact NE-OE1 3.42Å; R894-E898 IonicContact NH2-OE1 2.71Å; R894-E898 PolarHBondContact NH2-OE1 2.83Å; R894-E898 WeakPolarHBondContact O-CG 3.41Å; R894-E898 PolarHBondContact O-N 2.78Å
895	N	81.7	Confident	69.1	Low	80 Å²	80	64 Å²	64	43%	0.428	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-38.7	-178.1	-175.2	3.5	0	0	0	111.3	D893 L897 E898 Q899	D893-N895 VanDerWaalsContact C-N 3.28Å; D893-N895 PolarHBondContact O-N 3Å; D893-N895 WeakPolarHBondContact OD1-CB 3.26Å; D893-N895 PolarHBondContact OD1-N 3.22Å; D893-N895 WeakPolarHBondContact OD2-CB 3.28Å; N895-L897 PolarHBondContact O-N 2.73Å; N895-E898 PolarHBondContact O-N 2.74Å; N895-Q899 WeakPolarHBondContact O-CB 3.35Å; N895-Q899 VanDerWaalsContact O-CG 3.28Å; N895-Q899 WeakPolarHBondContact O-CG 3.5Å; N895-Q899 PolarHBondContact O-N 3.4Å; N895-Q899 PolarHBondContact OD1-NE2 3.05Å
896	L	84	Confident	71.3	Confident	26 Å²	26	62.5 Å²	62.5	14%	0.136	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-38.7	173.2	-172	68.3	0	0	0	112.9	L858 N861 L862 D893 R894 L900	L858-L896 HydrophobicContact CD2-CD1 3.59Å; N861-L896 HydrophobicContact CB-CD1 3.91Å; N861-L896 HydrophobicContact CB-CD2 3.94Å; L862-L896 HydrophobicContact CD1-CG 4.26Å; L862-L896 HydrophobicContact CD2-CD2 3.51Å; L862-L896 HydrophobicContact CD2-CG 3.97Å; L862-L896 HydrophobicContact CG-CD2 3.79Å; L862-L896 HydrophobicContact CG-CG 3.97Å; D893-L896 HydrophobicContact CB-CB 3.81Å; D893-L896 WeakPolarHBondContact O-CB 3.49Å; D893-L896 PolarHBondContact O-N 3.28Å; D893-L896 PolarHBondContact OD2-N 2.84Å; R894-L896 VanDerWaalsContact C-N 3.33Å; R894-L896 PolarHBondContact O-N 3.45Å; L896-L900 PolarHBondContact O-N 2.85Å; L896-L900 VanDerWaalsContact O-N 3.1Å
897	L	85.1	Confident	73.4	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-72	-39.5	176	-172	59.9	0	0	0	112.1	L879 I892 D893 R894 N895 L900 I901 I971 L974	L879-L897 HydrophobicContact CD1-CB 4.26Å; L879-L897 HydrophobicContact CD1-CD2 3.95Å; L879-L897 HydrophobicContact CD1-CG 4.07Å; L879-L897 HydrophobicContact CD2-CD2 4.02Å; I892-L897 HydrophobicContact CG2-CB 4.4Å; D893-L897 PolarHBondContact O-N 3.25Å; D893-L897 VanDerWaalsContact O-N 3.09Å; R894-L897 PolarHBondContact O-N 2.94Å; R894-L897 VanDerWaalsContact O-N 3.13Å; N895-L897 PolarHBondContact O-N 2.73Å; L897-L900 PolarHBondContact O-N 3.01Å; L897-I901 HydrophobicContact CG-CD1 4.44Å; L897-I901 WeakPolarHBondContact O-CG1 3.33Å; L897-I901 PolarHBondContact O-N 3.14Å; L897-I901 VanDerWaalsContact O-N 3.1Å; L897-I971 HydrophobicContact CD2-CD1 4.11Å; L897-I971 HydrophobicContact CD2-CG1 4.27Å; L897-I971 HydrophobicContact CD2-CG2 3.95Å; L897-L974 HydrophobicContact CD1-CD1 3.82Å; L897-L974 HydrophobicContact CD2-CD1 4Å; L897-L974 HydrophobicContact CG-CD1 4.08Å
898	E	86.2	Confident	75.3	Confident	42 Å²	42	57 Å²	57	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-44.4	174.2	-68.4	-176.6	169.1	0	0	111.1	L879 R894 N895 L900 I901 I902 I908	L879-E898 HydrophobicContact CD1-CG 3.47Å; L879-E898 VanDerWaalsContact CD1-CG 3.47Å; L879-E898 HydrophobicContact CG-CG 4.44Å; R894-E898 HydrophobicContact CG-CG 4.31Å; R894-E898 IonicContact CZ-OE1 3.33Å; R894-E898 IonicContact NE-OE1 3.11Å; R894-E898 PolarHBondContact NE-OE1 3.42Å; R894-E898 IonicContact NH2-OE1 2.71Å; R894-E898 PolarHBondContact NH2-OE1 2.83Å; R894-E898 WeakPolarHBondContact O-CG 3.41Å; R894-E898 PolarHBondContact O-N 2.78Å; N895-E898 PolarHBondContact O-N 2.74Å; E898-L900 VanDerWaalsContact C-N 3.32Å; E898-L900 PolarHBondContact O-N 3.2Å; E898-I901 PolarHBondContact O-N 3Å; E898-I902 WeakPolarHBondContact O-CG1 3.13Å; E898-I902 PolarHBondContact O-N 3.22Å; E898-I902 VanDerWaalsContact O-N 3.13Å; E898-I908 VanDerWaalsContact CA-CD1 3.41Å; E898-I908 HydrophobicContact CB-CD1 3.48Å; E898-I908 VanDerWaalsContact CB-CD1 3.48Å; E898-I908 HydrophobicContact CG-CD1 3.76Å; E898-I908 WeakPolarHBondContact O-CD1 3.26Å
899	Q	86	Confident	76.9	Confident	83 Å²	83	55.8 Å²	55.8	39%	0.388	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-37.4	173.6	-72.8	175.8	46.6	0	0	112.6	L858 N895 A903	L858-Q899 HydrophobicContact CD1-CB 4.02Å; L858-Q899 WeakPolarHBondContact CD1-O 3.5Å; L858-Q899 HydrophobicContact CD2-CB 3.64Å; L858-Q899 HydrophobicContact CG-CB 4.5Å; N895-Q899 WeakPolarHBondContact O-CB 3.35Å; N895-Q899 VanDerWaalsContact O-CG 3.28Å; N895-Q899 WeakPolarHBondContact O-CG 3.5Å; N895-Q899 PolarHBondContact O-N 3.4Å; N895-Q899 PolarHBondContact OD1-NE2 3.05Å; Q899-A903 WeakPolarHBondContact O-CB 3.29Å; Q899-A903 PolarHBondContact O-N 3.48Å
900	L	89.1	Confident	78.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-49.2	174.9	-179.9	69.7	0	0	0	111.6	L858 L862 I864 L896 L897 E898 I902 A903 C904 L975	L858-L900 HydrophobicContact CB-CD1 4.4Å; L862-L900 HydrophobicContact CD1-CB 4.02Å; L862-L900 HydrophobicContact CD1-CD2 3.67Å; L862-L900 HydrophobicContact CD1-CG 4.27Å; I864-L900 HydrophobicContact CD1-CD1 3.94Å; I864-L900 HydrophobicContact CD1-CD2 3.79Å; L896-L900 PolarHBondContact O-N 2.85Å; L896-L900 VanDerWaalsContact O-N 3.1Å; L897-L900 PolarHBondContact O-N 3.01Å; E898-L900 VanDerWaalsContact C-N 3.32Å; E898-L900 PolarHBondContact O-N 3.2Å; L900-I902 PolarHBondContact O-N 3.36Å; L900-A903 PolarHBondContact O-N 2.95Å; L900-C904 WeakPolarHBondContact O-CB 3.26Å; L900-C904 PolarHBondContact O-N 2.87Å; L900-C904 PolarHBondContact O-SG 3.22Å; L900-L975 HydrophobicContact CD2-CD2 4.45Å
901	I	87.7	Confident	78.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.3	-49.3	-178.3	-68	158.9	0	0	0	110.6	I877 L879 L897 E898 A903 C904 G905 G906 I908 L974	I877-I901 HydrophobicContact CB-CD1 4.13Å; I877-I901 HydrophobicContact CB-CG2 4.34Å; I877-I901 HydrophobicContact CD1-CD1 4.34Å; I877-I901 HydrophobicContact CD1-CG1 4.1Å; I877-I901 HydrophobicContact CD1-CG2 3.81Å; I877-I901 HydrophobicContact CG2-CD1 3.66Å; L879-I901 HydrophobicContact CD1-CD1 4.46Å; L879-I901 HydrophobicContact CD2-CD1 4.13Å; L879-I901 HydrophobicContact CG-CD1 4.45Å; L897-I901 HydrophobicContact CG-CD1 4.44Å; L897-I901 WeakPolarHBondContact O-CG1 3.33Å; L897-I901 PolarHBondContact O-N 3.14Å; L897-I901 VanDerWaalsContact O-N 3.1Å; E898-I901 PolarHBondContact O-N 3Å; I901-A903 PolarHBondContact O-N 3.21Å; I901-C904 CarbonylContact O-C 3.47Å; I901-C904 PolarHBondContact O-N 3.35Å; I901-G905 PolarHBondContact O-N 2.87Å; I901-G906 PolarHBondContact O-N 3.1Å; I901-I908 HydrophobicContact CB-CD1 4.03Å; I901-I908 HydrophobicContact CB-CG1 4.24Å; I901-I908 HydrophobicContact CD1-CD1 4.28Å; I901-I908 HydrophobicContact CG2-CD1 4.13Å; I901-I908 HydrophobicContact CG2-CG1 3.77Å; I901-L974 HydrophobicContact CD1-CD1 4.1Å; I901-L974 HydrophobicContact CG1-CD1 4.49Å
902	I	87.4	Confident	78.7	Confident	108 Å²	108	47 Å²	47	55%	0.554	25%	0.246	S	C	*	.	H	α-helix	trans	-62.3	-43.7	178.8	-66	166	0	0	0	110.9	E898 L900 C904 G905 I908	E898-I902 WeakPolarHBondContact O-CG1 3.13Å; E898-I902 PolarHBondContact O-N 3.22Å; E898-I902 VanDerWaalsContact O-N 3.13Å; L900-I902 PolarHBondContact O-N 3.36Å; I902-C904 VanDerWaalsContact C-N 3.26Å; I902-C904 PolarHBondContact O-N 2.92Å; I902-G905 PolarHBondContact O-N 2.84Å; I902-G905 VanDerWaalsContact O-N 3.14Å; I902-I908 HydrophobicContact CD1-CD1 3.89Å; I902-I908 HydrophobicContact CD1-CG1 4.48Å; I902-I908 HydrophobicContact CG1-CD1 3.79Å; I902-I908 HydrophobicContact CG1-CG1 4.1Å
903	A	86.1	Confident	78.1	Confident	19 Å²	19	49.7 Å²	49.7	16%	0.157	26%	0.261	C	S	.	.	H	α-helix	trans	-68.2	-24.9	179.4	0	0	0	0	0	113.3	L855 L858 Q899 L900 I901 G905	L855-A903 HydrophobicContact CD2-CB 3.59Å; L855-A903 HydrophobicContact CG-CB 3.92Å; L858-A903 HydrophobicContact CD1-CB 3.74Å; Q899-A903 WeakPolarHBondContact O-CB 3.29Å; Q899-A903 PolarHBondContact O-N 3.48Å; L900-A903 PolarHBondContact O-N 2.95Å; I901-A903 PolarHBondContact O-N 3.21Å; A903-G905 VanDerWaalsContact C-N 3.32Å
904	C	87.3	Confident	76.9	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	12	174	-62.4	0	0	0	0	113.5	P867 P869 T870 V871 F872 L900 I901 I902	P867-C904 VanDerWaalsContact CG-SG 3.54Å; P869-C904 CarbonylContact C-O 3.35Å; P869-C904 CarbonylContact O-C 3.54Å; P869-C904 VanDerWaalsContact O-C 3.25Å; T870-C904 CarbonylContact C-O 3.59Å; T870-C904 VanDerWaalsContact C-O 3.3Å; T870-C904 WeakPolarHBondContact CA-O 3.49Å; V871-C904 HydrophobicContact CB-CB 4.4Å; V871-C904 PolarHBondContact N-O 3.09Å; V871-C904 VanDerWaalsContact N-O 3.16Å; F872-C904 HydrophobicContact CD2-CB 3.7Å; F872-C904 HydrophobicContact CE2-CB 4.29Å; F872-C904 PolarHBondContact N-O 3.42Å; L900-C904 WeakPolarHBondContact O-CB 3.26Å; L900-C904 PolarHBondContact O-N 2.87Å; L900-C904 PolarHBondContact O-SG 3.22Å; I901-C904 CarbonylContact O-C 3.47Å; I901-C904 PolarHBondContact O-N 3.35Å; I902-C904 VanDerWaalsContact C-N 3.26Å; I902-C904 PolarHBondContact O-N 2.92Å
905	G	81.8	Confident	75.4	Confident	27 Å²	27	47.8 Å²	47.8	28%	0.278	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	10.4	171.2	0	0	0	0	0	116	P869 H873 I901 I902 A903	P869-G905 PolarHBondContact O-N 3.42Å; H873-G905 WeakPolarHBondContact CA-O 3.47Å; I901-G905 PolarHBondContact O-N 2.87Å; I902-G905 PolarHBondContact O-N 2.84Å; I902-G905 VanDerWaalsContact O-N 3.14Å; A903-G905 VanDerWaalsContact C-N 3.32Å
906	G	84.5	Confident	73.9	Confident	7 Å²	7	46.4 Å²	46.4	7%	0.072	25%	0.254	C	S	.	.			trans	-90.1	161.2	173.8	0	0	0	0	0	113.5	F872 W875 I901	F872-G906 WeakPolarHBondContact O-CA 3.33Å; W875-G906 WeakPolarHBondContact O-CA 3.44Å; I901-G906 PolarHBondContact O-N 3.1Å
907	E	84	Confident	72.3	Confident	129 Å²	129	46.1 Å²	46.1	60%	0.603	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	155.5	174.9	-63.2	-169.7	-176.7	0	0	110.8	W875 T876 I877	W875-E907 PolarHBondContact O-N 2.97Å; T876-E907 CarbonylContact C-O 3.57Å; T876-E907 WeakPolarHBondContact CA-O 3.39Å; I877-E907 PolarHBondContact N-O 3.27Å
908	I	81.4	Confident	70.1	Confident	48 Å²	48	50.3 Å²	50.3	25%	0.246	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128.1	177.3	-56.1	-175.8	0	0	0	108.6	I877 E898 I901 I902	I877-I908 WeakPolarHBondContact O-CA 3.48Å; E898-I908 VanDerWaalsContact CA-CD1 3.41Å; E898-I908 HydrophobicContact CB-CD1 3.48Å; E898-I908 VanDerWaalsContact CB-CD1 3.48Å; E898-I908 HydrophobicContact CG-CD1 3.76Å; E898-I908 WeakPolarHBondContact O-CD1 3.26Å; I901-I908 HydrophobicContact CB-CD1 4.03Å; I901-I908 HydrophobicContact CB-CG1 4.24Å; I901-I908 HydrophobicContact CD1-CD1 4.28Å; I901-I908 HydrophobicContact CG2-CD1 4.13Å; I901-I908 HydrophobicContact CG2-CG1 3.77Å; I902-I908 HydrophobicContact CD1-CD1 3.89Å; I902-I908 HydrophobicContact CD1-CG1 4.48Å; I902-I908 HydrophobicContact CG1-CD1 3.79Å; I902-I908 HydrophobicContact CG1-CG1 4.1Å
909	A	72.7	Confident	67.9	Low	20 Å²	20	57.4 Å²	57.4	17%	0.165	30%	0.299	C	S	.	.			trans	-117.7	139.6	173	0	0	0	0	0	110.3	T876 I877 I878 E911	T876-A909 HydrophobicContact CG2-CB 3.59Å; I877-A909 PolarHBondContact O-N 3.09Å; I878-A909 HydrophobicContact CD1-CB 4.1Å; I878-A909 HydrophobicContact CG1-CB 4.09Å; I878-A909 WeakPolarHBondContact CG1-O 3.48Å; I878-A909 WeakPolarHBondContact CG2-O 3.42Å; A909-E911 WeakPolarHBondContact CB-O 3.44Å
910	L	63.3	Low	65.5	Low	90 Å²	90	61.5 Å²	61.5	47%	0.471	31%	0.311	S	S	.	.	S	Bend	trans	-87.4	-20.6	170	-59	177.3	0	0	0	111.4
911	E	56.7	Low	63	Low	136 Å²	136	64.4 Å²	64.4	64%	0.636	32%	0.323	S	S	*	.	S	Bend	trans	-126.4	136.8	179.5	-63.7	174.6	-164.3	0	0	109.6	A909 N913	A909-E911 WeakPolarHBondContact CB-O 3.44Å; E911-N913 PolarHBondContact O-N 2.67Å
912	I	55.2	Low	60.1	Low	8 Å²	8	66.6 Å²	66.6	4%	0.041	35%	0.345	C	S	.	.			trans	-75.3	96.9	161	-67.8	176.2	0	0	0	107.6	I878 P914 L917 L945 F957 L960	I878-I912 HydrophobicContact CD1-CB 4.4Å; I878-I912 HydrophobicContact CD1-CD1 3.99Å; I878-I912 HydrophobicContact CD1-CG1 3.2Å; I912-P914 VanDerWaalsContact O-CD 3.31Å; I912-P914 WeakPolarHBondContact O-CD 3.39Å; I912-L917 HydrophobicContact CG2-CD1 3.67Å; I912-L917 HydrophobicContact CG2-CD2 4.21Å; I912-L917 HydrophobicContact CG2-CG 3.76Å; I912-L945 HydrophobicContact CD1-CD1 4.39Å; I912-L945 HydrophobicContact CD1-CD2 4.15Å; I912-L945 HydrophobicContact CD1-CG 4.41Å; I912-F957 HydrophobicContact CB-CE1 4.07Å; I912-F957 HydrophobicContact CD1-CD1 3.74Å; I912-F957 HydrophobicContact CD1-CE1 3.82Å; I912-F957 HydrophobicContact CG1-CD1 4.14Å; I912-F957 HydrophobicContact CG1-CE1 3.67Å; I912-L960 HydrophobicContact CB-CD1 4.1Å; I912-L960 HydrophobicContact CD1-CB 4.41Å; I912-L960 HydrophobicContact CD1-CD1 3.62Å; I912-L960 HydrophobicContact CG1-CD1 4.4Å; I912-L960 HydrophobicContact CG2-CD1 4.08Å
913	N	51.3	Low	57.4	Low	82 Å²	82	63.6 Å²	63.6	44%	0.439	33%	0.333	S	S	.	.			trans	-62.2	116.4	165	179.9	-27.9	0	0	0	108.1	E911 S915 L916	E911-N913 PolarHBondContact O-N 2.67Å; N913-S915 VanDerWaalsContact CG-OG 3.29Å; N913-S915 PolarHBondContact O-N 2.91Å; N913-S915 WeakPolarHBondContact OD1-CB 3.38Å; N913-S915 PolarHBondContact OD1-N 3.01Å; N913-S915 PolarHBondContact OD1-OG 3.43Å; N913-L916 HydrophobicContact CB-CD1 4.25Å; N913-L916 HydrophobicContact CB-CG 4.3Å; N913-L916 VanDerWaalsContact O-CB 3.26Å; N913-L916 WeakPolarHBondContact O-CB 3.44Å; N913-L916 PolarHBondContact O-N 3.31Å
914	P	45.6	Very low	54.6	Low	29 Å²	29	69.2 Å²	69.2	19%	0.188	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.2	-172.3	26.2	-34.2	0	0	0	113.8	I912 L916 L917 N918 N1078	I912-P914 VanDerWaalsContact O-CD 3.31Å; I912-P914 WeakPolarHBondContact O-CD 3.39Å; P914-L916 PolarHBondContact O-N 3.49Å; P914-L917 PolarHBondContact O-N 3.45Å; P914-N918 WeakPolarHBondContact O-CB 3.3Å; P914-N918 PolarHBondContact O-N 2.84Å; P914-N918 PolarHBondContact O-ND2 3.07Å; P914-N1078 HydrophobicContact CB-CB 3.47Å; P914-N1078 VanDerWaalsContact CB-CB 3.47Å; P914-N1078 HydrophobicContact CG-CB 4.03Å; P914-N1078 WeakPolarHBondContact CG-ND2 3.26Å
915	S	47.3	Very low	51.7	Low	69 Å²	69	73.3 Å²	73.3	48%	0.483	39%	0.385	S	S	.	.	H	α-helix	trans	-65.7	-23.1	167.9	66.7	0	0	0	0	113.2	N913 L917 R919	N913-S915 VanDerWaalsContact CG-OG 3.29Å; N913-S915 PolarHBondContact O-N 2.91Å; N913-S915 WeakPolarHBondContact OD1-CB 3.38Å; N913-S915 PolarHBondContact OD1-N 3.01Å; N913-S915 PolarHBondContact OD1-OG 3.43Å; S915-L917 VanDerWaalsContact C-N 3.27Å; S915-R919 PolarHBondContact O-N 2.84Å
916	L	48.5	Very low	49.3	Very low	51 Å²	51	76 Å²	76	27%	0.267	40%	0.397	S	S	.	.	H	α-helix	trans	-75.6	-12.1	169.2	-57.4	175.5	0	0	0	112.8	N913 P914 Y921	N913-L916 HydrophobicContact CB-CD1 4.25Å; N913-L916 HydrophobicContact CB-CG 4.3Å; N913-L916 VanDerWaalsContact O-CB 3.26Å; N913-L916 WeakPolarHBondContact O-CB 3.44Å; N913-L916 PolarHBondContact O-N 3.31Å; P914-L916 PolarHBondContact O-N 3.49Å; L916-Y921 WeakPolarHBondContact O-CE2 3.43Å; L916-Y921 PolarHBondContact O-OH 3.07Å
917	L	50.5	Low	46.6	Very low	20 Å²	20	83.3 Å²	83.3	11%	0.105	43%	0.43	C	S	.	.	H	α-helix	trans	-101.7	-35.1	172	-59.6	179.1	0	0	0	111.8	I912 P914 S915 R919 L960 V966 L1082	I912-L917 HydrophobicContact CG2-CD1 3.67Å; I912-L917 HydrophobicContact CG2-CD2 4.21Å; I912-L917 HydrophobicContact CG2-CG 3.76Å; P914-L917 PolarHBondContact O-N 3.45Å; S915-L917 VanDerWaalsContact C-N 3.27Å; L917-R919 VanDerWaalsContact C-N 3.28Å; L917-R919 PolarHBondContact O-N 3.12Å; L917-L960 HydrophobicContact CD1-CD1 4.15Å; L917-L960 HydrophobicContact CD1-CD2 3.43Å; L917-L960 VanDerWaalsContact CD1-CD2 3.43Å; L917-L960 HydrophobicContact CD1-CG 4.42Å; L917-V966 HydrophobicContact CD2-CG2 3.78Å; L917-L1082 HydrophobicContact CB-CD1 3.86Å; L917-L1082 HydrophobicContact CD1-CD1 3.66Å; L917-L1082 HydrophobicContact CG-CD1 4.42Å
918	N	40.6	Very low	44.4	Very low	89 Å²	89	86 Å²	86	48%	0.476	45%	0.447	S	S	.	.	H	α-helix	trans	-76.9	-9.1	-179.1	-73.8	-29.1	0	0	0	113.9	P914 R920 N1078	P914-N918 WeakPolarHBondContact O-CB 3.3Å; P914-N918 PolarHBondContact O-N 2.84Å; P914-N918 PolarHBondContact O-ND2 3.07Å; N918-R920 PolarHBondContact O-N 2.9Å; N918-N1078 PolarHBondContact ND2-OD1 3.21Å; N918-N1078 VanDerWaalsContact ND2-OD1 3.12Å
919	R	38.8	Very low	41.9	Very low	190 Å²	190	88.7 Å²	88.7	72%	0.717	46%	0.462	S	S	*	.	S	Bend	trans	-66.9	112.2	155.5	-82.6	-169	173.2	-163.1	-2.5	107.7	S915 L917 Y921	S915-R919 PolarHBondContact O-N 2.84Å; L917-R919 VanDerWaalsContact C-N 3.28Å; L917-R919 PolarHBondContact O-N 3.12Å; R919-Y921 PolarHBondContact O-N 3.16Å
920	R	36.6	Very low	40	Very low	169 Å²	169	96.3 Å²	96.3	64%	0.638	50%	0.5	S	S	*	.			trans	-48.1	106.3	157	-61.8	-175.1	-168.7	-162.6	2.7	106.1	N918 G922	N918-R920 PolarHBondContact O-N 2.9Å; R920-G922 PolarHBondContact O-N 3.41Å
921	Y	34.9	Very low	38.4	Very low	62 Å²	62	95.5 Å²	95.5	24%	0.243	50%	0.502	C	S	.	.			trans	-67	114	-172.9	-93.2	-71.6	0	0	0	108.5	L916 R919 C923 H941 V943	L916-Y921 WeakPolarHBondContact O-CE2 3.43Å; L916-Y921 PolarHBondContact O-OH 3.07Å; R919-Y921 PolarHBondContact O-N 3.16Å; Y921-C923 PolarHBondContact O-N 3.27Å; Y921-H941 WeakPolarHBondContact CD1-O 3.48Å; Y921-H941 HydrophobicContact CE1-CB 3.96Å; Y921-H941 AromaticContact CE1-ND1 3.9Å; Y921-H941 WeakPolarHBondContact CE1-O 3.32Å; Y921-H941 AromaticContact CZ-ND1 3.96Å; Y921-H941 PolarHBondContact OH-ND1 3.48Å; Y921-H941 VanDerWaalsContact OH-ND1 3.12Å; Y921-V943 WeakPolarHBondContact OH-CG2 3.4Å
922	G	28	Very low	37.2	Very low	45 Å²	45	97.6 Å²	97.6	46%	0.464	51%	0.509	S	S	.	.			trans	-66.7	71.3	179.7	0	0	0	0	0	111.9	R920 E924	R920-G922 PolarHBondContact O-N 3.41Å; G922-E924 PolarHBondContact O-N 2.89Å
923	C	30.2	Very low	36.1	Very low	45 Å²	45	103.9 Å²	103.9	30%	0.304	54%	0.538	S	S	.	.			trans	-67.4	90	133.7	-69.8	0	0	0	0	106.6	Y921 S925 P1035	Y921-C923 PolarHBondContact O-N 3.27Å; C923-S925 PolarHBondContact O-N 3.29Å; C923-P1035 HydrophobicContact CB-CB 4.48Å
924	E	26.9	Very low	35	Very low	137 Å²	137	108.7 Å²	108.7	64%	0.64	56%	0.558	S	S	*	*				-47.5	124.7	124.3	-69.6	179.9	155.8	0	0	105.4	G922 Q938	G922-E924 PolarHBondContact O-N 2.89Å; E924-Q938 PolarHBondContact OE1-NE2 2.86Å; E924-Q938 PolarHBondContact OE2-NE2 3.32Å
925	S	27.3	Very low	34.4	Very low	86 Å²	86	117.2 Å²	117.2	60%	0.601	59%	0.592	S	S	*	*			trans	-50.9	138.3	178.7	-68	0	0	0	0	108.5	C923 E927	C923-S925 PolarHBondContact O-N 3.29Å; S925-E927 PolarHBondContact O-N 2.74Å
926	P	31	Very low	33.6	Very low	84 Å²	84	124.2 Å²	124.2	55%	0.545	61%	0.614	S	S	.	*			trans	-64.4	82.7	145.4	30.7	-29.4	0	0	0	105.6
927	E	28.8	Very low	32.9	Very low	160 Å²	160	126.6 Å²	126.6	75%	0.748	64%	0.635	S	S	*	*			trans	-54.2	148	160.8	-63.5	-166.1	124.8	0	0	107.2	S925 D929	S925-E927 PolarHBondContact O-N 2.74Å; E927-D929 PolarHBondContact O-N 2.85Å
928	L	35.9	Very low	32.4	Very low	186 Å²	186	131.5 Å²	131.5	97%	0.974	66%	0.657	S	S	*	*	S	Bend	trans	-78	67.4	-173.7	-74.4	151.5	0	0	0	109.9
929	D	29.3	Very low	32.3	Very low	104 Å²	104	131.7 Å²	131.7	56%	0.556	66%	0.664	S	S	*	*			trans	-128.1	113.5	-179.1	-162.6	-28.3	0	0	0	108.4	E927 S931	E927-D929 PolarHBondContact O-N 2.85Å; D929-S931 PolarHBondContact O-N 3.3Å; D929-S931 WeakPolarHBondContact OD1-CB 3.27Å; D929-S931 PolarHBondContact OD1-N 2.92Å; D929-S931 PolarHBondContact OD1-OG 2.9Å
930	D	34.4	Very low	33	Very low	181 Å²	181	125.3 Å²	125.3	97%	0.968	65%	0.649	S	S	*	*	S	Bend	trans	-71.3	16.6	-175.6	-68.1	-53.8	0	0	0	113.3
931	S	28.9	Very low	34.3	Very low	72 Å²	72	119.6 Å²	119.6	50%	0.503	63%	0.629	S	S	.	*			trans	-107.5	50.9	-171.5	66.1	0	0	0	0	113.8	D929 H933	D929-S931 PolarHBondContact O-N 3.3Å; D929-S931 WeakPolarHBondContact OD1-CB 3.27Å; D929-S931 PolarHBondContact OD1-N 2.92Å; D929-S931 PolarHBondContact OD1-OG 2.9Å; S931-H933 PolarHBondContact O-N 3.1Å
932	F	31.1	Very low	36.1	Very low	180 Å²	180	118.7 Å²	118.7	79%	0.789	63%	0.627	S	S	*	*			trans	-69.5	28	-179	-130.8	-86.6	0	0	0	115.7
933	H	31.7	Very low	38.2	Very low	141 Å²	141	117 Å²	117	65%	0.653	61%	0.608	S	S	*	*			trans	-86.1	118.7	178.7	-73.2	-27.1	0	0	0	112.7	S931 E993	S931-H933 PolarHBondContact O-N 3.1Å; H933-E993 IonicContact CE1-OE2 2.77Å; H933-E993 PolarHBondContact CE1-OE2 3.21Å; H933-E993 IonicContact ND1-OE2 2.71Å; H933-E993 PolarHBondContact ND1-OE2 3.13Å
934	Q	29.3	Very low	40.5	Very low	182 Å²	182	114.9 Å²	114.9	85%	0.85	59%	0.593	S	S	*	*			trans	66.4	68.4	152.7	-51.7	-176.6	27.7	0	0	118.9
935	K	32	Very low	42.9	Very low	208 Å²	208	108.4 Å²	108.4	90%	0.904	56%	0.563	S	S	*	*			trans	-141.2	140	141	-107.2	157.9	-169.9	170.4	0	110.8
936	K	31.6	Very low	45.4	Very low	216 Å²	216	104.4 Å²	104.4	94%	0.939	54%	0.535	S	S	*	.			trans	-121.6	25.7	-150.3	-141.7	170.4	-168.6	167.5	0	114.2
937	S	34	Very low	47.6	Very low	102 Å²	102	100.5 Å²	100.5	71%	0.713	51%	0.509	S	S	*	.			trans	-136.6	-3.4	-155.4	51.4	0	0	0	0	117.6
938	Q	38.8	Very low	49.5	Very low	123 Å²	123	93.6 Å²	93.6	58%	0.575	48%	0.478	S	S	*	.			trans	-124.2	98	171.3	-67.6	-163.9	65.4	0	0	110	E924 S940	E924-Q938 PolarHBondContact OE1-NE2 2.86Å; E924-Q938 PolarHBondContact OE2-NE2 3.32Å; Q938-S940 PolarHBondContact O-N 2.92Å
939	C	37.9	Very low	50.9	Low	92 Å²	92	86.6 Å²	86.6	62%	0.622	44%	0.442	S	S	*	.			trans	-83.1	106.7	171.5	-151.1	0	0	0	0	107.7	H941	C939-H941 PolarHBondContact O-N 3.36Å
940	S	55.5	Low	52.3	Low	57 Å²	57	81.9 Å²	81.9	40%	0.399	42%	0.417	S	S	.	.			trans	-64.5	108	171.2	40.4	0	0	0	0	108.4	Q938 F942	Q938-S940 PolarHBondContact O-N 2.92Å; S940-F942 WeakPolarHBondContact O-CD2 3.34Å; S940-F942 WeakPolarHBondContact O-CE2 3.42Å
