A0A3Q0KRA0_SCHMA Loading...

MYND-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KRA0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,423 aa.

						>A0A3Q0KRA0_SCHMA|A0A3Q0KRA0
MAVYVDRNIFHIGNSSFKSDVFHKIPTESLNYHLKDHNNNHFQDNENTGVDDNFTTRGENYYREVKDWLNGDLFQGGVFDGKRNAWGCYQWDNGEKYFGTFFNDKKHGYGYYVWPNGSNYLGTFYLDKRSGYGIMRYSNHSIYEGFFLDDQRYGPGIFINNSPTSNEIDVGYWKNDRLIRLKKPAINQSGYDEFHFIKQFPQYNFYKLVNLELMFKHYQYQKSIKQDHNNQLLINEQIYHYDQYDHQYESVTNLNNIPINSTSLFIQIIQNILKQSNLPKSFQVWNMKSPLFEKFIADQSFNYLLHCMPTTKQSSFLNYNNIQQISEMMESIQNGYSNMSNLKNDEFEQQQQEKQFETSSKQDSLFDSRFKQNQTICLVDMRTYITKIAYLQHFLHKSYKTLNWYHLFKSSIKDGTIGEEEEEEEGGEQQHGDNLENSNLEKSNLEDSLNEQLFINDWSMIWNKLSKKIFKKSNKQHSTTTTNNNKKIQLTGNHECLSIKFIQYCYHGLFDKVKNLLHNKNQLNIDLNVIDSHGQFGLLGAVLTWNMKLVNLLLDFGANINQLTDDGLTVFTICLLKYYELFKEIMNMKNDRSDQFSQGEQESSYQSENYQPEQQQEQQRQYEPDHILPIITKIIKINDKTTDGTTVNGDNNEKKESDLNQSPSISFGRNYIYRVELPVLLSTTSSESMVMLRRAARLSQIRRMHLNKIKERRSLIMKSNEIRRSTQILKNDQQTPEIKNDLITQSTQSALPTFQRFTNCLTRFNTITELRNKDNLMNDNKLSPTASSKSMSAENRKSRPRTISIDRRNKKAMIDVISKKAAFSQPYRTKSPLLREAAAQELSRNPYFLASHSMTSSMTGQALDENNDKTPDTEQANETPVSRNSLDQQALLLAKQKQMINVIDLLLKRGANPNTGIRPLPALFLAVQAGDPEMVHKLIQYGADANICLRVDSTSESENLELKGIYIDEDEPPLIPSLDGLTVLHYAVLVPNEMGVKLTEILLEDGLADPNKQATLDDSFKLKSQFNTSIISGNSSEQNSGKTTPEENRINEGRTPLHLVCSREYDLLNSAIITKCLLKHNANPNLLCNGHSALSVAIATGNDPCIDALINHQNTNINQPLGDGLGSALCIACSSLFEFRRPIESRLELIKRLINKGGIESFQLFVLLKSKGIYGNVIDFTYMDYTKDTRISKTPYHALNEIEKETYNGRMQILTYLADRLREFAYSIEYTTDNTTEQINFDRNELKDKTISYPVKTASSKPSRLQSPTYLKKNSCISYSFCYECGRSVGVRLTVCSRCHRVYFCSKVCKLKSWTMRHKNECYLTPELQTERDRRSPTKVLPKLTTNKQENHQPLLNQQRIHSNLNWNLFNHLTCCTSSGEFIGIIYHPSYNYQYLLNHYMKINENGHIIIGTYKGEGNYSLI
					

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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	23.5	Very low	25.5	Very low	175 Å²	175	129.4 Å²	129.4	86%	0.862	65%	0.654	S	S	*	*				0	112	0	-82.1	156.5	163.9	0	0	105.6	F102	M1-F102 HydrophobicContact CE-CE2 3.77Å; M1-F102 HydrophobicContact CE-CZ 3.64Å; M1-F102 HydrophobicContact CG-CE2 4.31Å; M1-F102 HydrophobicContact SD-CE2 3.97Å; M1-F102 HydrophobicContact SD-CZ 3.65Å
2	A	23.3	Very low	25.4	Very low	85 Å²	85	131 Å²	131	70%	0.702	66%	0.664	S	S	*	*			trans	-140.1	140.1	170.3	0	0	0	0	0	105.7
3	V	25.3	Very low	25.3	Very low	96 Å²	96	125.8 Å²	125.8	58%	0.582	66%	0.663	S	S	*	*			trans	-77.4	128.4	-163.6	176.5	0	0	0	0	110.1	V5	V3-V5 HydrophobicContact CG1-CG2 4.2Å; V3-V5 PolarHBondContact O-N 3.27Å; V3-V5 VanDerWaalsContact O-N 3.15Å
4	Y	24.4	Very low	25.3	Very low	158 Å²	158	127.4 Å²	127.4	62%	0.62	67%	0.672	S	S	*	*			trans	-71.8	104.2	165.4	-120	-91.9	0	0	0	107.6	D6 L692	Y4-D6 PolarHBondContact O-N 2.68Å; Y4-L692 HydrophobicContact CE2-CD2 4.22Å
5	V	27.5	Very low	25.3	Very low	104 Å²	104	124 Å²	124	63%	0.63	66%	0.663	S	S	*	*			trans	-88.5	90	168.2	-177.5	0	0	0	0	106.7	V3 R7	V3-V5 HydrophobicContact CG1-CG2 4.2Å; V3-V5 PolarHBondContact O-N 3.27Å; V3-V5 VanDerWaalsContact O-N 3.15Å; V5-R7 HydrophobicContact CG1-CG 4.06Å; V5-R7 PolarHBondContact O-N 3Å
6	D	27.4	Very low	25.5	Very low	125 Å²	125	120.2 Å²	120.2	67%	0.668	65%	0.649	S	S	*	*			trans	-65.4	112.9	168.2	-105.3	-40.4	0	0	0	108.6	Y4 N8	Y4-D6 PolarHBondContact O-N 2.68Å; D6-N8 VanDerWaalsContact C-N 3.29Å; D6-N8 PolarHBondContact O-N 2.93Å
7	R	26.6	Very low	25.5	Very low	149 Å²	149	125.5 Å²	125.5	56%	0.562	67%	0.665	S	S	*	*			trans	-88	11.6	-173.4	-82.3	-176.7	159	142.7	-8	114.2	V5 I9 P678	V5-R7 HydrophobicContact CG1-CG 4.06Å; V5-R7 PolarHBondContact O-N 3Å; R7-I9 VanDerWaalsContact C-N 3.34Å; R7-I9 PolarHBondContact O-N 2.88Å; R7-P678 VanDerWaalsContact CZ-CG 3.48Å
8	N	26.3	Very low	25.5	Very low	139 Å²	139	122.3 Å²	122.3	74%	0.743	65%	0.645	S	S	*	*			trans	-86.8	10.6	-175.6	-72.4	-4.9	0	0	0	115	D6	D6-N8 VanDerWaalsContact C-N 3.29Å; D6-N8 PolarHBondContact O-N 2.93Å
9	I	26.6	Very low	25.5	Very low	109 Å²	109	120.7 Å²	120.7	56%	0.559	64%	0.644	S	S	*	*			trans	-134.7	69.5	179.1	-44	179.5	0	0	0	111.4	R7 H11 I12	R7-I9 VanDerWaalsContact C-N 3.34Å; R7-I9 PolarHBondContact O-N 2.88Å; I9-H11 VanDerWaalsContact C-N 3.3Å; I9-I12 HydrophobicContact CG2-CD1 3.7Å; I9-I12 HydrophobicContact CG2-CG1 3.79Å
10	F	25.2	Very low	25.6	Very low	170 Å²	170	120.4 Å²	120.4	75%	0.746	64%	0.643	S	S	*	*			trans	-95.1	12.1	153	-99.2	-76.5	0	0	0	112.2
11	H	24.8	Very low	25.7	Very low	113 Å²	113	121 Å²	121	52%	0.523	65%	0.651	S	S	.	*			trans	-100.9	39.9	-174.5	-66.3	-143.9	0	0	0	112	I9 Y671	I9-H11 VanDerWaalsContact C-N 3.3Å; H11-Y671 HydrophobicContact CB-CE1 4.36Å; H11-Y671 AromaticContact CD2-CE1 3.92Å; H11-Y671 AromaticContact CE1-CD1 3.57Å; H11-Y671 AromaticContact CE1-CE1 3.12Å; H11-Y671 WeakPolarHBondContact CE1-CE1 3.41Å; H11-Y671 AromaticContact CE1-CE2 3.66Å; H11-Y671 AromaticContact CE1-CZ 3.18Å; H11-Y671 AromaticContact CG-CE1 3.55Å; H11-Y671 AromaticContact ND1-CD1 3.93Å; H11-Y671 AromaticContact ND1-CE1 3.03Å; H11-Y671 WeakPolarHBondContact ND1-CE1 3.34Å; H11-Y671 AromaticContact ND1-CE2 3.95Å; H11-Y671 AromaticContact ND1-CZ 3.05Å; H11-Y671 PolarHBondContact ND1-OH 3.2Å; H11-Y671 AromaticContact NE2-CD1 3.8Å; H11-Y671 AromaticContact NE2-CE1 3.69Å
12	I	24.2	Very low	25.8	Very low	149 Å²	149	122 Å²	122	76%	0.764	65%	0.65	S	S	*	*			trans	-135.4	86.4	169.5	-54.1	178.5	0	0	0	108.1	I9	I9-I12 HydrophobicContact CG2-CD1 3.7Å; I9-I12 HydrophobicContact CG2-CG1 3.79Å
13	G	24.5	Very low	26	Very low	64 Å²	64	126.2 Å²	126.2	66%	0.66	66%	0.656	S	S	*	*	S	Bend	trans	-157.8	108.1	174.7	0	0	0	0	0	108.7
14	N	24.6	Very low	26	Very low	147 Å²	147	131.1 Å²	131.1	79%	0.786	67%	0.669	S	S	*	*			trans	57.1	73	-179.4	-57.8	2.3	0	0	0	114.8
15	S	25.5	Very low	26.1	Very low	77 Å²	77	131.5 Å²	131.5	54%	0.538	68%	0.68	S	S	.	*			trans	-115.1	138.9	136	57.3	0	0	0	0	108.2	D594	S15-D594 WeakPolarHBondContact CA-OD2 3.46Å; S15-D594 WeakPolarHBondContact CB-OD2 3.5Å
16	S	28.5	Very low	26	Very low	63 Å²	63	131.9 Å²	131.9	44%	0.441	69%	0.685	S	S	.	*			trans	-62.4	136	-169	50	0	0	0	0	112.7	K18 D594	S16-K18 PolarHBondContact O-N 3.42Å; S16-D594 PolarHBondContact N-OD2 2.57Å; S16-D594 PolarHBondContact OG-OD2 3.36Å
17	F	25.5	Very low	25.8	Very low	210 Å²	210	132.6 Å²	132.6	92%	0.921	69%	0.694	S	S	*	*			trans	-67	86.9	159.7	-104.9	-96.1	0	0	0	107.8	S19	F17-S19 PolarHBondContact O-N 3.09Å
18	K	25.8	Very low	25.8	Very low	69 Å²	69	134.2 Å²	134.2	30%	0.3	71%	0.707	S	S	.	*			trans	-80.4	109.6	161.1	-86.5	172.5	158.1	-170.1	0	108	S16 D594 Q595 Q598	S16-K18 PolarHBondContact O-N 3.42Å; K18-D594 WeakPolarHBondContact CE-O 3.38Å; K18-D594 PolarHBondContact NZ-O 3.18Å; K18-Q595 PolarHBondContact NZ-O 3.1Å; K18-Q598 HydrophobicContact CD-CG 4.04Å
19	S	25.8	Very low	26	Very low	91 Å²	91	133.7 Å²	133.7	64%	0.636	72%	0.715	S	S	*	*			trans	-51.7	141.5	156	46.1	0	0	0	0	109.1	F17 Q598	F17-S19 PolarHBondContact O-N 3.09Å; S19-Q598 PolarHBondContact O-NE2 3.42Å
20	D	26.9	Very low	25.9	Very low	114 Å²	114	135.7 Å²	135.7	61%	0.61	73%	0.726	S	S	*	*			trans	157.8	-11.1	146.2	-75.7	-16.6	0	0	0	114	F22 Q598	D20-F22 VanDerWaalsContact C-N 3.26Å; D20-F22 PolarHBondContact O-N 3.09Å; D20-Q598 PolarHBondContact OD2-NE2 3.16Å