941	H	63.6	Low	53.2	Low	49 Å²	49	76.5 Å²	76.5	23%	0.227	39%	0.393	C	S	.	.			trans	-80.2	148.4	175.1	-178.4	-88.2	0	0	0	108.9	G874 T876 Y921 C939	G874-H941 CarbonylContact O-C 3.59Å; G874-H941 VanDerWaalsContact O-CA 3.25Å; G874-H941 WeakPolarHBondContact O-CA 3.34Å; G874-H941 PolarHBondContact O-CD2 3.41Å; T876-H941 PolarHBondContact OG1-CE1 3.26Å; T876-H941 PolarHBondContact OG1-NE2 2.97Å; Y921-H941 WeakPolarHBondContact CD1-O 3.48Å; Y921-H941 HydrophobicContact CE1-CB 3.96Å; Y921-H941 AromaticContact CE1-ND1 3.9Å; Y921-H941 WeakPolarHBondContact CE1-O 3.32Å; Y921-H941 AromaticContact CZ-ND1 3.96Å; Y921-H941 PolarHBondContact OH-ND1 3.48Å; Y921-H941 VanDerWaalsContact OH-ND1 3.12Å; C939-H941 PolarHBondContact O-N 3.36Å
942	F	71.8	Confident	54.1	Low	43 Å²	43	79.7 Å²	79.7	19%	0.189	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	153.4	-177.5	-63	-82.5	0	0	0	109.9	G874 W875 T876 S940 L999	G874-F942 PolarHBondContact O-N 3.46Å; W875-F942 WeakPolarHBondContact CA-O 3.06Å; W875-F942 HydrophobicContact CD2-CB 3.53Å; W875-F942 HydrophobicContact CD2-CD2 4.41Å; W875-F942 HydrophobicContact CD2-CG 4.2Å; W875-F942 HydrophobicContact CE3-CB 3.42Å; W875-F942 VanDerWaalsContact CE3-CB 3.42Å; W875-F942 HydrophobicContact CE3-CG 4.36Å; W875-F942 HydrophobicContact CG-CB 4.12Å; W875-F942 HydrophobicContact CH2-CB 4.06Å; W875-F942 HydrophobicContact CH2-CD1 4.42Å; W875-F942 HydrophobicContact CH2-CG 4.25Å; W875-F942 HydrophobicContact CZ2-CB 4.16Å; W875-F942 HydrophobicContact CZ2-CD1 4.47Å; W875-F942 HydrophobicContact CZ2-CD2 4.34Å; W875-F942 HydrophobicContact CZ2-CG 4.08Å; W875-F942 HydrophobicContact CZ3-CB 3.7Å; W875-F942 HydrophobicContact CZ3-CG 4.38Å; T876-F942 PolarHBondContact N-O 3.13Å; S940-F942 WeakPolarHBondContact O-CD2 3.34Å; S940-F942 WeakPolarHBondContact O-CE2 3.42Å; F942-L999 HydrophobicContact CE1-CD2 4.33Å; F942-L999 HydrophobicContact CZ-CD2 4.11Å
943	V	72.5	Confident	55	Low	10 Å²	10	71.3 Å²	71.3	6%	0.061	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139	174.1	-174.2	0	0	0	0	108.6	T876 I878 Y921 V966 P967	T876-V943 CarbonylContact O-C 3.17Å; T876-V943 WeakPolarHBondContact O-CA 3.18Å; I878-V943 HydrophobicContact CD1-CG1 4.25Å; Y921-V943 WeakPolarHBondContact OH-CG2 3.4Å; V943-V966 HydrophobicContact CB-CG1 4.33Å; V943-V966 HydrophobicContact CB-CG2 4.42Å; V943-V966 HydrophobicContact CG1-CG1 3.94Å; V943-V966 HydrophobicContact CG1-CG2 4.35Å; V943-P967 WeakPolarHBondContact O-CD 3.44Å
944	A	77.5	Confident	56.2	Low	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.4	173	0	0	0	0	0	111.7	W875 T876 I877 I878 P967 L969 W973	W875-A944 HydrophobicContact CE3-CB 4.1Å; W875-A944 HydrophobicContact CZ3-CB 4.05Å; T876-A944 PolarHBondContact O-N 3.01Å; I877-A944 HydrophobicContact CG1-CB 4.46Å; I878-A944 PolarHBondContact N-O 3.29Å; A944-P967 HydrophobicContact CB-CG 4.3Å; A944-L969 HydrophobicContact CB-CD1 4.34Å; A944-W973 HydrophobicContact CB-CH2 3.54Å; A944-W973 HydrophobicContact CB-CZ3 3.69Å
945	L	78.4	Confident	57.6	Low	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121.7	169.6	-74.3	161.4	0	0	0	108.2	I878 T880 I912 F957 A961 V966 P967 L968 L969	I878-L945 HydrophobicContact CB-CD2 4.05Å; I878-L945 HydrophobicContact CG2-CD2 4Å; T880-L945 HydrophobicContact CG2-CD2 3.63Å; I912-L945 HydrophobicContact CD1-CD1 4.39Å; I912-L945 HydrophobicContact CD1-CD2 4.15Å; I912-L945 HydrophobicContact CD1-CG 4.41Å; L945-F957 HydrophobicContact CD1-CB 4.1Å; L945-F957 VanDerWaalsContact CD1-O 3.3Å; L945-F957 WeakPolarHBondContact CD1-O 3.34Å; L945-F957 HydrophobicContact CD2-CB 3.74Å; L945-F957 HydrophobicContact CD2-CD1 3.91Å; L945-F957 HydrophobicContact CD2-CD2 4.18Å; L945-F957 HydrophobicContact CD2-CG 3.69Å; L945-A961 HydrophobicContact CD1-CB 3.91Å; L945-V966 HydrophobicContact CB-CG1 4.24Å; L945-V966 HydrophobicContact CD1-CB 4.18Å; L945-V966 HydrophobicContact CD1-CG1 3.76Å; L945-V966 HydrophobicContact CG-CG1 3.66Å; L945-P967 PolarHBondContact N-O 3Å; L945-L968 HydrophobicContact CB-CD1 3.94Å; L945-L968 CarbonylContact O-C 3.46Å; L945-L968 WeakPolarHBondContact O-CA 3.46Å; L945-L969 PolarHBondContact O-N 3.23Å
946	V	80.6	Confident	58.9	Low	2 Å²	2	52.6 Å²	52.6	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129	177.2	-179.5	0	0	0	0	109.3	I877 I878 L879 T880 L969 I971 W973 L974	I877-V946 HydrophobicContact CG2-CB 4.44Å; I877-V946 HydrophobicContact CG2-CG2 3.87Å; I878-V946 PolarHBondContact O-N 3.04Å; L879-V946 HydrophobicContact CD2-CB 3.9Å; L879-V946 HydrophobicContact CD2-CG1 4.15Å; T880-V946 PolarHBondContact N-O 3.31Å; T880-V946 PolarHBondContact OG1-O 2.81Å; V946-L969 WeakPolarHBondContact CA-O 3.24Å; V946-L969 HydrophobicContact CG2-CB 4.47Å; V946-I971 HydrophobicContact CG1-CB 4.49Å; V946-I971 HydrophobicContact CG1-CG1 3.82Å; V946-W973 HydrophobicContact CG2-CE3 3.97Å; V946-W973 HydrophobicContact CG2-CZ3 3.94Å; V946-L974 HydrophobicContact CG1-CD1 4.01Å; V946-L974 HydrophobicContact CG2-CD1 4.19Å; V946-L974 HydrophobicContact CG2-CD2 4.47Å; V946-L974 HydrophobicContact CG2-CG 4.31Å
947	S	75.3	Confident	60.3	Low	2 Å²	2	42.7 Å²	42.7	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	167.1	177.7	-175.6	0	0	0	0	109.7	D949 L969 R970	S947-D949 PolarHBondContact OG-N 3.3Å; S947-D949 PolarHBondContact OG-O 3.38Å; S947-L969 PolarHBondContact N-O 3.39Å; S947-R970 WeakPolarHBondContact O-CA 3.5Å
948	T	69.8	Low	61.6	Low	15 Å²	15	38.9 Å²	38.9	9%	0.092	20%	0.2	C	C	.	.	S	Bend	trans	-86.8	-29.4	167.7	41.3	0	0	0	0	112.5	G882 K884 Y886 I971	G882-T948 WeakPolarHBondContact O-CG2 3.45Å; G882-T948 PolarHBondContact O-OG1 3.18Å; G882-T948 VanDerWaalsContact O-OG1 3.1Å; K884-T948 WeakPolarHBondContact O-CG2 3.44Å; Y886-T948 WeakPolarHBondContact CE2-O 3.4Å; T948-I971 HydrophobicContact CG2-CD1 3.5Å; T948-I971 HydrophobicContact CG2-CG1 4.23Å
949	D	64.8	Low	62.7	Low	39 Å²	39	33 Å²	33	21%	0.209	17%	0.173	C	C	.	.			trans	-148.6	149.4	-173.8	-168.8	2.4	0	0	0	110.8	S947 C951 R952	S947-D949 PolarHBondContact OG-N 3.3Å; S947-D949 PolarHBondContact OG-O 3.38Å; D949-C951 PolarHBondContact O-N 3.19Å; D949-C951 PolarHBondContact OD2-SG 2.75Å; D949-R952 PolarHBondContact O-N 3.27Å
950	C	59.6	Low	63.9	Low	5 Å²	5	28.8 Å²	28.8	3%	0.034	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.3	173.3	57.1	0	0	0	0	112.8	R952 Q958 L1011 P1012 F1015	C950-R952 VanDerWaalsContact C-N 3.28Å; C950-R952 PolarHBondContact O-N 2.89Å; C950-Q958 PolarHBondContact O-NE2 3.39Å; C950-L1011 HydrophobicContact CB-CB 4.33Å; C950-P1012 HydrophobicContact CB-CB 3.87Å; C950-P1012 HydrophobicContact CB-CG 4.28Å; C950-P1012 WeakPolarHBondContact CB-O 3.25Å; C950-F1015 WeakPolarHBondContact SG-CE2 3.48Å; C950-F1015 VanDerWaalsContact SG-CZ 3.51Å
951	C	52.1	Low	64.2	Low	69 Å²	69	26.1 Å²	26.1	47%	0.466	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-11.6	179	-51.3	0	0	0	0	115.4	D949 F1015	D949-C951 PolarHBondContact O-N 3.19Å; D949-C951 PolarHBondContact OD2-SG 2.75Å; C951-F1015 WeakPolarHBondContact SG-CE2 3.48Å
952	R	47.7	Very low	64.1	Low	138 Å²	138	24 Å²	24	52%	0.521	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-12.9	-158	-94.6	-177.9	164.2	-145.3	-12.2	118.3	T880 D949 C950 L954	T880-R952 VanDerWaalsContact O-O 3.08Å; D949-R952 PolarHBondContact O-N 3.27Å; C950-R952 VanDerWaalsContact C-N 3.28Å; C950-R952 PolarHBondContact O-N 2.89Å; R952-L954 PolarHBondContact O-N 2.81Å
953	T	50.7	Low	63.6	Low	4 Å²	4	22.4 Å²	22.4	3%	0.025	11%	0.109	C	C	.	.	S	Bend	trans	-54	129.6	160.6	11.2	0	0	0	0	108.8	T880 K955 F957 Q958 L968	T880-T953 HydrophobicContact CG2-CG2 4.02Å; T880-T953 WeakPolarHBondContact OG1-CG2 3.49Å; T953-K955 PolarHBondContact O-N 3.03Å; T953-F957 HydrophobicContact CG2-CB 3.76Å; T953-Q958 VanDerWaalsContact OG1-CG 3.24Å; T953-Q958 WeakPolarHBondContact OG1-CG 3.38Å; T953-L968 HydrophobicContact CG2-CD1 3.53Å; T953-L968 HydrophobicContact CG2-CD2 4.4Å
954	L	57	Low	62.7	Low	43 Å²	43	22.5 Å²	22.5	23%	0.225	11%	0.113	C	C	.	.			trans	-43	138.3	165.8	-79.7	158.4	0	0	0	109.1	D85 L89 R952 Y956 F957 Q958	D85-L954 HydrophobicContact CB-CD2 3.71Å; D85-L954 VanDerWaalsContact O-CD2 3.32Å; D85-L954 WeakPolarHBondContact O-CD2 3.32Å; L89-L954 HydrophobicContact CD1-CD1 4.17Å; R952-L954 PolarHBondContact O-N 2.81Å; L954-Y956 PolarHBondContact O-N 3.43Å; L954-F957 HydrophobicContact CB-CD2 3.81Å; L954-F957 HydrophobicContact CB-CE2 4.4Å; L954-F957 HydrophobicContact CB-CG 4.41Å; L954-F957 HydrophobicContact CD1-CD2 4.02Å; L954-F957 HydrophobicContact CD1-CE2 3.78Å; L954-F957 HydrophobicContact CG-CD2 4.45Å; L954-F957 CarbonylContact O-C 3.59Å; L954-F957 WeakPolarHBondContact O-CA 3.25Å; L954-F957 WeakPolarHBondContact O-CB 3.43Å; L954-F957 PolarHBondContact O-N 3.11Å; L954-Q958 PolarHBondContact O-N 3.27Å
955	K	58.2	Low	61.8	Low	72 Å²	72	26.7 Å²	26.7	31%	0.313	14%	0.142	S	C	.	.	H	α-helix	trans	-55	-33.1	-171.1	-65.6	165.5	156.9	-171.5	0	113.1	T953 Q958 A959 D1159 I1162	T953-K955 PolarHBondContact O-N 3.03Å; K955-Q958 WeakPolarHBondContact O-CB 3.48Å; K955-Q958 PolarHBondContact O-N 3.35Å; K955-A959 WeakPolarHBondContact O-CB 3.22Å; K955-A959 PolarHBondContact O-N 2.93Å; K955-D1159 WeakPolarHBondContact CD-OD1 3.42Å; K955-D1159 WeakPolarHBondContact CE-OD1 3.16Å; K955-D1159 IonicContact NZ-OD1 2.94Å; K955-D1159 PolarHBondContact NZ-OD1 2.91Å; K955-D1159 IonicContact NZ-OD2 3.27Å; K955-D1159 PolarHBondContact NZ-OD2 2.65Å; K955-I1162 HydrophobicContact CB-CD1 3.39Å; K955-I1162 HydrophobicContact CB-CG1 4.03Å; K955-I1162 HydrophobicContact CB-CG2 4.21Å; K955-I1162 HydrophobicContact CD-CD1 3.84Å; K955-I1162 HydrophobicContact CG-CD1 4.06Å
956	Y	59.9	Low	61.2	Low	23 Å²	23	26.7 Å²	26.7	9%	0.09	14%	0.142	C	C	.	.	H	α-helix	trans	-58.1	-40.6	169.6	-178	-94.1	0	0	0	114.1	F86 L954 A959 L960 G1075 I1079	F86-Y956 HydrophobicContact CE1-CD1 4.45Å; F86-Y956 AromaticContact CE1-CD2 3.92Å; F86-Y956 HydrophobicContact CE1-CD2 3.92Å; F86-Y956 HydrophobicContact CE1-CE2 4.33Å; F86-Y956 HydrophobicContact CE1-CG 4.01Å; F86-Y956 AromaticContact CZ-CD2 3.91Å; F86-Y956 HydrophobicContact CZ-CD2 3.91Å; F86-Y956 HydrophobicContact CZ-CG 4.16Å; L954-Y956 PolarHBondContact O-N 3.43Å; Y956-A959 WeakPolarHBondContact O-CB 3.37Å; Y956-L960 HydrophobicContact CD1-CD1 4.07Å; Y956-L960 HydrophobicContact CE1-CD1 3.53Å; Y956-L960 PolarHBondContact O-N 2.8Å; Y956-L960 VanDerWaalsContact O-N 3.07Å; Y956-G1075 WeakPolarHBondContact OH-CA 3.27Å; Y956-I1079 HydrophobicContact CD1-CD1 4.33Å; Y956-I1079 HydrophobicContact CD2-CD1 3.26Å; Y956-I1079 HydrophobicContact CD2-CG1 4.16Å; Y956-I1079 HydrophobicContact CE1-CD1 4.34Å; Y956-I1079 HydrophobicContact CE2-CD1 3.25Å; Y956-I1079 HydrophobicContact CE2-CG1 3.62Å; Y956-I1079 HydrophobicContact CG-CD1 3.81Å; Y956-I1079 WeakPolarHBondContact O-CD1 3.42Å
957	F	61.6	Low	60.8	Low	9 Å²	9	28.1 Å²	28.1	4%	0.039	15%	0.152	C	C	.	.	H	α-helix	trans	-78.8	-30.5	175.1	-65.3	-34.6	0	0	0	113.2	I878 T880 I912 L945 T953 L954 L960 A961	I878-F957 HydrophobicContact CG2-CE2 4.16Å; I878-F957 HydrophobicContact CG2-CZ 4.17Å; T880-F957 HydrophobicContact CG2-CB 4.47Å; T880-F957 HydrophobicContact CG2-CD2 3.41Å; T880-F957 VanDerWaalsContact CG2-CD2 3.41Å; T880-F957 HydrophobicContact CG2-CE2 3.86Å; T880-F957 HydrophobicContact CG2-CG 4.15Å; I912-F957 HydrophobicContact CB-CE1 4.07Å; I912-F957 HydrophobicContact CD1-CD1 3.74Å; I912-F957 HydrophobicContact CD1-CE1 3.82Å; I912-F957 HydrophobicContact CG1-CD1 4.14Å; I912-F957 HydrophobicContact CG1-CE1 3.67Å; L945-F957 HydrophobicContact CD1-CB 4.1Å; L945-F957 VanDerWaalsContact CD1-O 3.3Å; L945-F957 WeakPolarHBondContact CD1-O 3.34Å; L945-F957 HydrophobicContact CD2-CB 3.74Å; L945-F957 HydrophobicContact CD2-CD1 3.91Å; L945-F957 HydrophobicContact CD2-CD2 4.18Å; L945-F957 HydrophobicContact CD2-CG 3.69Å; T953-F957 HydrophobicContact CG2-CB 3.76Å; L954-F957 HydrophobicContact CB-CD2 3.81Å; L954-F957 HydrophobicContact CB-CE2 4.4Å; L954-F957 HydrophobicContact CB-CG 4.41Å; L954-F957 HydrophobicContact CD1-CD2 4.02Å; L954-F957 HydrophobicContact CD1-CE2 3.78Å; L954-F957 HydrophobicContact CG-CD2 4.45Å; L954-F957 CarbonylContact O-C 3.59Å; L954-F957 WeakPolarHBondContact O-CA 3.25Å; L954-F957 WeakPolarHBondContact O-CB 3.43Å; L954-F957 PolarHBondContact O-N 3.11Å; F957-L960 HydrophobicContact CD1-CD1 4.47Å; F957-L960 PolarHBondContact O-N 2.78Å; F957-A961 VanDerWaalsContact O-CB 3.29Å; F957-A961 WeakPolarHBondContact O-CB 3.38Å; F957-A961 PolarHBondContact O-N 3.08Å
958	Q	60.5	Low	60.9	Low	21 Å²	21	28.1 Å²	28.1	10%	0.098	15%	0.151	C	C	.	.	H	α-helix	trans	-58.5	-51.1	165.7	-70.6	172.4	-33.8	0	0	109.8	C950 T953 L954 K955 L960 A961 T962	C950-Q958 PolarHBondContact O-NE2 3.39Å; T953-Q958 VanDerWaalsContact OG1-CG 3.24Å; T953-Q958 WeakPolarHBondContact OG1-CG 3.38Å; L954-Q958 PolarHBondContact O-N 3.27Å; K955-Q958 WeakPolarHBondContact O-CB 3.48Å; K955-Q958 PolarHBondContact O-N 3.35Å; Q958-L960 VanDerWaalsContact C-N 3.35Å; Q958-L960 PolarHBondContact O-N 3.2Å; Q958-A961 WeakPolarHBondContact O-CA 3.38Å; Q958-A961 WeakPolarHBondContact O-CB 3.34Å; Q958-A961 PolarHBondContact O-N 2.74Å; Q958-T962 WeakPolarHBondContact O-CG2 3.29Å; Q958-T962 PolarHBondContact O-N 3.48Å; Q958-T962 PolarHBondContact O-OG1 3.19Å
959	A	62.2	Low	61.4	Low	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-55.3	-42.2	177.4	0	0	0	0	0	113.7	K955 Y956 T962 L963 W1076 I1079 L1165	K955-A959 WeakPolarHBondContact O-CB 3.22Å; K955-A959 PolarHBondContact O-N 2.93Å; Y956-A959 WeakPolarHBondContact O-CB 3.37Å; A959-T962 VanDerWaalsContact C-OG1 3.29Å; A959-T962 VanDerWaalsContact CA-OG1 3.26Å; A959-T962 WeakPolarHBondContact CA-OG1 3.41Å; A959-T962 PolarHBondContact O-N 3.05Å; A959-T962 PolarHBondContact O-OG1 3.15Å; A959-L963 PolarHBondContact O-N 3.29Å; A959-W1076 HydrophobicContact CB-CH2 4.11Å; A959-W1076 HydrophobicContact CB-CZ3 4.48Å; A959-I1079 HydrophobicContact CB-CD1 3.98Å; A959-I1079 HydrophobicContact CB-CG2 4.32Å; A959-L1165 HydrophobicContact CB-CD1 3.64Å
960	L	63.1	Low	62.3	Low	4 Å²	4	30 Å²	30	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-71.8	-34.1	174.3	-78.7	171.5	0	0	0	113.5	I912 L917 Y956 F957 Q958 T962 L963 I1079 L1082	I912-L960 HydrophobicContact CB-CD1 4.1Å; I912-L960 HydrophobicContact CD1-CB 4.41Å; I912-L960 HydrophobicContact CD1-CD1 3.62Å; I912-L960 HydrophobicContact CG1-CD1 4.4Å; I912-L960 HydrophobicContact CG2-CD1 4.08Å; L917-L960 HydrophobicContact CD1-CD1 4.15Å; L917-L960 HydrophobicContact CD1-CD2 3.43Å; L917-L960 VanDerWaalsContact CD1-CD2 3.43Å; L917-L960 HydrophobicContact CD1-CG 4.42Å; Y956-L960 HydrophobicContact CD1-CD1 4.07Å; Y956-L960 HydrophobicContact CE1-CD1 3.53Å; Y956-L960 PolarHBondContact O-N 2.8Å; Y956-L960 VanDerWaalsContact O-N 3.07Å; F957-L960 HydrophobicContact CD1-CD1 4.47Å; F957-L960 PolarHBondContact O-N 2.78Å; Q958-L960 VanDerWaalsContact C-N 3.35Å; Q958-L960 PolarHBondContact O-N 3.2Å; L960-T962 VanDerWaalsContact C-N 3.31Å; L960-L963 HydrophobicContact CD2-CD1 4.39Å; L960-I1079 HydrophobicContact CD1-CD1 4.18Å; L960-I1079 HydrophobicContact CD1-CG1 4.23Å; L960-I1079 HydrophobicContact CD2-CD1 4.29Å; L960-I1079 HydrophobicContact CD2-CG1 3.8Å; L960-I1079 HydrophobicContact CG-CD1 3.73Å; L960-I1079 HydrophobicContact CG-CG1 3.79Å; L960-L1082 HydrophobicContact CD2-CD1 4.45Å
961	A	61.3	Low	63.6	Low	1 Å²	1	30.6 Å²	30.6	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-67.3	-34.1	173.8	0	0	0	0	0	112.4	L945 F957 Q958 G964 V966 L968 R1013	L945-A961 HydrophobicContact CD1-CB 3.91Å; F957-A961 VanDerWaalsContact O-CB 3.29Å; F957-A961 WeakPolarHBondContact O-CB 3.38Å; F957-A961 PolarHBondContact O-N 3.08Å; Q958-A961 WeakPolarHBondContact O-CA 3.38Å; Q958-A961 WeakPolarHBondContact O-CB 3.34Å; Q958-A961 PolarHBondContact O-N 2.74Å; A961-G964 VanDerWaalsContact O-CA 3.29Å; A961-G964 WeakPolarHBondContact O-CA 3.19Å; A961-G964 PolarHBondContact O-N 2.98Å; A961-V966 WeakPolarHBondContact CA-O 3.27Å; A961-L968 HydrophobicContact CB-CB 3.63Å; A961-L968 HydrophobicContact CB-CD2 4.33Å; A961-R1013 VanDerWaalsContact O-CZ 3.29Å; A961-R1013 PolarHBondContact O-NH1 3.06Å
962	T	61.6	Low	65.2	Low	4 Å²	4	29.6 Å²	29.6	3%	0.025	15%	0.146	C	C	.	.	H	α-helix	trans	-77.8	-22.1	-179	46.8	0	0	0	0	113.7	Q958 A959 L960 G964 R1013 V1028 L1165 I1166	Q958-T962 WeakPolarHBondContact O-CG2 3.29Å; Q958-T962 PolarHBondContact O-N 3.48Å; Q958-T962 PolarHBondContact O-OG1 3.19Å; A959-T962 VanDerWaalsContact C-OG1 3.29Å; A959-T962 VanDerWaalsContact CA-OG1 3.26Å; A959-T962 WeakPolarHBondContact CA-OG1 3.41Å; A959-T962 PolarHBondContact O-N 3.05Å; A959-T962 PolarHBondContact O-OG1 3.15Å; L960-T962 VanDerWaalsContact C-N 3.31Å; T962-G964 PolarHBondContact O-N 2.79Å; T962-R1013 HydrophobicContact CG2-CB 3.72Å; T962-R1013 HydrophobicContact CG2-CG 4.14Å; T962-V1028 WeakPolarHBondContact O-CG1 3.33Å; T962-V1028 WeakPolarHBondContact O-CG2 3.25Å; T962-L1165 VanDerWaalsContact CB-O 3.3Å; T962-L1165 WeakPolarHBondContact CB-O 3.4Å; T962-I1166 HydrophobicContact CG2-CB 4.12Å; T962-I1166 HydrophobicContact CG2-CG1 3.87Å; T962-I1166 HydrophobicContact CG2-CG2 4.38Å
963	L	60.5	Low	67.1	Low	9 Å²	9	23 Å²	23	5%	0.047	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	0.7	160.8	-68	173.3	0	0	0	113	A959 L960 S965 Y1032 I1079 L1082 A1083 L1165	A959-L963 PolarHBondContact O-N 3.29Å; L960-L963 HydrophobicContact CD2-CD1 4.39Å; L963-S965 PolarHBondContact O-N 3.2Å; L963-S965 PolarHBondContact O-OG 2.96Å; L963-Y1032 WeakPolarHBondContact O-CB 3.38Å; L963-Y1032 WeakPolarHBondContact O-CD1 3.4Å; L963-I1079 HydrophobicContact CD1-CG2 4.12Å; L963-L1082 HydrophobicContact CD1-CB 4.01Å; L963-A1083 HydrophobicContact CD1-CB 4.41Å; L963-A1083 HydrophobicContact CD2-CB 3.87Å; L963-L1165 HydrophobicContact CD2-CD2 3.66Å; L963-L1165 HydrophobicContact CG-CD2 4.01Å
964	G	55.1	Low	69	Low	13 Å²	13	22.8 Å²	22.8	13%	0.134	12%	0.12	C	C	.	.	S	Bend	trans	63.5	-18.3	171.9	0	0	0	0	0	117	A961 T962 V966 Y1032	A961-G964 VanDerWaalsContact O-CA 3.29Å; A961-G964 WeakPolarHBondContact O-CA 3.19Å; A961-G964 PolarHBondContact O-N 2.98Å; T962-G964 PolarHBondContact O-N 2.79Å; G964-V966 PolarHBondContact O-N 2.92Å; G964-Y1032 CarbonylContact C-O 3.56Å
965	S	56.8	Low	70.5	Confident	87 Å²	87	21.2 Å²	21.2	61%	0.608	11%	0.112	S	C	*	.	S	Bend	trans	-58.8	-19.6	176.2	-58.4	0	0	0	0	113.1	L963	L963-S965 PolarHBondContact O-N 3.2Å; L963-S965 PolarHBondContact O-OG 2.96Å
966	V	67.7	Low	72	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.006	10%	0.101	C	C	.	.	S	Bend	trans	-126.4	121.7	170.3	-170.3	0	0	0	0	108.5	L917 V943 L945 A961 G964	L917-V966 HydrophobicContact CD2-CG2 3.78Å; V943-V966 HydrophobicContact CB-CG1 4.33Å; V943-V966 HydrophobicContact CB-CG2 4.42Å; V943-V966 HydrophobicContact CG1-CG1 3.94Å; V943-V966 HydrophobicContact CG1-CG2 4.35Å; L945-V966 HydrophobicContact CB-CG1 4.24Å; L945-V966 HydrophobicContact CD1-CB 4.18Å; L945-V966 HydrophobicContact CD1-CG1 3.76Å; L945-V966 HydrophobicContact CG-CG1 3.66Å; A961-V966 WeakPolarHBondContact CA-O 3.27Å; G964-V966 PolarHBondContact O-N 2.92Å
967	P	72.2	Confident	73.4	Confident	32 Å²	32	17.5 Å²	17.5	21%	0.208	10%	0.097	C	C	.	.			trans	-71.2	142	175	30.7	-35	0	0	0	110.7	V943 A944 L945 L969 L1002	V943-P967 WeakPolarHBondContact O-CD 3.44Å; A944-P967 HydrophobicContact CB-CG 4.3Å; L945-P967 PolarHBondContact N-O 3Å; P967-L969 HydrophobicContact CB-CD1 4.03Å; P967-L969 HydrophobicContact CB-CD2 3.97Å; P967-L969 HydrophobicContact CB-CG 3.92Å; P967-L969 HydrophobicContact CG-CD1 3.97Å; P967-L969 HydrophobicContact CG-CG 4.35Å; P967-L1002 HydrophobicContact CG-CD1 4.43Å
968	L	76.6	Confident	74.8	Confident	1 Å²	1	17 Å²	17	1%	0.005	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	114.4	171.4	175	61.2	0	0	0	109.6	L945 T953 A961 E1010 L1011	L945-L968 HydrophobicContact CB-CD1 3.94Å; L945-L968 CarbonylContact O-C 3.46Å; L945-L968 WeakPolarHBondContact O-CA 3.46Å; T953-L968 HydrophobicContact CG2-CD1 3.53Å; T953-L968 HydrophobicContact CG2-CD2 4.4Å; A961-L968 HydrophobicContact CB-CB 3.63Å; A961-L968 HydrophobicContact CB-CD2 4.33Å; L968-E1010 WeakPolarHBondContact O-CA 3.47Å; L968-L1011 HydrophobicContact CD1-CD1 4.26Å; L968-L1011 HydrophobicContact CD2-CB 4.3Å; L968-L1011 HydrophobicContact CG-CB 4.13Å; L968-L1011 HydrophobicContact CG-CD1 4.13Å; L968-L1011 PolarHBondContact O-N 3.34Å; L968-L1011 VanDerWaalsContact O-N 3.07Å
969	L	81.1	Confident	76.2	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	151.5	-161.3	-57.8	176.8	0	0	0	112.4	A944 L945 V946 S947 P967 W973 L1002 Y1009 E1010	A944-L969 HydrophobicContact CB-CD1 4.34Å; L945-L969 PolarHBondContact O-N 3.23Å; V946-L969 WeakPolarHBondContact CA-O 3.24Å; V946-L969 HydrophobicContact CG2-CB 4.47Å; S947-L969 PolarHBondContact N-O 3.39Å; P967-L969 HydrophobicContact CB-CD1 4.03Å; P967-L969 HydrophobicContact CB-CD2 3.97Å; P967-L969 HydrophobicContact CB-CG 3.92Å; P967-L969 HydrophobicContact CG-CD1 3.97Å; P967-L969 HydrophobicContact CG-CG 4.35Å; L969-W973 HydrophobicContact CB-CB 4.39Å; L969-W973 HydrophobicContact CB-CE3 4.36Å; L969-W973 HydrophobicContact CD1-CD2 3.42Å; L969-W973 VanDerWaalsContact CD1-CD2 3.42Å; L969-W973 HydrophobicContact CD1-CE3 3.57Å; L969-W973 HydrophobicContact CD1-CG 3.89Å; L969-W973 HydrophobicContact CD1-CH2 4.06Å; L969-W973 HydrophobicContact CD1-CZ2 3.9Å; L969-W973 HydrophobicContact CD1-CZ3 3.89Å; L969-L1002 HydrophobicContact CD1-CD1 4.04Å; L969-L1002 HydrophobicContact CD1-CD2 3.88Å; L969-L1002 HydrophobicContact CD2-CD2 3.51Å; L969-L1002 HydrophobicContact CG-CD2 4.37Å; L969-Y1009 CarbonylContact C-O 3.53Å; L969-Y1009 WeakPolarHBondContact CA-O 3.32Å; L969-E1010 HydrophobicContact CD2-CG 4.01Å