21	V	27	Very low	25.9	Very low	134 Å²	134	133.4 Å²	133.4	81%	0.812	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	8.9	-175.5	-168.7	0	0	0	0	114.4
22	F	25.9	Very low	25.9	Very low	195 Å²	195	138.4 Å²	138.4	86%	0.855	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.5	57.2	177.5	-75.3	-74	0	0	0	113.7	D20	D20-F22 VanDerWaalsContact C-N 3.26Å; D20-F22 PolarHBondContact O-N 3.09Å
23	H	27	Very low	26.1	Very low	175 Å²	175	138.7 Å²	138.7	81%	0.81	74%	0.735	S	S	*	*	S	Bend	trans	-136.1	138.5	158.3	-84	-58.4	0	0	0	111.9
24	K	26	Very low	26.1	Very low	198 Å²	198	142.7 Å²	142.7	86%	0.861	74%	0.74	S	S	*	*			trans	68.4	84.1	177.5	-58.9	179.9	179.1	176.7	0	117.1
25	I	25.9	Very low	26.2	Very low	167 Å²	167	144.1 Å²	144.1	86%	0.856	74%	0.74	S	S	*	*				-108	122.2	127.9	-62.3	-179.4	0	0	0	106.2
26	P	25.7	Very low	26.3	Very low	112 Å²	112	146.3 Å²	146.3	73%	0.727	75%	0.745	S	S	*	*			trans	-67.5	148.1	-179.7	-21	33.5	0	0	0	113.2	E28	P26-E28 PolarHBondContact O-N 3.22Å
27	T	24.3	Very low	26.3	Very low	139 Å²	139	151.1 Å²	151.1	85%	0.853	76%	0.76	S	S	*	*	S	Bend	trans	-76	89.4	170.7	45.9	0	0	0	0	111.1
28	E	26.4	Very low	26.2	Very low	183 Å²	183	147.7 Å²	147.7	86%	0.855	75%	0.752	S	S	*	*			trans	-163.2	83.6	169	-116.6	162.8	-132.9	0	0	112.8	P26	P26-E28 PolarHBondContact O-N 3.22Å
29	S	29.9	Very low	26.3	Very low	128 Å²	128	151.2 Å²	151.2	90%	0.895	77%	0.774	S	S	*	*			trans	-176.9	79.5	153.8	24.3	0	0	0	0	110.9
30	L	23.7	Very low	26.2	Very low	151 Å²	151	153.3 Å²	153.3	79%	0.791	78%	0.778	S	S	*	*			trans	-76	153.3	166	-130.6	80.3	0	0	0	110.2
31	N	25.2	Very low	26.1	Very low	123 Å²	123	155 Å²	155	66%	0.658	78%	0.782	S	S	*	*			trans	71.6	129.8	166.8	-44.1	-40.1	0	0	0	115.2
32	Y	25.8	Very low	25.9	Very low	218 Å²	218	156.4 Å²	156.4	86%	0.855	78%	0.778	S	S	*	*				-156.8	170.9	63.3	-115.6	-90.2	0	0	0	115.2
33	H	29.3	Very low	26	Very low	155 Å²	155	155.1 Å²	155.1	72%	0.718	77%	0.774	S	S	*	*			trans	-74.1	152	-171.7	-81.1	-103.2	0	0	0	116.4
34	L	22.8	Very low	25.9	Very low	147 Å²	147	154 Å²	154	77%	0.77	77%	0.774	S	S	*	*			trans	8.5	126.1	138	-69	137.9	0	0	0	117.7
35	K	28.5	Very low	25.9	Very low	178 Å²	178	152.3 Å²	152.3	77%	0.774	77%	0.774	S	S	*	*				179.8	134.2	106.3	-95.3	175	-174.2	179.9	0	114.3
36	D	26.4	Very low	25.9	Very low	123 Å²	123	152.3 Å²	152.3	66%	0.658	77%	0.771	S	S	*	*			trans	57.6	142.2	136.7	-52.2	-32.9	0	0	0	124.5
37	H	28.9	Very low	26	Very low	163 Å²	163	154 Å²	154	76%	0.755	77%	0.774	S	S	*	*			trans	75.6	108.1	155.3	-60.8	-48.9	0	0	0	121.5
38	N	24.1	Very low	26.2	Very low	139 Å²	139	154.3 Å²	154.3	74%	0.743	78%	0.776	S	S	*	*				20.4	114.6	125.1	-57.8	-10	0	0	0	117.3
39	N	26	Very low	26.1	Very low	143 Å²	143	149.5 Å²	149.5	77%	0.765	78%	0.775	S	S	*	*				-173.3	146.4	107.1	-93.3	-36	0	0	0	112.9
40	N	23.7	Very low	26.1	Very low	135 Å²	135	149.3 Å²	149.3	72%	0.722	77%	0.768	S	S	*	*			trans	2.3	146	148	-47.1	-35.6	0	0	0	120.5
41	H	24.9	Very low	26.1	Very low	150 Å²	150	149.2 Å²	149.2	69%	0.694	77%	0.769	S	S	*	*			trans	85.5	135.5	133.5	-108.3	-63.3	0	0	0	120.3
42	F	23.6	Very low	26.3	Very low	163 Å²	163	149.4 Å²	149.4	72%	0.715	77%	0.77	S	S	*	*			trans	68.1	155.5	165	-56.8	-65.4	0	0	0	115.2
43	Q	27.7	Very low	26.2	Very low	167 Å²	167	145.8 Å²	145.8	78%	0.78	77%	0.765	S	S	*	*			cis	-153.7	155.9	-4.8	-133.2	147.8	-10	0	0	108.5
44	D	24.5	Very low	26.2	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	77%	0.774	S	S	*	*			trans	-66.4	146.3	169.8	-49.9	-70.8	0	0	0	111.2
45	N	27.9	Very low	26.3	Very low	163 Å²	163	146.4 Å²	146.4	87%	0.872	77%	0.769	S	S	*	*			trans	-167.9	156.1	148.9	-99.4	-24.4	0	0	0	111.9
46	E	25.6	Very low	26.2	Very low	168 Å²	168	144.6 Å²	144.6	79%	0.785	77%	0.773	S	S	*	*			trans	-96.3	179.6	-155.8	-57.1	165.8	142.2	0	0	114.6
47	N	26.5	Very low	26.2	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	77%	0.765	S	S	*	*			trans	84.7	76.2	160.9	-55.1	-42.3	0	0	0	120
48	T	29.1	Very low	26.2	Very low	144 Å²	144	140.2 Å²	140.2	88%	0.883	76%	0.761	S	S	*	*			trans	-139.3	119.5	139.4	52.9	0	0	0	0	109.6
49	G	24.4	Very low	26.4	Very low	82 Å²	82	141 Å²	141	85%	0.845	76%	0.76	S	S	*	*			trans	-86.5	117.4	-172.3	0	0	0	0	0	114.8
50	V	29.8	Very low	26.4	Very low	124 Å²	124	136.2 Å²	136.2	75%	0.752	73%	0.734	S	S	*	*			trans	-145.7	141.5	151	-178.2	0	0	0	0	106	D52	V50-D52 PolarHBondContact O-N 2.87Å
51	D	24.6	Very low	26.6	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	74%	0.736	S	S	*	*			trans	-68.6	82.6	-175.3	-82.3	-49.1	0	0	0	114	N53	D51-N53 PolarHBondContact O-N 3.42Å
52	D	27.5	Very low	26.9	Very low	128 Å²	128	137.5 Å²	137.5	68%	0.684	73%	0.725	S	S	*	*			trans	-79.1	35.1	179.8	-86.5	-19.7	0	0	0	114.6	V50 F54	V50-D52 PolarHBondContact O-N 2.87Å; D52-F54 PolarHBondContact O-N 2.81Å
53	N	25.7	Very low	27.2	Very low	142 Å²	142	139.5 Å²	139.5	76%	0.759	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	50.4	179.5	-87	-45.6	0	0	0	113.8	D51	D51-N53 PolarHBondContact O-N 3.42Å
54	F	27.2	Very low	27.7	Very low	206 Å²	206	133.8 Å²	133.8	90%	0.904	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.8	20	167.9	-118.9	-76.5	0	0	0	116.3	D52	D52-F54 PolarHBondContact O-N 2.81Å
55	T	26.4	Very low	28.6	Very low	109 Å²	109	130.5 Å²	130.5	67%	0.669	69%	0.687	S	S	*	*			trans	-140.5	63.7	-176.2	42.3	0	0	0	0	117
56	T	25.9	Very low	29.7	Very low	139 Å²	139	126.3 Å²	126.3	85%	0.853	66%	0.66	S	S	*	*	S	Bend	trans	-152.9	77.3	158.1	44.3	0	0	0	0	114.2
57	R	25.8	Very low	30.8	Very low	130 Å²	130	124 Å²	124	49%	0.491	65%	0.653	S	S	.	*	S	Bend	trans	170	114.1	153.1	-97.2	161.4	-168.7	-168	4.4	109.4	D1103 S1145	R57-D1103 IonicContact CZ-OD2 2.73Å; R57-D1103 IonicContact NH1-OD2 2.89Å; R57-D1103 PolarHBondContact NH1-OD2 2.67Å; R57-D1103 VanDerWaalsContact NH1-OD2 3.14Å; R57-D1103 IonicContact NH2-OD2 3.73Å; R57-S1145 PolarHBondContact NH2-OG 3.46Å
58	G	28.7	Very low	32.1	Very low	64 Å²	64	122.7 Å²	122.7	66%	0.66	64%	0.638	S	S	*	*			trans	130.4	71.4	169.9	0	0	0	0	0	115.6
59	E	28.1	Very low	32.8	Very low	155 Å²	155	124.7 Å²	124.7	72%	0.724	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	150.8	179.1	-59.3	174.9	145.8	0	0	113.4
60	N	27.4	Very low	34.3	Very low	44 Å²	44	126.6 Å²	126.6	24%	0.235	63%	0.632	C	S	.	*	T	Hydrogen-bonded Turn	trans	80.7	27.3	172.9	-61.8	-78.4	0	0	0	119.1	Y62	N60-Y62 HydrophobicContact CB-CE2 4.22Å; N60-Y62 WeakPolarHBondContact OD1-CE2 3.24Å; N60-Y62 PolarHBondContact OD1-OH 2.93Å
61	Y	27.8	Very low	35.8	Very low	191 Å²	191	123.1 Å²	123.1	75%	0.749	62%	0.622	S	S	*	*			trans	-103.3	90.1	146.7	-77.9	-81.8	0	0	0	110.2	R63	Y61-R63 PolarHBondContact O-N 2.85Å
62	Y	30.9	Very low	38.4	Very low	120 Å²	120	116.8 Å²	116.8	47%	0.471	59%	0.588	S	S	.	*			trans	-63.5	104.7	175.3	-59.4	-96	0	0	0	109.9	N60 E64	N60-Y62 HydrophobicContact CB-CE2 4.22Å; N60-Y62 WeakPolarHBondContact OD1-CE2 3.24Å; N60-Y62 PolarHBondContact OD1-OH 2.93Å; Y62-E64 PolarHBondContact O-N 3.35Å; Y62-E64 VanDerWaalsContact O-N 3.11Å
63	R	30.7	Very low	40.8	Very low	206 Å²	206	113.6 Å²	113.6	78%	0.777	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.8	86.6	147.8	-78.1	-175.3	-179.9	173.1	1.3	106.4	Y61 V65	Y61-R63 PolarHBondContact O-N 2.85Å; R63-V65 PolarHBondContact O-N 3.38Å