970	R	82.8	Confident	77.3	Confident	95 Å²	95	22.1 Å²	22.1	36%	0.358	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	152.3	169.3	-61.9	167.2	-164.2	-133.9	4.2	110.3	S947 D972 W973 Y1009 E1010 L1011	S947-R970 WeakPolarHBondContact O-CA 3.5Å; R970-D972 HydrophobicContact CB-CB 4.38Å; R970-D972 PolarHBondContact O-N 2.98Å; R970-D972 VanDerWaalsContact O-N 3.14Å; R970-W973 WeakPolarHBondContact O-CB 3.4Å; R970-W973 PolarHBondContact O-N 3.45Å; R970-W973 VanDerWaalsContact O-N 3.09Å; R970-Y1009 VanDerWaalsContact CG-O 3.31Å; R970-Y1009 WeakPolarHBondContact CG-O 3.3Å; R970-Y1009 PolarHBondContact N-O 2.99Å; R970-E1010 PolarHBondContact NE-O 3.49Å; R970-L1011 HydrophobicContact CG-CD2 3.72Å; R970-L1011 HydrophobicContact CG-CG 3.9Å
971	I	86.3	Confident	78.5	Confident	16 Å²	16	23 Å²	23	8%	0.082	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.3	172.6	-63.7	-178.9	0	0	0	112.1	A883 I892 L897 V946 T948 W973 L974 L975	A883-I971 HydrophobicContact CB-CD1 3.45Å; A883-I971 VanDerWaalsContact CB-CD1 3.45Å; I892-I971 HydrophobicContact CD1-CG2 4.09Å; L897-I971 HydrophobicContact CD2-CD1 4.11Å; L897-I971 HydrophobicContact CD2-CG1 4.27Å; L897-I971 HydrophobicContact CD2-CG2 3.95Å; V946-I971 HydrophobicContact CG1-CB 4.49Å; V946-I971 HydrophobicContact CG1-CG1 3.82Å; T948-I971 HydrophobicContact CG2-CD1 3.5Å; T948-I971 HydrophobicContact CG2-CG1 4.23Å; I971-W973 PolarHBondContact O-N 3.38Å; I971-W973 VanDerWaalsContact O-N 3.1Å; I971-L974 WeakPolarHBondContact O-CB 3.41Å; I971-L974 PolarHBondContact O-N 3.33Å; I971-L975 HydrophobicContact CG2-CD1 4.32Å; I971-L975 HydrophobicContact CG2-CG 4.42Å; I971-L975 PolarHBondContact O-N 3.01Å
972	D	86.5	Confident	79.6	Confident	48 Å²	48	23 Å²	23	26%	0.257	12%	0.12	S	C	.	.	H	α-helix	trans	-53	-31.4	176.5	-61.8	-50.8	0	0	0	113.4	R970 L974 L975 D976	R970-D972 HydrophobicContact CB-CB 4.38Å; R970-D972 PolarHBondContact O-N 2.98Å; R970-D972 VanDerWaalsContact O-N 3.14Å; D972-L974 PolarHBondContact O-N 3.34Å; D972-L975 PolarHBondContact O-N 2.97Å; D972-D976 WeakPolarHBondContact O-CB 3.4Å; D972-D976 PolarHBondContact O-N 2.87Å
973	W	88.5	Confident	80.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.4	-40.9	175.9	171.8	70.6	0	0	0	112.9	W875 I877 A944 V946 L969 R970 I971 S977 P998 L1002 Y1009	W875-W973 HydrophobicContact CD2-CH2 4.32Å; W875-W973 AromaticContact CE3-CH2 3.75Å; W875-W973 HydrophobicContact CE3-CH2 3.75Å; W875-W973 HydrophobicContact CE3-CZ2 4.11Å; W875-W973 HydrophobicContact CH2-CH2 4.31Å; W875-W973 AromaticContact CH2-CZ2 3.84Å; W875-W973 HydrophobicContact CH2-CZ2 3.84Å; W875-W973 HydrophobicContact CZ2-CZ2 4.28Å; W875-W973 AromaticContact CZ3-CH2 3.75Å; W875-W973 HydrophobicContact CZ3-CH2 3.75Å; W875-W973 AromaticContact CZ3-CZ2 3.75Å; W875-W973 HydrophobicContact CZ3-CZ2 3.75Å; I877-W973 HydrophobicContact CD1-CZ3 4.41Å; I877-W973 HydrophobicContact CG1-CH2 4.5Å; I877-W973 HydrophobicContact CG1-CZ3 4.27Å; A944-W973 HydrophobicContact CB-CH2 3.54Å; A944-W973 HydrophobicContact CB-CZ3 3.69Å; V946-W973 HydrophobicContact CG2-CE3 3.97Å; V946-W973 HydrophobicContact CG2-CZ3 3.94Å; L969-W973 HydrophobicContact CB-CB 4.39Å; L969-W973 HydrophobicContact CB-CE3 4.36Å; L969-W973 HydrophobicContact CD1-CD2 3.42Å; L969-W973 VanDerWaalsContact CD1-CD2 3.42Å; L969-W973 HydrophobicContact CD1-CE3 3.57Å; L969-W973 HydrophobicContact CD1-CG 3.89Å; L969-W973 HydrophobicContact CD1-CH2 4.06Å; L969-W973 HydrophobicContact CD1-CZ2 3.9Å; L969-W973 HydrophobicContact CD1-CZ3 3.89Å; R970-W973 WeakPolarHBondContact O-CB 3.4Å; R970-W973 PolarHBondContact O-N 3.45Å; R970-W973 VanDerWaalsContact O-N 3.09Å; I971-W973 PolarHBondContact O-N 3.38Å; I971-W973 VanDerWaalsContact O-N 3.1Å; W973-S977 VanDerWaalsContact O-CB 3.27Å; W973-S977 WeakPolarHBondContact O-CB 3.4Å; W973-S977 PolarHBondContact O-N 2.71Å; W973-S977 PolarHBondContact O-OG 3.02Å; W973-P998 HydrophobicContact CH2-CB 4.24Å; W973-P998 HydrophobicContact CZ2-CB 3.44Å; W973-P998 VanDerWaalsContact CZ2-CB 3.44Å; W973-P998 PolarHBondContact NE1-O 2.97Å; W973-L1002 HydrophobicContact CZ2-CD1 4.14Å; W973-Y1009 VanDerWaalsContact CA-CD1 3.48Å; W973-Y1009 HydrophobicContact CB-CD1 3.67Å; W973-Y1009 HydrophobicContact CB-CE1 4.4Å; W973-Y1009 HydrophobicContact CB-CG 3.97Å; W973-Y1009 HydrophobicContact CG-CD1 4.5Å; W973-Y1009 HydrophobicContact CG-CG 4.44Å
974	L	88.9	Confident	81.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.4	-45.4	177.9	-64.1	173.6	0	0	0	110.4	F872 I877 L879 L897 I901 V946 I971 D972 S977 C978	F872-L974 HydrophobicContact CD1-CD2 4.44Å; F872-L974 HydrophobicContact CE1-CD2 3.67Å; F872-L974 HydrophobicContact CE2-CD2 4.24Å; F872-L974 HydrophobicContact CZ-CB 4.14Å; F872-L974 HydrophobicContact CZ-CD2 3.57Å; F872-L974 HydrophobicContact CZ-CG 4.49Å; I877-L974 HydrophobicContact CD1-CD2 3.63Å; I877-L974 HydrophobicContact CG1-CD2 4.36Å; I877-L974 HydrophobicContact CG2-CD1 4.5Å; I877-L974 HydrophobicContact CG2-CD2 4.36Å; L879-L974 HydrophobicContact CD2-CD1 4.3Å; L897-L974 HydrophobicContact CD1-CD1 3.82Å; L897-L974 HydrophobicContact CD2-CD1 4Å; L897-L974 HydrophobicContact CG-CD1 4.08Å; I901-L974 HydrophobicContact CD1-CD1 4.1Å; I901-L974 HydrophobicContact CG1-CD1 4.49Å; V946-L974 HydrophobicContact CG1-CD1 4.01Å; V946-L974 HydrophobicContact CG2-CD1 4.19Å; V946-L974 HydrophobicContact CG2-CD2 4.47Å; V946-L974 HydrophobicContact CG2-CG 4.31Å; I971-L974 WeakPolarHBondContact O-CB 3.41Å; I971-L974 PolarHBondContact O-N 3.33Å; D972-L974 PolarHBondContact O-N 3.34Å; L974-S977 PolarHBondContact O-N 2.79Å; L974-C978 PolarHBondContact O-N 3.15Å; L974-C978 PolarHBondContact O-SG 3.06Å
975	L	89.9	Confident	81.6	Confident	9 Å²	9	37.7 Å²	37.7	5%	0.047	18%	0.18	C	C	.	.	H	α-helix	trans	-69.4	-41.9	-177.3	-58.7	179.4	0	0	0	111.8	I864 I892 L900 I971 D972 C978 R979	I864-L975 HydrophobicContact CG2-CD2 4.26Å; I892-L975 HydrophobicContact CD1-CD1 4.15Å; L900-L975 HydrophobicContact CD2-CD2 4.45Å; I971-L975 HydrophobicContact CG2-CD1 4.32Å; I971-L975 HydrophobicContact CG2-CG 4.42Å; I971-L975 PolarHBondContact O-N 3.01Å; D972-L975 PolarHBondContact O-N 2.97Å; L975-C978 PolarHBondContact O-N 3.39Å; L975-R979 VanDerWaalsContact O-CD 3.32Å; L975-R979 WeakPolarHBondContact O-CD 3.43Å; L975-R979 WeakPolarHBondContact O-CG 3.36Å; L975-R979 PolarHBondContact O-N 2.69Å
976	D	88.8	Confident	81.6	Confident	17 Å²	17	39.6 Å²	39.6	9%	0.091	18%	0.184	C	C	.	.	H	α-helix	trans	-70.2	-33.9	176.1	-76.4	-12.6	0	0	0	112.2	D972 C978 R979 E980 L1001 R1008 Y1009	D972-D976 WeakPolarHBondContact O-CB 3.4Å; D972-D976 PolarHBondContact O-N 2.87Å; D976-C978 PolarHBondContact O-N 2.85Å; D976-R979 PolarHBondContact O-N 3.48Å; D976-R979 VanDerWaalsContact O-N 3.12Å; D976-R979 WeakPolarHBondContact OD1-CD 3.49Å; D976-R979 IonicContact OD1-CZ 3.81Å; D976-R979 IonicContact OD1-NE 2.91Å; D976-R979 IonicContact OD1-NH1 3.88Å; D976-R979 PolarHBondContact OD1-NH1 3.14Å; D976-E980 WeakPolarHBondContact O-CG 3.48Å; D976-E980 PolarHBondContact O-N 3.47Å; D976-L1001 HydrophobicContact CB-CD1 3.98Å; D976-R1008 IonicContact OD2-CZ 2.82Å; D976-R1008 IonicContact OD2-NE 3.43Å; D976-R1008 IonicContact OD2-NH2 3.56Å; D976-R1008 PolarHBondContact OD2-NH2 2.81Å; D976-Y1009 HydrophobicContact CB-CE1 4.1Å; D976-Y1009 PolarHBondContact OD2-OH 2.71Å
977	S	89.2	Confident	81	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-47.4	171.7	-63.1	0	0	0	0	111.8	W973 L974 R979 D981 P998	W973-S977 VanDerWaalsContact O-CB 3.27Å; W973-S977 WeakPolarHBondContact O-CB 3.4Å; W973-S977 PolarHBondContact O-N 2.71Å; W973-S977 PolarHBondContact O-OG 3.02Å; L974-S977 PolarHBondContact O-N 2.79Å; S977-R979 VanDerWaalsContact C-N 3.33Å; S977-R979 PolarHBondContact O-N 3.01Å; S977-D981 PolarHBondContact O-N 3.39Å; S977-P998 WeakPolarHBondContact OG-CA 3.36Å
978	C	90.5	Very high	79.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-34.4	174.8	-67.7	0	0	0	0	112.8	I864 P867 L974 L975 D976 A982	I864-C978 HydrophobicContact CD1-CB 4.06Å; P867-C978 HydrophobicContact CB-CB 3.9Å; P867-C978 HydrophobicContact CG-CB 4.13Å; L974-C978 PolarHBondContact O-N 3.15Å; L974-C978 PolarHBondContact O-SG 3.06Å; L975-C978 PolarHBondContact O-N 3.39Å; D976-C978 PolarHBondContact O-N 2.85Å; C978-A982 VanDerWaalsContact O-CB 3.26Å; C978-A982 WeakPolarHBondContact O-CB 3.36Å; C978-A982 PolarHBondContact O-N 2.78Å
979	R	90	Very high	78.2	Confident	82 Å²	82	57.1 Å²	57.1	31%	0.309	28%	0.279	S	S	.	.	H	α-helix	trans	-70.6	-39.3	179.7	-74.2	159	174.6	168.3	3.3	113.1	I864 P865 L975 D976 S977 K983	I864-R979 HydrophobicContact CG2-CG 4.31Å; P865-R979 HydrophobicContact CG-CG 4.3Å; L975-R979 VanDerWaalsContact O-CD 3.32Å; L975-R979 WeakPolarHBondContact O-CD 3.43Å; L975-R979 WeakPolarHBondContact O-CG 3.36Å; L975-R979 PolarHBondContact O-N 2.69Å; D976-R979 PolarHBondContact O-N 3.48Å; D976-R979 VanDerWaalsContact O-N 3.12Å; D976-R979 WeakPolarHBondContact OD1-CD 3.49Å; D976-R979 IonicContact OD1-CZ 3.81Å; D976-R979 IonicContact OD1-NE 2.91Å; D976-R979 IonicContact OD1-NH1 3.88Å; D976-R979 PolarHBondContact OD1-NH1 3.14Å; S977-R979 VanDerWaalsContact C-N 3.33Å; S977-R979 PolarHBondContact O-N 3.01Å; R979-K983 WeakPolarHBondContact O-CG 3.48Å; R979-K983 PolarHBondContact O-N 3.21Å
980	E	86.8	Confident	76.3	Confident	46 Å²	46	60.6 Å²	60.6	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-73	-45.2	178.8	-61.4	-46.4	132.9	0	0	111.7	D976 A982 K983 T984 W997 L1001	D976-E980 WeakPolarHBondContact O-CG 3.48Å; D976-E980 PolarHBondContact O-N 3.47Å; E980-A982 VanDerWaalsContact C-N 3.35Å; E980-A982 PolarHBondContact O-N 3.34Å; E980-K983 WeakPolarHBondContact O-CB 3.07Å; E980-K983 PolarHBondContact O-N 2.95Å; E980-K983 VanDerWaalsContact O-N 3.08Å; E980-K983 WeakPolarHBondContact OE1-CE 3.45Å; E980-K983 IonicContact OE1-NZ 2.69Å; E980-K983 PolarHBondContact OE1-NZ 2.95Å; E980-K983 VanDerWaalsContact OE2-CE 3.3Å; E980-K983 WeakPolarHBondContact OE2-CE 3.22Å; E980-K983 IonicContact OE2-NZ 3.02Å; E980-K983 PolarHBondContact OE2-NZ 2.9Å; E980-T984 PolarHBondContact O-N 2.74Å; E980-T984 VanDerWaalsContact O-N 3.13Å; E980-T984 PolarHBondContact O-OG1 3Å; E980-W997 HydrophobicContact CB-CD2 3.86Å; E980-W997 HydrophobicContact CB-CE3 3.42Å; E980-W997 VanDerWaalsContact CB-CE3 3.42Å; E980-W997 HydrophobicContact CB-CH2 4.28Å; E980-W997 HydrophobicContact CB-CZ3 3.64Å; E980-W997 HydrophobicContact CG-CE3 4.19Å; E980-W997 HydrophobicContact CG-CZ3 4.24Å; E980-L1001 HydrophobicContact CG-CD1 4.43Å; E980-L1001 HydrophobicContact CG-CD2 4.05Å
981	D	86.6	Confident	74.1	Confident	22 Å²	22	65.8 Å²	65.8	12%	0.118	33%	0.328	C	S	.	.	H	α-helix	trans	-54.5	-49.5	175.3	179.3	85.1	0	0	0	112.2	S868 V871 S977 K983 T984 Y985 W997	S868-D981 WeakPolarHBondContact CB-OD2 3.32Å; S868-D981 PolarHBondContact N-OD2 2.84Å; V871-D981 HydrophobicContact CG2-CB 3.54Å; V871-D981 WeakPolarHBondContact CG2-OD2 3.21Å; S977-D981 PolarHBondContact O-N 3.39Å; D981-K983 VanDerWaalsContact C-N 3.28Å; D981-K983 PolarHBondContact O-N 2.73Å; D981-T984 PolarHBondContact O-N 3.47Å; D981-Y985 PolarHBondContact O-N 3.05Å; D981-W997 HydrophobicContact CB-CG 4.09Å
982	A	85.1	Confident	72.1	Confident	2 Å²	2	70.8 Å²	70.8	2%	0.017	35%	0.351	C	S	.	.	H	α-helix	trans	-66	-25.2	179.5	0	0	0	0	0	113.6	P865 I866 C978 E980 N986	P865-A982 HydrophobicContact CB-CB 3.67Å; P865-A982 HydrophobicContact CG-CB 3.61Å; I866-A982 VanDerWaalsContact O-CB 3.26Å; I866-A982 WeakPolarHBondContact O-CB 3.31Å; C978-A982 VanDerWaalsContact O-CB 3.26Å; C978-A982 WeakPolarHBondContact O-CB 3.36Å; C978-A982 PolarHBondContact O-N 2.78Å; E980-A982 VanDerWaalsContact C-N 3.35Å; E980-A982 PolarHBondContact O-N 3.34Å; A982-N986 PolarHBondContact O-ND2 3.06Å
983	K	83.3	Confident	70.2	Confident	92 Å²	92	74.5 Å²	74.5	40%	0.4	37%	0.367	S	S	.	.	H	α-helix	trans	-68.1	-46.7	169.4	-72.7	175	-141.2	171	0	110.3	R979 E980 D981 Y985 N986	R979-K983 WeakPolarHBondContact O-CG 3.48Å; R979-K983 PolarHBondContact O-N 3.21Å; E980-K983 WeakPolarHBondContact O-CB 3.07Å; E980-K983 PolarHBondContact O-N 2.95Å; E980-K983 VanDerWaalsContact O-N 3.08Å; E980-K983 WeakPolarHBondContact OE1-CE 3.45Å; E980-K983 IonicContact OE1-NZ 2.69Å; E980-K983 PolarHBondContact OE1-NZ 2.95Å; E980-K983 VanDerWaalsContact OE2-CE 3.3Å; E980-K983 WeakPolarHBondContact OE2-CE 3.22Å; E980-K983 IonicContact OE2-NZ 3.02Å; E980-K983 PolarHBondContact OE2-NZ 2.9Å; D981-K983 VanDerWaalsContact C-N 3.28Å; D981-K983 PolarHBondContact O-N 2.73Å; K983-Y985 VanDerWaalsContact C-N 3.35Å; K983-Y985 PolarHBondContact O-N 2.79Å; K983-N986 PolarHBondContact O-N 2.9Å
984	T	73.1	Confident	68.6	Low	54 Å²	54	82 Å²	82	33%	0.331	41%	0.407	S	S	.	.	H	α-helix	trans	-65.5	-38.2	-175.1	-55.3	0	0	0	0	111.8	E980 D981 N986 N987 W997	E980-T984 PolarHBondContact O-N 2.74Å; E980-T984 VanDerWaalsContact O-N 3.13Å; E980-T984 PolarHBondContact O-OG1 3Å; D981-T984 PolarHBondContact O-N 3.47Å; T984-N986 PolarHBondContact O-N 3.15Å; T984-N986 VanDerWaalsContact O-N 3.09Å; T984-N987 PolarHBondContact O-N 3.32Å; T984-N987 VanDerWaalsContact O-N 3.1Å; T984-W997 HydrophobicContact CG2-CZ2 4.28Å; T984-W997 WeakPolarHBondContact OG1-CZ2 3.36Å
985	Y	62.7	Low	67.4	Low	188 Å²	188	87 Å²	87	74%	0.737	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.1	175.7	-159.2	-89.4	0	0	0	114.2	D981 K983	D981-Y985 PolarHBondContact O-N 3.05Å; K983-Y985 VanDerWaalsContact C-N 3.35Å; K983-Y985 PolarHBondContact O-N 2.79Å
986	N	58.3	Low	66.7	Low	126 Å²	126	89 Å²	89	67%	0.674	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-2.9	178.7	-75	-79.5	0	0	0	114.2	A982 K983 T984	A982-N986 PolarHBondContact O-ND2 3.06Å; K983-N986 PolarHBondContact O-N 2.9Å; T984-N986 PolarHBondContact O-N 3.15Å; T984-N986 VanDerWaalsContact O-N 3.09Å
987	N	54.4	Low	66.5	Low	103 Å²	103	89.1 Å²	89.1	55%	0.551	44%	0.436	S	S	*	.			trans	-105	94	177.6	-75.6	-13.8	0	0	0	110.4	T984 S989	T984-N987 PolarHBondContact O-N 3.32Å; T984-N987 VanDerWaalsContact O-N 3.1Å; N987-S989 PolarHBondContact O-N 3.03Å
988	E	48.5	Very low	66.2	Low	188 Å²	188	89.1 Å²	89.1	88%	0.879	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	2	-178.4	-59.3	-176.1	136.1	0	0	114.9
989	S	41.9	Very low	65.6	Low	112 Å²	112	91 Å²	91	78%	0.783	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	4	-166.7	54.8	0	0	0	0	116.2	N987	N987-S989 PolarHBondContact O-N 3.03Å
990	S	40.7	Very low	65	Low	72 Å²	72	92 Å²	92	50%	0.503	45%	0.45	S	S	.	.			trans	-146.6	91.1	174	62.1	0	0	0	0	112.6	E992	S990-E992 VanDerWaalsContact C-N 3.33Å; S990-E992 PolarHBondContact O-N 2.77Å
991	F	36.3	Very low	64.7	Low	204 Å²	204	89.9 Å²	89.9	90%	0.895	44%	0.44	S	S	*	.			trans	-75.1	81.1	168.6	-92.9	-95.7	0	0	0	110.7
992	E	43.4	Very low	64.2	Low	122 Å²	122	90.1 Å²	90.1	57%	0.57	44%	0.441	S	S	*	.			trans	-93.9	128.5	156.3	-87.4	-175.4	-133.2	0	0	109.5	S990 R995	S990-E992 VanDerWaalsContact C-N 3.33Å; S990-E992 PolarHBondContact O-N 2.77Å; E992-R995 IonicContact OE1-CZ 3.27Å; E992-R995 IonicContact OE1-NH2 2.65Å; E992-R995 PolarHBondContact OE1-NH2 2.87Å; E992-R995 IonicContact OE2-CZ 3.77Å; E992-R995 IonicContact OE2-NE 2.61Å; E992-R995 PolarHBondContact OE2-NE 3.35Å; E992-R995 IonicContact OE2-NH2 2.77Å; E992-R995 PolarHBondContact OE2-NH2 3.16Å
993	E	48.5	Very low	63.5	Low	125 Å²	125	97.2 Å²	97.2	58%	0.584	47%	0.468	S	S	*	.			trans	-73.1	130.6	-174.8	-57.4	-171.8	86.7	0	0	111.9	H933 R995	H933-E993 IonicContact CE1-OE2 2.77Å; H933-E993 PolarHBondContact CE1-OE2 3.21Å; H933-E993 IonicContact ND1-OE2 2.71Å; H933-E993 PolarHBondContact ND1-OE2 3.13Å; E993-R995 PolarHBondContact O-N 3.2Å
994	N	52.9	Low	62.9	Low	157 Å²	157	94.8 Å²	94.8	84%	0.84	46%	0.464	S	S	*	.			trans	50.4	47.3	160.7	-60.9	-34.2	0	0	0	118.1	N996	N994-N996 PolarHBondContact O-N 3.15Å
995	R	64.1	Low	63	Low	107 Å²	107	97.3 Å²	97.3	40%	0.404	47%	0.469	S	S	.	.			trans	-60	110.7	166.4	-71.7	-172.2	176.3	-165.4	3.6	111.1	E992 E993 W997	E992-R995 IonicContact OE1-CZ 3.27Å; E992-R995 IonicContact OE1-NH2 2.65Å; E992-R995 PolarHBondContact OE1-NH2 2.87Å; E992-R995 IonicContact OE2-CZ 3.77Å; E992-R995 IonicContact OE2-NE 2.61Å; E992-R995 PolarHBondContact OE2-NE 3.35Å; E992-R995 IonicContact OE2-NH2 2.77Å; E992-R995 PolarHBondContact OE2-NH2 3.16Å; E993-R995 PolarHBondContact O-N 3.2Å; R995-W997 VanDerWaalsContact C-N 3.34Å; R995-W997 PolarHBondContact O-N 2.73Å
996	N	75.9	Confident	63.4	Low	49 Å²	49	92.2 Å²	92.2	26%	0.262	46%	0.458	S	S	.	.			trans	-70.4	86.1	173	-179.1	-20.7	0	0	0	109.6	W875 N994 P998 L999 Y1000	W875-N996 PolarHBondContact NE1-OD1 3.2Å; W875-N996 VanDerWaalsContact NE1-OD1 3.15Å; N994-N996 PolarHBondContact O-N 3.15Å; N996-P998 WeakPolarHBondContact OD1-CD 3.07Å; N996-L999 HydrophobicContact CB-CB 4.13Å; N996-L999 PolarHBondContact O-N 2.93Å; N996-L999 VanDerWaalsContact O-N 3.09Å; N996-L999 WeakPolarHBondContact OD1-CB 3.12Å; N996-L999 PolarHBondContact OD1-N 3.27Å; N996-Y1000 PolarHBondContact O-N 3.35Å
997	W	83.7	Confident	64.1	Low	20 Å²	20	87.1 Å²	87.1	8%	0.076	44%	0.436	C	S	.	.	H	α-helix	trans	-53.1	-44.3	-176.5	-76.4	106.6	0	0	0	114.8	E980 D981 T984 R995 L999 Y1000 L1001	E980-W997 HydrophobicContact CB-CD2 3.86Å; E980-W997 HydrophobicContact CB-CE3 3.42Å; E980-W997 VanDerWaalsContact CB-CE3 3.42Å; E980-W997 HydrophobicContact CB-CH2 4.28Å; E980-W997 HydrophobicContact CB-CZ3 3.64Å; E980-W997 HydrophobicContact CG-CE3 4.19Å; E980-W997 HydrophobicContact CG-CZ3 4.24Å; D981-W997 HydrophobicContact CB-CG 4.09Å; T984-W997 HydrophobicContact CG2-CZ2 4.28Å; T984-W997 WeakPolarHBondContact OG1-CZ2 3.36Å; R995-W997 VanDerWaalsContact C-N 3.34Å; R995-W997 PolarHBondContact O-N 2.73Å; W997-L999 VanDerWaalsContact C-N 3.3Å; W997-L999 PolarHBondContact O-N 3.06Å; W997-Y1000 AromaticContact CE3-CD1 3.75Å; W997-Y1000 HydrophobicContact CE3-CD1 3.75Å; W997-Y1000 HydrophobicContact CE3-CE1 4.44Å; W997-Y1000 HydrophobicContact CE3-CG 4.38Å; W997-Y1000 AromaticContact CZ3-CD1 3.51Å; W997-Y1000 HydrophobicContact CZ3-CD1 3.51Å; W997-Y1000 AromaticContact CZ3-CE1 3.74Å; W997-Y1000 HydrophobicContact CZ3-CE1 3.74Å; W997-Y1000 HydrophobicContact CZ3-CG 4.34Å; W997-Y1000 PolarHBondContact O-N 2.97Å; W997-L1001 WeakPolarHBondContact O-CG 3.2Å; W997-L1001 PolarHBondContact O-N 3.5Å
998	P	83.7	Confident	65.3	Low	0 Å²	0	87.7 Å²	87.7	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-59.6	-37.7	175.7	-21.8	30.4	0	0	0	113.4	V871 F872 W875 W973 S977 N996 L1002	V871-P998 HydrophobicContact CG1-CG 4.12Å; V871-P998 WeakPolarHBondContact O-CD 3.29Å; V871-P998 VanDerWaalsContact O-CG 3.3Å; V871-P998 WeakPolarHBondContact O-CG 3.19Å; F872-P998 HydrophobicContact CD1-CB 4.28Å; F872-P998 HydrophobicContact CD1-CG 3.57Å; F872-P998 HydrophobicContact CE1-CB 4.15Å; F872-P998 HydrophobicContact CE1-CG 3.57Å; W875-P998 HydrophobicContact CD2-CB 4.44Å; W875-P998 HydrophobicContact CH2-CB 4.45Å; W875-P998 HydrophobicContact CZ2-CB 3.74Å; W973-P998 HydrophobicContact CH2-CB 4.24Å; W973-P998 HydrophobicContact CZ2-CB 3.44Å; W973-P998 VanDerWaalsContact CZ2-CB 3.44Å; W973-P998 PolarHBondContact NE1-O 2.97Å; S977-P998 WeakPolarHBondContact OG-CA 3.36Å; N996-P998 WeakPolarHBondContact OD1-CD 3.07Å; P998-L1002 WeakPolarHBondContact O-CG 3.3Å
999	L	77.9	Confident	66.9	Low	39 Å²	39	78.8 Å²	78.8	20%	0.204	39%	0.389	C	S	.	.	H	α-helix	trans	-74.4	-38.1	174.8	-173.5	60.3	0	0	0	112.4	W875 F942 N996 W997 L1002 R1003	W875-L999 HydrophobicContact CZ2-CB 4.04Å; F942-L999 HydrophobicContact CE1-CD2 4.33Å; F942-L999 HydrophobicContact CZ-CD2 4.11Å; N996-L999 HydrophobicContact CB-CB 4.13Å; N996-L999 PolarHBondContact O-N 2.93Å; N996-L999 VanDerWaalsContact O-N 3.09Å; N996-L999 WeakPolarHBondContact OD1-CB 3.12Å; N996-L999 PolarHBondContact OD1-N 3.27Å; W997-L999 VanDerWaalsContact C-N 3.3Å; W997-L999 PolarHBondContact O-N 3.06Å; L999-L1002 PolarHBondContact O-N 3.45Å; L999-R1003 WeakPolarHBondContact O-CG 3.28Å; L999-R1003 PolarHBondContact O-N 3.32Å
1000	Y	77.1	Confident	68.7	Low	103 Å²	103	74.4 Å²	74.4	40%	0.404	36%	0.356	S	S	.	.	H	α-helix	trans	-62.9	-45.4	178.8	177.7	-96.2	0	0	0	111.5	N996 W997 L1002 R1003 A1004	N996-Y1000 PolarHBondContact O-N 3.35Å; W997-Y1000 AromaticContact CE3-CD1 3.75Å; W997-Y1000 HydrophobicContact CE3-CD1 3.75Å; W997-Y1000 HydrophobicContact CE3-CE1 4.44Å; W997-Y1000 HydrophobicContact CE3-CG 4.38Å; W997-Y1000 AromaticContact CZ3-CD1 3.51Å; W997-Y1000 HydrophobicContact CZ3-CD1 3.51Å; W997-Y1000 AromaticContact CZ3-CE1 3.74Å; W997-Y1000 HydrophobicContact CZ3-CE1 3.74Å; W997-Y1000 HydrophobicContact CZ3-CG 4.34Å; W997-Y1000 PolarHBondContact O-N 2.97Å; Y1000-L1002 VanDerWaalsContact C-N 3.32Å; Y1000-L1002 PolarHBondContact O-N 2.94Å; Y1000-R1003 PolarHBondContact O-N 3.42Å; Y1000-R1003 VanDerWaalsContact O-N 3.1Å; Y1000-A1004 HydrophobicContact CD1-CB 4.39Å; Y1000-A1004 HydrophobicContact CE1-CB 4.01Å; Y1000-A1004 VanDerWaalsContact O-CB 3.31Å; Y1000-A1004 WeakPolarHBondContact O-CB 3.26Å; Y1000-A1004 PolarHBondContact O-N 3.45Å
1001	L	80.9	Confident	70.4	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-37.1	-180	-76.4	-178	0	0	0	113.3	D976 E980 W997 R1003 Y1005 Y1009	D976-L1001 HydrophobicContact CB-CD1 3.98Å; E980-L1001 HydrophobicContact CG-CD1 4.43Å; E980-L1001 HydrophobicContact CG-CD2 4.05Å; W997-L1001 WeakPolarHBondContact O-CG 3.2Å; W997-L1001 PolarHBondContact O-N 3.5Å; L1001-R1003 VanDerWaalsContact C-N 3.35Å; L1001-Y1005 HydrophobicContact CD2-CD2 3.88Å; L1001-Y1005 HydrophobicContact CD2-CE2 3.82Å; L1001-Y1005 PolarHBondContact O-N 3.39Å; L1001-Y1009 HydrophobicContact CB-CD2 4.45Å; L1001-Y1009 HydrophobicContact CB-CE2 3.78Å; L1001-Y1009 HydrophobicContact CD2-CE2 4.41Å; L1001-Y1009 HydrophobicContact CG-CE2 4.48Å
1002	L	75.4	Confident	72.1	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.141	30%	0.302	C	S	.	.	H	α-helix	trans	-69.9	-30.6	175.4	-64.5	173.1	0	0	0	112.8	W875 P967 L969 W973 P998 L999 Y1000 Y1009	W875-L1002 HydrophobicContact CH2-CD1 4.28Å; P967-L1002 HydrophobicContact CG-CD1 4.43Å; L969-L1002 HydrophobicContact CD1-CD1 4.04Å; L969-L1002 HydrophobicContact CD1-CD2 3.88Å; L969-L1002 HydrophobicContact CD2-CD2 3.51Å; L969-L1002 HydrophobicContact CG-CD2 4.37Å; W973-L1002 HydrophobicContact CZ2-CD1 4.14Å; P998-L1002 WeakPolarHBondContact O-CG 3.3Å; L999-L1002 PolarHBondContact O-N 3.45Å; Y1000-L1002 VanDerWaalsContact C-N 3.32Å; Y1000-L1002 PolarHBondContact O-N 2.94Å; L1002-Y1009 HydrophobicContact CD2-CD2 4.46Å
1003	R	70.2	Confident	73.3	Confident	152 Å²	152	58 Å²	58	57%	0.574	28%	0.277	S	S	*	.	H	α-helix	trans	-80.6	-33.9	175.8	-69.7	177.1	178.1	-167.9	0	112.9	L999 Y1000 L1001	L999-R1003 WeakPolarHBondContact O-CG 3.28Å; L999-R1003 PolarHBondContact O-N 3.32Å; Y1000-R1003 PolarHBondContact O-N 3.42Å; Y1000-R1003 VanDerWaalsContact O-N 3.1Å; L1001-R1003 VanDerWaalsContact C-N 3.35Å
1004	A	71.5	Confident	74.2	Confident	40 Å²	40	52.2 Å²	52.2	33%	0.331	25%	0.25	S	C	.	.	H	α-helix	trans	-85.9	-27	-175.4	0	0	0	0	0	113.8	Y1000	Y1000-A1004 HydrophobicContact CD1-CB 4.39Å; Y1000-A1004 HydrophobicContact CE1-CB 4.01Å; Y1000-A1004 VanDerWaalsContact O-CB 3.31Å; Y1000-A1004 WeakPolarHBondContact O-CB 3.26Å; Y1000-A1004 PolarHBondContact O-N 3.45Å
1005	Y	75.2	Confident	74.9	Confident	108 Å²	108	48.1 Å²	48.1	42%	0.424	23%	0.225	S	C	.	.	S	Bend	trans	-132.8	60	-178.2	-53.6	-77.8	0	0	0	112	L1001 G1007 R1008 Y1009	L1001-Y1005 HydrophobicContact CD2-CD2 3.88Å; L1001-Y1005 HydrophobicContact CD2-CE2 3.82Å; L1001-Y1005 PolarHBondContact O-N 3.39Å; Y1005-G1007 PolarHBondContact O-N 2.97Å; Y1005-R1008 WeakPolarHBondContact O-CB 3.49Å; Y1005-R1008 PolarHBondContact O-N 2.87Å; Y1005-R1008 VanDerWaalsContact O-N 3.1Å; Y1005-Y1009 HydrophobicContact CD2-CE2 4.26Å
1006	P	71.6	Confident	74.9	Confident	80 Å²	80	46.6 Å²	46.6	52%	0.519	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	128.4	180	26.2	-35.2	0	0	0	110.8	W1025	P1006-W1025 HydrophobicContact CB-CH2 3.93Å; P1006-W1025 HydrophobicContact CB-CZ2 4.42Å
1007	G	73	Confident	74	Confident	19 Å²	19	47.1 Å²	47.1	20%	0.196	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-7.6	-178.3	0	0	0	0	0	116.8	Y1005 E1010	Y1005-G1007 PolarHBondContact O-N 2.97Å; G1007-E1010 VanDerWaalsContact CA-OE2 3.23Å; G1007-E1010 WeakPolarHBondContact CA-OE2 3.5Å; G1007-E1010 PolarHBondContact N-OE1 2.89Å; G1007-E1010 PolarHBondContact N-OE2 3.29Å
1008	R	79.3	Confident	72.7	Confident	116 Å²	116	50.4 Å²	50.4	44%	0.438	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-38.2	173.9	173.5	177.1	165.8	171.2	-6.9	111.7	D976 Y1005 E1010	D976-R1008 IonicContact OD2-CZ 2.82Å; D976-R1008 IonicContact OD2-NE 3.43Å; D976-R1008 IonicContact OD2-NH2 3.56Å; D976-R1008 PolarHBondContact OD2-NH2 2.81Å; Y1005-R1008 WeakPolarHBondContact O-CB 3.49Å; Y1005-R1008 PolarHBondContact O-N 2.87Å; Y1005-R1008 VanDerWaalsContact O-N 3.1Å; R1008-E1010 PolarHBondContact N-OE2 3.28Å
1009	Y	82.5	Confident	71.5	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	29%	0.29	C	S	.	.	S	Bend	trans	-103.4	-23.7	-170.9	-64.2	-65.4	0	0	0	112.4	L969 R970 W973 D976 L1001 L1002 Y1005	L969-Y1009 CarbonylContact C-O 3.53Å; L969-Y1009 WeakPolarHBondContact CA-O 3.32Å; R970-Y1009 VanDerWaalsContact CG-O 3.31Å; R970-Y1009 WeakPolarHBondContact CG-O 3.3Å; R970-Y1009 PolarHBondContact N-O 2.99Å; W973-Y1009 VanDerWaalsContact CA-CD1 3.48Å; W973-Y1009 HydrophobicContact CB-CD1 3.67Å; W973-Y1009 HydrophobicContact CB-CE1 4.4Å; W973-Y1009 HydrophobicContact CB-CG 3.97Å; W973-Y1009 HydrophobicContact CG-CD1 4.5Å; W973-Y1009 HydrophobicContact CG-CG 4.44Å; D976-Y1009 HydrophobicContact CB-CE1 4.1Å; D976-Y1009 PolarHBondContact OD2-OH 2.71Å; L1001-Y1009 HydrophobicContact CB-CD2 4.45Å; L1001-Y1009 HydrophobicContact CB-CE2 3.78Å; L1001-Y1009 HydrophobicContact CD2-CE2 4.41Å; L1001-Y1009 HydrophobicContact CG-CE2 4.48Å; L1002-Y1009 HydrophobicContact CD2-CD2 4.46Å; Y1005-Y1009 HydrophobicContact CD2-CE2 4.26Å
1010	E	79.5	Confident	70.8	Confident	20 Å²	20	56.1 Å²	56.1	9%	0.093	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-69.9	141.8	-178.5	-61.8	89.2	133.8	0	0	111	L968 L969 R970 G1007 R1008 W1025	L968-E1010 WeakPolarHBondContact O-CA 3.47Å; L969-E1010 HydrophobicContact CD2-CG 4.01Å; R970-E1010 PolarHBondContact NE-O 3.49Å; G1007-E1010 VanDerWaalsContact CA-OE2 3.23Å; G1007-E1010 WeakPolarHBondContact CA-OE2 3.5Å; G1007-E1010 PolarHBondContact N-OE1 2.89Å; G1007-E1010 PolarHBondContact N-OE2 3.29Å; R1008-E1010 PolarHBondContact N-OE2 3.28Å; E1010-W1025 HydrophobicContact CB-CB 3.65Å; E1010-W1025 HydrophobicContact CB-CD2 4.19Å; E1010-W1025 HydrophobicContact CB-CG 3.73Å; E1010-W1025 HydrophobicContact CG-CB 4.46Å; E1010-W1025 HydrophobicContact CG-CD2 4.4Å; E1010-W1025 HydrophobicContact CG-CE3 4.36Å; E1010-W1025 HydrophobicContact CG-CG 4.42Å
1011	L	75.7	Confident	70.3	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.042	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-90.7	154.7	167.6	-71.6	165	0	0	0	109.7	C950 L968 R970	C950-L1011 HydrophobicContact CB-CB 4.33Å; L968-L1011 HydrophobicContact CD1-CD1 4.26Å; L968-L1011 HydrophobicContact CD2-CB 4.3Å; L968-L1011 HydrophobicContact CG-CB 4.13Å; L968-L1011 HydrophobicContact CG-CD1 4.13Å; L968-L1011 PolarHBondContact O-N 3.34Å; L968-L1011 VanDerWaalsContact O-N 3.07Å; R970-L1011 HydrophobicContact CG-CD2 3.72Å; R970-L1011 HydrophobicContact CG-CG 3.9Å
1012	P	72.6	Confident	69.8	Low	34 Å²	34	59.9 Å²	59.9	22%	0.221	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-49.4	149.2	161	-24	33.5	0	0	0	111	C950 G1014 P1022 I1023	C950-P1012 HydrophobicContact CB-CB 3.87Å; C950-P1012 HydrophobicContact CB-CG 4.28Å; C950-P1012 WeakPolarHBondContact CB-O 3.25Å; P1012-G1014 VanDerWaalsContact C-N 3.34Å; P1012-P1022 HydrophobicContact CB-CB 3.9Å; P1012-P1022 HydrophobicContact CG-CB 4.13Å; P1012-I1023 CarbonylContact C-O 3.57Å; P1012-I1023 WeakPolarHBondContact CA-O 3.33Å; P1012-I1023 WeakPolarHBondContact CB-O 3.48Å
1013	R	69	Low	69.5	Low	12 Å²	12	59.1 Å²	59.1	5%	0.045	34%	0.338	C	S	.	.			trans	-77.4	-23.4	-174	-64.3	-49.8	-169.2	158.8	10	113.7	A961 T962 I1023 V1028 I1166	A961-R1013 VanDerWaalsContact O-CZ 3.29Å; A961-R1013 PolarHBondContact O-NH1 3.06Å; T962-R1013 HydrophobicContact CG2-CB 3.72Å; T962-R1013 HydrophobicContact CG2-CG 4.14Å; R1013-I1023 HydrophobicContact CB-CG2 4.33Å; R1013-I1023 PolarHBondContact N-O 2.96Å; R1013-V1028 HydrophobicContact CG-CG2 4.28Å; R1013-I1166 HydrophobicContact CB-CG2 3.9Å
1014	G	67.4	Low	69.4	Low	2 Å²	2	52.8 Å²	52.8	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.8	-156.7	-176.7	0	0	0	0	0	108.8	P1012 P1022 I1023	P1012-G1014 VanDerWaalsContact C-N 3.34Å; G1014-P1022 CarbonylContact O-C 3.33Å; G1014-P1022 WeakPolarHBondContact O-CA 3.37Å; G1014-I1023 PolarHBondContact O-N 3.07Å
1015	F	66.1	Low	69.3	Low	72 Å²	72	52.6 Å²	52.6	32%	0.316	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.5	179.2	-64.5	-94.2	0	0	0	111	C950 C951 S1017 S1020 E1021 P1022	C950-F1015 WeakPolarHBondContact SG-CE2 3.48Å; C950-F1015 VanDerWaalsContact SG-CZ 3.51Å; C951-F1015 WeakPolarHBondContact SG-CE2 3.48Å; F1015-S1017 PolarHBondContact O-N 2.82Å; F1015-S1020 WeakPolarHBondContact CD1-O 3.29Å; F1015-E1021 VanDerWaalsContact CA-O 3.32Å; F1015-E1021 WeakPolarHBondContact CA-O 3.41Å; F1015-P1022 HydrophobicContact CD1-CB 4.1Å; F1015-P1022 HydrophobicContact CE1-CB 3.81Å; F1015-P1022 HydrophobicContact CZ-CB 4.45Å
1016	I	65.3	Low	69	Low	74 Å²	74	54.9 Å²	54.9	38%	0.379	32%	0.315	S	S	.	.			trans	-70.3	125.8	169.4	-55.4	175.5	0	0	0	108.3	G1018 S1019 E1021 I1023	I1016-G1018 PolarHBondContact O-N 2.91Å; I1016-G1018 VanDerWaalsContact O-N 3.12Å; I1016-S1019 WeakPolarHBondContact CB-OG 3.47Å; I1016-S1019 PolarHBondContact O-N 2.82Å; I1016-E1021 HydrophobicContact CD1-CB 4.45Å; I1016-E1021 PolarHBondContact N-O 2.99Å; I1016-I1023 HydrophobicContact CD1-CG1 4.42Å; I1016-I1023 HydrophobicContact CG1-CD1 3.76Å; I1016-I1023 HydrophobicContact CG1-CG1 3.52Å
1017	S	56.1	Low	68.6	Low	61 Å²	61	54.2 Å²	54.2	43%	0.427	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	112.8	172.6	-76.7	0	0	0	0	110.3	F1015 H1163	F1015-S1017 PolarHBondContact O-N 2.82Å; S1017-H1163 PolarHBondContact OG-CE1 2.59Å; S1017-H1163 PolarHBondContact OG-ND1 3.49Å; S1017-H1163 PolarHBondContact OG-NE2 3.11Å
1018	G	57.1	Low	67.8	Low	88 Å²	88	53.5 Å²	53.5	91%	0.907	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.1	-39.7	177	0	0	0	0	0	114.5	I1016	I1016-G1018 PolarHBondContact O-N 2.91Å; I1016-G1018 VanDerWaalsContact O-N 3.12Å
1019	S	58.8	Low	66.4	Low	57 Å²	57	49.9 Å²	49.9	40%	0.399	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-14.6	-177.3	68.5	0	0	0	0	114.8	I1016 E1021	I1016-S1019 WeakPolarHBondContact CB-OG 3.47Å; I1016-S1019 PolarHBondContact O-N 2.82Å; S1019-E1021 PolarHBondContact O-N 3.44Å; S1019-E1021 WeakPolarHBondContact OG-CB 3.49Å; S1019-E1021 PolarHBondContact OG-N 3.4Å
1020	S	63.4	Low	64.6	Low	102 Å²	102	52.7 Å²	52.7	71%	0.713	31%	0.313	S	S	*	.			trans	58.8	16.3	-169	70.5	0	0	0	0	114.8	F1015	F1015-S1020 WeakPolarHBondContact CD1-O 3.29Å
1021	E	66	Low	63.1	Low	117 Å²	117	57 Å²	57	55%	0.547	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-83.2	132.1	-179.6	-168.1	174.8	-172.3	0	0	111.2	F1015 I1016 S1019 I1023	F1015-E1021 VanDerWaalsContact CA-O 3.32Å; F1015-E1021 WeakPolarHBondContact CA-O 3.41Å; I1016-E1021 HydrophobicContact CD1-CB 4.45Å; I1016-E1021 PolarHBondContact N-O 2.99Å; S1019-E1021 PolarHBondContact O-N 3.44Å; S1019-E1021 WeakPolarHBondContact OG-CB 3.49Å; S1019-E1021 PolarHBondContact OG-N 3.4Å; E1021-I1023 PolarHBondContact O-N 3.05Å
1022	P	69.8	Low	61.5	Low	67 Å²	67	58.7 Å²	58.7	44%	0.435	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	120.6	-178.7	28.9	-33.4	0	0	0	111.4	P1012 G1014 F1015 S1024	P1012-P1022 HydrophobicContact CB-CB 3.9Å; P1012-P1022 HydrophobicContact CG-CB 4.13Å; G1014-P1022 CarbonylContact O-C 3.33Å; G1014-P1022 WeakPolarHBondContact O-CA 3.37Å; F1015-P1022 HydrophobicContact CD1-CB 4.1Å; F1015-P1022 HydrophobicContact CE1-CB 3.81Å; F1015-P1022 HydrophobicContact CZ-CB 4.45Å; P1022-S1024 PolarHBondContact O-N 3.24Å
1023	I	68.5	Low	60.3	Low	12 Å²	12	60.5 Å²	60.5	6%	0.062	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	119.2	174.3	-65.2	171.8	0	0	0	108.1	P1012 R1013 G1014 I1016 E1021 I1166	P1012-I1023 CarbonylContact C-O 3.57Å; P1012-I1023 WeakPolarHBondContact CA-O 3.33Å; P1012-I1023 WeakPolarHBondContact CB-O 3.48Å; R1013-I1023 HydrophobicContact CB-CG2 4.33Å; R1013-I1023 PolarHBondContact N-O 2.96Å; G1014-I1023 PolarHBondContact O-N 3.07Å; I1016-I1023 HydrophobicContact CD1-CG1 4.42Å; I1016-I1023 HydrophobicContact CG1-CD1 3.76Å; I1016-I1023 HydrophobicContact CG1-CG1 3.52Å; E1021-I1023 PolarHBondContact O-N 3.05Å; I1023-I1166 HydrophobicContact CB-CG2 4.01Å; I1023-I1166 HydrophobicContact CD1-CB 4.41Å; I1023-I1166 HydrophobicContact CD1-CG2 3.5Å; I1023-I1166 VanDerWaalsContact CD1-CG2 3.5Å; I1023-I1166 HydrophobicContact CG1-CG2 4.3Å; I1023-I1166 HydrophobicContact CG2-CG2 4.12Å
1024	S	69.8	Low	59.1	Low	18 Å²	18	61.4 Å²	61.4	13%	0.126	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-64.2	155.8	-169.5	86.7	0	0	0	0	111.9	P1022 W1026 S1027	P1022-S1024 PolarHBondContact O-N 3.24Å; S1024-W1026 PolarHBondContact O-N 3.48Å; S1024-W1026 VanDerWaalsContact O-N 3.14Å; S1024-W1026 PolarHBondContact OG-N 3.39Å; S1024-W1026 PolarHBondContact OG-NE1 2.96Å; S1024-S1027 PolarHBondContact N-OG 2.82Å; S1024-S1027 PolarHBondContact O-N 2.72Å; S1024-S1027 PolarHBondContact OG-N 2.94Å; S1024-S1027 PolarHBondContact OG-OG 3.07Å
1025	W	69.4	Low	58	Low	36 Å²	36	64.3 Å²	64.3	14%	0.136	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.1	174	71.3	-97.3	0	0	0	112	P1006 E1010 R1033	P1006-W1025 HydrophobicContact CB-CH2 3.93Å; P1006-W1025 HydrophobicContact CB-CZ2 4.42Å; E1010-W1025 HydrophobicContact CB-CB 3.65Å; E1010-W1025 HydrophobicContact CB-CD2 4.19Å; E1010-W1025 HydrophobicContact CB-CG 3.73Å; E1010-W1025 HydrophobicContact CG-CB 4.46Å; E1010-W1025 HydrophobicContact CG-CD2 4.4Å; E1010-W1025 HydrophobicContact CG-CE3 4.36Å; E1010-W1025 HydrophobicContact CG-CG 4.42Å; W1025-R1033 PolarHBondContact O-NE 3.21Å; W1025-R1033 PolarHBondContact O-NH2 3.09Å
1026	W	68.3	Low	56.7	Low	157 Å²	157	64.3 Å²	64.3	60%	0.595	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-11.3	179.1	70.3	86.3	0	0	0	115.3	S1024 V1028 R1033	S1024-W1026 PolarHBondContact O-N 3.48Å; S1024-W1026 VanDerWaalsContact O-N 3.14Å; S1024-W1026 PolarHBondContact OG-N 3.39Å; S1024-W1026 PolarHBondContact OG-NE1 2.96Å; W1026-V1028 PolarHBondContact O-N 3.32Å; W1026-R1033 VanDerWaalsContact CA-CZ 3.45Å; W1026-R1033 VanDerWaalsContact O-CZ 3.26Å; W1026-R1033 PolarHBondContact O-NH1 3.05Å; W1026-R1033 VanDerWaalsContact O-NH1 3.08Å; W1026-R1033 PolarHBondContact O-NH2 3.16Å
1027	S	62.3	Low	55.7	Low	66 Å²	66	63.3 Å²	63.3	46%	0.462	37%	0.369	S	S	.	.	S	Bend	trans	-63.6	-32.4	-177.9	-64.6	0	0	0	0	115.2	S1024	S1024-S1027 PolarHBondContact N-OG 2.82Å; S1024-S1027 PolarHBondContact O-N 2.72Å; S1024-S1027 PolarHBondContact OG-N 2.94Å; S1024-S1027 PolarHBondContact OG-OG 3.07Å
1028	V	57.5	Low	55	Low	3 Å²	3	66.2 Å²	66.2	2%	0.018	38%	0.375	C	S	.	.	S	Bend	trans	-63.3	146.8	176	166.8	0	0	0	0	110.8	T962 R1013 W1026 Y1032 R1033	T962-V1028 WeakPolarHBondContact O-CG1 3.33Å; T962-V1028 WeakPolarHBondContact O-CG2 3.25Å; R1013-V1028 HydrophobicContact CG-CG2 4.28Å; W1026-V1028 PolarHBondContact O-N 3.32Å; V1028-Y1032 HydrophobicContact CG1-CD2 3.65Å; V1028-Y1032 HydrophobicContact CG1-CE2 4.48Å; V1028-Y1032 HydrophobicContact CG1-CG 4.25Å; V1028-R1033 PolarHBondContact O-NH1 3.2Å; V1028-R1033 PolarHBondContact O-NH2 3.45Å
1029	P	49.7	Very low	54.3	Low	40 Å²	40	68.3 Å²	68.3	26%	0.26	37%	0.371	S	S	.	.			trans	-55.3	139.8	179	-29.6	36.2	0	0	0	115	R1031 Y1032	P1029-R1031 PolarHBondContact O-N 3.32Å; P1029-Y1032 HydrophobicContact CB-CD2 4.01Å; P1029-Y1032 HydrophobicContact CB-CE2 4.15Å; P1029-Y1032 HydrophobicContact CG-CD2 4.33Å; P1029-Y1032 HydrophobicContact CG-CE2 4.14Å; P1029-Y1032 PolarHBondContact O-N 3.13Å
1030	V	44.3	Very low	53.6	Low	61 Å²	61	69 Å²	69	37%	0.37	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-57	-27	-176.4	-179.8	0	0	0	0	113.2	Y1032 R1033 Y1037	V1030-Y1032 PolarHBondContact O-N 2.66Å; V1030-Y1032 VanDerWaalsContact O-N 3.15Å; V1030-R1033 PolarHBondContact O-N 3.2Å; V1030-Y1037 HydrophobicContact CG1-CE2 3.91Å
1031	R	47.7	Very low	53	Low	110 Å²	110	69 Å²	69	42%	0.415	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-56.9	-28.1	176.9	-53.1	-175.5	-157.8	-74.5	-6.3	112.6	P1029	P1029-R1031 PolarHBondContact O-N 3.32Å
1032	Y	42.5	Very low	52.3	Low	44 Å²	44	66.2 Å²	66.2	17%	0.173	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-89.5	0.4	175.9	-54.3	-74.2	0	0	0	114.4	L963 G964 V1028 P1029 V1030 P1043	L963-Y1032 WeakPolarHBondContact O-CB 3.38Å; L963-Y1032 WeakPolarHBondContact O-CD1 3.4Å; G964-Y1032 CarbonylContact C-O 3.56Å; V1028-Y1032 HydrophobicContact CG1-CD2 3.65Å; V1028-Y1032 HydrophobicContact CG1-CE2 4.48Å; V1028-Y1032 HydrophobicContact CG1-CG 4.25Å; P1029-Y1032 HydrophobicContact CB-CD2 4.01Å; P1029-Y1032 HydrophobicContact CB-CE2 4.15Å; P1029-Y1032 HydrophobicContact CG-CD2 4.33Å; P1029-Y1032 HydrophobicContact CG-CE2 4.14Å; P1029-Y1032 PolarHBondContact O-N 3.13Å; V1030-Y1032 PolarHBondContact O-N 2.66Å; V1030-Y1032 VanDerWaalsContact O-N 3.15Å; Y1032-P1043 PolarHBondContact OH-O 3.41Å
1033	R	47.4	Very low	51.6	Low	72 Å²	72	63.9 Å²	63.9	27%	0.272	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-16.1	178.5	-67.2	-163.3	-175.5	71.2	34.5	115.1	W1025 W1026 V1028 V1030	W1025-R1033 PolarHBondContact O-NE 3.21Å; W1025-R1033 PolarHBondContact O-NH2 3.09Å; W1026-R1033 VanDerWaalsContact CA-CZ 3.45Å; W1026-R1033 VanDerWaalsContact O-CZ 3.26Å; W1026-R1033 PolarHBondContact O-NH1 3.05Å; W1026-R1033 VanDerWaalsContact O-NH1 3.08Å; W1026-R1033 PolarHBondContact O-NH2 3.16Å; V1028-R1033 PolarHBondContact O-NH1 3.2Å; V1028-R1033 PolarHBondContact O-NH2 3.45Å; V1030-R1033 PolarHBondContact O-N 3.2Å
1034	S	43.2	Very low	51.6	Low	31 Å²	31	63.9 Å²	63.9	22%	0.217	35%	0.346	C	S	.	.			trans	-139	127.9	-171.6	-160.8	0	0	0	0	112.6	A1036 Y1037	S1034-A1036 PolarHBondContact O-N 2.95Å; S1034-Y1037 PolarHBondContact O-N 2.98Å
1035	P	44.3	Very low	51.7	Low	62 Å²	62	63.4 Å²	63.4	40%	0.403	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-55.6	-21.8	171.2	-26.4	35.3	0	0	0	114.1	C923 Y1037 Q1038	C923-P1035 HydrophobicContact CB-CB 4.48Å; P1035-Y1037 PolarHBondContact O-N 3.02Å; P1035-Y1037 VanDerWaalsContact O-N 3.08Å; P1035-Q1038 WeakPolarHBondContact O-CG 3.45Å; P1035-Q1038 PolarHBondContact O-N 3.47Å
1036	A	39.5	Very low	51.9	Low	72 Å²	72	62.5 Å²	62.5	60%	0.595	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-62.9	-12.2	-179.5	0	0	0	0	0	115	S1034	S1034-A1036 PolarHBondContact O-N 2.95Å
1037	Y	43.9	Very low	51.9	Low	54 Å²	54	60 Å²	60	21%	0.212	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-103	8.5	-179.8	-67.9	-66.7	0	0	0	114.6	R267 V1030 S1034 P1035 T1039 I1040	R267-Y1037 PolarHBondContact NH2-OH 2.9Å; V1030-Y1037 HydrophobicContact CG1-CE2 3.91Å; S1034-Y1037 PolarHBondContact O-N 2.98Å; P1035-Y1037 PolarHBondContact O-N 3.02Å; P1035-Y1037 VanDerWaalsContact O-N 3.08Å; Y1037-T1039 PolarHBondContact O-N 2.9Å; Y1037-T1039 VanDerWaalsContact O-N 3.08Å; Y1037-I1040 HydrophobicContact CD1-CD1 4.07Å; Y1037-I1040 PolarHBondContact O-N 2.72Å; Y1037-I1040 VanDerWaalsContact O-N 3.09Å
1038	Q	42.4	Very low	52	Low	122 Å²	122	60.9 Å²	60.9	57%	0.57	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.5	-179.4	-72.7	-177.6	11.2	0	0	115.1	P1035 I1040	P1035-Q1038 WeakPolarHBondContact O-CG 3.45Å; P1035-Q1038 PolarHBondContact O-N 3.47Å; Q1038-I1040 VanDerWaalsContact C-N 3.31Å
1039	T	42.2	Very low	52.5	Low	132 Å²	132	63.8 Å²	63.8	81%	0.81	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-11.8	173.2	48.8	0	0	0	0	113.9	Y1037	Y1037-T1039 PolarHBondContact O-N 2.9Å; Y1037-T1039 VanDerWaalsContact O-N 3.08Å
1040	I	44.4	Very low	53.1	Low	70 Å²	70	62.5 Å²	62.5	36%	0.359	34%	0.341	S	S	.	.	S	Bend	trans	-101.8	132	178.6	-55.3	178.1	0	0	0	107.9	Y1037 Q1038 S1042	Y1037-I1040 HydrophobicContact CD1-CD1 4.07Å; Y1037-I1040 PolarHBondContact O-N 2.72Å; Y1037-I1040 VanDerWaalsContact O-N 3.09Å; Q1038-I1040 VanDerWaalsContact C-N 3.31Å; I1040-S1042 PolarHBondContact O-N 2.81Å
1041	P	50.1	Low	54	Low	104 Å²	104	68.3 Å²	68.3	68%	0.675	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-57.4	130.9	175.2	24.1	-33.6	0	0	0	110.3
1042	S	52.4	Low	55.1	Low	58 Å²	58	66.7 Å²	66.7	41%	0.406	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-57.6	122.8	177.9	-51.1	0	0	0	0	109.8	I1040 G1085	I1040-S1042 PolarHBondContact O-N 2.81Å; S1042-G1085 WeakPolarHBondContact O-CA 3.37Å
1043	P	54.7	Low	56.4	Low	17 Å²	17	65.2 Å²	65.2	11%	0.11	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-61.3	143.3	173.7	26.7	-33.8	0	0	0	109.7	Y1032 H1048	Y1032-P1043 PolarHBondContact OH-O 3.41Å; P1043-H1048 VanDerWaalsContact CB-CE1 3.45Å; P1043-H1048 WeakPolarHBondContact CB-CE1 3.42Å
1044	S	67.2	Low	57.4	Low	13 Å²	13	66 Å²	66	9%	0.091	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-74.3	145.4	171.4	-173.6	0	0	0	0	110.1	F1046 D1047 A1083 C1084	S1044-F1046 PolarHBondContact O-N 2.59Å; S1044-F1046 VanDerWaalsContact O-N 3.16Å; S1044-F1046 WeakPolarHBondContact OG-CB 3.35Å; S1044-F1046 PolarHBondContact OG-N 2.78Å; S1044-F1046 VanDerWaalsContact OG-N 3.09Å; S1044-D1047 VanDerWaalsContact CB-CG 3.43Å; S1044-D1047 VanDerWaalsContact CB-OD2 3.25Å; S1044-D1047 WeakPolarHBondContact CB-OD2 3.3Å; S1044-D1047 PolarHBondContact N-OD2 3.08Å; S1044-D1047 WeakPolarHBondContact O-CB 3.38Å; S1044-D1047 PolarHBondContact O-N 3.09Å; S1044-A1083 CarbonylContact C-O 3.52Å; S1044-A1083 WeakPolarHBondContact CA-O 3.38Å; S1044-C1084 WeakPolarHBondContact OG-CA 3.26Å; S1044-C1084 PolarHBondContact OG-O 3.46Å
1045	L	71.8	Confident	58.2	Low	8 Å²	8	72.3 Å²	72.3	4%	0.042	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-29.2	162.4	-178.3	67.8	0	0	0	111.2	A1083 F1161 L1165 L1170	L1045-A1083 HydrophobicContact CB-CB 4.21Å; L1045-A1083 HydrophobicContact CD2-CB 4.45Å; L1045-A1083 PolarHBondContact N-O 3.46Å; L1045-F1161 HydrophobicContact CD2-CD1 4.27Å; L1045-L1165 HydrophobicContact CD1-CD2 4.34Å; L1045-L1165 HydrophobicContact CD2-CD2 3.82Å; L1045-L1165 HydrophobicContact CD2-CG 4.04Å; L1045-L1170 HydrophobicContact CD2-CD2 4.08Å; L1045-L1170 HydrophobicContact CG-CD2 3.96Å
1046	F	73.7	Confident	59.2	Low	17 Å²	17	72.1 Å²	72.1	8%	0.075	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	1.9	178.1	-57.8	-95.2	0	0	0	113.9	S1044 F1049 Y1059 L1061 C1084 F1132 F1161 L1170	S1044-F1046 PolarHBondContact O-N 2.59Å; S1044-F1046 VanDerWaalsContact O-N 3.16Å; S1044-F1046 WeakPolarHBondContact OG-CB 3.35Å; S1044-F1046 PolarHBondContact OG-N 2.78Å; S1044-F1046 VanDerWaalsContact OG-N 3.09Å; F1046-F1049 WeakPolarHBondContact O-CE1 3.32Å; F1046-F1049 WeakPolarHBondContact O-CZ 3.35Å; F1046-Y1059 WeakPolarHBondContact CD1-O 3.37Å; F1046-L1061 HydrophobicContact CE1-CB 4.4Å; F1046-L1061 HydrophobicContact CZ-CB 3.96Å; F1046-C1084 WeakPolarHBondContact CE2-SG 3.34Å; F1046-F1132 HydrophobicContact CE1-CD2 4.15Å; F1046-F1161 HydrophobicContact CE1-CE1 4.11Å; F1046-F1161 HydrophobicContact CE1-CZ 4.5Å; F1046-F1161 AromaticContact CZ-CE1 3.65Å; F1046-F1161 HydrophobicContact CZ-CE1 3.65Å; F1046-F1161 HydrophobicContact CZ-CZ 4.15Å; F1046-L1170 HydrophobicContact CD1-CD1 3.83Å; F1046-L1170 HydrophobicContact CD1-CD2 4.42Å; F1046-L1170 HydrophobicContact CE1-CD1 4.35Å; F1046-L1170 HydrophobicContact CE1-CD2 4.33Å