64	E	36.9	Very low	43.4	Very low	47 Å²	47	107 Å²	107	22%	0.22	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	116.1	160.5	-70.1	-174.4	164.9	0	0	106.6	Y62 K66 V78	Y62-E64 PolarHBondContact O-N 3.35Å; Y62-E64 VanDerWaalsContact O-N 3.11Å; E64-K66 IonicContact OE1-NZ 3.99Å; E64-K66 PolarHBondContact OE1-NZ 3.12Å; E64-K66 IonicContact OE2-NZ 3.4Å; E64-K66 PolarHBondContact OE2-NZ 3.05Å; E64-V78 HydrophobicContact CB-CG2 4.21Å
65	V	44.2	Very low	45.7	Very low	82 Å²	82	101.3 Å²	101.3	50%	0.497	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.2	149.9	-179.4	0	0	0	0	105.2	R63 L73 F74 Q75	R63-V65 PolarHBondContact O-N 3.38Å; V65-L73 HydrophobicContact CG1-CD2 4.42Å; V65-L73 HydrophobicContact CG1-CG 4.42Å; V65-F74 CarbonylContact C-O 3.54Å; V65-F74 WeakPolarHBondContact CA-O 3.38Å; V65-Q75 HydrophobicContact CG2-CB 4.38Å; V65-Q75 HydrophobicContact CG2-CG 4.01Å
66	K	50	Low	48.1	Very low	74 Å²	74	96.5 Å²	96.5	32%	0.322	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	107.1	174.2	-106.3	-171.3	176	65.5	0	108.9	E64 W68 F74	E64-K66 IonicContact OE1-NZ 3.99Å; E64-K66 PolarHBondContact OE1-NZ 3.12Å; E64-K66 IonicContact OE2-NZ 3.4Å; E64-K66 PolarHBondContact OE2-NZ 3.05Å; K66-W68 HydrophobicContact CD-CH2 4.26Å; K66-W68 HydrophobicContact CD-CZ2 3.84Å; K66-F74 PolarHBondContact N-O 3.37Å; K66-F74 PolarHBondContact O-N 2.71Å
67	D	49.2	Very low	50.1	Low	119 Å²	119	91 Å²	91	64%	0.636	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	117.3	161.1	-54.4	-25.9	0	0	0	106.8	L73	D67-L73 WeakPolarHBondContact OD1-CD1 3.41Å
68	W	53.9	Low	52	Low	122 Å²	122	85.9 Å²	85.9	46%	0.462	44%	0.438	S	S	.	.			trans	-86.5	152.3	170.6	-60.8	87.6	0	0	0	108.7	K66 N70 G71 D72	K66-W68 HydrophobicContact CD-CH2 4.26Å; K66-W68 HydrophobicContact CD-CZ2 3.84Å; W68-N70 PolarHBondContact O-N 2.86Å; W68-G71 PolarHBondContact O-N 2.93Å; W68-D72 HydrophobicContact CB-CB 4.17Å; W68-D72 HydrophobicContact CG-CB 4.47Å; W68-D72 PolarHBondContact N-O 3.49Å
69	L	44.4	Very low	53.3	Low	186 Å²	186	85.2 Å²	85.2	97%	0.974	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-10.8	-178.9	-78	161.6	0	0	0	115.1
70	N	55.7	Low	54.7	Low	121 Å²	121	81.1 Å²	81.1	65%	0.647	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.6	-179.6	-58.2	10.9	0	0	0	113.2	W68 D92	W68-N70 PolarHBondContact O-N 2.86Å; N70-D92 VanDerWaalsContact O-CB 3.32Å; N70-D92 WeakPolarHBondContact O-CB 3.33Å
71	G	60.5	Low	56.7	Low	52 Å²	52	80.7 Å²	80.7	54%	0.536	41%	0.406	S	S	.	.	S	Bend	trans	92.4	-8.7	-171.2	0	0	0	0	0	114.4	W68 L73	W68-G71 PolarHBondContact O-N 2.93Å; G71-L73 PolarHBondContact O-N 2.92Å
72	D	80	Confident	58.9	Low	16 Å²	16	75.9 Å²	75.9	9%	0.086	39%	0.389	C	S	.	.			trans	-59.7	131.4	167	-78.6	10.2	0	0	0	110.5	W68 Y89 Q90 W91 D92	W68-D72 HydrophobicContact CB-CB 4.17Å; W68-D72 HydrophobicContact CG-CB 4.47Å; W68-D72 PolarHBondContact N-O 3.49Å; D72-Y89 HydrophobicContact CB-CE1 3.98Å; D72-Y89 WeakPolarHBondContact CB-OH 3.16Å; D72-Y89 WeakPolarHBondContact OD2-CE1 3.32Å; D72-Y89 PolarHBondContact OD2-OH 3.37Å; D72-Q90 CarbonylContact C-O 3.43Å; D72-Q90 WeakPolarHBondContact CA-O 3.32Å; D72-W91 VanDerWaalsContact OD1-CA 3.27Å; D72-W91 WeakPolarHBondContact OD1-CA 3.2Å; D72-D92 PolarHBondContact OD1-N 3.17Å
73	L	78	Confident	61.3	Low	61 Å²	61	72.4 Å²	72.4	32%	0.319	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118	-178.4	-170.3	151.6	0	0	0	110.1	V65 D67 G71 Q90	V65-L73 HydrophobicContact CG1-CD2 4.42Å; V65-L73 HydrophobicContact CG1-CG 4.42Å; D67-L73 WeakPolarHBondContact OD1-CD1 3.41Å; G71-L73 PolarHBondContact O-N 2.92Å; L73-Q90 PolarHBondContact N-O 2.97Å; L73-Q90 PolarHBondContact O-N 3.4Å
74	F	80.7	Confident	63.6	Low	3 Å²	3	63.7 Å²	63.7	1%	0.013	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.6	172.9	-179.5	-106.6	0	0	0	111.4	V65 K66 V78 R83 C88 Y89 F101	V65-F74 CarbonylContact C-O 3.54Å; V65-F74 WeakPolarHBondContact CA-O 3.38Å; K66-F74 PolarHBondContact N-O 3.37Å; K66-F74 PolarHBondContact O-N 2.71Å; F74-V78 HydrophobicContact CD1-CG2 3.93Å; F74-V78 HydrophobicContact CE1-CG2 3.55Å; F74-R83 HydrophobicContact CD1-CG 4.12Å; F74-R83 HydrophobicContact CD2-CG 3.99Å; F74-R83 HydrophobicContact CE1-CB 4.36Å; F74-R83 HydrophobicContact CE1-CG 3.9Å; F74-R83 HydrophobicContact CE2-CB 4.03Å; F74-R83 HydrophobicContact CE2-CG 3.75Å; F74-R83 HydrophobicContact CG-CG 4.15Å; F74-R83 HydrophobicContact CZ-CB 3.81Å; F74-R83 HydrophobicContact CZ-CG 3.69Å; F74-C88 WeakPolarHBondContact CA-O 3.48Å; F74-C88 WeakPolarHBondContact CD2-O 3.14Å; F74-Y89 HydrophobicContact CB-CD2 3.71Å; F74-Y89 HydrophobicContact CB-CE2 4.08Å; F74-Y89 AromaticContact CD2-CD2 3.58Å; F74-Y89 HydrophobicContact CD2-CD2 3.58Å; F74-Y89 HydrophobicContact CD2-CG 4.24Å; F74-Y89 HydrophobicContact CG-CD2 4.01Å; F74-F101 HydrophobicContact CD2-CE2 4.48Å; F74-F101 HydrophobicContact CE2-CD2 4.01Å; F74-F101 AromaticContact CE2-CE2 3.65Å; F74-F101 HydrophobicContact CE2-CE2 3.65Å; F74-F101 HydrophobicContact CE2-CZ 4.06Å; F74-F101 HydrophobicContact CZ-CD2 4.48Å
75	Q	74.7	Confident	65.5	Low	86 Å²	86	64.4 Å²	64.4	40%	0.402	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	105.5	171.7	-177.3	-175.4	39.9	0	0	109.3	V65 G87 C88	V65-Q75 HydrophobicContact CG2-CB 4.38Å; V65-Q75 HydrophobicContact CG2-CG 4.01Å; Q75-G87 CarbonylContact O-C 3.3Å; Q75-G87 WeakPolarHBondContact O-CA 3.35Å; Q75-C88 HydrophobicContact CB-CB 4.47Å; Q75-C88 PolarHBondContact N-O 3.01Å; Q75-C88 PolarHBondContact O-N 3.27Å
76	G	75.7	Confident	67.3	Low	8 Å²	8	67 Å²	67	8%	0.082	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.9	-168.2	180	0	0	0	0	0	114.3	V78	G76-V78 PolarHBondContact O-N 3.39Å
77	G	69.1	Low	68.9	Low	24 Å²	24	63.6 Å²	63.6	25%	0.247	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	121.7	176.4	0	0	0	0	0	112.1	N84 W86	G77-N84 CarbonylContact C-O 3.55Å; G77-N84 VanDerWaalsContact C-O 3.3Å; G77-N84 VanDerWaalsContact CA-O 3.3Å; G77-N84 WeakPolarHBondContact CA-O 3.19Å; G77-N84 PolarHBondContact O-N 3.5Å; G77-W86 PolarHBondContact N-O 3.23Å; G77-W86 VanDerWaalsContact N-O 3.09Å
78	V	65.8	Low	70.6	Confident	23 Å²	23	58.8 Å²	58.8	14%	0.139	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.3	167.5	-175	0	0	0	0	109.1	E64 F74 G76 G81	E64-V78 HydrophobicContact CB-CG2 4.21Å; F74-V78 HydrophobicContact CD1-CG2 3.93Å; F74-V78 HydrophobicContact CE1-CG2 3.55Å; G76-V78 PolarHBondContact O-N 3.39Å; V78-G81 VanDerWaalsContact CG1-CA 3.46Å
79	F	56	Low	72.3	Confident	50 Å²	50	54 Å²	54	22%	0.219	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.7	173.1	-176.5	-76.6	0	0	0	108.8	G81 K82 N84 S699 R702 R703 L706	F79-G81 PolarHBondContact O-N 3.29Å; F79-K82 CarbonylContact C-O 3.51Å; F79-K82 PolarHBondContact N-O 2.89Å; F79-K82 CarbonylContact O-C 3.55Å; F79-K82 WeakPolarHBondContact O-CA 3.36Å; F79-K82 WeakPolarHBondContact O-CB 3.49Å; F79-K82 PolarHBondContact O-N 3.08Å; F79-N84 HydrophobicContact CB-CB 3.66Å; F79-N84 PolarHBondContact O-ND2 3.46Å; F79-S699 WeakPolarHBondContact CE2-O 3.48Å; F79-S699 VanDerWaalsContact CE2-OG 3.25Å; F79-S699 WeakPolarHBondContact CE2-OG 3.35Å; F79-R702 HydrophobicContact CZ-CB 4.49Å; F79-R703 VanDerWaalsContact CD2-CD 3.44Å; F79-R703 HydrophobicContact CD2-CG 3.52Å; F79-R703 VanDerWaalsContact CD2-NE 3.3Å; F79-R703 HydrophobicContact CE2-CG 3.52Å; F79-R703 HydrophobicContact CG-CG 4.21Å; F79-R703 HydrophobicContact CZ-CG 4.24Å; F79-L706 HydrophobicContact CE1-CD1 4.42Å
80	D	57.3	Low	74.3	Confident	69 Å²	69	48.4 Å²	48.4	37%	0.369	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	25.2	-176.2	-159.6	11	0	0	0	115.1	K82 L706	D80-K82 PolarHBondContact O-N 3.46Å; D80-L706 HydrophobicContact CB-CD1 3.85Å; D80-L706 WeakPolarHBondContact OD1-CB 3.45Å; D80-L706 WeakPolarHBondContact OD1-CD2 3.44Å
81	G	68.4	Low	75.8	Confident	34 Å²	34	44.8 Å²	44.8	35%	0.351	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	3.3	-175.1	0	0	0	0	0	113.5	V78 F79 K710	V78-G81 VanDerWaalsContact CG1-CA 3.46Å; F79-G81 PolarHBondContact O-N 3.29Å; G81-K710 VanDerWaalsContact CA-CE 3.43Å
82	K	76	Confident	77	Confident	90 Å²	90	47.4 Å²	47.4	39%	0.391	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	136	170.3	-53.7	-156.5	172	-170.9	0	110.2	F79 D80 N84 N103 D104	F79-K82 CarbonylContact C-O 3.51Å; F79-K82 PolarHBondContact N-O 2.89Å; F79-K82 CarbonylContact O-C 3.55Å; F79-K82 WeakPolarHBondContact O-CA 3.36Å; F79-K82 WeakPolarHBondContact O-CB 3.49Å; F79-K82 PolarHBondContact O-N 3.08Å; D80-K82 PolarHBondContact O-N 3.46Å; K82-N84 PolarHBondContact O-N 3.21Å; K82-N84 PolarHBondContact O-ND2 3.19Å; K82-N103 HydrophobicContact CD-CB 4.17Å; K82-D104 WeakPolarHBondContact CA-OD1 3.43Å; K82-D104 VanDerWaalsContact CA-OD2 3.29Å; K82-D104 WeakPolarHBondContact CA-OD2 3.45Å; K82-D104 WeakPolarHBondContact CB-OD2 3.24Å; K82-D104 WeakPolarHBondContact CD-OD2 3.5Å; K82-D104 WeakPolarHBondContact CG-OD2 3.44Å
83	R	80.4	Confident	77.2	Confident	48 Å²	48	50.3 Å²	50.3	18%	0.181	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	128.4	172.6	-56.8	166.3	-71.7	-178.2	4.5	108.6	F74 F101 N103 D104	F74-R83 HydrophobicContact CD1-CG 4.12Å; F74-R83 HydrophobicContact CD2-CG 3.99Å; F74-R83 HydrophobicContact CE1-CB 4.36Å; F74-R83 HydrophobicContact CE1-CG 3.9Å; F74-R83 HydrophobicContact CE2-CB 4.03Å; F74-R83 HydrophobicContact CE2-CG 3.75Å; F74-R83 HydrophobicContact CG-CG 4.15Å; F74-R83 HydrophobicContact CZ-CB 3.81Å; F74-R83 HydrophobicContact CZ-CG 3.69Å; R83-F101 VanDerWaalsContact C-CB 3.43Å; R83-F101 HydrophobicContact CB-CB 3.8Å; R83-F101 HydrophobicContact CB-CD1 3.62Å; R83-F101 HydrophobicContact CB-CD2 4.29Å; R83-F101 HydrophobicContact CB-CE1 4.21Å; R83-F101 HydrophobicContact CB-CG 3.65Å; R83-F101 HydrophobicContact CG-CD1 4.48Å; R83-F101 WeakPolarHBondContact O-CB 3.44Å; R83-N103 PolarHBondContact O-N 2.95Å; R83-D104 WeakPolarHBondContact CG-OD1 3.4Å; R83-D104 PolarHBondContact N-OD1 3.04Å; R83-D104 IonicContact NE-OD1 2.84Å; R83-D104 PolarHBondContact NE-OD1 3.18Å; R83-D104 PolarHBondContact NH2-O 3.09Å; R83-D104 PolarHBondContact O-N 3.23Å
84	N	79.6	Confident	77.5	Confident	23 Å²	23	48.8 Å²	48.8	12%	0.123	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	144.5	-173.8	-85.9	-74.3	0	0	0	111	G77 F79 K82 F101 F102 N103	G77-N84 CarbonylContact C-O 3.55Å; G77-N84 VanDerWaalsContact C-O 3.3Å; G77-N84 VanDerWaalsContact CA-O 3.3Å; G77-N84 WeakPolarHBondContact CA-O 3.19Å; G77-N84 PolarHBondContact O-N 3.5Å; F79-N84 HydrophobicContact CB-CB 3.66Å; F79-N84 PolarHBondContact O-ND2 3.46Å; K82-N84 PolarHBondContact O-N 3.21Å; K82-N84 PolarHBondContact O-ND2 3.19Å; N84-F101 CarbonylContact C-O 3.52Å; N84-F101 WeakPolarHBondContact CA-O 3.47Å; N84-F102 WeakPolarHBondContact OD1-CA 3.14Å; N84-N103 PolarHBondContact OD1-N 3.39Å
85	A	76.8	Confident	78.1	Confident	62 Å²	62	50.5 Å²	50.5	51%	0.512	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.2	-164.1	-167.3	0	0	0	0	0	111.6	F101	A85-F101 PolarHBondContact N-O 3.47Å; A85-F101 PolarHBondContact O-N 3.22Å
86	W	81.7	Confident	78.9	Confident	135 Å²	135	49.9 Å²	49.9	51%	0.511	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	141.6	-173.4	-146.5	-84.6	0	0	0	112.3	G77 G99 T100 Y109	G77-W86 PolarHBondContact N-O 3.23Å; G77-W86 VanDerWaalsContact N-O 3.09Å; W86-G99 WeakPolarHBondContact CA-O 3.43Å; W86-T100 HydrophobicContact CE3-CG2 3.7Å; W86-T100 HydrophobicContact CZ3-CG2 4.18Å; W86-Y109 HydrophobicContact CH2-CD1 4.37Å
87	G	82.5	Confident	79.6	Confident	3 Å²	3	49.5 Å²	49.5	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	157.7	172.6	0	0	0	0	0	113.2	Q75 F98 G99	Q75-G87 CarbonylContact O-C 3.3Å; Q75-G87 WeakPolarHBondContact O-CA 3.35Å; G87-F98 WeakPolarHBondContact O-CA 3.49Å; G87-G99 PolarHBondContact N-O 2.94Å; G87-G99 PolarHBondContact O-N 3.22Å
88	C	85.8	Confident	80.6	Confident	19 Å²	19	52.1 Å²	52.1	13%	0.128	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.8	162.8	179.7	0	0	0	0	108.7	F74 Q75 Y97 F98	F74-C88 WeakPolarHBondContact CA-O 3.48Å; F74-C88 WeakPolarHBondContact CD2-O 3.14Å; Q75-C88 HydrophobicContact CB-CB 4.47Å; Q75-C88 PolarHBondContact N-O 3.01Å; Q75-C88 PolarHBondContact O-N 3.27Å; C88-Y97 CarbonylContact C-O 3.6Å; C88-Y97 VanDerWaalsContact CA-O 3.23Å; C88-Y97 WeakPolarHBondContact CA-O 3.32Å; C88-F98 HydrophobicContact CB-CD1 3.83Å; C88-F98 HydrophobicContact CB-CE1 3.96Å; C88-F98 WeakPolarHBondContact SG-CE1 3.47Å
89	Y	88.3	Confident	81.6	Confident	20 Å²	20	51 Å²	51	8%	0.078	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.3	164.9	-164.1	-76.4	0	0	0	108.1	D72 F74 W91 K96 Y97	D72-Y89 HydrophobicContact CB-CE1 3.98Å; D72-Y89 WeakPolarHBondContact CB-OH 3.16Å; D72-Y89 WeakPolarHBondContact OD2-CE1 3.32Å; D72-Y89 PolarHBondContact OD2-OH 3.37Å; F74-Y89 HydrophobicContact CB-CD2 3.71Å; F74-Y89 HydrophobicContact CB-CE2 4.08Å; F74-Y89 AromaticContact CD2-CD2 3.58Å; F74-Y89 HydrophobicContact CD2-CD2 3.58Å; F74-Y89 HydrophobicContact CD2-CG 4.24Å; F74-Y89 HydrophobicContact CG-CD2 4.01Å; Y89-W91 AromaticContact CD1-CD2 3.48Å; Y89-W91 HydrophobicContact CD1-CD2 3.48Å; Y89-W91 VanDerWaalsContact CD1-CD2 3.48Å; Y89-W91 AromaticContact CD1-CE2 3.43Å; Y89-W91 VanDerWaalsContact CD1-CE2 3.43Å; Y89-W91 AromaticContact CD1-CE3 3.73Å; Y89-W91 HydrophobicContact CD1-CE3 3.73Å; Y89-W91 AromaticContact CD1-CG 4Å; Y89-W91 HydrophobicContact CD1-CG 4Å; Y89-W91 AromaticContact CD1-CH2 3.9Å; Y89-W91 HydrophobicContact CD1-CH2 3.9Å; Y89-W91 AromaticContact CD1-CZ2 3.66Å; Y89-W91 HydrophobicContact CD1-CZ2 3.66Å; Y89-W91 AromaticContact CD1-CZ3 3.94Å; Y89-W91 HydrophobicContact CD1-CZ3 3.94Å; Y89-W91 AromaticContact CD1-NE1 3.89Å; Y89-W91 AromaticContact CE1-CD1 3.55Å; Y89-W91 AromaticContact CE1-CD2 3.66Å; Y89-W91 HydrophobicContact CE1-CD2 3.66Å; Y89-W91 AromaticContact CE1-CE2 3.45Å; Y89-W91 VanDerWaalsContact CE1-CE2 3.45Å; Y89-W91 HydrophobicContact CE1-CE3 4.37Å; Y89-W91 AromaticContact CE1-CG 3.73Å; Y89-W91 HydrophobicContact CE1-CG 3.73Å; Y89-W91 HydrophobicContact CE1-CZ2 4.02Å; Y89-W91 AromaticContact CE1-NE1 3.38Å; Y89-W91 HydrophobicContact CG-CH2 4.37Å; Y89-W91 HydrophobicContact CG-CZ2 4.34Å; Y89-K96 CarbonylContact O-C 3.52Å; Y89-K96 WeakPolarHBondContact O-CA 3.39Å; Y89-Y97 PolarHBondContact N-O 3.38Å; Y89-Y97 PolarHBondContact O-N 3.44Å