1047	D	68	Low	60.7	Low	103 Å²	103	69.1 Å²	69.1	55%	0.551	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-18.7	169.5	-57.6	-27.9	0	0	0	111.8	S1044	S1044-D1047 VanDerWaalsContact CB-CG 3.43Å; S1044-D1047 VanDerWaalsContact CB-OD2 3.25Å; S1044-D1047 WeakPolarHBondContact CB-OD2 3.3Å; S1044-D1047 PolarHBondContact N-OD2 3.08Å; S1044-D1047 WeakPolarHBondContact O-CB 3.38Å; S1044-D1047 PolarHBondContact O-N 3.09Å
1048	H	64.7	Low	62.1	Low	86 Å²	86	70.6 Å²	70.6	40%	0.398	40%	0.396	S	S	.	.			trans	-111.9	111.2	-174.5	-68.7	63.9	0	0	0	109.9	P1043 H1169 L1170	P1043-H1048 VanDerWaalsContact CB-CE1 3.45Å; P1043-H1048 WeakPolarHBondContact CB-CE1 3.42Å; H1048-H1169 HydrophobicContact CB-CB 4.03Å; H1048-H1169 WeakPolarHBondContact O-CA 3.38Å; H1048-H1169 WeakPolarHBondContact O-CB 3.23Å; H1048-L1170 PolarHBondContact O-N 2.81Å; H1048-L1170 VanDerWaalsContact O-N 3.08Å
1049	F	68.3	Low	63.9	Low	63 Å²	63	65.7 Å²	65.7	28%	0.276	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-111	151.6	177.6	-43.3	-62.3	0	0	0	110.5	F1046 A1053 Y1059 L1170	F1046-F1049 WeakPolarHBondContact O-CE1 3.32Å; F1046-F1049 WeakPolarHBondContact O-CZ 3.35Å; F1049-A1053 HydrophobicContact CB-CB 3.73Å; F1049-A1053 HydrophobicContact CG-CB 4.16Å; F1049-Y1059 AromaticContact CD1-CD2 3.88Å; F1049-Y1059 HydrophobicContact CD1-CD2 3.88Å; F1049-Y1059 HydrophobicContact CD1-CE2 4.17Å; F1049-Y1059 AromaticContact CE1-CD2 3.4Å; F1049-Y1059 HydrophobicContact CE1-CD2 3.4Å; F1049-Y1059 VanDerWaalsContact CE1-CD2 3.4Å; F1049-Y1059 HydrophobicContact CE1-CE2 4.09Å; F1049-Y1059 HydrophobicContact CE1-CG 4.17Å; F1049-Y1059 AromaticContact CZ-CD2 3.89Å; F1049-Y1059 HydrophobicContact CZ-CD2 3.89Å; F1049-L1170 HydrophobicContact CD1-CD1 4.14Å; F1049-L1170 HydrophobicContact CE1-CD1 4.1Å
1050	G	61.8	Low	65.7	Low	14 Å²	14	64.9 Å²	64.9	14%	0.144	36%	0.355	C	S	.	.			trans	-86.7	170.8	164.6	0	0	0	0	0	111.7	W1052 A1053	G1050-W1052 PolarHBondContact O-N 3.08Å; G1050-A1053 PolarHBondContact O-N 3.28Å; G1050-A1053 VanDerWaalsContact O-N 3.12Å
1051	D	64.1	Low	67.6	Low	182 Å²	182	62.4 Å²	62.4	97%	0.973	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-6.8	-174.1	-47.4	-26.1	0	0	0	116.5
1052	W	71.7	Confident	69.2	Low	77 Å²	77	58.2 Å²	58.2	29%	0.292	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-12	178.9	67.7	-89.1	0	0	0	114	G1050 Y1059 L1170 V1171 N1172 P1173	G1050-W1052 PolarHBondContact O-N 3.08Å; W1052-Y1059 HydrophobicContact CH2-CD1 4.34Å; W1052-Y1059 AromaticContact CH2-CE1 3.57Å; W1052-Y1059 HydrophobicContact CH2-CE1 3.57Å; W1052-Y1059 AromaticContact CH2-CZ 3.81Å; W1052-Y1059 AromaticContact CZ3-CE1 3.87Å; W1052-Y1059 HydrophobicContact CZ3-CE1 3.87Å; W1052-Y1059 AromaticContact CZ3-CZ 3.92Å; W1052-Y1059 WeakPolarHBondContact CZ3-OH 3.1Å; W1052-L1170 HydrophobicContact CZ2-CB 4.06Å; W1052-L1170 PolarHBondContact NE1-O 3.27Å; W1052-V1171 WeakPolarHBondContact CZ2-O 3.18Å; W1052-N1172 HydrophobicContact CB-CB 4.07Å; W1052-N1172 HydrophobicContact CD2-CB 3.68Å; W1052-N1172 HydrophobicContact CE3-CB 4.12Å; W1052-N1172 HydrophobicContact CG-CB 3.63Å; W1052-P1173 HydrophobicContact CH2-CG 4.48Å; W1052-P1173 HydrophobicContact CZ3-CG 4.46Å
1053	A	69.1	Low	70.8	Confident	13 Å²	13	55.5 Å²	55.5	11%	0.107	30%	0.296	C	S	.	.	S	Bend	trans	-105.7	141.2	-174.1	0	0	0	0	0	112.4	F1049 G1050 N1055 Y1059	F1049-A1053 HydrophobicContact CB-CB 3.73Å; F1049-A1053 HydrophobicContact CG-CB 4.16Å; G1050-A1053 PolarHBondContact O-N 3.28Å; G1050-A1053 VanDerWaalsContact O-N 3.12Å; A1053-N1055 PolarHBondContact O-N 3.36Å; A1053-Y1059 HydrophobicContact CB-CE2 3.96Å; A1053-Y1059 WeakPolarHBondContact CB-OH 3.45Å
1054	D	68.7	Low	72.3	Confident	89 Å²	89	54.7 Å²	54.7	48%	0.476	29%	0.29	S	S	.	.			trans	-68.5	129	168.7	-65.6	-53.1	0	0	0	110.2	G1056 T1057 K1128	D1054-G1056 PolarHBondContact O-N 3.2Å; D1054-T1057 PolarHBondContact O-N 3.45Å; D1054-K1128 IonicContact OD1-NZ 2.97Å; D1054-K1128 IonicContact OD2-NZ 2.68Å; D1054-K1128 PolarHBondContact OD2-NZ 2.73Å
1055	N	60.1	Low	73.2	Confident	163 Å²	163	54 Å²	54	87%	0.872	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	1.3	174.7	-72	-14.1	0	0	0	115.6	A1053	A1053-N1055 PolarHBondContact O-N 3.36Å
1056	G	64	Low	73.7	Confident	57 Å²	57	53.7 Å²	53.7	59%	0.588	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	10.3	173.6	0	0	0	0	0	114.5	D1054	D1054-G1056 PolarHBondContact O-N 3.2Å
1057	T	71.4	Confident	74.1	Confident	10 Å²	10	56.1 Å²	56.1	6%	0.061	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.7	177.4	-61.8	0	0	0	0	110.9	D1054 Y1059 K1128 V1130	D1054-T1057 PolarHBondContact O-N 3.45Å; T1057-Y1059 HydrophobicContact CG2-CD2 3.95Å; T1057-Y1059 HydrophobicContact CG2-CE1 4.2Å; T1057-Y1059 HydrophobicContact CG2-CE2 3.46Å; T1057-Y1059 VanDerWaalsContact CG2-CE2 3.46Å; T1057-Y1059 VanDerWaalsContact O-CD2 3.28Å; T1057-Y1059 WeakPolarHBondContact O-CD2 3.46Å; T1057-Y1059 WeakPolarHBondContact O-CE2 3.43Å; T1057-K1128 WeakPolarHBondContact CA-O 3.4Å; T1057-K1128 HydrophobicContact CG2-CB 4.08Å; T1057-K1128 VanDerWaalsContact OG1-CB 3.3Å; T1057-K1128 WeakPolarHBondContact OG1-CB 3.46Å; T1057-K1128 VanDerWaalsContact OG1-CD 3.3Å; T1057-K1128 WeakPolarHBondContact OG1-CD 3.36Å; T1057-V1130 HydrophobicContact CG2-CB 4.46Å; T1057-V1130 HydrophobicContact CG2-CG2 3.68Å
1058	N	74	Confident	74.4	Confident	84 Å²	84	51.9 Å²	51.9	45%	0.449	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	114.8	175.9	-178.8	-79.5	0	0	0	109.6	K1128 K1129 V1130	N1058-K1128 PolarHBondContact N-O 2.94Å; N1058-K1129 HydrophobicContact CB-CG 4.06Å; N1058-K1129 WeakPolarHBondContact O-CA 3.33Å; N1058-V1130 PolarHBondContact O-N 2.97Å
1059	Y	79	Confident	75	Confident	19 Å²	19	51.4 Å²	51.4	8%	0.075	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.5	178.9	-63.5	-100.2	0	0	0	109.7	F1046 F1049 W1052 A1053 T1057 V1130 F1132 L1170	F1046-Y1059 WeakPolarHBondContact CD1-O 3.37Å; F1049-Y1059 AromaticContact CD1-CD2 3.88Å; F1049-Y1059 HydrophobicContact CD1-CD2 3.88Å; F1049-Y1059 HydrophobicContact CD1-CE2 4.17Å; F1049-Y1059 AromaticContact CE1-CD2 3.4Å; F1049-Y1059 HydrophobicContact CE1-CD2 3.4Å; F1049-Y1059 VanDerWaalsContact CE1-CD2 3.4Å; F1049-Y1059 HydrophobicContact CE1-CE2 4.09Å; F1049-Y1059 HydrophobicContact CE1-CG 4.17Å; F1049-Y1059 AromaticContact CZ-CD2 3.89Å; F1049-Y1059 HydrophobicContact CZ-CD2 3.89Å; W1052-Y1059 HydrophobicContact CH2-CD1 4.34Å; W1052-Y1059 AromaticContact CH2-CE1 3.57Å; W1052-Y1059 HydrophobicContact CH2-CE1 3.57Å; W1052-Y1059 AromaticContact CH2-CZ 3.81Å; W1052-Y1059 AromaticContact CZ3-CE1 3.87Å; W1052-Y1059 HydrophobicContact CZ3-CE1 3.87Å; W1052-Y1059 AromaticContact CZ3-CZ 3.92Å; W1052-Y1059 WeakPolarHBondContact CZ3-OH 3.1Å; A1053-Y1059 HydrophobicContact CB-CE2 3.96Å; A1053-Y1059 WeakPolarHBondContact CB-OH 3.45Å; T1057-Y1059 HydrophobicContact CG2-CD2 3.95Å; T1057-Y1059 HydrophobicContact CG2-CE1 4.2Å; T1057-Y1059 HydrophobicContact CG2-CE2 3.46Å; T1057-Y1059 VanDerWaalsContact CG2-CE2 3.46Å; T1057-Y1059 VanDerWaalsContact O-CD2 3.28Å; T1057-Y1059 WeakPolarHBondContact O-CD2 3.46Å; T1057-Y1059 WeakPolarHBondContact O-CE2 3.43Å; Y1059-V1130 HydrophobicContact CD1-CB 3.57Å; Y1059-V1130 HydrophobicContact CD1-CG1 3.74Å; Y1059-V1130 HydrophobicContact CD1-CG2 4.02Å; Y1059-V1130 HydrophobicContact CE1-CB 3.9Å; Y1059-V1130 HydrophobicContact CE1-CG1 4.06Å; Y1059-V1130 HydrophobicContact CE1-CG2 3.82Å; Y1059-V1130 HydrophobicContact CG-CB 4.26Å; Y1059-F1132 AromaticContact CD1-CE2 3.68Å; Y1059-F1132 HydrophobicContact CD1-CE2 3.68Å; Y1059-F1132 AromaticContact CD1-CZ 3.73Å; Y1059-F1132 HydrophobicContact CD1-CZ 3.73Å; Y1059-F1132 HydrophobicContact CE1-CZ 4.35Å; Y1059-F1132 HydrophobicContact CG-CE2 4.28Å; Y1059-L1170 HydrophobicContact CG-CD1 4.14Å
1060	R	81.3	Confident	75	Confident	116 Å²	116	57.2 Å²	57.2	44%	0.438	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	146.1	178.2	62.5	177.5	-170.8	152.3	9	112.4	V1062 V1130 N1131 F1132	R1060-V1062 HydrophobicContact CG-CG2 3.99Å; R1060-V1130 PolarHBondContact N-O 2.61Å; R1060-N1131 VanDerWaalsContact CZ-OD1 3.26Å; R1060-N1131 PolarHBondContact NE-OD1 3.12Å; R1060-N1131 PolarHBondContact NH2-OD1 3Å; R1060-N1131 CarbonylContact O-C 3.59Å; R1060-F1132 PolarHBondContact O-N 3Å
1061	L	84.4	Confident	75.1	Confident	17 Å²	17	58.8 Å²	58.8	9%	0.089	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	122.2	169.6	178.2	60.8	0	0	0	110	F1046 A1063 I1064 L1080 I1100 F1132 L1134 F1161	F1046-L1061 HydrophobicContact CE1-CB 4.4Å; F1046-L1061 HydrophobicContact CZ-CB 3.96Å; L1061-A1063 WeakPolarHBondContact CD1-O 2.93Å; L1061-I1064 HydrophobicContact CD2-CG1 4.36Å; L1061-L1080 HydrophobicContact CD2-CB 4.19Å; L1061-L1080 HydrophobicContact CD2-CD1 3.6Å; L1061-L1080 HydrophobicContact CD2-CG 4.31Å; L1061-I1100 HydrophobicContact CD2-CD1 4.04Å; L1061-I1100 HydrophobicContact CD2-CG2 4.36Å; L1061-I1100 HydrophobicContact CG-CD1 4.42Å; L1061-I1100 HydrophobicContact CG-CG2 4.17Å; L1061-F1132 HydrophobicContact CD1-CB 4.25Å; L1061-L1134 HydrophobicContact CD1-CB 4.03Å; L1061-F1161 HydrophobicContact CD1-CE2 4.18Å; L1061-F1161 HydrophobicContact CD1-CZ 4.21Å; L1061-F1161 HydrophobicContact CD2-CE2 4.49Å; L1061-F1161 HydrophobicContact CD2-CZ 4.37Å
1062	V	83.6	Confident	75.4	Confident	17 Å²	17	50.2 Å²	50.2	10%	0.103	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-25.8	-173.8	179.6	0	0	0	0	113.2	R1060 P1101 F1116 N1131 F1132	R1060-V1062 HydrophobicContact CG-CG2 3.99Å; V1062-P1101 WeakPolarHBondContact O-CD 3.44Å; V1062-P1101 VanDerWaalsContact O-CG 3.26Å; V1062-P1101 WeakPolarHBondContact O-CG 3.39Å; V1062-F1116 HydrophobicContact CG1-CE2 3.99Å; V1062-F1116 HydrophobicContact CG1-CZ 3.87Å; V1062-N1131 HydrophobicContact CG2-CB 3.69Å; V1062-F1132 PolarHBondContact N-O 2.99Å
1063	A	85.5	Confident	75.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	158.8	175.2	0	0	0	0	0	112.5	L1061 P1101 I1103 L1112 V1133 L1134	L1061-A1063 WeakPolarHBondContact CD1-O 2.93Å; A1063-P1101 HydrophobicContact CB-CG 4.15Å; A1063-I1103 HydrophobicContact CB-CD1 3.71Å; A1063-I1103 HydrophobicContact CB-CG1 4.45Å; A1063-L1112 HydrophobicContact CB-CD2 3.97Å; A1063-V1133 HydrophobicContact CB-CG1 4.3Å; A1063-V1133 HydrophobicContact CB-CG2 4.35Å; A1063-L1134 PolarHBondContact O-N 3.44Å
1064	I	85.4	Confident	75.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	115.9	166.3	-59.5	173.6	0	0	0	107.9	L1061 W1076 L1077 L1080 I1100 P1101 L1102 I1103 L1134	L1061-I1064 HydrophobicContact CD2-CG1 4.36Å; I1064-W1076 HydrophobicContact CD1-CB 4.29Å; I1064-L1077 HydrophobicContact CD1-CB 4.05Å; I1064-L1077 HydrophobicContact CD1-CD1 4.47Å; I1064-L1080 HydrophobicContact CD1-CD1 4.27Å; I1064-I1100 HydrophobicContact CD1-CG2 4.25Å; I1064-I1100 HydrophobicContact CG1-CG2 3.97Å; I1064-P1101 PolarHBondContact N-O 3.41Å; I1064-L1102 HydrophobicContact CB-CD2 3.87Å; I1064-L1102 HydrophobicContact CG2-CD2 3.85Å; I1064-I1103 PolarHBondContact O-N 2.86Å; I1064-L1134 HydrophobicContact CD1-CD2 4.43Å; I1064-L1134 HydrophobicContact CG1-CB 4.23Å; I1064-L1134 HydrophobicContact CG1-CD2 4.18Å; I1064-L1134 HydrophobicContact CG2-CD2 4.17Å; I1064-L1134 HydrophobicContact CG2-CG 4.31Å
1065	V	85.6	Confident	75.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	117.5	-179.4	174.7	0	0	0	0	109.2	I1103 L1105 I1108 V1133 L1134 V1135 D1136	V1065-I1103 WeakPolarHBondContact CA-O 3.45Å; V1065-I1103 HydrophobicContact CG2-CB 4.27Å; V1065-I1103 HydrophobicContact CG2-CG2 4.48Å; V1065-L1105 HydrophobicContact CG1-CD1 4.02Å; V1065-I1108 HydrophobicContact CG1-CD1 3.64Å; V1065-I1108 HydrophobicContact CG1-CG1 3.9Å; V1065-V1133 HydrophobicContact CB-CG1 4.43Å; V1065-V1133 HydrophobicContact CG2-CG1 3.6Å; V1065-L1134 PolarHBondContact N-O 3.4Å; V1065-V1135 HydrophobicContact CB-CG1 4.37Å; V1065-V1135 HydrophobicContact CB-CG2 4.38Å; V1065-V1135 HydrophobicContact CG1-CG1 4.22Å; V1065-D1136 VanDerWaalsContact O-CB 3.3Å; V1065-D1136 WeakPolarHBondContact O-CB 3.46Å; V1065-D1136 PolarHBondContact O-N 3.14Å
1066	T	83.3	Confident	76.1	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.8	-171.9	178.4	0	0	0	0	113	D1068 L1069 F1072 L1102 I1103 H1104 D1136	T1066-D1068 PolarHBondContact OG1-N 3.08Å; T1066-L1069 HydrophobicContact CG2-CD2 3.88Å; T1066-F1072 WeakPolarHBondContact OG1-CD1 3.31Å; T1066-L1102 HydrophobicContact CG2-CD2 4.18Å; T1066-I1103 PolarHBondContact N-O 2.84Å; T1066-H1104 WeakPolarHBondContact O-CA 3.25Å; T1066-D1136 VanDerWaalsContact CA-OD2 3.32Å; T1066-D1136 WeakPolarHBondContact CA-OD2 3.14Å; T1066-D1136 WeakPolarHBondContact CB-OD2 3.18Å; T1066-D1136 PolarHBondContact OG1-OD2 3.24Å
1067	N	81.1	Confident	76.7	Confident	68 Å²	68	34.1 Å²	34.1	36%	0.364	17%	0.169	S	C	.	.	S	Bend	trans	-86.5	-29.4	165.5	-81.6	19	0	0	0	111.8	L1069 L1105 D1136	N1067-L1069 PolarHBondContact O-N 2.95Å; N1067-L1105 WeakPolarHBondContact OD1-CB 3.39Å; N1067-D1136 PolarHBondContact N-OD2 2.84Å
1068	D	75.9	Confident	76.5	Confident	14 Å²	14	34.7 Å²	34.7	8%	0.075	17%	0.172	C	C	.	.			trans	-96.3	79.2	178.1	-158.6	-30.1	0	0	0	112	R87 T1066 K1070 V1071 F1072 G1073	R87-D1068 IonicContact CZ-OD2 2.62Å; R87-D1068 IonicContact NE-OD2 2.59Å; R87-D1068 IonicContact NH2-OD2 3.84Å; R87-D1068 PolarHBondContact NH2-OD2 3.39Å; T1066-D1068 PolarHBondContact OG1-N 3.08Å; D1068-K1070 PolarHBondContact O-N 3.07Å; D1068-K1070 VanDerWaalsContact O-N 3.14Å; D1068-K1070 WeakPolarHBondContact OD1-CA 3.44Å; D1068-K1070 WeakPolarHBondContact OD1-CB 3.17Å; D1068-K1070 PolarHBondContact OD1-N 3.07Å; D1068-V1071 PolarHBondContact OD1-N 2.79Å; D1068-F1072 HydrophobicContact CB-CB 4.07Å; D1068-F1072 PolarHBondContact O-N 3Å; D1068-G1073 PolarHBondContact O-N 3.12Å
1069	L	77	Confident	76.3	Confident	75 Å²	75	30.7 Å²	30.7	39%	0.393	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-3.7	170.4	-65.6	175	0	0	0	114.1	T1066 N1067 P1074 L1102 H1104	T1066-L1069 HydrophobicContact CG2-CD2 3.88Å; N1067-L1069 PolarHBondContact O-N 2.95Å; L1069-P1074 WeakPolarHBondContact O-CD 3.36Å; L1069-P1074 VanDerWaalsContact O-CG 3.24Å; L1069-P1074 WeakPolarHBondContact O-CG 3.01Å; L1069-L1102 HydrophobicContact CD2-CB 3.99Å; L1069-H1104 HydrophobicContact CD1-CB 4.14Å
1070	K	68.2	Low	76.1	Confident	186 Å²	186	29.8 Å²	29.8	81%	0.809	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-37.8	-179.2	-62.5	-177.9	179.9	179.4	0	112.5	D1068	D1068-K1070 PolarHBondContact O-N 3.07Å; D1068-K1070 VanDerWaalsContact O-N 3.14Å; D1068-K1070 WeakPolarHBondContact OD1-CA 3.44Å; D1068-K1070 WeakPolarHBondContact OD1-CB 3.17Å; D1068-K1070 PolarHBondContact OD1-N 3.07Å
1071	V	63.4	Low	75.5	Confident	46 Å²	46	25.6 Å²	25.6	28%	0.279	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-68.9	-172.5	-164.9	0	0	0	0	111.8	F86 D1068 G1073 G1075	F86-V1071 HydrophobicContact CB-CG1 3.82Å; F86-V1071 HydrophobicContact CD1-CG1 3.73Å; F86-V1071 HydrophobicContact CG-CG1 4Å; D1068-V1071 PolarHBondContact OD1-N 2.79Å; V1071-G1073 PolarHBondContact O-N 2.66Å; V1071-G1075 PolarHBondContact O-N 3.02Å
1072	F	70.5	Confident	74.5	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.009	14%	0.144	C	C	.	.	H	α-helix	trans	-56.5	-53.9	-176.4	-179.8	-81.9	0	0	0	111.9	F86 T1066 D1068 G1075 W1076 D1136 C1158	F86-F1072 AromaticContact CE2-CD2 3.79Å; F86-F1072 HydrophobicContact CE2-CD2 3.79Å; F86-F1072 HydrophobicContact CZ-CD2 4.33Å; T1066-F1072 WeakPolarHBondContact OG1-CD1 3.31Å; D1068-F1072 HydrophobicContact CB-CB 4.07Å; D1068-F1072 PolarHBondContact O-N 3Å; F1072-G1075 PolarHBondContact O-N 3.11Å; F1072-W1076 AromaticContact CD1-CD1 3.82Å; F1072-W1076 AromaticContact CD2-CD1 3.79Å; F1072-W1076 AromaticContact CD2-NE1 3.99Å; F1072-W1076 AromaticContact CE1-CD1 3.46Å; F1072-W1076 VanDerWaalsContact CE1-CD1 3.46Å; F1072-W1076 HydrophobicContact CE1-CG 4.23Å; F1072-W1076 AromaticContact CE2-CD1 3.45Å; F1072-W1076 VanDerWaalsContact CE2-CD1 3.45Å; F1072-W1076 AromaticContact CE2-NE1 3.39Å; F1072-W1076 AromaticContact CG-CD1 3.96Å; F1072-W1076 AromaticContact CZ-CD1 3.25Å; F1072-W1076 HydrophobicContact CZ-CG 4.22Å; F1072-W1076 AromaticContact CZ-NE1 3.48Å; F1072-W1076 PolarHBondContact O-N 3.06Å; F1072-D1136 HydrophobicContact CD1-CB 3.9Å; F1072-D1136 HydrophobicContact CE1-CB 3.62Å; F1072-D1136 HydrophobicContact CE2-CB 4.49Å; F1072-D1136 HydrophobicContact CG-CB 4.49Å; F1072-D1136 HydrophobicContact CZ-CB 3.95Å; F1072-C1158 HydrophobicContact CZ-CB 4.23Å
1073	G	74.2	Confident	73.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-58.1	-176.2	0	0	0	0	0	113.3	D1068 V1071 G1075 W1076 L1077 L1102	D1068-G1073 PolarHBondContact O-N 3.12Å; V1071-G1073 PolarHBondContact O-N 2.66Å; G1073-G1075 VanDerWaalsContact C-N 3.28Å; G1073-G1075 PolarHBondContact O-N 3.01Å; G1073-W1076 PolarHBondContact O-N 2.89Å; G1073-L1077 VanDerWaalsContact O-CB 3.28Å; G1073-L1077 WeakPolarHBondContact O-CB 3.48Å; G1073-L1077 PolarHBondContact O-N 2.92Å; G1073-L1102 VanDerWaalsContact CA-CD2 3.42Å
1074	P	69	Low	72.8	Confident	40 Å²	40	28.3 Å²	28.3	26%	0.26	15%	0.151	S	C	.	.	H	α-helix	trans	-58.8	-35.9	175.6	-27.7	37.7	0	0	0	113.6	L1069 N1078 L1102	L1069-P1074 WeakPolarHBondContact O-CD 3.36Å; L1069-P1074 VanDerWaalsContact O-CG 3.24Å; L1069-P1074 WeakPolarHBondContact O-CG 3.01Å; P1074-N1078 PolarHBondContact O-N 3.3Å; P1074-N1078 PolarHBondContact O-ND2 2.64Å; P1074-L1102 HydrophobicContact CG-CD1 4.31Å
1075	G	66.8	Low	71.4	Confident	7 Å²	7	28.7 Å²	28.7	7%	0.072	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-60.2	174.5	0	0	0	0	0	111.6	Y956 V1071 F1072 G1073 L1077 N1078 I1079	Y956-G1075 WeakPolarHBondContact OH-CA 3.27Å; V1071-G1075 PolarHBondContact O-N 3.02Å; F1072-G1075 PolarHBondContact O-N 3.11Å; G1073-G1075 VanDerWaalsContact C-N 3.28Å; G1073-G1075 PolarHBondContact O-N 3.01Å; G1075-L1077 VanDerWaalsContact C-N 3.29Å; G1075-L1077 PolarHBondContact O-N 2.85Å; G1075-N1078 PolarHBondContact O-N 3.22Å; G1075-I1079 PolarHBondContact O-N 3.3Å; G1075-I1079 VanDerWaalsContact O-N 3.08Å
1076	W	75.2	Confident	69.5	Low	4 Å²	4	31.1 Å²	31.1	2%	0.015	17%	0.173	C	C	.	.	H	α-helix	trans	-60.3	-37.9	-179.2	-86.4	109.3	0	0	0	113.1	A959 I1064 F1072 G1073 N1078 I1079 L1080 L1134 C1158 F1161 I1162 L1165	A959-W1076 HydrophobicContact CB-CH2 4.11Å; A959-W1076 HydrophobicContact CB-CZ3 4.48Å; I1064-W1076 HydrophobicContact CD1-CB 4.29Å; F1072-W1076 AromaticContact CD1-CD1 3.82Å; F1072-W1076 AromaticContact CD2-CD1 3.79Å; F1072-W1076 AromaticContact CD2-NE1 3.99Å; F1072-W1076 AromaticContact CE1-CD1 3.46Å; F1072-W1076 VanDerWaalsContact CE1-CD1 3.46Å; F1072-W1076 HydrophobicContact CE1-CG 4.23Å; F1072-W1076 AromaticContact CE2-CD1 3.45Å; F1072-W1076 VanDerWaalsContact CE2-CD1 3.45Å; F1072-W1076 AromaticContact CE2-NE1 3.39Å; F1072-W1076 AromaticContact CG-CD1 3.96Å; F1072-W1076 AromaticContact CZ-CD1 3.25Å; F1072-W1076 HydrophobicContact CZ-CG 4.22Å; F1072-W1076 AromaticContact CZ-NE1 3.48Å; F1072-W1076 PolarHBondContact O-N 3.06Å; G1073-W1076 PolarHBondContact O-N 2.89Å; W1076-N1078 VanDerWaalsContact C-N 3.26Å; W1076-N1078 PolarHBondContact O-N 2.69Å; W1076-I1079 HydrophobicContact CE3-CB 4.22Å; W1076-I1079 HydrophobicContact CE3-CD1 4.4Å; W1076-I1079 HydrophobicContact CE3-CG2 4.29Å; W1076-I1079 HydrophobicContact CH2-CD1 4.46Å; W1076-I1079 HydrophobicContact CZ3-CB 4.37Å; W1076-I1079 HydrophobicContact CZ3-CD1 4.21Å; W1076-I1079 HydrophobicContact CZ3-CG2 3.98Å; W1076-I1079 PolarHBondContact O-N 3.23Å; W1076-L1080 HydrophobicContact CB-CD1 4.33Å; W1076-L1080 HydrophobicContact CE3-CD1 3.8Å; W1076-L1080 HydrophobicContact CE3-CG 4.03Å; W1076-L1080 WeakPolarHBondContact O-CB 3.26Å; W1076-L1080 WeakPolarHBondContact O-CD1 3.38Å; W1076-L1080 VanDerWaalsContact O-CG 3.31Å; W1076-L1080 WeakPolarHBondContact O-CG 3.49Å; W1076-L1080 PolarHBondContact O-N 2.71Å; W1076-L1134 HydrophobicContact CB-CD2 3.94Å; W1076-L1134 HydrophobicContact CD2-CD2 4.18Å; W1076-L1134 HydrophobicContact CE3-CD2 4.43Å; W1076-L1134 HydrophobicContact CG-CD2 3.96Å; W1076-C1158 HydrophobicContact CZ2-CB 3.75Å; W1076-F1161 HydrophobicContact CZ3-CB 4.25Å; W1076-I1162 HydrophobicContact CH2-CD1 4.23Å; W1076-I1162 HydrophobicContact CH2-CG1 3.55Å; W1076-I1162 HydrophobicContact CZ2-CD1 4.02Å; W1076-I1162 HydrophobicContact CZ2-CG1 3.86Å; W1076-L1165 HydrophobicContact CZ3-CD1 4.41Å
1077	L	75.5	Confident	67.3	Low	10 Å²	10	38.1 Å²	38.1	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-55.5	-40.4	173.1	178.2	60.4	0	0	0	112.1	I1064 G1073 G1075 S1081 I1100 L1102	I1064-L1077 HydrophobicContact CD1-CB 4.05Å; I1064-L1077 HydrophobicContact CD1-CD1 4.47Å; G1073-L1077 VanDerWaalsContact O-CB 3.28Å; G1073-L1077 WeakPolarHBondContact O-CB 3.48Å; G1073-L1077 PolarHBondContact O-N 2.92Å; G1075-L1077 VanDerWaalsContact C-N 3.29Å; G1075-L1077 PolarHBondContact O-N 2.85Å; L1077-S1081 VanDerWaalsContact O-CB 3.24Å; L1077-S1081 WeakPolarHBondContact O-CB 3.48Å; L1077-S1081 PolarHBondContact O-N 2.91Å; L1077-S1081 PolarHBondContact O-OG 2.81Å; L1077-I1100 HydrophobicContact CD1-CB 3.75Å; L1077-I1100 HydrophobicContact CD1-CD1 4.42Å; L1077-I1100 HydrophobicContact CD1-CG2 4.49Å; L1077-I1100 WeakPolarHBondContact CD1-O 3.5Å; L1077-L1102 HydrophobicContact CD2-CD1 3.9Å; L1077-L1102 HydrophobicContact CD2-CG 4.35Å