90	Q	87.9	Confident	83	Confident	69 Å²	69	49.7 Å²	49.7	32%	0.322	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.6	170.9	173.1	168.8	-36.5	0	0	107.8	D72 L73 E95 K96	D72-Q90 CarbonylContact C-O 3.43Å; D72-Q90 WeakPolarHBondContact CA-O 3.32Å; L73-Q90 PolarHBondContact N-O 2.97Å; L73-Q90 PolarHBondContact O-N 3.4Å; Q90-E95 WeakPolarHBondContact CA-O 3.37Å; Q90-K96 HydrophobicContact CB-CG 4.27Å; Q90-K96 HydrophobicContact CG-CD 4.37Å; Q90-K96 HydrophobicContact CG-CG 4.1Å
91	W	87.5	Confident	84.4	Confident	46 Å²	46	46.7 Å²	46.7	17%	0.174	24%	0.242	C	C	.	.			trans	-87.4	155	173.8	-71.8	-93.6	0	0	0	110.5	D72 Y89 N93 G94 E95 Y112	D72-W91 VanDerWaalsContact OD1-CA 3.27Å; D72-W91 WeakPolarHBondContact OD1-CA 3.2Å; Y89-W91 AromaticContact CD1-CD2 3.48Å; Y89-W91 HydrophobicContact CD1-CD2 3.48Å; Y89-W91 VanDerWaalsContact CD1-CD2 3.48Å; Y89-W91 AromaticContact CD1-CE2 3.43Å; Y89-W91 VanDerWaalsContact CD1-CE2 3.43Å; Y89-W91 AromaticContact CD1-CE3 3.73Å; Y89-W91 HydrophobicContact CD1-CE3 3.73Å; Y89-W91 AromaticContact CD1-CG 4Å; Y89-W91 HydrophobicContact CD1-CG 4Å; Y89-W91 AromaticContact CD1-CH2 3.9Å; Y89-W91 HydrophobicContact CD1-CH2 3.9Å; Y89-W91 AromaticContact CD1-CZ2 3.66Å; Y89-W91 HydrophobicContact CD1-CZ2 3.66Å; Y89-W91 AromaticContact CD1-CZ3 3.94Å; Y89-W91 HydrophobicContact CD1-CZ3 3.94Å; Y89-W91 AromaticContact CD1-NE1 3.89Å; Y89-W91 AromaticContact CE1-CD1 3.55Å; Y89-W91 AromaticContact CE1-CD2 3.66Å; Y89-W91 HydrophobicContact CE1-CD2 3.66Å; Y89-W91 AromaticContact CE1-CE2 3.45Å; Y89-W91 VanDerWaalsContact CE1-CE2 3.45Å; Y89-W91 HydrophobicContact CE1-CE3 4.37Å; Y89-W91 AromaticContact CE1-CG 3.73Å; Y89-W91 HydrophobicContact CE1-CG 3.73Å; Y89-W91 HydrophobicContact CE1-CZ2 4.02Å; Y89-W91 AromaticContact CE1-NE1 3.38Å; Y89-W91 HydrophobicContact CG-CH2 4.37Å; Y89-W91 HydrophobicContact CG-CZ2 4.34Å; W91-N93 VanDerWaalsContact CB-OD1 3.28Å; W91-N93 WeakPolarHBondContact CB-OD1 3.48Å; W91-N93 PolarHBondContact O-N 3.28Å; W91-G94 PolarHBondContact O-N 3.32Å; W91-E95 HydrophobicContact CB-CB 4.12Å; W91-E95 HydrophobicContact CD2-CB 4.04Å; W91-E95 HydrophobicContact CE3-CB 3.53Å; W91-E95 HydrophobicContact CG-CB 4.31Å; W91-E95 HydrophobicContact CZ3-CB 4.32Å; W91-E95 PolarHBondContact N-O 2.99Å; W91-Y112 AromaticContact CH2-CE2 3.72Å; W91-Y112 HydrophobicContact CH2-CE2 3.72Å; W91-Y112 AromaticContact CZ3-CE2 3.78Å; W91-Y112 HydrophobicContact CZ3-CE2 3.78Å; W91-Y112 AromaticContact CZ3-CZ 3.88Å
92	D	84.7	Confident	85.1	Confident	106 Å²	106	48 Å²	48	57%	0.567	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-36.9	173	67.9	-16.8	0	0	0	113.2	N70 D72 G94	N70-D92 VanDerWaalsContact O-CB 3.32Å; N70-D92 WeakPolarHBondContact O-CB 3.33Å; D72-D92 PolarHBondContact OD1-N 3.17Å; D92-G94 PolarHBondContact O-N 3.24Å
93	N	85.2	Confident	85.4	Confident	78 Å²	78	46.8 Å²	46.8	42%	0.417	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-3.4	179.1	77.9	-0.4	0	0	0	114.5	W91 E95 P115	W91-N93 VanDerWaalsContact CB-OD1 3.28Å; W91-N93 WeakPolarHBondContact CB-OD1 3.48Å; W91-N93 PolarHBondContact O-N 3.28Å; N93-E95 PolarHBondContact ND2-OE1 2.85Å; N93-E95 VanDerWaalsContact OD1-CB 3.27Å; N93-E95 WeakPolarHBondContact OD1-CB 3.46Å; N93-E95 WeakPolarHBondContact OD1-CG 3.42Å; N93-E95 PolarHBondContact OD1-N 3.2Å; N93-P115 WeakPolarHBondContact O-CG 3.23Å
94	G	84	Confident	85.7	Confident	28 Å²	28	46.8 Å²	46.8	29%	0.289	24%	0.24	S	C	.	.	S	Bend	trans	91.4	-1.6	-179.8	0	0	0	0	0	115.7	W91 D92	W91-G94 PolarHBondContact O-N 3.32Å; D92-G94 PolarHBondContact O-N 3.24Å
95	E	92.6	Very high	86.2	Confident	40 Å²	40	49.9 Å²	49.9	19%	0.187	25%	0.252	C	S	.	.			trans	-60.7	146.4	167.8	-73.6	176.5	-126.8	0	0	109.8	Q90 W91 N93 Y112 V113 P115	Q90-E95 WeakPolarHBondContact CA-O 3.37Å; W91-E95 HydrophobicContact CB-CB 4.12Å; W91-E95 HydrophobicContact CD2-CB 4.04Å; W91-E95 HydrophobicContact CE3-CB 3.53Å; W91-E95 HydrophobicContact CG-CB 4.31Å; W91-E95 HydrophobicContact CZ3-CB 4.32Å; W91-E95 PolarHBondContact N-O 2.99Å; N93-E95 PolarHBondContact ND2-OE1 2.85Å; N93-E95 VanDerWaalsContact OD1-CB 3.27Å; N93-E95 WeakPolarHBondContact OD1-CB 3.46Å; N93-E95 WeakPolarHBondContact OD1-CG 3.42Å; N93-E95 PolarHBondContact OD1-N 3.2Å; E95-Y112 HydrophobicContact CB-CE1 4.42Å; E95-Y112 HydrophobicContact CG-CE1 4.35Å; E95-Y112 VanDerWaalsContact OE2-CE1 3.28Å; E95-Y112 WeakPolarHBondContact OE2-CE1 3.49Å; E95-Y112 VanDerWaalsContact OE2-CZ 3.26Å; E95-Y112 PolarHBondContact OE2-OH 3.15Å; E95-V113 CarbonylContact C-O 3.54Å; E95-V113 WeakPolarHBondContact CA-O 3.19Å; E95-P115 HydrophobicContact CG-CG 3.99Å
96	K	91.4	Very high	86.9	Confident	73 Å²	73	48.6 Å²	48.6	32%	0.317	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	140.2	175.6	-50.6	-168.6	-171.7	-155.9	0	111	Y89 Q90 F98 Y112 V113	Y89-K96 CarbonylContact O-C 3.52Å; Y89-K96 WeakPolarHBondContact O-CA 3.39Å; Q90-K96 HydrophobicContact CB-CG 4.27Å; Q90-K96 HydrophobicContact CG-CD 4.37Å; Q90-K96 HydrophobicContact CG-CG 4.1Å; K96-F98 HydrophobicContact CB-CE2 3.72Å; K96-F98 HydrophobicContact CB-CZ 4.3Å; K96-F98 HydrophobicContact CD-CE2 4.48Å; K96-F98 HydrophobicContact CD-CZ 4.41Å; K96-Y112 CarbonylContact O-C 3.53Å; K96-Y112 WeakPolarHBondContact O-CA 3.29Å; K96-V113 HydrophobicContact CB-CB 4.34Å; K96-V113 PolarHBondContact N-O 3.19Å; K96-V113 PolarHBondContact O-N 3.29Å
97	Y	91.2	Very high	87.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129	173.4	173.5	-104.2	0	0	0	111.2	C88 Y89 T100 F101 K106 Y111 Y112 F124	C88-Y97 CarbonylContact C-O 3.6Å; C88-Y97 VanDerWaalsContact CA-O 3.23Å; C88-Y97 WeakPolarHBondContact CA-O 3.32Å; Y89-Y97 PolarHBondContact N-O 3.38Å; Y89-Y97 PolarHBondContact O-N 3.44Å; Y97-T100 PolarHBondContact OH-O 3.12Å; Y97-F101 HydrophobicContact CD1-CD2 4.4Å; Y97-F101 HydrophobicContact CD1-CE1 4.13Å; Y97-F101 AromaticContact CD1-CE2 3.49Å; Y97-F101 HydrophobicContact CD1-CE2 3.49Å; Y97-F101 VanDerWaalsContact CD1-CE2 3.49Å; Y97-F101 AromaticContact CD1-CZ 3.35Å; Y97-F101 HydrophobicContact CD1-CZ 3.35Å; Y97-F101 HydrophobicContact CE1-CD2 4.01Å; Y97-F101 HydrophobicContact CE1-CE1 4.2Å; Y97-F101 AromaticContact CE1-CE2 3.55Å; Y97-F101 HydrophobicContact CE1-CE2 3.55Å; Y97-F101 AromaticContact CE1-CZ 3.68Å; Y97-F101 HydrophobicContact CE1-CZ 3.68Å; Y97-K106 HydrophobicContact CD1-CG 4.22Å; Y97-K106 HydrophobicContact CD2-CD 4.41Å; Y97-K106 HydrophobicContact CD2-CG 4.49Å; Y97-K106 HydrophobicContact CE1-CB 4.11Å; Y97-K106 HydrophobicContact CE1-CG 4.01Å; Y97-K106 HydrophobicContact CE2-CB 4.2Å; Y97-K106 HydrophobicContact CE2-CD 4.45Å; Y97-K106 HydrophobicContact CE2-CG 4.27Å; Y97-K106 HydrophobicContact CG-CG 4.4Å; Y97-Y111 CarbonylContact C-O 3.38Å; Y97-Y111 WeakPolarHBondContact CA-O 3.41Å; Y97-Y111 WeakPolarHBondContact CD2-O 3.19Å; Y97-Y112 AromaticContact CD2-CD2 3.56Å; Y97-Y112 HydrophobicContact CD2-CD2 3.56Å; Y97-Y112 HydrophobicContact CD2-CE2 4.36Å; Y97-Y112 HydrophobicContact CD2-CG 4.38Å; Y97-Y112 AromaticContact CG-CD2 3.97Å; Y97-Y112 HydrophobicContact CG-CD2 3.97Å; Y97-Y112 HydrophobicContact CG-CE2 4.38Å; Y97-F124 HydrophobicContact CD2-CE2 4.4Å; Y97-F124 HydrophobicContact CD2-CZ 4.47Å; Y97-F124 AromaticContact CE2-CD2 3.9Å; Y97-F124 HydrophobicContact CE2-CD2 3.9Å; Y97-F124 AromaticContact CE2-CE2 3.64Å; Y97-F124 HydrophobicContact CE2-CE2 3.64Å; Y97-F124 HydrophobicContact CE2-CZ 4.05Å