1078	N	67.8	Low	65.3	Low	23 Å²	23	40.3 Å²	40.3	12%	0.123	22%	0.221	C	C	.	.	H	α-helix	trans	-77.3	-40.2	179.6	-76.7	-81.9	0	0	0	112.8	P914 N918 P1074 G1075 W1076 L1080 S1081 L1082	P914-N1078 HydrophobicContact CB-CB 3.47Å; P914-N1078 VanDerWaalsContact CB-CB 3.47Å; P914-N1078 HydrophobicContact CG-CB 4.03Å; P914-N1078 WeakPolarHBondContact CG-ND2 3.26Å; N918-N1078 PolarHBondContact ND2-OD1 3.21Å; N918-N1078 VanDerWaalsContact ND2-OD1 3.12Å; P1074-N1078 PolarHBondContact O-N 3.3Å; P1074-N1078 PolarHBondContact O-ND2 2.64Å; G1075-N1078 PolarHBondContact O-N 3.22Å; W1076-N1078 VanDerWaalsContact C-N 3.26Å; W1076-N1078 PolarHBondContact O-N 2.69Å; N1078-L1080 VanDerWaalsContact C-N 3.3Å; N1078-L1080 PolarHBondContact O-N 2.81Å; N1078-S1081 PolarHBondContact O-N 2.79Å; N1078-L1082 WeakPolarHBondContact O-CG 3.31Å; N1078-L1082 PolarHBondContact O-N 2.95Å; N1078-L1082 VanDerWaalsContact O-N 3.11Å
1079	I	69.3	Low	63.2	Low	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.4	-50.6	171.7	-66.6	-167.6	0	0	0	110	Y956 A959 L960 L963 G1075 W1076 S1081 L1082 A1083 L1165	Y956-I1079 HydrophobicContact CD1-CD1 4.33Å; Y956-I1079 HydrophobicContact CD2-CD1 3.26Å; Y956-I1079 HydrophobicContact CD2-CG1 4.16Å; Y956-I1079 HydrophobicContact CE1-CD1 4.34Å; Y956-I1079 HydrophobicContact CE2-CD1 3.25Å; Y956-I1079 HydrophobicContact CE2-CG1 3.62Å; Y956-I1079 HydrophobicContact CG-CD1 3.81Å; Y956-I1079 WeakPolarHBondContact O-CD1 3.42Å; A959-I1079 HydrophobicContact CB-CD1 3.98Å; A959-I1079 HydrophobicContact CB-CG2 4.32Å; L960-I1079 HydrophobicContact CD1-CD1 4.18Å; L960-I1079 HydrophobicContact CD1-CG1 4.23Å; L960-I1079 HydrophobicContact CD2-CD1 4.29Å; L960-I1079 HydrophobicContact CD2-CG1 3.8Å; L960-I1079 HydrophobicContact CG-CD1 3.73Å; L960-I1079 HydrophobicContact CG-CG1 3.79Å; L963-I1079 HydrophobicContact CD1-CG2 4.12Å; G1075-I1079 PolarHBondContact O-N 3.3Å; G1075-I1079 VanDerWaalsContact O-N 3.08Å; W1076-I1079 HydrophobicContact CE3-CB 4.22Å; W1076-I1079 HydrophobicContact CE3-CD1 4.4Å; W1076-I1079 HydrophobicContact CE3-CG2 4.29Å; W1076-I1079 HydrophobicContact CH2-CD1 4.46Å; W1076-I1079 HydrophobicContact CZ3-CB 4.37Å; W1076-I1079 HydrophobicContact CZ3-CD1 4.21Å; W1076-I1079 HydrophobicContact CZ3-CG2 3.98Å; W1076-I1079 PolarHBondContact O-N 3.23Å; I1079-S1081 PolarHBondContact O-N 2.62Å; I1079-L1082 PolarHBondContact O-N 3.09Å; I1079-L1082 VanDerWaalsContact O-N 3.16Å; I1079-A1083 WeakPolarHBondContact O-CB 3.42Å; I1079-A1083 PolarHBondContact O-N 2.85Å; I1079-L1165 HydrophobicContact CG2-CD1 3.68Å
1080	L	75	Confident	60.9	Low	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-73.5	-31.2	-173.2	-64.2	160.7	0	0	0	111.1	L1061 I1064 W1076 N1078 L1082 A1083 C1084 L1134 F1161	L1061-L1080 HydrophobicContact CD2-CB 4.19Å; L1061-L1080 HydrophobicContact CD2-CD1 3.6Å; L1061-L1080 HydrophobicContact CD2-CG 4.31Å; I1064-L1080 HydrophobicContact CD1-CD1 4.27Å; W1076-L1080 HydrophobicContact CB-CD1 4.33Å; W1076-L1080 HydrophobicContact CE3-CD1 3.8Å; W1076-L1080 HydrophobicContact CE3-CG 4.03Å; W1076-L1080 WeakPolarHBondContact O-CB 3.26Å; W1076-L1080 WeakPolarHBondContact O-CD1 3.38Å; W1076-L1080 VanDerWaalsContact O-CG 3.31Å; W1076-L1080 WeakPolarHBondContact O-CG 3.49Å; W1076-L1080 PolarHBondContact O-N 2.71Å; N1078-L1080 VanDerWaalsContact C-N 3.3Å; N1078-L1080 PolarHBondContact O-N 2.81Å; L1080-L1082 VanDerWaalsContact C-N 3.3Å; L1080-L1082 PolarHBondContact O-N 3.16Å; L1080-A1083 PolarHBondContact O-N 3.28Å; L1080-C1084 WeakPolarHBondContact O-CB 3.31Å; L1080-C1084 PolarHBondContact O-N 3.04Å; L1080-C1084 PolarHBondContact O-SG 2.86Å; L1080-L1134 HydrophobicContact CD1-CD2 3.76Å; L1080-F1161 HydrophobicContact CD2-CB 4.22Å; L1080-F1161 HydrophobicContact CD2-CD1 3.75Å; L1080-F1161 HydrophobicContact CD2-CD2 4.42Å; L1080-F1161 HydrophobicContact CD2-CE1 4.23Å; L1080-F1161 HydrophobicContact CD2-CG 3.87Å
1081	S	68.7	Low	59	Low	28 Å²	28	43 Å²	43	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-31	169.8	-61.7	0	0	0	0	113.5	L1077 N1078 I1079	L1077-S1081 VanDerWaalsContact O-CB 3.24Å; L1077-S1081 WeakPolarHBondContact O-CB 3.48Å; L1077-S1081 PolarHBondContact O-N 2.91Å; L1077-S1081 PolarHBondContact O-OG 2.81Å; N1078-S1081 PolarHBondContact O-N 2.79Å; I1079-S1081 PolarHBondContact O-N 2.62Å
1082	L	64.5	Low	57.5	Low	53 Å²	53	50.7 Å²	50.7	28%	0.277	28%	0.282	S	S	.	.	H	α-helix	trans	-79.1	-36.5	173.6	-67.4	166.1	0	0	0	111.5	L917 L960 L963 N1078 I1079 L1080 G1085	L917-L1082 HydrophobicContact CB-CD1 3.86Å; L917-L1082 HydrophobicContact CD1-CD1 3.66Å; L917-L1082 HydrophobicContact CG-CD1 4.42Å; L960-L1082 HydrophobicContact CD2-CD1 4.45Å; L963-L1082 HydrophobicContact CD1-CB 4.01Å; N1078-L1082 WeakPolarHBondContact O-CG 3.31Å; N1078-L1082 PolarHBondContact O-N 2.95Å; N1078-L1082 VanDerWaalsContact O-N 3.11Å; I1079-L1082 PolarHBondContact O-N 3.09Å; I1079-L1082 VanDerWaalsContact O-N 3.16Å; L1080-L1082 VanDerWaalsContact C-N 3.3Å; L1080-L1082 PolarHBondContact O-N 3.16Å; L1082-G1085 PolarHBondContact O-N 3.19Å
1083	A	67.1	Low	55.4	Low	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68	-30.3	175.7	0	0	0	0	0	113.5	L963 S1044 L1045 I1079 L1080 G1085 L1165	L963-A1083 HydrophobicContact CD1-CB 4.41Å; L963-A1083 HydrophobicContact CD2-CB 3.87Å; S1044-A1083 CarbonylContact C-O 3.52Å; S1044-A1083 WeakPolarHBondContact CA-O 3.38Å; L1045-A1083 HydrophobicContact CB-CB 4.21Å; L1045-A1083 HydrophobicContact CD2-CB 4.45Å; L1045-A1083 PolarHBondContact N-O 3.46Å; I1079-A1083 WeakPolarHBondContact O-CB 3.42Å; I1079-A1083 PolarHBondContact O-N 2.85Å; L1080-A1083 PolarHBondContact O-N 3.28Å; A1083-G1085 PolarHBondContact O-N 3.5Å; A1083-L1165 HydrophobicContact CB-CD2 3.83Å
1084	C	64.6	Low	53.1	Low	37 Å²	37	58.6 Å²	58.6	25%	0.25	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	0.2	178.6	-74.4	0	0	0	0	114.9	S1044 F1046 L1080	S1044-C1084 WeakPolarHBondContact OG-CA 3.26Å; S1044-C1084 PolarHBondContact OG-O 3.46Å; F1046-C1084 WeakPolarHBondContact CE2-SG 3.34Å; L1080-C1084 WeakPolarHBondContact O-CB 3.31Å; L1080-C1084 PolarHBondContact O-N 3.04Å; L1080-C1084 PolarHBondContact O-SG 2.86Å
1085	G	56.1	Low	51.1	Low	8 Å²	8	63.6 Å²	63.6	8%	0.082	38%	0.375	C	S	.	.			trans	78.5	175.6	-179	0	0	0	0	0	114.7	S1042 L1082 A1083 N1087	S1042-G1085 WeakPolarHBondContact O-CA 3.37Å; L1082-G1085 PolarHBondContact O-N 3.19Å; A1083-G1085 PolarHBondContact O-N 3.5Å; G1085-N1087 VanDerWaalsContact C-N 3.29Å; G1085-N1087 PolarHBondContact O-N 2.88Å
1086	S	47.4	Very low	49.3	Very low	52 Å²	52	68.8 Å²	68.8	36%	0.364	41%	0.41	S	S	.	.	S	Bend	trans	-86.4	50.5	-166.7	-153.4	0	0	0	0	114.6	N1088	S1086-N1088 PolarHBondContact O-N 3.15Å
1087	N	37.2	Very low	47.4	Very low	148 Å²	148	73.1 Å²	73.1	79%	0.791	44%	0.441	S	S	*	.			trans	-82.1	5.6	171.2	-71.7	-12	0	0	0	113.4	G1085	G1085-N1087 VanDerWaalsContact C-N 3.29Å; G1085-N1087 PolarHBondContact O-N 2.88Å
1088	N	38	Very low	46.2	Very low	113 Å²	113	79.3 Å²	79.3	60%	0.604	47%	0.474	S	S	*	.			trans	-100.4	30.6	176.3	-66.2	-49.2	0	0	0	112.4	S1086 S1090	S1086-N1088 PolarHBondContact O-N 3.15Å; N1088-S1090 PolarHBondContact O-N 3.28Å; N1088-S1090 VanDerWaalsContact O-N 3.12Å
1089	Q	32.1	Very low	45.9	Very low	105 Å²	105	87.1 Å²	87.1	49%	0.491	50%	0.502	S	S	.	.			trans	-77.8	93.4	174.6	-70.2	-137.6	55.4	0	0	111.5	D1091	Q1089-D1091 PolarHBondContact O-N 2.9Å; Q1089-D1091 VanDerWaalsContact O-N 3.11Å
1090	S	28.8	Very low	46.2	Very low	92 Å²	92	88.3 Å²	88.3	64%	0.643	51%	0.508	S	S	*	.			trans	48.1	51.6	137.1	57.6	0	0	0	0	118.2	N1088	N1088-S1090 PolarHBondContact O-N 3.28Å; N1088-S1090 VanDerWaalsContact O-N 3.12Å
1091	D	28	Very low	46.6	Very low	136 Å²	136	90.3 Å²	90.3	73%	0.727	52%	0.521	S	S	*	.			trans	-92.7	112.2	153	-82.8	-34.8	0	0	0	109	Q1089	Q1089-D1091 PolarHBondContact O-N 2.9Å; Q1089-D1091 VanDerWaalsContact O-N 3.11Å
1092	E	31.6	Very low	47.3	Very low	206 Å²	206	91.3 Å²	91.3	96%	0.963	52%	0.524	S	S	*	.			trans	-77.5	-6.7	168	-68.6	-165.1	130.3	0	0	112.1	G1094	E1092-G1094 PolarHBondContact O-N 3.16Å
1093	S	27.4	Very low	48.2	Very low	88 Å²	88	88.9 Å²	88.9	62%	0.615	51%	0.511	S	S	*	.	S	Bend	trans	-77.1	103.5	163.7	50.9	0	0	0	0	109.9	D1095	S1093-D1095 PolarHBondContact O-N 3.41Å
1094	G	25.2	Very low	49	Very low	81 Å²	81	91.5 Å²	91.5	84%	0.835	52%	0.524	S	S	*	.			trans	-72.7	127.6	-169.9	0	0	0	0	0	115.1	E1092	E1092-G1094 PolarHBondContact O-N 3.16Å
1095	D	26.7	Very low	49.8	Very low	144 Å²	144	91 Å²	91	77%	0.77	52%	0.518	S	S	*	.			trans	-134.8	125.8	145.7	-155.9	-13.7	0	0	0	108.8	S1093 S1097	S1093-D1095 PolarHBondContact O-N 3.41Å; D1095-S1097 PolarHBondContact O-N 3.11Å
1096	S	29.8	Very low	50.8	Low	116 Å²	116	95 Å²	95	81%	0.811	55%	0.545	S	S	*	.			trans	-85.2	9.6	-164.7	54.1	0	0	0	0	114.5	N1098	S1096-N1098 PolarHBondContact O-N 3.5Å
1097	S	35.6	Very low	52.5	Low	96 Å²	96	95.4 Å²	95.4	67%	0.671	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-33	-160.9	-152.3	0	0	0	0	115.6	D1095 R1099	D1095-S1097 PolarHBondContact O-N 3.11Å; S1097-R1099 PolarHBondContact O-N 2.95Å
1098	N	48.8	Very low	54.6	Low	140 Å²	140	88.5 Å²	88.5	75%	0.749	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	7.6	-165.4	-72.6	-15.6	0	0	0	115.9	S1096	S1096-N1098 PolarHBondContact O-N 3.5Å
1099	R	62.5	Low	56.6	Low	186 Å²	186	86.4 Å²	86.4	70%	0.702	50%	0.499	S	S	*	.	S	Bend	trans	-93.9	119.7	-176.7	-160.7	175.6	-163.9	175.9	5.7	111.7	S1097 P1101	S1097-R1099 PolarHBondContact O-N 2.95Å; R1099-P1101 WeakPolarHBondContact O-CD 3.32Å
1100	I	75.1	Confident	58.9	Low	25 Å²	25	87.5 Å²	87.5	13%	0.128	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-54.3	121.3	179	-58.7	154.5	0	0	0	109.8	L1061 I1064 L1077	L1061-I1100 HydrophobicContact CD2-CD1 4.04Å; L1061-I1100 HydrophobicContact CD2-CG2 4.36Å; L1061-I1100 HydrophobicContact CG-CD1 4.42Å; L1061-I1100 HydrophobicContact CG-CG2 4.17Å; I1064-I1100 HydrophobicContact CD1-CG2 4.25Å; I1064-I1100 HydrophobicContact CG1-CG2 3.97Å; L1077-I1100 HydrophobicContact CD1-CB 3.75Å; L1077-I1100 HydrophobicContact CD1-CD1 4.42Å; L1077-I1100 HydrophobicContact CD1-CG2 4.49Å; L1077-I1100 WeakPolarHBondContact CD1-O 3.5Å
1101	P	83	Confident	61.4	Low	43 Å²	43	86.4 Å²	86.4	28%	0.279	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-73.7	140.5	-174.8	27	-33.9	0	0	0	112.5	V1062 A1063 I1064 R1099 L1115	V1062-P1101 WeakPolarHBondContact O-CD 3.44Å; V1062-P1101 VanDerWaalsContact O-CG 3.26Å; V1062-P1101 WeakPolarHBondContact O-CG 3.39Å; A1063-P1101 HydrophobicContact CB-CG 4.15Å; I1064-P1101 PolarHBondContact N-O 3.41Å; R1099-P1101 WeakPolarHBondContact O-CD 3.32Å; P1101-L1115 HydrophobicContact CB-CD1 4.43Å; P1101-L1115 HydrophobicContact CG-CD1 3.62Å; P1101-L1115 HydrophobicContact CG-CD2 4.21Å
1102	L	83.4	Confident	63.8	Low	49 Å²	49	80 Å²	80	26%	0.257	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	122.2	169.4	-75.7	166.8	0	0	0	109.5	I1064 T1066 L1069 G1073 P1074 L1077	I1064-L1102 HydrophobicContact CB-CD2 3.87Å; I1064-L1102 HydrophobicContact CG2-CD2 3.85Å; T1066-L1102 HydrophobicContact CG2-CD2 4.18Å; L1069-L1102 HydrophobicContact CD2-CB 3.99Å; G1073-L1102 VanDerWaalsContact CA-CD2 3.42Å; P1074-L1102 HydrophobicContact CG-CD1 4.31Å; L1077-L1102 HydrophobicContact CD2-CD1 3.9Å; L1077-L1102 HydrophobicContact CD2-CG 4.35Å
1103	I	83.5	Confident	66	Low	1 Å²	1	72.6 Å²	72.6	1%	0.005	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.6	-173.2	-60.5	-179.9	0	0	0	108.9	A1063 I1064 V1065 T1066 E1107 I1108 K1111 L1112 L1115	A1063-I1103 HydrophobicContact CB-CD1 3.71Å; A1063-I1103 HydrophobicContact CB-CG1 4.45Å; I1064-I1103 PolarHBondContact O-N 2.86Å; V1065-I1103 WeakPolarHBondContact CA-O 3.45Å; V1065-I1103 HydrophobicContact CG2-CB 4.27Å; V1065-I1103 HydrophobicContact CG2-CG2 4.48Å; T1066-I1103 PolarHBondContact N-O 2.84Å; I1103-E1107 HydrophobicContact CG2-CB 4.43Å; I1103-I1108 HydrophobicContact CG2-CG1 4.21Å; I1103-K1111 HydrophobicContact CD1-CB 3.87Å; I1103-K1111 HydrophobicContact CG1-CB 4Å; I1103-K1111 HydrophobicContact CG1-CD 4.25Å; I1103-K1111 HydrophobicContact CG2-CB 4.08Å; I1103-K1111 HydrophobicContact CG2-CD 4.33Å; I1103-L1112 HydrophobicContact CD1-CD2 3.52Å; I1103-L1112 HydrophobicContact CD1-CG 4.03Å; I1103-L1115 HydrophobicContact CD1-CD1 3.92Å
1104	H	83.8	Confident	68.4	Low	56 Å²	56	73.4 Å²	73.4	26%	0.259	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	146.9	171.9	-165.5	-116.6	0	0	0	110.6	T1066 L1069 S1106 E1107 I1108	T1066-H1104 WeakPolarHBondContact O-CA 3.25Å; L1069-H1104 HydrophobicContact CD1-CB 4.14Å; H1104-S1106 PolarHBondContact ND1-OG 3.43Å; H1104-S1106 PolarHBondContact O-N 3.35Å; H1104-E1107 HydrophobicContact CB-CB 4.42Å; H1104-E1107 HydrophobicContact CB-CG 3.99Å; H1104-E1107 VanDerWaalsContact CB-OE2 3.23Å; H1104-E1107 WeakPolarHBondContact CB-OE2 3.42Å; H1104-E1107 PolarHBondContact N-OE2 3.41Å; H1104-E1107 PolarHBondContact O-N 3.34Å; H1104-I1108 PolarHBondContact O-N 2.93Å
1105	L	81	Confident	70.7	Confident	26 Å²	26	73 Å²	73	14%	0.136	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.8	-177.8	-163.8	95.2	0	0	0	113.4	V1065 N1067 I1108	V1065-L1105 HydrophobicContact CG1-CD1 4.02Å; N1067-L1105 WeakPolarHBondContact OD1-CB 3.39Å; L1105-I1108 HydrophobicContact CB-CD1 4.4Å; L1105-I1108 HydrophobicContact CD1-CD1 3.84Å; L1105-I1108 HydrophobicContact CG-CD1 3.93Å; L1105-I1108 VanDerWaalsContact O-CD1 3.31Å; L1105-I1108 WeakPolarHBondContact O-CD1 3.45Å; L1105-I1108 WeakPolarHBondContact O-CG1 3.45Å
1106	S	78.9	Confident	72.9	Confident	92 Å²	92	67.7 Å²	67.7	64%	0.643	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-13.9	174.4	66.6	0	0	0	0	114.7	H1104	H1104-S1106 PolarHBondContact ND1-OG 3.43Å; H1104-S1106 PolarHBondContact O-N 3.35Å
1107	E	81.9	Confident	74	Confident	60 Å²	60	66.7 Å²	66.7	28%	0.28	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-0.6	-174.9	-59.2	173.8	130.8	0	0	112.6	I1103 H1104 S1109 Q1110 K1111	I1103-E1107 HydrophobicContact CG2-CB 4.43Å; H1104-E1107 HydrophobicContact CB-CB 4.42Å; H1104-E1107 HydrophobicContact CB-CG 3.99Å; H1104-E1107 VanDerWaalsContact CB-OE2 3.23Å; H1104-E1107 WeakPolarHBondContact CB-OE2 3.42Å; H1104-E1107 PolarHBondContact N-OE2 3.41Å; H1104-E1107 PolarHBondContact O-N 3.34Å; E1107-S1109 VanDerWaalsContact C-N 3.32Å; E1107-S1109 PolarHBondContact O-N 3.02Å; E1107-Q1110 PolarHBondContact O-N 3.08Å; E1107-K1111 HydrophobicContact CB-CD 4Å; E1107-K1111 HydrophobicContact CB-CG 4.29Å; E1107-K1111 PolarHBondContact O-N 3.24Å; E1107-K1111 IonicContact OE1-NZ 2.97Å; E1107-K1111 PolarHBondContact OE1-NZ 2.64Å; E1107-K1111 WeakPolarHBondContact OE2-CE 3.28Å; E1107-K1111 IonicContact OE2-NZ 3.62Å; E1107-K1111 PolarHBondContact OE2-NZ 3.12Å
1108	I	82.4	Confident	74.7	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-49.2	-50.3	-175.8	-69	173.3	0	0	0	111.9	V1065 I1103 H1104 L1105 Q1110 L1112 A1144 F1147 M1148	V1065-I1108 HydrophobicContact CG1-CD1 3.64Å; V1065-I1108 HydrophobicContact CG1-CG1 3.9Å; I1103-I1108 HydrophobicContact CG2-CG1 4.21Å; H1104-I1108 PolarHBondContact O-N 2.93Å; L1105-I1108 HydrophobicContact CB-CD1 4.4Å; L1105-I1108 HydrophobicContact CD1-CD1 3.84Å; L1105-I1108 HydrophobicContact CG-CD1 3.93Å; L1105-I1108 VanDerWaalsContact O-CD1 3.31Å; L1105-I1108 WeakPolarHBondContact O-CD1 3.45Å; L1105-I1108 WeakPolarHBondContact O-CG1 3.45Å; I1108-Q1110 VanDerWaalsContact C-N 3.31Å; I1108-Q1110 PolarHBondContact O-N 3.31Å; I1108-L1112 HydrophobicContact CG2-CD1 3.7Å; I1108-L1112 HydrophobicContact CG2-CG 4.33Å; I1108-L1112 VanDerWaalsContact O-CB 3.29Å; I1108-L1112 WeakPolarHBondContact O-CB 3.03Å; I1108-L1112 PolarHBondContact O-N 2.75Å; I1108-A1144 HydrophobicContact CD1-CB 4Å; I1108-F1147 HydrophobicContact CG2-CD1 3.8Å; I1108-F1147 HydrophobicContact CG2-CE1 4.03Å; I1108-M1148 HydrophobicContact CD1-CE 4.12Å; I1108-M1148 HydrophobicContact CD1-SD 4.33Å; I1108-M1148 HydrophobicContact CG2-CG 3.76Å; I1108-M1148 HydrophobicContact CG2-SD 3.96Å
1109	S	78.4	Confident	74.5	Confident	69 Å²	69	65.7 Å²	65.7	48%	0.483	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-37.3	-175.2	50.4	0	0	0	0	112.9	E1107 S1113	E1107-S1109 VanDerWaalsContact C-N 3.32Å; E1107-S1109 PolarHBondContact O-N 3.02Å; S1109-S1113 VanDerWaalsContact O-CB 3.29Å; S1109-S1113 WeakPolarHBondContact O-CB 3.5Å; S1109-S1113 PolarHBondContact O-OG 3.42Å
1110	Q	80.7	Confident	73.4	Confident	128 Å²	128	67.3 Å²	67.3	60%	0.598	37%	0.365	S	S	*	.	H	α-helix	trans	-77	-62.6	176	-174.2	173.4	8.2	0	0	110.4	E1107 I1108 L1112 S1113 D1114	E1107-Q1110 PolarHBondContact O-N 3.08Å; I1108-Q1110 VanDerWaalsContact C-N 3.31Å; I1108-Q1110 PolarHBondContact O-N 3.31Å; Q1110-L1112 PolarHBondContact O-N 3.45Å; Q1110-S1113 WeakPolarHBondContact O-CA 3.14Å; Q1110-S1113 WeakPolarHBondContact O-CB 3.42Å; Q1110-S1113 PolarHBondContact O-N 3.37Å; Q1110-D1114 VanDerWaalsContact O-CG 3.32Å; Q1110-D1114 PolarHBondContact O-N 2.94Å
1111	K	81.1	Confident	71.4	Confident	69 Å²	69	71.3 Å²	71.3	30%	0.3	39%	0.394	S	S	.	.	H	α-helix	trans	-67.5	-30.9	-168.9	-70.8	-177.4	177.3	171.8	0	114.1	I1103 E1107 L1115	I1103-K1111 HydrophobicContact CD1-CB 3.87Å; I1103-K1111 HydrophobicContact CG1-CB 4Å; I1103-K1111 HydrophobicContact CG1-CD 4.25Å; I1103-K1111 HydrophobicContact CG2-CB 4.08Å; I1103-K1111 HydrophobicContact CG2-CD 4.33Å; E1107-K1111 HydrophobicContact CB-CD 4Å; E1107-K1111 HydrophobicContact CB-CG 4.29Å; E1107-K1111 PolarHBondContact O-N 3.24Å; E1107-K1111 IonicContact OE1-NZ 2.97Å; E1107-K1111 PolarHBondContact OE1-NZ 2.64Å; E1107-K1111 WeakPolarHBondContact OE2-CE 3.28Å; E1107-K1111 IonicContact OE2-NZ 3.62Å; E1107-K1111 PolarHBondContact OE2-NZ 3.12Å; K1111-L1115 WeakPolarHBondContact O-CD1 3.49Å; K1111-L1115 VanDerWaalsContact O-CG 3.26Å; K1111-L1115 WeakPolarHBondContact O-CG 3.32Å; K1111-L1115 PolarHBondContact O-N 2.93Å
1112	L	79.9	Confident	69.1	Low	0 Å²	0	81.2 Å²	81.2	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-76.4	-30.7	171.3	-65.9	-178.1	0	0	0	112.3	A1063 I1103 I1108 Q1110 D1114 L1115 F1116 F1147 M1148 L1151 I1153	A1063-L1112 HydrophobicContact CB-CD2 3.97Å; I1103-L1112 HydrophobicContact CD1-CD2 3.52Å; I1103-L1112 HydrophobicContact CD1-CG 4.03Å; I1108-L1112 HydrophobicContact CG2-CD1 3.7Å; I1108-L1112 HydrophobicContact CG2-CG 4.33Å; I1108-L1112 VanDerWaalsContact O-CB 3.29Å; I1108-L1112 WeakPolarHBondContact O-CB 3.03Å; I1108-L1112 PolarHBondContact O-N 2.75Å; Q1110-L1112 PolarHBondContact O-N 3.45Å; L1112-D1114 VanDerWaalsContact C-N 3.33Å; L1112-L1115 HydrophobicContact CD2-CD1 4.2Å; L1112-L1115 PolarHBondContact O-N 3.02Å; L1112-F1116 WeakPolarHBondContact O-CD2 3.36Å; L1112-F1116 PolarHBondContact O-N 2.81Å; L1112-F1147 HydrophobicContact CB-CE1 4.16Å; L1112-F1147 HydrophobicContact CD1-CE1 4.42Å; L1112-M1148 HydrophobicContact CD1-CG 3.79Å; L1112-M1148 HydrophobicContact CD1-SD 4.07Å; L1112-L1151 HydrophobicContact CB-CD1 3.58Å; L1112-L1151 HydrophobicContact CD1-CD1 3.98Å; L1112-L1151 HydrophobicContact CG-CD1 4.41Å; L1112-I1153 HydrophobicContact CD1-CD1 4.16Å
1113	S	77.9	Confident	67	Low	51 Å²	51	84 Å²	84	36%	0.357	45%	0.449	S	S	.	.	H	α-helix	trans	-65.5	-38.5	172	-62.7	0	0	0	0	111.5	S1109 Q1110 L1115 F1116 P1117	S1109-S1113 VanDerWaalsContact O-CB 3.29Å; S1109-S1113 WeakPolarHBondContact O-CB 3.5Å; S1109-S1113 PolarHBondContact O-OG 3.42Å; Q1110-S1113 WeakPolarHBondContact O-CA 3.14Å; Q1110-S1113 WeakPolarHBondContact O-CB 3.42Å; Q1110-S1113 PolarHBondContact O-N 3.37Å; S1113-L1115 VanDerWaalsContact C-N 3.27Å; S1113-L1115 PolarHBondContact O-N 2.65Å; S1113-F1116 CarbonylContact O-C 3.15Å; S1113-F1116 PolarHBondContact O-N 3.06Å; S1113-P1117 WeakPolarHBondContact O-CA 3.4Å
1114	D	76.8	Confident	65	Low	106 Å²	106	93.2 Å²	93.2	57%	0.567	49%	0.489	S	S	*	.	H	α-helix	trans	-65.1	-29.7	175.3	-62.2	-32.8	0	0	0	112.4	Q1110 L1112	Q1110-D1114 VanDerWaalsContact O-CG 3.32Å; Q1110-D1114 PolarHBondContact O-N 2.94Å; L1112-D1114 VanDerWaalsContact C-N 3.33Å
1115	L	73.3	Confident	63	Low	73 Å²	73	96.1 Å²	96.1	38%	0.382	52%	0.523	S	S	.	.	H	α-helix	trans	-84.4	-22.3	175.4	-70	164.9	0	0	0	113.8	P1101 I1103 K1111 L1112 S1113 P1117	P1101-L1115 HydrophobicContact CB-CD1 4.43Å; P1101-L1115 HydrophobicContact CG-CD1 3.62Å; P1101-L1115 HydrophobicContact CG-CD2 4.21Å; I1103-L1115 HydrophobicContact CD1-CD1 3.92Å; K1111-L1115 WeakPolarHBondContact O-CD1 3.49Å; K1111-L1115 VanDerWaalsContact O-CG 3.26Å; K1111-L1115 WeakPolarHBondContact O-CG 3.32Å; K1111-L1115 PolarHBondContact O-N 2.93Å; L1112-L1115 HydrophobicContact CD2-CD1 4.2Å; L1112-L1115 PolarHBondContact O-N 3.02Å; S1113-L1115 VanDerWaalsContact C-N 3.27Å; S1113-L1115 PolarHBondContact O-N 2.65Å; L1115-P1117 WeakPolarHBondContact O-CD 3.36Å
1116	F	73.1	Confident	61.5	Low	31 Å²	31	99.6 Å²	99.6	14%	0.136	55%	0.55	C	S	.	.	S	Bend	trans	-120.4	59.1	174.1	-66.5	-81	0	0	0	111.6	V1062 L1112 S1113 S1118 N1131 L1151 P1152 I1153	V1062-F1116 HydrophobicContact CG1-CE2 3.99Å; V1062-F1116 HydrophobicContact CG1-CZ 3.87Å; L1112-F1116 WeakPolarHBondContact O-CD2 3.36Å; L1112-F1116 PolarHBondContact O-N 2.81Å; S1113-F1116 CarbonylContact O-C 3.15Å; S1113-F1116 PolarHBondContact O-N 3.06Å; F1116-S1118 PolarHBondContact O-N 3.33Å; F1116-N1131 HydrophobicContact CZ-CB 4.13Å; F1116-L1151 HydrophobicContact CB-CD2 4.23Å; F1116-L1151 HydrophobicContact CD2-CD1 4.33Å; F1116-P1152 HydrophobicContact CD1-CG 3.91Å; F1116-P1152 HydrophobicContact CE1-CG 3.98Å; F1116-I1153 HydrophobicContact CD2-CG2 4.45Å; F1116-I1153 HydrophobicContact CE1-CG2 4.31Å; F1116-I1153 HydrophobicContact CE2-CG2 3.48Å; F1116-I1153 VanDerWaalsContact CE2-CG2 3.48Å; F1116-I1153 HydrophobicContact CZ-CG2 3.39Å
1117	P	53.6	Low	60.4	Low	96 Å²	96	101.2 Å²	101.2	62%	0.623	55%	0.547	S	S	*	.			trans	-71.3	89.6	-170.8	30.3	-36.4	0	0	0	111.8	S1113 L1115	S1113-P1117 WeakPolarHBondContact O-CA 3.4Å; L1115-P1117 WeakPolarHBondContact O-CD 3.36Å
1118	S	48.7	Very low	59.7	Low	87 Å²	87	104 Å²	104	61%	0.608	56%	0.558	S	S	*	*			trans	67.8	118.2	180	-149.3	0	0	0	0	115.7	F1116 R1120	F1116-S1118 PolarHBondContact O-N 3.33Å; S1118-R1120 PolarHBondContact O-N 2.93Å
1119	V	46.1	Very low	59.2	Low	127 Å²	127	108.7 Å²	108.7	77%	0.77	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	27.4	173.9	-166.2	0	0	0	0	112.2
1120	R	38.2	Very low	59.2	Low	220 Å²	220	107 Å²	107	83%	0.83	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-14.9	-177.7	-114	177.6	-176.2	166.1	3.5	114.3	S1118 R1122	S1118-R1120 PolarHBondContact O-N 2.93Å; R1120-R1122 PolarHBondContact O-N 3.41Å
1121	C	34.4	Very low	59.4	Low	110 Å²	110	101.7 Å²	101.7	74%	0.743	54%	0.541	S	S	*	.			trans	-73.9	93.4	172.8	-74.3	0	0	0	0	110.5	S1123	C1121-S1123 PolarHBondContact O-N 2.94Å
1122	R	34.4	Very low	59.7	Low	251 Å²	251	98.4 Å²	98.4	95%	0.947	53%	0.526	S	S	*	.			trans	-66.6	74.7	163.2	-71.6	-175.8	174.2	-172.4	-2	110.1	R1120	R1120-R1122 PolarHBondContact O-N 3.41Å
1123	S	39	Very low	60	Low	107 Å²	107	98.4 Å²	98.4	75%	0.748	53%	0.526	S	S	*	.			trans	-67	161.3	165.8	50.3	0	0	0	0	110.5	C1121	C1121-S1123 PolarHBondContact O-N 2.94Å
1124	K	41.1	Very low	60.4	Low	194 Å²	194	96 Å²	96	84%	0.843	51%	0.509	S	S	*	.			trans	-66.5	137.4	-164.9	-62.8	176.2	-177.8	176	0	111.7	S1126	K1124-S1126 VanDerWaalsContact C-N 3.31Å; K1124-S1126 PolarHBondContact O-N 3.36Å
1125	A	41.9	Very low	60.9	Low	117 Å²	117	90.9 Å²	90.9	97%	0.967	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	65.7	-171.2	0	0	0	0	0	113.1
1126	S	49.6	Very low	61.1	Low	99 Å²	99	87.9 Å²	87.9	69%	0.692	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.3	-6.3	-176.8	59	0	0	0	0	116.1	K1124	K1124-S1126 VanDerWaalsContact C-N 3.31Å; K1124-S1126 PolarHBondContact O-N 3.36Å
1127	E	55.1	Low	61.1	Low	127 Å²	127	90 Å²	90	59%	0.593	48%	0.476	S	S	*	.			trans	-133.7	116.4	-177.4	-66.1	175.4	166.7	0	0	110.8	K1129	E1127-K1129 HydrophobicContact CB-CD 4.48Å; E1127-K1129 PolarHBondContact O-N 3.34Å; E1127-K1129 WeakPolarHBondContact OE2-CE 3.4Å; E1127-K1129 IonicContact OE2-NZ 3.11Å; E1127-K1129 PolarHBondContact OE2-NZ 2.87Å
1128	K	67.9	Low	61.8	Low	117 Å²	117	88.1 Å²	88.1	51%	0.509	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.1	167.3	-72.9	176	175.4	175.4	0	107.7	D1054 T1057 N1058	D1054-K1128 IonicContact OD1-NZ 2.97Å; D1054-K1128 IonicContact OD2-NZ 2.68Å; D1054-K1128 PolarHBondContact OD2-NZ 2.73Å; T1057-K1128 WeakPolarHBondContact CA-O 3.4Å; T1057-K1128 HydrophobicContact CG2-CB 4.08Å; T1057-K1128 VanDerWaalsContact OG1-CB 3.3Å; T1057-K1128 WeakPolarHBondContact OG1-CB 3.46Å; T1057-K1128 VanDerWaalsContact OG1-CD 3.3Å; T1057-K1128 WeakPolarHBondContact OG1-CD 3.36Å; N1058-K1128 PolarHBondContact N-O 2.94Å
1129	K	71.8	Confident	62.6	Low	104 Å²	104	89.6 Å²	89.6	45%	0.452	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.1	-178.2	-82.9	174.6	170.9	168.9	0	111.8	N1058 E1127	N1058-K1129 HydrophobicContact CB-CG 4.06Å; N1058-K1129 WeakPolarHBondContact O-CA 3.33Å; E1127-K1129 HydrophobicContact CB-CD 4.48Å; E1127-K1129 PolarHBondContact O-N 3.34Å; E1127-K1129 WeakPolarHBondContact OE2-CE 3.4Å; E1127-K1129 IonicContact OE2-NZ 3.11Å; E1127-K1129 PolarHBondContact OE2-NZ 2.87Å
1130	V	79.1	Confident	63.9	Low	34 Å²	34	83.6 Å²	83.6	21%	0.206	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.2	177	175.1	0	0	0	0	108.9	T1057 N1058 Y1059 R1060 F1132 E1154	T1057-V1130 HydrophobicContact CG2-CB 4.46Å; T1057-V1130 HydrophobicContact CG2-CG2 3.68Å; N1058-V1130 PolarHBondContact O-N 2.97Å; Y1059-V1130 HydrophobicContact CD1-CB 3.57Å; Y1059-V1130 HydrophobicContact CD1-CG1 3.74Å; Y1059-V1130 HydrophobicContact CD1-CG2 4.02Å; Y1059-V1130 HydrophobicContact CE1-CB 3.9Å; Y1059-V1130 HydrophobicContact CE1-CG1 4.06Å; Y1059-V1130 HydrophobicContact CE1-CG2 3.82Å; Y1059-V1130 HydrophobicContact CG-CB 4.26Å; R1060-V1130 PolarHBondContact N-O 2.61Å; V1130-F1132 HydrophobicContact CG1-CD1 4.43Å; V1130-F1132 HydrophobicContact CG1-CE1 4.07Å; V1130-F1132 HydrophobicContact CG1-CE2 4.46Å; V1130-F1132 HydrophobicContact CG1-CZ 4.1Å; V1130-E1154 HydrophobicContact CG1-CB 4.47Å
1131	N	84	Confident	65.8	Low	15 Å²	15	78 Å²	78	8%	0.08	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	99.3	-176.6	-56.9	-64.7	0	0	0	109.4	R1060 V1062 F1116 P1152 I1153 E1154	R1060-N1131 VanDerWaalsContact CZ-OD1 3.26Å; R1060-N1131 PolarHBondContact NE-OD1 3.12Å; R1060-N1131 PolarHBondContact NH2-OD1 3Å; R1060-N1131 CarbonylContact O-C 3.59Å; V1062-N1131 HydrophobicContact CG2-CB 3.69Å; F1116-N1131 HydrophobicContact CZ-CB 4.13Å; N1131-P1152 WeakPolarHBondContact CB-O 3.49Å; N1131-P1152 PolarHBondContact ND2-O 3.24Å; N1131-I1153 HydrophobicContact CB-CG2 4.01Å; N1131-I1153 CarbonylContact O-C 3.6Å; N1131-I1153 VanDerWaalsContact O-CA 3.26Å; N1131-I1153 WeakPolarHBondContact O-CA 3.31Å; N1131-E1154 PolarHBondContact O-N 3.49Å
1132	F	86.9	Confident	67.9	Low	0 Å²	0	79.9 Å²	79.9	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	144.2	173.1	-66.9	-59	0	0	0	111.4	F1046 Y1059 R1060 L1061 V1062 V1130 E1154 V1156 Y1160 F1161 L1170 P1173	F1046-F1132 HydrophobicContact CE1-CD2 4.15Å; Y1059-F1132 AromaticContact CD1-CE2 3.68Å; Y1059-F1132 HydrophobicContact CD1-CE2 3.68Å; Y1059-F1132 AromaticContact CD1-CZ 3.73Å; Y1059-F1132 HydrophobicContact CD1-CZ 3.73Å; Y1059-F1132 HydrophobicContact CE1-CZ 4.35Å; Y1059-F1132 HydrophobicContact CG-CE2 4.28Å; R1060-F1132 PolarHBondContact O-N 3Å; L1061-F1132 HydrophobicContact CD1-CB 4.25Å; V1062-F1132 PolarHBondContact N-O 2.99Å; V1130-F1132 HydrophobicContact CG1-CD1 4.43Å; V1130-F1132 HydrophobicContact CG1-CE1 4.07Å; V1130-F1132 HydrophobicContact CG1-CE2 4.46Å; V1130-F1132 HydrophobicContact CG1-CZ 4.1Å; F1132-E1154 CarbonylContact C-O 3.59Å; F1132-E1154 WeakPolarHBondContact CA-O 3.34Å; F1132-E1154 HydrophobicContact CD1-CB 3.96Å; F1132-E1154 HydrophobicContact CD1-CG 4.18Å; F1132-E1154 HydrophobicContact CE1-CB 4.19Å; F1132-E1154 HydrophobicContact CE1-CG 4.07Å; F1132-E1154 WeakPolarHBondContact CE1-OE2 3.36Å; F1132-V1156 HydrophobicContact CB-CG2 4.13Å; F1132-V1156 HydrophobicContact CD1-CG1 3.66Å; F1132-V1156 HydrophobicContact CD1-CG2 4.22Å; F1132-V1156 HydrophobicContact CE1-CG1 3.97Å; F1132-V1156 HydrophobicContact CG-CG2 4.42Å; F1132-Y1160 HydrophobicContact CE1-CE1 4.21Å; F1132-Y1160 HydrophobicContact CE2-CE1 4.2Å; F1132-Y1160 HydrophobicContact CZ-CE1 4.02Å; F1132-Y1160 AromaticContact CZ-CZ 3.86Å; F1132-Y1160 VanDerWaalsContact CZ-OH 3.31Å; F1132-Y1160 WeakPolarHBondContact CZ-OH 3.24Å; F1132-F1161 HydrophobicContact CB-CZ 4.35Å; F1132-L1170 HydrophobicContact CE2-CD1 4.2Å; F1132-P1173 HydrophobicContact CE1-CG 4.42Å
1133	V	87	Confident	70	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	116.3	164.9	174.1	0	0	0	0	107.9	A1063 V1065 V1135 I1153 E1154 V1156	A1063-V1133 HydrophobicContact CB-CG1 4.3Å; A1063-V1133 HydrophobicContact CB-CG2 4.35Å; V1065-V1133 HydrophobicContact CB-CG1 4.43Å; V1065-V1133 HydrophobicContact CG2-CG1 3.6Å; V1133-V1135 HydrophobicContact CG1-CG2 4.39Å; V1133-I1153 HydrophobicContact CG2-CB 4.08Å; V1133-I1153 HydrophobicContact CG2-CD1 3.95Å; V1133-I1153 HydrophobicContact CG2-CG2 4.06Å; V1133-E1154 PolarHBondContact N-O 3.02Å; V1133-V1156 PolarHBondContact O-N 3.29Å
1134	L	87.2	Confident	71.9	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	126.1	174.9	169.6	56.8	0	0	0	109.1	L1061 A1063 I1064 V1065 W1076 L1080 V1156 T1157 C1158 F1161	L1061-L1134 HydrophobicContact CD1-CB 4.03Å; A1063-L1134 PolarHBondContact O-N 3.44Å; I1064-L1134 HydrophobicContact CD1-CD2 4.43Å; I1064-L1134 HydrophobicContact CG1-CB 4.23Å; I1064-L1134 HydrophobicContact CG1-CD2 4.18Å; I1064-L1134 HydrophobicContact CG2-CD2 4.17Å; I1064-L1134 HydrophobicContact CG2-CG 4.31Å; V1065-L1134 PolarHBondContact N-O 3.4Å; W1076-L1134 HydrophobicContact CB-CD2 3.94Å; W1076-L1134 HydrophobicContact CD2-CD2 4.18Å; W1076-L1134 HydrophobicContact CE3-CD2 4.43Å; W1076-L1134 HydrophobicContact CG-CD2 3.96Å; L1080-L1134 HydrophobicContact CD1-CD2 3.76Å; L1134-V1156 CarbonylContact C-O 3.54Å; L1134-V1156 WeakPolarHBondContact CA-O 3.42Å; L1134-T1157 VanDerWaalsContact CD1-C 3.44Å; L1134-T1157 WeakPolarHBondContact CD1-O 3.3Å; L1134-C1158 HydrophobicContact CD1-CB 4.05Å; L1134-F1161 HydrophobicContact CB-CE2 4.18Å; L1134-F1161 HydrophobicContact CD1-CD2 4.27Å; L1134-F1161 HydrophobicContact CD2-CD2 4.47Å
1135	V	85.4	Confident	73.9	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.7	172.7	-164.5	0	0	0	0	111.2	V1065 V1133 I1140 V1156	V1065-V1135 HydrophobicContact CB-CG1 4.37Å; V1065-V1135 HydrophobicContact CB-CG2 4.38Å; V1065-V1135 HydrophobicContact CG1-CG1 4.22Å; V1133-V1135 HydrophobicContact CG1-CG2 4.39Å; V1135-I1140 HydrophobicContact CB-CD1 4.1Å; V1135-I1140 HydrophobicContact CG1-CD1 3.65Å; V1135-I1140 HydrophobicContact CG1-CG1 3.99Å; V1135-I1140 HydrophobicContact CG2-CD1 4.01Å; V1135-V1156 PolarHBondContact N-O 3.34Å
1136	D	79.3	Confident	75.8	Confident	9 Å²	9	56.9 Å²	56.9	5%	0.048	30%	0.301	C	S	.	.	S	Bend	trans	-60	-40.3	176.3	173.9	8.7	0	0	0	113.5	V1065 T1066 N1067 F1072	V1065-D1136 VanDerWaalsContact O-CB 3.3Å; V1065-D1136 WeakPolarHBondContact O-CB 3.46Å; V1065-D1136 PolarHBondContact O-N 3.14Å; T1066-D1136 VanDerWaalsContact CA-OD2 3.32Å; T1066-D1136 WeakPolarHBondContact CA-OD2 3.14Å; T1066-D1136 WeakPolarHBondContact CB-OD2 3.18Å; T1066-D1136 PolarHBondContact OG1-OD2 3.24Å; N1067-D1136 PolarHBondContact N-OD2 2.84Å; F1072-D1136 HydrophobicContact CD1-CB 3.9Å; F1072-D1136 HydrophobicContact CE1-CB 3.62Å; F1072-D1136 HydrophobicContact CE2-CB 4.49Å; F1072-D1136 HydrophobicContact CG-CB 4.49Å; F1072-D1136 HydrophobicContact CZ-CB 3.95Å
1137	K	72.2	Confident	77.3	Confident	77 Å²	77	54.6 Å²	54.6	34%	0.335	28%	0.279	S	S	.	.			trans	-101.6	131	-177.5	-67.4	-170.1	170.4	-167.4	0	112.8	H1139	K1137-H1139 VanDerWaalsContact CB-O 3.26Å; K1137-H1139 WeakPolarHBondContact CB-O 3.28Å; K1137-H1139 PolarHBondContact O-N 3.03Å
1138	N	68.2	Low	78.6	Confident	55 Å²	55	48.5 Å²	48.5	29%	0.294	25%	0.251	S	S	.	.	S	Bend	trans	-66.4	-14.1	165.2	-68.9	-7.6	0	0	0	113.8	T1157 I1182	N1138-T1157 WeakPolarHBondContact OD1-CG2 3.4Å; N1138-I1182 CarbonylContact O-C 3.57Å; N1138-I1182 WeakPolarHBondContact O-CA 3.29Å; N1138-I1182 WeakPolarHBondContact O-CB 3.39Å; N1138-I1182 PolarHBondContact O-N 3.34Å
1139	H	65.3	Low	79.3	Confident	119 Å²	119	49.9 Å²	49.9	55%	0.551	26%	0.256	S	S	*	.	B	Isolated β-bridge	trans	-121.8	123.5	171.9	-69.9	-76.1	0	0	0	110.6	K1137 I1182 V1183	K1137-H1139 VanDerWaalsContact CB-O 3.26Å; K1137-H1139 WeakPolarHBondContact CB-O 3.28Å; K1137-H1139 PolarHBondContact O-N 3.03Å; H1139-I1182 WeakPolarHBondContact CA-O 3.48Å; H1139-V1183 PolarHBondContact ND1-O 2.85Å
1140	I	74	Confident	79.7	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.264	C	S	.	.			trans	-122.5	126.8	-174.9	-57.5	173.6	0	0	0	109.2	V1135 Q1142 A1144 F1145 M1148 P1181 I1182	V1135-I1140 HydrophobicContact CB-CD1 4.1Å; V1135-I1140 HydrophobicContact CG1-CD1 3.65Å; V1135-I1140 HydrophobicContact CG1-CG1 3.99Å; V1135-I1140 HydrophobicContact CG2-CD1 4.01Å; I1140-Q1142 PolarHBondContact O-N 2.99Å; I1140-A1144 HydrophobicContact CG2-CB 4.01Å; I1140-F1145 HydrophobicContact CB-CB 4.33Å; I1140-F1145 HydrophobicContact CB-CD2 4.45Å; I1140-F1145 HydrophobicContact CD1-CD2 4.32Å; I1140-F1145 HydrophobicContact CG2-CB 4Å; I1140-M1148 HydrophobicContact CD1-CE 4.05Å; I1140-M1148 HydrophobicContact CG2-CE 3.77Å; I1140-P1181 HydrophobicContact CD1-CB 3.42Å; I1140-P1181 VanDerWaalsContact CD1-CB 3.42Å; I1140-P1181 HydrophobicContact CD1-CG 3.49Å; I1140-P1181 VanDerWaalsContact CD1-CG 3.49Å; I1140-P1181 HydrophobicContact CG1-CB 4.06Å; I1140-I1182 PolarHBondContact N-O 2.8Å
1141	N	77.9	Confident	79.8	Confident	102 Å²	102	49.2 Å²	49.2	55%	0.545	26%	0.26	S	S	.	.			trans	-43.6	126	175	-66.4	13.3	0	0	0	111.3	S1143 A1144 F1145	N1141-S1143 PolarHBondContact O-N 3.2Å; N1141-A1144 WeakPolarHBondContact O-CA 3.3Å; N1141-A1144 WeakPolarHBondContact O-CB 3.47Å; N1141-A1144 PolarHBondContact O-N 2.88Å; N1141-F1145 PolarHBondContact O-N 3.36Å
1142	Q	79.1	Confident	79.7	Confident	150 Å²	150	51.9 Å²	51.9	70%	0.701	28%	0.278	S	S	*	.	H	α-helix	trans	-49.9	-36	-171.8	-169.2	-179	21.9	0	0	114	I1140 A1146 V1183	I1140-Q1142 PolarHBondContact O-N 2.99Å; Q1142-A1146 WeakPolarHBondContact O-CB 3.32Å; Q1142-A1146 PolarHBondContact O-N 2.91Å; Q1142-V1183 HydrophobicContact CB-CG1 4Å; Q1142-V1183 HydrophobicContact CG-CG1 4.03Å
1143	S	78.7	Confident	79.6	Confident	93 Å²	93	53.2 Å²	53.2	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-66	-41.7	175.6	51.7	0	0	0	0	113.7	N1141 F1147	N1141-S1143 PolarHBondContact O-N 3.2Å; S1143-F1147 WeakPolarHBondContact O-CB 3.35Å; S1143-F1147 PolarHBondContact O-N 3.4Å
1144	A	79	Confident	79.5	Confident	15 Å²	15	55.7 Å²	55.7	12%	0.124	30%	0.297	C	S	.	.	H	α-helix	trans	-71.2	-39.1	176.1	0	0	0	0	0	111.6	I1108 I1140 N1141 F1147 M1148	I1108-A1144 HydrophobicContact CD1-CB 4Å; I1140-A1144 HydrophobicContact CG2-CB 4.01Å; N1141-A1144 WeakPolarHBondContact O-CA 3.3Å; N1141-A1144 WeakPolarHBondContact O-CB 3.47Å; N1141-A1144 PolarHBondContact O-N 2.88Å; A1144-F1147 PolarHBondContact O-N 2.86Å; A1144-M1148 WeakPolarHBondContact O-CB 3.41Å; A1144-M1148 WeakPolarHBondContact O-CE 3.39Å; A1144-M1148 WeakPolarHBondContact O-CG 3.24Å; A1144-M1148 PolarHBondContact O-N 3.01Å
1145	F	81.8	Confident	79.5	Confident	25 Å²	25	56.8 Å²	56.8	11%	0.11	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-43.2	174.7	-174.8	-97.2	0	0	0	112.1	I1140 N1141 M1148 K1149 M1155 V1183	I1140-F1145 HydrophobicContact CB-CB 4.33Å; I1140-F1145 HydrophobicContact CB-CD2 4.45Å; I1140-F1145 HydrophobicContact CD1-CD2 4.32Å; I1140-F1145 HydrophobicContact CG2-CB 4Å; N1141-F1145 PolarHBondContact O-N 3.36Å; F1145-M1148 PolarHBondContact O-N 2.98Å; F1145-K1149 HydrophobicContact CD1-CD 4.21Å; F1145-K1149 HydrophobicContact CE1-CD 3.82Å; F1145-K1149 HydrophobicContact CE1-CG 4.5Å; F1145-K1149 HydrophobicContact CZ-CD 4.43Å; F1145-K1149 PolarHBondContact O-N 2.98Å; F1145-M1155 HydrophobicContact CD2-CE 3.68Å; F1145-M1155 HydrophobicContact CD2-SD 3.98Å; F1145-M1155 HydrophobicContact CE2-CE 3.47Å; F1145-M1155 VanDerWaalsContact CE2-CE 3.47Å; F1145-M1155 HydrophobicContact CE2-SD 4.25Å; F1145-M1155 HydrophobicContact CG-CE 4.41Å; F1145-M1155 HydrophobicContact CZ-CE 4.07Å; F1145-V1183 HydrophobicContact CD1-CG2 3.53Å; F1145-V1183 HydrophobicContact CD2-CG2 4.34Å; F1145-V1183 HydrophobicContact CE1-CG2 3.34Å; F1145-V1183 HydrophobicContact CE2-CG2 4.2Å; F1145-V1183 HydrophobicContact CG-CG2 4.02Å; F1145-V1183 HydrophobicContact CZ-CG2 3.71Å
1146	A	81.4	Confident	79.5	Confident	52 Å²	52	56.8 Å²	56.8	43%	0.43	30%	0.302	S	S	.	.	H	α-helix	trans	-61.9	-44.7	174	0	0	0	0	0	111.8	Q1142 K1149 T1150	Q1142-A1146 WeakPolarHBondContact O-CB 3.32Å; Q1142-A1146 PolarHBondContact O-N 2.91Å; A1146-K1149 PolarHBondContact O-N 2.84Å; A1146-T1150 PolarHBondContact O-N 2.81Å
1147	F	82.6	Confident	79.8	Confident	51 Å²	51	56.3 Å²	56.3	22%	0.224	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-49.1	174.3	171.6	-92.5	0	0	0	111.9	I1108 L1112 S1143 A1144 K1149 T1150 L1151	I1108-F1147 HydrophobicContact CG2-CD1 3.8Å; I1108-F1147 HydrophobicContact CG2-CE1 4.03Å; L1112-F1147 HydrophobicContact CB-CE1 4.16Å; L1112-F1147 HydrophobicContact CD1-CE1 4.42Å; S1143-F1147 WeakPolarHBondContact O-CB 3.35Å; S1143-F1147 PolarHBondContact O-N 3.4Å; A1144-F1147 PolarHBondContact O-N 2.86Å; F1147-K1149 VanDerWaalsContact C-N 3.26Å; F1147-K1149 PolarHBondContact O-N 2.86Å; F1147-T1150 WeakPolarHBondContact O-CB 3.49Å; F1147-T1150 PolarHBondContact O-N 2.85Å; F1147-T1150 PolarHBondContact O-OG1 2.97Å; F1147-L1151 HydrophobicContact CE1-CD1 3.7Å; F1147-L1151 HydrophobicContact CE1-CG 4.43Å; F1147-L1151 HydrophobicContact CZ-CD1 3.96Å; F1147-L1151 HydrophobicContact CZ-CG 4.43Å
1148	M	81.6	Confident	80.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-33.7	179.5	-76.2	-173.2	-69.4	0	0	112.5	I1108 L1112 I1140 A1144 F1145 T1150 L1151 I1153 M1155	I1108-M1148 HydrophobicContact CD1-CE 4.12Å; I1108-M1148 HydrophobicContact CD1-SD 4.33Å; I1108-M1148 HydrophobicContact CG2-CG 3.76Å; I1108-M1148 HydrophobicContact CG2-SD 3.96Å; L1112-M1148 HydrophobicContact CD1-CG 3.79Å; L1112-M1148 HydrophobicContact CD1-SD 4.07Å; I1140-M1148 HydrophobicContact CD1-CE 4.05Å; I1140-M1148 HydrophobicContact CG2-CE 3.77Å; A1144-M1148 WeakPolarHBondContact O-CB 3.41Å; A1144-M1148 WeakPolarHBondContact O-CE 3.39Å; A1144-M1148 WeakPolarHBondContact O-CG 3.24Å; A1144-M1148 PolarHBondContact O-N 3.01Å; F1145-M1148 PolarHBondContact O-N 2.98Å; M1148-T1150 PolarHBondContact O-N 2.84Å; M1148-L1151 PolarHBondContact O-N 3.19Å; M1148-L1151 VanDerWaalsContact O-N 3.15Å; M1148-I1153 HydrophobicContact CB-CD1 3.99Å; M1148-I1153 HydrophobicContact CG-CD1 4.17Å; M1148-I1153 WeakPolarHBondContact O-CG1 3.04Å; M1148-M1155 HydrophobicContact CB-CG 4.38Å; M1148-M1155 HydrophobicContact CB-SD 3.58Å; M1148-M1155 VanDerWaalsContact CB-SD 3.58Å; M1148-M1155 HydrophobicContact CE-SD 3.86Å; M1148-M1155 HydrophobicContact CG-SD 4.42Å; M1148-M1155 HydrophobicContact SD-SD 4.12Å
1149	K	82.1	Confident	80.6	Confident	145 Å²	145	51 Å²	51	63%	0.63	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.5	171.5	-82.2	-171.9	167.2	-174.8	0	115.2	F1145 A1146 F1147 M1155	F1145-K1149 HydrophobicContact CD1-CD 4.21Å; F1145-K1149 HydrophobicContact CE1-CD 3.82Å; F1145-K1149 HydrophobicContact CE1-CG 4.5Å; F1145-K1149 HydrophobicContact CZ-CD 4.43Å; F1145-K1149 PolarHBondContact O-N 2.98Å; A1146-K1149 PolarHBondContact O-N 2.84Å; F1147-K1149 VanDerWaalsContact C-N 3.26Å; F1147-K1149 PolarHBondContact O-N 2.86Å; K1149-M1155 HydrophobicContact CG-CE 3.97Å
1150	T	80.7	Confident	81.5	Confident	100 Å²	100	45.4 Å²	45.4	61%	0.613	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-13.5	173.1	69.9	0	0	0	0	113.6	A1146 F1147 M1148	A1146-T1150 PolarHBondContact O-N 2.81Å; F1147-T1150 WeakPolarHBondContact O-CB 3.49Å; F1147-T1150 PolarHBondContact O-N 2.85Å; F1147-T1150 PolarHBondContact O-OG1 2.97Å; M1148-T1150 PolarHBondContact O-N 2.84Å
1151	L	82	Confident	81.9	Confident	24 Å²	24	45.3 Å²	45.3	13%	0.126	25%	0.249	C	C	.	.	S	Bend	trans	-96.2	154.8	-178.4	-63.6	178.3	0	0	0	110.9	L1112 F1116 F1147 M1148 I1153	L1112-L1151 HydrophobicContact CB-CD1 3.58Å; L1112-L1151 HydrophobicContact CD1-CD1 3.98Å; L1112-L1151 HydrophobicContact CG-CD1 4.41Å; F1116-L1151 HydrophobicContact CB-CD2 4.23Å; F1116-L1151 HydrophobicContact CD2-CD1 4.33Å; F1147-L1151 HydrophobicContact CE1-CD1 3.7Å; F1147-L1151 HydrophobicContact CE1-CG 4.43Å; F1147-L1151 HydrophobicContact CZ-CD1 3.96Å; F1147-L1151 HydrophobicContact CZ-CG 4.43Å; M1148-L1151 PolarHBondContact O-N 3.19Å; M1148-L1151 VanDerWaalsContact O-N 3.15Å; L1151-I1153 HydrophobicContact CB-CD1 3.99Å; L1151-I1153 HydrophobicContact CB-CG1 3.94Å; L1151-I1153 HydrophobicContact CB-CG2 4.34Å; L1151-I1153 HydrophobicContact CD1-CD1 4.25Å; L1151-I1153 PolarHBondContact O-N 2.92Å
1152	P	82.3	Confident	81.8	Confident	71 Å²	71	40.7 Å²	40.7	46%	0.461	22%	0.224	S	C	.	.	S	Bend	trans	-78.3	61.9	178.1	34	-36.4	0	0	0	111.3	F1116 N1131	F1116-P1152 HydrophobicContact CD1-CG 3.91Å; F1116-P1152 HydrophobicContact CE1-CG 3.98Å; N1131-P1152 WeakPolarHBondContact CB-O 3.49Å; N1131-P1152 PolarHBondContact ND2-O 3.24Å
1153	I	84.2	Confident	81.6	Confident	28 Å²	28	35.4 Å²	35.4	14%	0.144	20%	0.2	C	C	.	.			trans	-131.6	151.1	-175.3	62.2	180	0	0	0	112.3	L1112 F1116 N1131 V1133 M1148 L1151	L1112-I1153 HydrophobicContact CD1-CD1 4.16Å; F1116-I1153 HydrophobicContact CD2-CG2 4.45Å; F1116-I1153 HydrophobicContact CE1-CG2 4.31Å; F1116-I1153 HydrophobicContact CE2-CG2 3.48Å; F1116-I1153 VanDerWaalsContact CE2-CG2 3.48Å; F1116-I1153 HydrophobicContact CZ-CG2 3.39Å; N1131-I1153 HydrophobicContact CB-CG2 4.01Å; N1131-I1153 CarbonylContact O-C 3.6Å; N1131-I1153 VanDerWaalsContact O-CA 3.26Å; N1131-I1153 WeakPolarHBondContact O-CA 3.31Å; V1133-I1153 HydrophobicContact CG2-CB 4.08Å; V1133-I1153 HydrophobicContact CG2-CD1 3.95Å; V1133-I1153 HydrophobicContact CG2-CG2 4.06Å; M1148-I1153 HydrophobicContact CB-CD1 3.99Å; M1148-I1153 HydrophobicContact CG-CD1 4.17Å; M1148-I1153 WeakPolarHBondContact O-CG1 3.04Å; L1151-I1153 HydrophobicContact CB-CD1 3.99Å; L1151-I1153 HydrophobicContact CB-CG1 3.94Å; L1151-I1153 HydrophobicContact CB-CG2 4.34Å; L1151-I1153 HydrophobicContact CD1-CD1 4.25Å; L1151-I1153 PolarHBondContact O-N 2.92Å
1154	E	84.8	Confident	81.6	Confident	53 Å²	53	31 Å²	31	25%	0.248	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.4	170.4	-173.2	159.9	-150	0	0	108.9	V1130 N1131 F1132 V1133 V1156 P1173	V1130-E1154 HydrophobicContact CG1-CB 4.47Å; N1131-E1154 PolarHBondContact O-N 3.49Å; F1132-E1154 CarbonylContact C-O 3.59Å; F1132-E1154 WeakPolarHBondContact CA-O 3.34Å; F1132-E1154 HydrophobicContact CD1-CB 3.96Å; F1132-E1154 HydrophobicContact CD1-CG 4.18Å; F1132-E1154 HydrophobicContact CE1-CB 4.19Å; F1132-E1154 HydrophobicContact CE1-CG 4.07Å; F1132-E1154 WeakPolarHBondContact CE1-OE2 3.36Å; V1133-E1154 PolarHBondContact N-O 3.02Å; E1154-V1156 HydrophobicContact CG-CG1 4.49Å; E1154-P1173 WeakPolarHBondContact OE1-CG 3.36Å