98	F	89.9	Confident	87.4	Confident	79 Å²	79	44.4 Å²	44.4	35%	0.346	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	106.1	177.6	-54.9	-99.3	0	0	0	108.3	G87 C88 K96 G110 Y111	G87-F98 WeakPolarHBondContact O-CA 3.49Å; C88-F98 HydrophobicContact CB-CD1 3.83Å; C88-F98 HydrophobicContact CB-CE1 3.96Å; C88-F98 WeakPolarHBondContact SG-CE1 3.47Å; K96-F98 HydrophobicContact CB-CE2 3.72Å; K96-F98 HydrophobicContact CB-CZ 4.3Å; K96-F98 HydrophobicContact CD-CE2 4.48Å; K96-F98 HydrophobicContact CD-CZ 4.41Å; F98-G110 CarbonylContact O-C 3.57Å; F98-G110 WeakPolarHBondContact O-CA 3.4Å; F98-Y111 HydrophobicContact CD2-CD1 4.01Å; F98-Y111 PolarHBondContact N-O 3.33Å; F98-Y111 PolarHBondContact O-N 3.41Å
99	G	87.1	Confident	87.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176	-173.8	-176.8	0	0	0	0	0	113.6	W86 G87 Y109	W86-G99 WeakPolarHBondContact CA-O 3.43Å; G87-G99 PolarHBondContact N-O 2.94Å; G87-G99 PolarHBondContact O-N 3.22Å; G99-Y109 WeakPolarHBondContact CA-O 3.45Å
100	T	85.4	Confident	87.5	Confident	22 Å²	22	47.9 Å²	47.9	14%	0.135	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	134.6	175	31.8	0	0	0	0	112.6	W86 Y97 H107 G108 Y109	W86-T100 HydrophobicContact CE3-CG2 3.7Å; W86-T100 HydrophobicContact CZ3-CG2 4.18Å; Y97-T100 PolarHBondContact OH-O 3.12Å; T100-H107 CarbonylContact C-O 3.45Å; T100-H107 VanDerWaalsContact CB-O 3.29Å; T100-H107 WeakPolarHBondContact CB-O 3.49Å; T100-H107 CarbonylContact O-C 3.55Å; T100-H107 PolarHBondContact O-N 2.93Å; T100-H107 PolarHBondContact OG1-O 3.29Å; T100-G108 WeakPolarHBondContact OG1-CA 3.45Å; T100-Y109 PolarHBondContact N-O 3.37Å; T100-Y109 VanDerWaalsContact N-O 3.11Å; T100-Y109 PolarHBondContact OG1-N 3.4Å; T100-Y109 PolarHBondContact OG1-O 3.48Å
101	F	86.1	Confident	87.7	Confident	6 Å²	6	48.1 Å²	48.1	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	151.5	166	-72	-95.7	0	0	0	110.7	F74 R83 N84 A85 Y97 K105	F74-F101 HydrophobicContact CD2-CE2 4.48Å; F74-F101 HydrophobicContact CE2-CD2 4.01Å; F74-F101 AromaticContact CE2-CE2 3.65Å; F74-F101 HydrophobicContact CE2-CE2 3.65Å; F74-F101 HydrophobicContact CE2-CZ 4.06Å; F74-F101 HydrophobicContact CZ-CD2 4.48Å; R83-F101 VanDerWaalsContact C-CB 3.43Å; R83-F101 HydrophobicContact CB-CB 3.8Å; R83-F101 HydrophobicContact CB-CD1 3.62Å; R83-F101 HydrophobicContact CB-CD2 4.29Å; R83-F101 HydrophobicContact CB-CE1 4.21Å; R83-F101 HydrophobicContact CB-CG 3.65Å; R83-F101 HydrophobicContact CG-CD1 4.48Å; R83-F101 WeakPolarHBondContact O-CB 3.44Å; N84-F101 CarbonylContact C-O 3.52Å; N84-F101 WeakPolarHBondContact CA-O 3.47Å; A85-F101 PolarHBondContact N-O 3.47Å; A85-F101 PolarHBondContact O-N 3.22Å; Y97-F101 HydrophobicContact CD1-CD2 4.4Å; Y97-F101 HydrophobicContact CD1-CE1 4.13Å; Y97-F101 AromaticContact CD1-CE2 3.49Å; Y97-F101 HydrophobicContact CD1-CE2 3.49Å; Y97-F101 VanDerWaalsContact CD1-CE2 3.49Å; Y97-F101 AromaticContact CD1-CZ 3.35Å; Y97-F101 HydrophobicContact CD1-CZ 3.35Å; Y97-F101 HydrophobicContact CE1-CD2 4.01Å; Y97-F101 HydrophobicContact CE1-CE1 4.2Å; Y97-F101 AromaticContact CE1-CE2 3.55Å; Y97-F101 HydrophobicContact CE1-CE2 3.55Å; Y97-F101 AromaticContact CE1-CZ 3.68Å; Y97-F101 HydrophobicContact CE1-CZ 3.68Å; F101-K105 CarbonylContact C-O 3.51Å; F101-K105 VanDerWaalsContact CA-O 3.28Å; F101-K105 WeakPolarHBondContact CA-O 3.37Å
102	F	83.7	Confident	88	Confident	62 Å²	62	46.4 Å²	46.4	27%	0.272	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	112.9	169.9	176.8	-102	0	0	0	109.4	M1 N84 D104 K105 H107 L126	M1-F102 HydrophobicContact CE-CE2 3.77Å; M1-F102 HydrophobicContact CE-CZ 3.64Å; M1-F102 HydrophobicContact CG-CE2 4.31Å; M1-F102 HydrophobicContact SD-CE2 3.97Å; M1-F102 HydrophobicContact SD-CZ 3.65Å; N84-F102 WeakPolarHBondContact OD1-CA 3.14Å; F102-D104 PolarHBondContact O-N 3.4Å; F102-K105 PolarHBondContact N-O 2.96Å; F102-K105 WeakPolarHBondContact O-CB 3.32Å; F102-K105 PolarHBondContact O-N 3.34Å; F102-H107 HydrophobicContact CB-CB 3.7Å; F102-L126 HydrophobicContact CD1-CD2 4.09Å
103	N	82.5	Confident	88.5	Confident	63 Å²	63	42.9 Å²	42.9	34%	0.337	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	55.6	-176	-72.7	-37.5	0	0	0	113.6	K82 R83 N84 K105	K82-N103 HydrophobicContact CD-CB 4.17Å; R83-N103 PolarHBondContact O-N 2.95Å; N84-N103 PolarHBondContact OD1-N 3.39Å; N103-K105 PolarHBondContact O-N 3.36Å
104	D	86.7	Confident	88.9	Confident	48 Å²	48	42.3 Å²	42.3	26%	0.257	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	-4.7	-175.1	-68	-54.7	0	0	0	116.7	K82 R83 F102	K82-D104 WeakPolarHBondContact CA-OD1 3.43Å; K82-D104 VanDerWaalsContact CA-OD2 3.29Å; K82-D104 WeakPolarHBondContact CA-OD2 3.45Å; K82-D104 WeakPolarHBondContact CB-OD2 3.24Å; K82-D104 WeakPolarHBondContact CD-OD2 3.5Å; K82-D104 WeakPolarHBondContact CG-OD2 3.44Å; R83-D104 WeakPolarHBondContact CG-OD1 3.4Å; R83-D104 PolarHBondContact N-OD1 3.04Å; R83-D104 IonicContact NE-OD1 2.84Å; R83-D104 PolarHBondContact NE-OD1 3.18Å; R83-D104 PolarHBondContact NH2-O 3.09Å; R83-D104 PolarHBondContact O-N 3.23Å; F102-D104 PolarHBondContact O-N 3.4Å
105	K	88.8	Confident	89.1	Confident	88 Å²	88	44.8 Å²	44.8	38%	0.383	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	143.7	-179	-56.1	-158.3	157	-146.1	0	112.3	F101 F102 N103 H107 L126 D127	F101-K105 CarbonylContact C-O 3.51Å; F101-K105 VanDerWaalsContact CA-O 3.28Å; F101-K105 WeakPolarHBondContact CA-O 3.37Å; F102-K105 PolarHBondContact N-O 2.96Å; F102-K105 WeakPolarHBondContact O-CB 3.32Å; F102-K105 PolarHBondContact O-N 3.34Å; N103-K105 PolarHBondContact O-N 3.36Å; K105-H107 PolarHBondContact O-N 3.46Å; K105-L126 HydrophobicContact CD-CB 3.99Å; K105-L126 HydrophobicContact CD-CD2 4.12Å; K105-D127 WeakPolarHBondContact CA-OD1 3.21Å; K105-D127 WeakPolarHBondContact CB-OD2 3.48Å; K105-D127 WeakPolarHBondContact CD-OD2 3.49Å; K105-D127 WeakPolarHBondContact CE-OD2 3.49Å; K105-D127 WeakPolarHBondContact CG-OD2 3.43Å; K105-D127 IonicContact NZ-OD2 2.86Å
106	K	91.2	Very high	89	Confident	36 Å²	36	47.5 Å²	47.5	16%	0.157	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	130.5	168.7	-47.1	164.3	-153.8	173.6	0	108.2	Y97 Y112 F124 L126 D127	Y97-K106 HydrophobicContact CD1-CG 4.22Å; Y97-K106 HydrophobicContact CD2-CD 4.41Å; Y97-K106 HydrophobicContact CD2-CG 4.49Å; Y97-K106 HydrophobicContact CE1-CB 4.11Å; Y97-K106 HydrophobicContact CE1-CG 4.01Å; Y97-K106 HydrophobicContact CE2-CB 4.2Å; Y97-K106 HydrophobicContact CE2-CD 4.45Å; Y97-K106 HydrophobicContact CE2-CG 4.27Å; Y97-K106 HydrophobicContact CG-CG 4.4Å; K106-Y112 HydrophobicContact CD-CD2 4.05Å; K106-Y112 HydrophobicContact CD-CE2 3.84Å; K106-Y112 VanDerWaalsContact CE-CE2 3.47Å; K106-Y112 PolarHBondContact NZ-OH 3.17Å; K106-F124 HydrophobicContact CB-CB 4.12Å; K106-F124 HydrophobicContact CB-CD1 3.9Å; K106-F124 HydrophobicContact CB-CG 4.03Å; K106-F124 HydrophobicContact CD-CD1 4.19Å; K106-F124 HydrophobicContact CD-CE1 4.07Å; K106-L126 PolarHBondContact O-N 3.35Å; K106-D127 PolarHBondContact N-OD1 3.44Å; K106-D127 PolarHBondContact O-N 3.08Å
107	H	89.7	Confident	88.7	Confident	31 Å²	31	46.3 Å²	46.3	14%	0.144	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162.8	-175.3	-163	88.2	0	0	0	110.1	T100 F102 K105 F124 Y125	T100-H107 CarbonylContact C-O 3.45Å; T100-H107 VanDerWaalsContact CB-O 3.29Å; T100-H107 WeakPolarHBondContact CB-O 3.49Å; T100-H107 CarbonylContact O-C 3.55Å; T100-H107 PolarHBondContact O-N 2.93Å; T100-H107 PolarHBondContact OG1-O 3.29Å; F102-H107 HydrophobicContact CB-CB 3.7Å; K105-H107 PolarHBondContact O-N 3.46Å; H107-F124 CarbonylContact C-O 3.46Å; H107-F124 WeakPolarHBondContact CA-O 3.28Å; H107-Y125 AromaticContact CE1-CD2 3.52Å; H107-Y125 AromaticContact CE1-CE2 3.78Å
108	G	86.2	Confident	88.8	Confident	19 Å²	19	46.7 Å²	46.7	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	60.7	-147.8	179.5	0	0	0	0	0	112	T100 T123 F124	T100-G108 WeakPolarHBondContact OG1-CA 3.45Å; G108-T123 CarbonylContact O-C 3.45Å; G108-T123 VanDerWaalsContact O-CA 3.27Å; G108-T123 WeakPolarHBondContact O-CA 3.06Å; G108-F124 PolarHBondContact N-O 3.47Å; G108-F124 PolarHBondContact O-N 2.91Å
109	Y	87.3	Confident	89	Confident	111 Å²	111	44.1 Å²	44.1	44%	0.435	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	144.7	179.7	-159.3	-100.7	0	0	0	111.3	W86 G99 T100 L121 T123	W86-Y109 HydrophobicContact CH2-CD1 4.37Å; G99-Y109 WeakPolarHBondContact CA-O 3.45Å; T100-Y109 PolarHBondContact N-O 3.37Å; T100-Y109 VanDerWaalsContact N-O 3.11Å; T100-Y109 PolarHBondContact OG1-N 3.4Å; T100-Y109 PolarHBondContact OG1-O 3.48Å; Y109-L121 HydrophobicContact CE1-CD1 3.73Å; Y109-L121 HydrophobicContact CE1-CG 4.2Å; Y109-L121 WeakPolarHBondContact OH-CG 3.44Å; Y109-T123 HydrophobicContact CD2-CG2 4.06Å
110	G	88.2	Confident	89.3	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167	162.7	174.8	0	0	0	0	0	114.6	F98 G122	F98-G110 CarbonylContact O-C 3.57Å; F98-G110 WeakPolarHBondContact O-CA 3.4Å; G110-G122 PolarHBondContact N-O 3.34Å; G110-G122 PolarHBondContact O-N 2.99Å; G110-G122 VanDerWaalsContact O-O 3.1Å
111	Y	92.7	Very high	89.6	Confident	74 Å²	74	46 Å²	46	29%	0.29	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.3	176.5	-177.5	-123	0	0	0	109.3	Y97 F98 V113 N119 Y120 L121	Y97-Y111 CarbonylContact C-O 3.38Å; Y97-Y111 WeakPolarHBondContact CA-O 3.41Å; Y97-Y111 WeakPolarHBondContact CD2-O 3.19Å; F98-Y111 HydrophobicContact CD2-CD1 4.01Å; F98-Y111 PolarHBondContact N-O 3.33Å; F98-Y111 PolarHBondContact O-N 3.41Å; Y111-V113 HydrophobicContact CD1-CG2 3.91Å; Y111-V113 HydrophobicContact CE1-CG2 3.33Å; Y111-V113 HydrophobicContact CE2-CG2 4.5Å; Y111-N119 HydrophobicContact CE2-CB 3.64Å; Y111-N119 WeakPolarHBondContact OH-CB 3.42Å; Y111-Y120 CarbonylContact C-O 3.53Å; Y111-Y120 VanDerWaalsContact CA-O 3.22Å; Y111-Y120 WeakPolarHBondContact CA-O 3.23Å; Y111-Y120 WeakPolarHBondContact CD2-O 3.36Å; Y111-L121 HydrophobicContact CD2-CB 3.97Å; Y111-L121 HydrophobicContact CD2-CD1 3.88Å; Y111-L121 HydrophobicContact CG-CD1 4.25Å
112	Y	94.5	Very high	89.8	Confident	10 Å²	10	45.7 Å²	45.7	4%	0.039	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.6	178.3	-155.2	-83.8	0	0	0	109.5	W91 E95 K96 Y97 K106 W114 N119 Y120 F124	W91-Y112 AromaticContact CH2-CE2 3.72Å; W91-Y112 HydrophobicContact CH2-CE2 3.72Å; W91-Y112 AromaticContact CZ3-CE2 3.78Å; W91-Y112 HydrophobicContact CZ3-CE2 3.78Å; W91-Y112 AromaticContact CZ3-CZ 3.88Å; E95-Y112 HydrophobicContact CB-CE1 4.42Å; E95-Y112 HydrophobicContact CG-CE1 4.35Å; E95-Y112 VanDerWaalsContact OE2-CE1 3.28Å; E95-Y112 WeakPolarHBondContact OE2-CE1 3.49Å; E95-Y112 VanDerWaalsContact OE2-CZ 3.26Å; E95-Y112 PolarHBondContact OE2-OH 3.15Å; K96-Y112 CarbonylContact O-C 3.53Å; K96-Y112 WeakPolarHBondContact O-CA 3.29Å; Y97-Y112 AromaticContact CD2-CD2 3.56Å; Y97-Y112 HydrophobicContact CD2-CD2 3.56Å; Y97-Y112 HydrophobicContact CD2-CE2 4.36Å; Y97-Y112 HydrophobicContact CD2-CG 4.38Å; Y97-Y112 AromaticContact CG-CD2 3.97Å; Y97-Y112 HydrophobicContact CG-CD2 3.97Å; Y97-Y112 HydrophobicContact CG-CE2 4.38Å; K106-Y112 HydrophobicContact CD-CD2 4.05Å; K106-Y112 HydrophobicContact CD-CE2 3.84Å; K106-Y112 VanDerWaalsContact CE-CE2 3.47Å; K106-Y112 PolarHBondContact NZ-OH 3.17Å; Y112-W114 AromaticContact CD1-CD2 3.75Å; Y112-W114 HydrophobicContact CD1-CD2 3.75Å; Y112-W114 AromaticContact CD1-CE2 3.43Å; Y112-W114 VanDerWaalsContact CD1-CE2 3.43Å; Y112-W114 HydrophobicContact CD1-CE3 4.04Å; Y112-W114 HydrophobicContact CD1-CG 4.36Å; Y112-W114 AromaticContact CD1-CH2 3.75Å; Y112-W114 HydrophobicContact CD1-CH2 3.75Å; Y112-W114 AromaticContact CD1-CZ2 3.45Å; Y112-W114 HydrophobicContact CD1-CZ2 3.45Å; Y112-W114 VanDerWaalsContact CD1-CZ2 3.45Å; Y112-W114 HydrophobicContact CD1-CZ3 4.05Å; Y112-W114 AromaticContact CD1-NE1 3.89Å; Y112-W114 AromaticContact CE1-CD1 3.96Å; Y112-W114 HydrophobicContact CE1-CD2 4.09Å; Y112-W114 AromaticContact CE1-CE2 3.56Å; Y112-W114 HydrophobicContact CE1-CG 4.33Å; Y112-W114 AromaticContact CE1-CZ2 3.85Å; Y112-W114 HydrophobicContact CE1-CZ2 3.85Å; Y112-W114 AromaticContact CE1-NE1 3.49Å; Y112-W114 HydrophobicContact CG-CH2 4.22Å; Y112-W114 HydrophobicContact CG-CZ2 4.19Å; Y112-N119 CarbonylContact O-C 3.35Å; Y112-N119 WeakPolarHBondContact O-CA 3.37Å; Y112-N119 VanDerWaalsContact O-CB 3.26Å; Y112-N119 WeakPolarHBondContact O-CB 3.38Å; Y112-Y120 PolarHBondContact N-O 3.19Å; Y112-Y120 PolarHBondContact O-N 3.02Å; Y112-F124 HydrophobicContact CD2-CZ 4.39Å
113	V	93.6	Very high	90	Very high	32 Å²	32	45 Å²	45	19%	0.194	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.5	178.8	-173.6	0	0	0	0	108.2	E95 K96 Y111 N119	E95-V113 CarbonylContact C-O 3.54Å; E95-V113 WeakPolarHBondContact CA-O 3.19Å; K96-V113 HydrophobicContact CB-CB 4.34Å; K96-V113 PolarHBondContact N-O 3.19Å; K96-V113 PolarHBondContact O-N 3.29Å; Y111-V113 HydrophobicContact CD1-CG2 3.91Å; Y111-V113 HydrophobicContact CE1-CG2 3.33Å; Y111-V113 HydrophobicContact CE2-CG2 4.5Å; V113-N119 HydrophobicContact CG2-CB 4.15Å
114	W	93.6	Very high	90.4	Very high	66 Å²	66	42.5 Å²	42.5	25%	0.25	23%	0.225	C	C	.	.			trans	-96.9	154.6	174.2	-70.4	-85.6	0	0	0	110.7	Y112 N116 G117 S118 M135	Y112-W114 AromaticContact CD1-CD2 3.75Å; Y112-W114 HydrophobicContact CD1-CD2 3.75Å; Y112-W114 AromaticContact CD1-CE2 3.43Å; Y112-W114 VanDerWaalsContact CD1-CE2 3.43Å; Y112-W114 HydrophobicContact CD1-CE3 4.04Å; Y112-W114 HydrophobicContact CD1-CG 4.36Å; Y112-W114 AromaticContact CD1-CH2 3.75Å; Y112-W114 HydrophobicContact CD1-CH2 3.75Å; Y112-W114 AromaticContact CD1-CZ2 3.45Å; Y112-W114 HydrophobicContact CD1-CZ2 3.45Å; Y112-W114 VanDerWaalsContact CD1-CZ2 3.45Å; Y112-W114 HydrophobicContact CD1-CZ3 4.05Å; Y112-W114 AromaticContact CD1-NE1 3.89Å; Y112-W114 AromaticContact CE1-CD1 3.96Å; Y112-W114 HydrophobicContact CE1-CD2 4.09Å; Y112-W114 AromaticContact CE1-CE2 3.56Å; Y112-W114 HydrophobicContact CE1-CG 4.33Å; Y112-W114 AromaticContact CE1-CZ2 3.85Å; Y112-W114 HydrophobicContact CE1-CZ2 3.85Å; Y112-W114 AromaticContact CE1-NE1 3.49Å; Y112-W114 HydrophobicContact CG-CH2 4.22Å; Y112-W114 HydrophobicContact CG-CZ2 4.19Å; W114-N116 WeakPolarHBondContact CB-OD1 3.33Å; W114-N116 PolarHBondContact O-N 3.35Å; W114-N116 VanDerWaalsContact O-N 3.08Å; W114-G117 PolarHBondContact O-N 3.36Å; W114-S118 PolarHBondContact N-O 2.94Å; W114-M135 HydrophobicContact CE3-SD 4.45Å; W114-M135 HydrophobicContact CH2-CE 3.61Å; W114-M135 HydrophobicContact CH2-SD 4.06Å; W114-M135 HydrophobicContact CZ3-CE 3.81Å; W114-M135 HydrophobicContact CZ3-SD 3.59Å; W114-M135 VanDerWaalsContact CZ3-SD 3.59Å