1155	M	86.1	Confident	81.4	Confident	22 Å²	22	30.5 Å²	30.5	11%	0.108	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	121.9	-178.9	-64.2	176.6	-73.5	0	0	109.6	F1145 M1148 K1149 P1181	F1145-M1155 HydrophobicContact CD2-CE 3.68Å; F1145-M1155 HydrophobicContact CD2-SD 3.98Å; F1145-M1155 HydrophobicContact CE2-CE 3.47Å; F1145-M1155 VanDerWaalsContact CE2-CE 3.47Å; F1145-M1155 HydrophobicContact CE2-SD 4.25Å; F1145-M1155 HydrophobicContact CG-CE 4.41Å; F1145-M1155 HydrophobicContact CZ-CE 4.07Å; M1148-M1155 HydrophobicContact CB-CG 4.38Å; M1148-M1155 HydrophobicContact CB-SD 3.58Å; M1148-M1155 VanDerWaalsContact CB-SD 3.58Å; M1148-M1155 HydrophobicContact CE-SD 3.86Å; M1148-M1155 HydrophobicContact CG-SD 4.42Å; M1148-M1155 HydrophobicContact SD-SD 4.12Å; K1149-M1155 HydrophobicContact CG-CE 3.97Å; M1155-P1181 HydrophobicContact CB-CG 3.75Å; M1155-P1181 VanDerWaalsContact O-CD 3.31Å; M1155-P1181 WeakPolarHBondContact O-CD 3.3Å
1156	V	86.6	Confident	80.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.7	-179.4	-68	0	0	0	0	111.5	F1132 V1133 L1134 V1135 E1154 Y1160 F1161 F1179	F1132-V1156 HydrophobicContact CB-CG2 4.13Å; F1132-V1156 HydrophobicContact CD1-CG1 3.66Å; F1132-V1156 HydrophobicContact CD1-CG2 4.22Å; F1132-V1156 HydrophobicContact CE1-CG1 3.97Å; F1132-V1156 HydrophobicContact CG-CG2 4.42Å; V1133-V1156 PolarHBondContact O-N 3.29Å; L1134-V1156 CarbonylContact C-O 3.54Å; L1134-V1156 WeakPolarHBondContact CA-O 3.42Å; V1135-V1156 PolarHBondContact N-O 3.34Å; E1154-V1156 HydrophobicContact CG-CG1 4.49Å; V1156-Y1160 HydrophobicContact CB-CD1 3.8Å; V1156-Y1160 HydrophobicContact CB-CG 3.96Å; V1156-Y1160 HydrophobicContact CG1-CD1 3.79Å; V1156-Y1160 HydrophobicContact CG1-CD2 4.43Å; V1156-Y1160 HydrophobicContact CG1-CE1 4.21Å; V1156-Y1160 HydrophobicContact CG1-CG 3.91Å; V1156-Y1160 HydrophobicContact CG2-CD1 3.96Å; V1156-F1161 HydrophobicContact CG2-CD2 4.26Å; V1156-F1161 HydrophobicContact CG2-CE2 3.56Å; V1156-F1161 HydrophobicContact CG2-CZ 4.22Å; V1156-F1179 CarbonylContact C-O 3.56Å; V1156-F1179 VanDerWaalsContact CA-O 3.26Å; V1156-F1179 WeakPolarHBondContact CA-O 3.45Å
1157	T	86	Confident	80.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	172.8	172.2	65.8	0	0	0	0	110.5	L1134 N1138 D1159 Y1160 Y1178 F1179 P1181	L1134-T1157 VanDerWaalsContact CD1-C 3.44Å; L1134-T1157 WeakPolarHBondContact CD1-O 3.3Å; N1138-T1157 WeakPolarHBondContact OD1-CG2 3.4Å; T1157-D1159 PolarHBondContact O-N 2.91Å; T1157-D1159 PolarHBondContact OG1-N 2.94Å; T1157-Y1160 WeakPolarHBondContact O-CB 3.34Å; T1157-Y1178 PolarHBondContact OG1-O 3.28Å; T1157-Y1178 WeakPolarHBondContact CG2-O 3.29Å; T1157-F1179 PolarHBondContact N-O 2.83Å; T1157-P1181 HydrophobicContact CG2-CB 4.45Å
1158	C	79.2	Confident	79.6	Confident	3 Å²	3	27 Å²	27	2%	0.02	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-31.2	170.3	59.9	0	0	0	0	112.4	Q82 F1072 W1076 L1134 Y1160 F1161 I1162	Q82-C1158 VanDerWaalsContact CD-SG 3.52Å; Q82-C1158 PolarHBondContact NE2-SG 3.4Å; F1072-C1158 HydrophobicContact CZ-CB 4.23Å; W1076-C1158 HydrophobicContact CZ2-CB 3.75Å; L1134-C1158 HydrophobicContact CD1-CB 4.05Å; C1158-Y1160 PolarHBondContact O-N 3Å; C1158-F1161 PolarHBondContact O-N 3.44Å; C1158-I1162 HydrophobicContact CB-CD1 4.2Å; C1158-I1162 WeakPolarHBondContact O-CD1 3.26Å; C1158-I1162 VanDerWaalsContact O-CG1 3.29Å; C1158-I1162 WeakPolarHBondContact O-CG1 3.48Å; C1158-I1162 PolarHBondContact O-N 2.86Å
1159	D	77.9	Confident	79.2	Confident	18 Å²	18	30.1 Å²	30.1	10%	0.096	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-30.9	-177.3	-74.5	-9.5	0	0	0	112.3	K955 T1157 I1162 H1163 F1179	K955-D1159 WeakPolarHBondContact CD-OD1 3.42Å; K955-D1159 WeakPolarHBondContact CE-OD1 3.16Å; K955-D1159 IonicContact NZ-OD1 2.94Å; K955-D1159 PolarHBondContact NZ-OD1 2.91Å; K955-D1159 IonicContact NZ-OD2 3.27Å; K955-D1159 PolarHBondContact NZ-OD2 2.65Å; T1157-D1159 PolarHBondContact O-N 2.91Å; T1157-D1159 PolarHBondContact OG1-N 2.94Å; D1159-I1162 WeakPolarHBondContact OD1-CD1 3.45Å; D1159-I1162 VanDerWaalsContact OD1-CD1 3.25Å; D1159-I1162 PolarHBondContact O-N 3.31Å; D1159-H1163 PolarHBondContact O-CD2 2.84Å; D1159-H1163 PolarHBondContact O-N 3.07Å; D1159-F1179 HydrophobicContact CB-CD1 4.39Å
1160	Y	83.7	Confident	79.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.6	-49.6	169.9	175.7	-105.9	0	0	0	112.8	F1132 V1156 T1157 C1158 S1164 L1170 V1171 P1173 F1179	F1132-Y1160 HydrophobicContact CE1-CE1 4.21Å; F1132-Y1160 HydrophobicContact CE2-CE1 4.2Å; F1132-Y1160 HydrophobicContact CZ-CE1 4.02Å; F1132-Y1160 AromaticContact CZ-CZ 3.86Å; F1132-Y1160 VanDerWaalsContact CZ-OH 3.31Å; F1132-Y1160 WeakPolarHBondContact CZ-OH 3.24Å; V1156-Y1160 HydrophobicContact CB-CD1 3.8Å; V1156-Y1160 HydrophobicContact CB-CG 3.96Å; V1156-Y1160 HydrophobicContact CG1-CD1 3.79Å; V1156-Y1160 HydrophobicContact CG1-CD2 4.43Å; V1156-Y1160 HydrophobicContact CG1-CE1 4.21Å; V1156-Y1160 HydrophobicContact CG1-CG 3.91Å; V1156-Y1160 HydrophobicContact CG2-CD1 3.96Å; T1157-Y1160 WeakPolarHBondContact O-CB 3.34Å; C1158-Y1160 PolarHBondContact O-N 3Å; Y1160-S1164 WeakPolarHBondContact O-CB 3.49Å; Y1160-S1164 PolarHBondContact O-N 3.12Å; Y1160-S1164 PolarHBondContact O-OG 3.33Å; Y1160-L1170 HydrophobicContact CE1-CD2 4.36Å; Y1160-V1171 VanDerWaalsContact OH-O 3.07Å; Y1160-V1171 PolarHBondContact OH-O 3.41Å; Y1160-V1171 WeakPolarHBondContact CE2-O 3.26Å; Y1160-V1171 HydrophobicContact CD2-CG2 4.09Å; Y1160-V1171 HydrophobicContact CE2-CG2 3.95Å; Y1160-P1173 HydrophobicContact CD2-CB 4.09Å; Y1160-P1173 HydrophobicContact CE2-CB 3.7Å; Y1160-P1173 HydrophobicContact CE2-CG 4.38Å; Y1160-F1179 HydrophobicContact CD2-CB 4.07Å; Y1160-F1179 AromaticContact CD2-CD2 3.92Å; Y1160-F1179 HydrophobicContact CD2-CD2 3.92Å; Y1160-F1179 HydrophobicContact CD2-CG 4.02Å
1161	F	81.3	Confident	79.1	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-74.2	-31.9	179.6	-76.8	-64.4	0	0	0	112.3	L1045 F1046 L1061 W1076 L1080 F1132 L1134 V1156 C1158 S1164 L1165 L1170	L1045-F1161 HydrophobicContact CD2-CD1 4.27Å; F1046-F1161 HydrophobicContact CE1-CE1 4.11Å; F1046-F1161 HydrophobicContact CE1-CZ 4.5Å; F1046-F1161 AromaticContact CZ-CE1 3.65Å; F1046-F1161 HydrophobicContact CZ-CE1 3.65Å; F1046-F1161 HydrophobicContact CZ-CZ 4.15Å; L1061-F1161 HydrophobicContact CD1-CE2 4.18Å; L1061-F1161 HydrophobicContact CD1-CZ 4.21Å; L1061-F1161 HydrophobicContact CD2-CE2 4.49Å; L1061-F1161 HydrophobicContact CD2-CZ 4.37Å; W1076-F1161 HydrophobicContact CZ3-CB 4.25Å; L1080-F1161 HydrophobicContact CD2-CB 4.22Å; L1080-F1161 HydrophobicContact CD2-CD1 3.75Å; L1080-F1161 HydrophobicContact CD2-CD2 4.42Å; L1080-F1161 HydrophobicContact CD2-CE1 4.23Å; L1080-F1161 HydrophobicContact CD2-CG 3.87Å; F1132-F1161 HydrophobicContact CB-CZ 4.35Å; L1134-F1161 HydrophobicContact CB-CE2 4.18Å; L1134-F1161 HydrophobicContact CD1-CD2 4.27Å; L1134-F1161 HydrophobicContact CD2-CD2 4.47Å; V1156-F1161 HydrophobicContact CG2-CD2 4.26Å; V1156-F1161 HydrophobicContact CG2-CE2 3.56Å; V1156-F1161 HydrophobicContact CG2-CZ 4.22Å; C1158-F1161 PolarHBondContact O-N 3.44Å; F1161-S1164 PolarHBondContact O-N 2.83Å; F1161-L1165 WeakPolarHBondContact O-CB 3.48Å; F1161-L1165 PolarHBondContact O-N 3.15Å; F1161-L1165 WeakPolarHBondContact O-CG 3.46Å; F1161-L1165 WeakPolarHBondContact O-CD1 3.42Å; F1161-L1165 VanDerWaalsContact O-CB 3.28Å; F1161-L1170 HydrophobicContact CE1-CD2 4.4Å
1162	I	76	Confident	79	Confident	4 Å²	4	20.6 Å²	20.6	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-60.4	-52.4	173.4	-64.9	154.1	0	0	0	109.7	K955 W1076 C1158 D1159 S1164 L1165 I1166	K955-I1162 HydrophobicContact CB-CD1 3.39Å; K955-I1162 HydrophobicContact CB-CG1 4.03Å; K955-I1162 HydrophobicContact CB-CG2 4.21Å; K955-I1162 HydrophobicContact CD-CD1 3.84Å; K955-I1162 HydrophobicContact CG-CD1 4.06Å; W1076-I1162 HydrophobicContact CH2-CD1 4.23Å; W1076-I1162 HydrophobicContact CH2-CG1 3.55Å; W1076-I1162 HydrophobicContact CZ2-CD1 4.02Å; W1076-I1162 HydrophobicContact CZ2-CG1 3.86Å; C1158-I1162 HydrophobicContact CB-CD1 4.2Å; C1158-I1162 WeakPolarHBondContact O-CD1 3.26Å; C1158-I1162 VanDerWaalsContact O-CG1 3.29Å; C1158-I1162 WeakPolarHBondContact O-CG1 3.48Å; C1158-I1162 PolarHBondContact O-N 2.86Å; D1159-I1162 WeakPolarHBondContact OD1-CD1 3.45Å; D1159-I1162 VanDerWaalsContact OD1-CD1 3.25Å; D1159-I1162 PolarHBondContact O-N 3.31Å; I1162-S1164 PolarHBondContact O-N 2.83Å; I1162-L1165 PolarHBondContact O-N 2.66Å; I1162-I1166 HydrophobicContact CG2-CD1 3.76Å; I1162-I1166 WeakPolarHBondContact O-CD1 3.42Å; I1162-I1166 WeakPolarHBondContact O-CG1 3.18Å; I1162-I1166 PolarHBondContact O-N 2.98Å
1163	H	75.6	Confident	78.9	Confident	40 Å²	40	17.3 Å²	17.3	19%	0.185	9%	0.094	C	C	.	.	H	α-helix	trans	-65.2	-39.8	177.6	-81.8	-83.7	0	0	0	112.8	S1017 D1159 L1165 I1166 C1167 V1171 F1179	S1017-H1163 PolarHBondContact OG-CE1 2.59Å; S1017-H1163 PolarHBondContact OG-ND1 3.49Å; S1017-H1163 PolarHBondContact OG-NE2 3.11Å; D1159-H1163 PolarHBondContact O-CD2 2.84Å; D1159-H1163 PolarHBondContact O-N 3.07Å; H1163-L1165 PolarHBondContact O-N 3.43Å; H1163-L1165 VanDerWaalsContact C-N 3.32Å; H1163-I1166 PolarHBondContact O-N 2.85Å; H1163-C1167 PolarHBondContact O-N 3.2Å; H1163-C1167 PolarHBondContact O-SG 2.68Å; H1163-C1167 WeakPolarHBondContact O-CB 3.31Å; H1163-V1171 HydrophobicContact CB-CG2 4.31Å; H1163-F1179 HydrophobicContact CB-CE1 3.99Å; H1163-F1179 HydrophobicContact CB-CZ 3.68Å; H1163-F1179 AromaticContact CD2-CE1 3.64Å; H1163-F1179 AromaticContact CG-CE1 3.93Å; H1163-F1179 AromaticContact CG-CZ 3.83Å
1164	S	78.4	Confident	78.8	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.4	-43.8	173.8	-60	0	0	0	0	112.3	Y1160 F1161 I1162 C1167 G1168 H1169 V1171	Y1160-S1164 WeakPolarHBondContact O-CB 3.49Å; Y1160-S1164 PolarHBondContact O-N 3.12Å; Y1160-S1164 PolarHBondContact O-OG 3.33Å; F1161-S1164 PolarHBondContact O-N 2.83Å; I1162-S1164 PolarHBondContact O-N 2.83Å; S1164-C1167 PolarHBondContact O-N 3.31Å; S1164-G1168 PolarHBondContact O-N 2.97Å; S1164-H1169 CarbonylContact C-O 3.56Å; S1164-H1169 VanDerWaalsContact O-N 3.16Å; S1164-H1169 PolarHBondContact O-N 3.18Å; S1164-H1169 WeakPolarHBondContact CB-O 3.2Å; S1164-H1169 WeakPolarHBondContact CA-O 3.4Å; S1164-H1169 VanDerWaalsContact CA-O 3.22Å; S1164-V1171 PolarHBondContact OG-N 2.95Å
1165	L	74.5	Confident	78.5	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-67.2	-42	178.2	-73.6	167.6	0	0	0	112	A959 T962 L963 L1045 W1076 I1079 A1083 F1161 I1162 H1163 C1167 G1168	A959-L1165 HydrophobicContact CB-CD1 3.64Å; T962-L1165 VanDerWaalsContact CB-O 3.3Å; T962-L1165 WeakPolarHBondContact CB-O 3.4Å; L963-L1165 HydrophobicContact CD2-CD2 3.66Å; L963-L1165 HydrophobicContact CG-CD2 4.01Å; L1045-L1165 HydrophobicContact CD1-CD2 4.34Å; L1045-L1165 HydrophobicContact CD2-CD2 3.82Å; L1045-L1165 HydrophobicContact CD2-CG 4.04Å; W1076-L1165 HydrophobicContact CZ3-CD1 4.41Å; I1079-L1165 HydrophobicContact CG2-CD1 3.68Å; A1083-L1165 HydrophobicContact CB-CD2 3.83Å; F1161-L1165 WeakPolarHBondContact O-CB 3.48Å; F1161-L1165 PolarHBondContact O-N 3.15Å; F1161-L1165 WeakPolarHBondContact O-CG 3.46Å; F1161-L1165 WeakPolarHBondContact O-CD1 3.42Å; F1161-L1165 VanDerWaalsContact O-CB 3.28Å; I1162-L1165 PolarHBondContact O-N 2.66Å; H1163-L1165 PolarHBondContact O-N 3.43Å; H1163-L1165 VanDerWaalsContact C-N 3.32Å; L1165-C1167 VanDerWaalsContact C-N 3.32Å; L1165-C1167 PolarHBondContact O-N 3.37Å; L1165-G1168 PolarHBondContact O-N 3.28Å; L1165-G1168 VanDerWaalsContact O-N 3.15Å
1166	I	70.2	Confident	78.2	Confident	3 Å²	3	25 Å²	25	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-40.2	175.2	-58.4	158.7	0	0	0	111.4	T962 R1013 I1023 I1162 H1163 G1168	T962-I1166 HydrophobicContact CG2-CB 4.12Å; T962-I1166 HydrophobicContact CG2-CG1 3.87Å; T962-I1166 HydrophobicContact CG2-CG2 4.38Å; R1013-I1166 HydrophobicContact CB-CG2 3.9Å; I1023-I1166 HydrophobicContact CB-CG2 4.01Å; I1023-I1166 HydrophobicContact CD1-CB 4.41Å; I1023-I1166 HydrophobicContact CD1-CG2 3.5Å; I1023-I1166 VanDerWaalsContact CD1-CG2 3.5Å; I1023-I1166 HydrophobicContact CG1-CG2 4.3Å; I1023-I1166 HydrophobicContact CG2-CG2 4.12Å; I1162-I1166 HydrophobicContact CG2-CD1 3.76Å; I1162-I1166 WeakPolarHBondContact O-CD1 3.42Å; I1162-I1166 WeakPolarHBondContact O-CG1 3.18Å; I1162-I1166 PolarHBondContact O-N 2.98Å; H1163-I1166 PolarHBondContact O-N 2.85Å; I1166-G1168 VanDerWaalsContact C-N 3.31Å
1167	C	69.9	Low	77.7	Confident	32 Å²	32	29.9 Å²	29.9	22%	0.216	17%	0.168	C	C	.	.	H	α-helix	trans	-75.9	-14.2	176.3	-67.3	0	0	0	0	114.2	H1163 S1164 L1165 H1169 V1171	H1163-C1167 PolarHBondContact O-N 3.2Å; H1163-C1167 PolarHBondContact O-SG 2.68Å; H1163-C1167 WeakPolarHBondContact O-CB 3.31Å; S1164-C1167 PolarHBondContact O-N 3.31Å; L1165-C1167 VanDerWaalsContact C-N 3.32Å; L1165-C1167 PolarHBondContact O-N 3.37Å; C1167-H1169 PolarHBondContact O-ND1 3.22Å; C1167-H1169 PolarHBondContact O-N 2.94Å; C1167-V1171 HydrophobicContact CB-CG1 4.01Å
1168	G	67.8	Low	77.3	Confident	20 Å²	20	36.3 Å²	36.3	21%	0.206	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	9.5	-176.4	0	0	0	0	0	115.3	S1164 L1165 I1166	S1164-G1168 PolarHBondContact O-N 2.97Å; L1165-G1168 PolarHBondContact O-N 3.28Å; L1165-G1168 VanDerWaalsContact O-N 3.15Å; I1166-G1168 VanDerWaalsContact C-N 3.31Å
1169	H	73.2	Confident	77.5	Confident	65 Å²	65	36.3 Å²	36.3	30%	0.301	19%	0.193	S	C	.	.	S	Bend	trans	-154.7	159.6	-178	65.3	-89.5	0	0	0	109.6	H1048 S1164 C1167 V1171	H1048-H1169 HydrophobicContact CB-CB 4.03Å; H1048-H1169 WeakPolarHBondContact O-CA 3.38Å; H1048-H1169 WeakPolarHBondContact O-CB 3.23Å; S1164-H1169 CarbonylContact C-O 3.56Å; S1164-H1169 VanDerWaalsContact O-N 3.16Å; S1164-H1169 PolarHBondContact O-N 3.18Å; S1164-H1169 WeakPolarHBondContact CB-O 3.2Å; S1164-H1169 WeakPolarHBondContact CA-O 3.4Å; S1164-H1169 VanDerWaalsContact CA-O 3.22Å; C1167-H1169 PolarHBondContact O-ND1 3.22Å; C1167-H1169 PolarHBondContact O-N 2.94Å; H1169-V1171 PolarHBondContact O-N 3.49Å
1170	L	80.5	Confident	77.6	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-65.3	119.8	175.8	-66.6	179.3	0	0	0	111	L1045 F1046 H1048 F1049 W1052 Y1059 F1132 Y1160 F1161	L1045-L1170 HydrophobicContact CD2-CD2 4.08Å; L1045-L1170 HydrophobicContact CG-CD2 3.96Å; F1046-L1170 HydrophobicContact CD1-CD1 3.83Å; F1046-L1170 HydrophobicContact CD1-CD2 4.42Å; F1046-L1170 HydrophobicContact CE1-CD1 4.35Å; F1046-L1170 HydrophobicContact CE1-CD2 4.33Å; H1048-L1170 PolarHBondContact O-N 2.81Å; H1048-L1170 VanDerWaalsContact O-N 3.08Å; F1049-L1170 HydrophobicContact CD1-CD1 4.14Å; F1049-L1170 HydrophobicContact CE1-CD1 4.1Å; W1052-L1170 HydrophobicContact CZ2-CB 4.06Å; W1052-L1170 PolarHBondContact NE1-O 3.27Å; Y1059-L1170 HydrophobicContact CG-CD1 4.14Å; F1132-L1170 HydrophobicContact CE2-CD1 4.2Å; Y1160-L1170 HydrophobicContact CE1-CD2 4.36Å; F1161-L1170 HydrophobicContact CE1-CD2 4.4Å
1171	V	80.3	Confident	77.3	Confident	18 Å²	18	38.4 Å²	38.4	11%	0.109	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-75.5	161.7	169.9	-61.7	0	0	0	0	110.5	W1052 Y1160 H1163 S1164 C1167 H1169 P1173 F1179	W1052-V1171 WeakPolarHBondContact CZ2-O 3.18Å; Y1160-V1171 VanDerWaalsContact OH-O 3.07Å; Y1160-V1171 PolarHBondContact OH-O 3.41Å; Y1160-V1171 WeakPolarHBondContact CE2-O 3.26Å; Y1160-V1171 HydrophobicContact CD2-CG2 4.09Å; Y1160-V1171 HydrophobicContact CE2-CG2 3.95Å; H1163-V1171 HydrophobicContact CB-CG2 4.31Å; S1164-V1171 PolarHBondContact OG-N 2.95Å; C1167-V1171 HydrophobicContact CB-CG1 4.01Å; H1169-V1171 PolarHBondContact O-N 3.49Å; V1171-P1173 WeakPolarHBondContact O-CD 3.43Å; V1171-F1179 HydrophobicContact CG2-CD2 4.28Å; V1171-F1179 HydrophobicContact CG2-CE2 3.56Å; V1171-F1179 HydrophobicContact CG2-CZ 4Å
1172	N	81.7	Confident	77	Confident	51 Å²	51	43.1 Å²	43.1	27%	0.273	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-67.9	120	176.2	-177.4	-16.2	0	0	0	109.7	W1052 K1174 S1175	W1052-N1172 HydrophobicContact CB-CB 4.07Å; W1052-N1172 HydrophobicContact CD2-CB 3.68Å; W1052-N1172 HydrophobicContact CE3-CB 4.12Å; W1052-N1172 HydrophobicContact CG-CB 3.63Å; N1172-K1174 PolarHBondContact O-N 3.27Å; N1172-K1174 WeakPolarHBondContact OD1-CB 3.46Å; N1172-K1174 PolarHBondContact OD1-N 3.29Å; N1172-S1175 PolarHBondContact O-OG 2.99Å; N1172-S1175 VanDerWaalsContact O-OG 3.07Å; N1172-S1175 PolarHBondContact O-N 2.64Å
1173	P	79.8	Confident	76.2	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.019	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-60.5	-21	-179.5	23.8	-33.1	0	0	0	113	W1052 F1132 E1154 Y1160 V1171 F1179	W1052-P1173 HydrophobicContact CH2-CG 4.48Å; W1052-P1173 HydrophobicContact CZ3-CG 4.46Å; F1132-P1173 HydrophobicContact CE1-CG 4.42Å; E1154-P1173 WeakPolarHBondContact OE1-CG 3.36Å; Y1160-P1173 HydrophobicContact CD2-CB 4.09Å; Y1160-P1173 HydrophobicContact CE2-CB 3.7Å; Y1160-P1173 HydrophobicContact CE2-CG 4.38Å; V1171-P1173 WeakPolarHBondContact O-CD 3.43Å; P1173-F1179 WeakPolarHBondContact O-CB 3.4Å
1174	K	80.8	Confident	76.3	Confident	175 Å²	175	47.6 Å²	47.6	76%	0.761	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-87.3	-4.1	178	-56.9	175.6	-176.3	172.4	0	114.1	N1172 S1176	N1172-K1174 PolarHBondContact O-N 3.27Å; N1172-K1174 WeakPolarHBondContact OD1-CB 3.46Å; N1172-K1174 PolarHBondContact OD1-N 3.29Å; K1174-S1176 VanDerWaalsContact C-N 3.27Å; K1174-S1176 PolarHBondContact O-N 2.95Å
1175	S	79.5	Confident	76.2	Confident	76 Å²	76	50.1 Å²	50.1	53%	0.531	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-78.6	-7	-178	76.3	0	0	0	0	114.2	N1172 F1179	N1172-S1175 PolarHBondContact O-OG 2.99Å; N1172-S1175 VanDerWaalsContact O-OG 3.07Å; N1172-S1175 PolarHBondContact O-N 2.64Å; S1175-F1179 WeakPolarHBondContact OG-CE2 3.26Å
1176	S	78.9	Confident	76.3	Confident	14 Å²	14	52.7 Å²	52.7	10%	0.098	29%	0.29	C	S	.	.			trans	-150.3	134.1	176.1	-166.2	0	0	0	0	111.3	K1174 Y1178 F1179	K1174-S1176 VanDerWaalsContact C-N 3.27Å; K1174-S1176 PolarHBondContact O-N 2.95Å; S1176-Y1178 PolarHBondContact O-N 2.89Å; S1176-Y1178 WeakPolarHBondContact OG-CD2 3.41Å; S1176-F1179 WeakPolarHBondContact O-CB 3.39Å; S1176-F1179 PolarHBondContact O-N 3.48Å; S1176-F1179 VanDerWaalsContact O-N 3.13Å
1177	P	77.7	Confident	76.6	Confident	102 Å²	102	55.6 Å²	55.6	66%	0.662	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-63.4	-22.7	175	28	-35.5	0	0	0	112.4	F1179	P1177-F1179 PolarHBondContact O-N 3.03Å
1178	Y	76.9	Confident	77	Confident	134 Å²	134	57.1 Å²	57.1	53%	0.525	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-72.2	-11.3	177.5	-54.8	-62.8	0	0	0	113.8	T1157 S1176	T1157-Y1178 PolarHBondContact OG1-O 3.28Å; T1157-Y1178 WeakPolarHBondContact CG2-O 3.29Å; S1176-Y1178 PolarHBondContact O-N 2.89Å; S1176-Y1178 WeakPolarHBondContact OG-CD2 3.41Å
1179	F	82.5	Confident	77.7	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.018	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-83.9	-16.3	179.5	-65.5	-12.2	0	0	0	113.3	V1156 T1157 D1159 Y1160 H1163 V1171 P1173 S1175 S1176 P1177	V1156-F1179 CarbonylContact C-O 3.56Å; V1156-F1179 VanDerWaalsContact CA-O 3.26Å; V1156-F1179 WeakPolarHBondContact CA-O 3.45Å; T1157-F1179 PolarHBondContact N-O 2.83Å; D1159-F1179 HydrophobicContact CB-CD1 4.39Å; Y1160-F1179 HydrophobicContact CD2-CB 4.07Å; Y1160-F1179 AromaticContact CD2-CD2 3.92Å; Y1160-F1179 HydrophobicContact CD2-CD2 3.92Å; Y1160-F1179 HydrophobicContact CD2-CG 4.02Å; H1163-F1179 HydrophobicContact CB-CE1 3.99Å; H1163-F1179 HydrophobicContact CB-CZ 3.68Å; H1163-F1179 AromaticContact CD2-CE1 3.64Å; H1163-F1179 AromaticContact CG-CE1 3.93Å; H1163-F1179 AromaticContact CG-CZ 3.83Å; V1171-F1179 HydrophobicContact CG2-CD2 4.28Å; V1171-F1179 HydrophobicContact CG2-CE2 3.56Å; V1171-F1179 HydrophobicContact CG2-CZ 4Å; P1173-F1179 WeakPolarHBondContact O-CB 3.4Å; S1175-F1179 WeakPolarHBondContact OG-CE2 3.26Å; S1176-F1179 WeakPolarHBondContact O-CB 3.39Å; S1176-F1179 PolarHBondContact O-N 3.48Å; S1176-F1179 VanDerWaalsContact O-N 3.13Å; P1177-F1179 PolarHBondContact O-N 3.03Å
1180	S	81.4	Confident	78	Confident	52 Å²	52	59.1 Å²	59.1	36%	0.364	32%	0.32	S	S	.	.	S	Bend	trans	-111.8	143.1	174	-60.7	0	0	0	0	110.8
1181	P	77.7	Confident	77.8	Confident	9 Å²	9	63.7 Å²	63.7	6%	0.058	34%	0.344	C	S	.	.			trans	-71.6	148.7	175.9	29.6	-33.6	0	0	0	111.8	I1140 M1155 T1157	I1140-P1181 HydrophobicContact CD1-CB 3.42Å; I1140-P1181 VanDerWaalsContact CD1-CB 3.42Å; I1140-P1181 HydrophobicContact CD1-CG 3.49Å; I1140-P1181 VanDerWaalsContact CD1-CG 3.49Å; I1140-P1181 HydrophobicContact CG1-CB 4.06Å; M1155-P1181 HydrophobicContact CB-CG 3.75Å; M1155-P1181 VanDerWaalsContact O-CD 3.31Å; M1155-P1181 WeakPolarHBondContact O-CD 3.3Å; T1157-P1181 HydrophobicContact CG2-CB 4.45Å
1182	I	74	Confident	77.6	Confident	99 Å²	99	67.5 Å²	67.5	51%	0.508	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-94.9	158.3	178.4	-52.6	172.7	0	0	0	108.4	N1138 H1139 I1140	N1138-I1182 CarbonylContact O-C 3.57Å; N1138-I1182 WeakPolarHBondContact O-CA 3.29Å; N1138-I1182 WeakPolarHBondContact O-CB 3.39Å; N1138-I1182 PolarHBondContact O-N 3.34Å; H1139-I1182 WeakPolarHBondContact CA-O 3.48Å; I1140-I1182 PolarHBondContact N-O 2.8Å
1183	V	60	Low	77.2	Confident	91 Å²	91	69 Å²	69	55%	0.552	37%	0.372	S	S	*	.			trans	-80.2	0	173.7	-169.1	0	0	0	0	110.2	H1139 Q1142 F1145	H1139-V1183 PolarHBondContact ND1-O 2.85Å; Q1142-V1183 HydrophobicContact CB-CG1 4Å; Q1142-V1183 HydrophobicContact CG-CG1 4.03Å; F1145-V1183 HydrophobicContact CD1-CG2 3.53Å; F1145-V1183 HydrophobicContact CD2-CG2 4.34Å; F1145-V1183 HydrophobicContact CE1-CG2 3.34Å; F1145-V1183 HydrophobicContact CE2-CG2 4.2Å; F1145-V1183 HydrophobicContact CG-CG2 4.02Å; F1145-V1183 HydrophobicContact CZ-CG2 3.71Å

Retrieved 1,183 of 1,183 residues in 1481.3 ms (Link to these results)

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