115	P	88.9	Confident	90.5	Very high	79 Å²	79	46.2 Å²	46.2	51%	0.513	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23	-175.9	-21.8	33.8	0	0	0	113.3	N93 E95 G117	N93-P115 WeakPolarHBondContact O-CG 3.23Å; E95-P115 HydrophobicContact CG-CG 3.99Å; P115-G117 PolarHBondContact O-N 3.06Å
116	N	89.7	Confident	90.4	Very high	98 Å²	98	44.9 Å²	44.9	52%	0.524	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	4.3	175.3	70.1	6.1	0	0	0	114	W114 S118 S138	W114-N116 WeakPolarHBondContact CB-OD1 3.33Å; W114-N116 PolarHBondContact O-N 3.35Å; W114-N116 VanDerWaalsContact O-N 3.08Å; N116-S118 VanDerWaalsContact C-N 3.32Å; N116-S118 PolarHBondContact ND2-OG 3.12Å; N116-S118 PolarHBondContact O-N 2.86Å; N116-S118 WeakPolarHBondContact OD1-CB 3.42Å; N116-S118 PolarHBondContact OD1-N 2.97Å; N116-S118 PolarHBondContact OD1-OG 3.12Å; N116-S138 WeakPolarHBondContact O-CB 3.17Å
117	G	85.2	Confident	90.5	Very high	47 Å²	47	45.8 Å²	45.8	49%	0.485	24%	0.239	S	C	.	.	S	Bend	trans	85.3	-6.7	-178.2	0	0	0	0	0	115.1	W114 P115 N119	W114-G117 PolarHBondContact O-N 3.36Å; P115-G117 PolarHBondContact O-N 3.06Å; G117-N119 PolarHBondContact O-ND2 3.13Å
118	S	92.9	Very high	90.6	Very high	8 Å²	8	48.6 Å²	48.6	6%	0.056	25%	0.251	C	S	.	.			trans	-62.5	149.2	170	-46.3	0	0	0	0	109.8	W114 N116 R136 S138	W114-S118 PolarHBondContact N-O 2.94Å; N116-S118 VanDerWaalsContact C-N 3.32Å; N116-S118 PolarHBondContact ND2-OG 3.12Å; N116-S118 PolarHBondContact O-N 2.86Å; N116-S118 WeakPolarHBondContact OD1-CB 3.42Å; N116-S118 PolarHBondContact OD1-N 2.97Å; N116-S118 PolarHBondContact OD1-OG 3.12Å; S118-R136 CarbonylContact C-O 3.58Å; S118-R136 WeakPolarHBondContact CA-O 3.21Å; S118-R136 WeakPolarHBondContact CB-O 3.4Å; S118-S138 PolarHBondContact OG-N 2.86Å
119	N	94.3	Very high	90.9	Very high	25 Å²	25	49.6 Å²	49.6	13%	0.134	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	156	176	58.6	77.4	0	0	0	112.8	Y111 Y112 V113 G117 M135 R136	Y111-N119 HydrophobicContact CE2-CB 3.64Å; Y111-N119 WeakPolarHBondContact OH-CB 3.42Å; Y112-N119 CarbonylContact O-C 3.35Å; Y112-N119 WeakPolarHBondContact O-CA 3.37Å; Y112-N119 VanDerWaalsContact O-CB 3.26Å; Y112-N119 WeakPolarHBondContact O-CB 3.38Å; V113-N119 HydrophobicContact CG2-CB 4.15Å; G117-N119 PolarHBondContact O-ND2 3.13Å; N119-M135 CarbonylContact O-C 3.39Å; N119-M135 WeakPolarHBondContact O-CA 3.5Å; N119-M135 VanDerWaalsContact O-SD 3.4Å; N119-R136 PolarHBondContact N-O 2.94Å; N119-R136 PolarHBondContact O-N 2.89Å; N119-R136 VanDerWaalsContact O-O 3.14Å; N119-R136 WeakPolarHBondContact OD1-CD 3.28Å
120	Y	94.3	Very high	91	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.6	178.7	171.5	-94.3	0	0	0	110.1	Y111 Y112 T123 F124 R129 I134 M135 F147	Y111-Y120 CarbonylContact C-O 3.53Å; Y111-Y120 VanDerWaalsContact CA-O 3.22Å; Y111-Y120 WeakPolarHBondContact CA-O 3.23Å; Y111-Y120 WeakPolarHBondContact CD2-O 3.36Å; Y112-Y120 PolarHBondContact N-O 3.19Å; Y112-Y120 PolarHBondContact O-N 3.02Å; Y120-T123 PolarHBondContact OH-N 3.41Å; Y120-T123 PolarHBondContact OH-O 3.29Å; Y120-T123 VanDerWaalsContact OH-O 3.09Å; Y120-F124 HydrophobicContact CD1-CE1 4.41Å; Y120-F124 AromaticContact CD1-CE2 3.5Å; Y120-F124 HydrophobicContact CD1-CE2 3.5Å; Y120-F124 AromaticContact CD1-CZ 3.41Å; Y120-F124 HydrophobicContact CD1-CZ 3.41Å; Y120-F124 VanDerWaalsContact CD1-CZ 3.41Å; Y120-F124 HydrophobicContact CE1-CD2 4.11Å; Y120-F124 HydrophobicContact CE1-CE1 4.43Å; Y120-F124 AromaticContact CE1-CE2 3.45Å; Y120-F124 HydrophobicContact CE1-CE2 3.45Å; Y120-F124 VanDerWaalsContact CE1-CE2 3.45Å; Y120-F124 AromaticContact CE1-CZ 3.65Å; Y120-F124 HydrophobicContact CE1-CZ 3.65Å; Y120-R129 HydrophobicContact CD1-CG 3.9Å; Y120-R129 HydrophobicContact CD2-CG 4.3Å; Y120-R129 HydrophobicContact CE1-CB 4.25Å; Y120-R129 HydrophobicContact CE1-CG 3.61Å; Y120-R129 HydrophobicContact CE2-CB 4.31Å; Y120-R129 HydrophobicContact CE2-CG 4.05Å; Y120-R129 HydrophobicContact CG-CG 4.21Å; Y120-I134 CarbonylContact C-O 3.59Å; Y120-I134 VanDerWaalsContact CA-O 3.3Å; Y120-I134 WeakPolarHBondContact CA-O 3.4Å; Y120-M135 HydrophobicContact CD2-CB 4.19Å; Y120-M135 HydrophobicContact CD2-CE 4.02Å; Y120-M135 HydrophobicContact CG-CE 4.29Å; Y120-F147 HydrophobicContact CD2-CE2 4.27Å; Y120-F147 HydrophobicContact CD2-CZ 4.32Å; Y120-F147 AromaticContact CE2-CD2 3.75Å; Y120-F147 HydrophobicContact CE2-CD2 3.75Å; Y120-F147 AromaticContact CE2-CE2 3.52Å; Y120-F147 HydrophobicContact CE2-CE2 3.52Å; Y120-F147 HydrophobicContact CE2-CG 4.36Å; Y120-F147 AromaticContact CE2-CZ 3.95Å; Y120-F147 HydrophobicContact CE2-CZ 3.95Å
121	L	92.4	Very high	91	Very high	62 Å²	62	46.6 Å²	46.6	33%	0.325	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	110.8	174.8	-176.3	70.1	0	0	0	109.1	Y109 Y111 G133 I134	Y109-L121 HydrophobicContact CE1-CD1 3.73Å; Y109-L121 HydrophobicContact CE1-CG 4.2Å; Y109-L121 WeakPolarHBondContact OH-CG 3.44Å; Y111-L121 HydrophobicContact CD2-CB 3.97Å; Y111-L121 HydrophobicContact CD2-CD1 3.88Å; Y111-L121 HydrophobicContact CG-CD1 4.25Å; L121-G133 CarbonylContact O-C 3.59Å; L121-G133 VanDerWaalsContact O-CA 3.25Å; L121-G133 WeakPolarHBondContact O-CA 3.39Å; L121-I134 PolarHBondContact N-O 3.5Å; L121-I134 PolarHBondContact O-N 3.38Å
122	G	89.6	Confident	90.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	-164.5	-177.7	0	0	0	0	0	113.7	G110 Y132	G110-G122 PolarHBondContact N-O 3.34Å; G110-G122 PolarHBondContact O-N 2.99Å; G110-G122 VanDerWaalsContact O-O 3.1Å; G122-Y132 WeakPolarHBondContact CA-O 3.47Å
123	T	88.2	Confident	90.4	Very high	47 Å²	47	46 Å²	46	29%	0.288	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	146.6	-179.8	37.7	0	0	0	0	114.1	G108 Y109 Y120 S130 Y132	G108-T123 CarbonylContact O-C 3.45Å; G108-T123 VanDerWaalsContact O-CA 3.27Å; G108-T123 WeakPolarHBondContact O-CA 3.06Å; Y109-T123 HydrophobicContact CD2-CG2 4.06Å; Y120-T123 PolarHBondContact OH-N 3.41Å; Y120-T123 PolarHBondContact OH-O 3.29Å; Y120-T123 VanDerWaalsContact OH-O 3.09Å; T123-S130 CarbonylContact C-O 3.55Å; T123-S130 VanDerWaalsContact C-O 3.28Å; T123-S130 VanDerWaalsContact CB-O 3.22Å; T123-S130 WeakPolarHBondContact CB-O 3.49Å; T123-S130 PolarHBondContact O-N 3.09Å; T123-S130 PolarHBondContact OG1-O 3.05Å; T123-Y132 PolarHBondContact N-O 3.48Å; T123-Y132 PolarHBondContact OG1-O 3.37Å
124	F	90.1	Very high	90.4	Very high	10 Å²	10	46.3 Å²	46.3	4%	0.044	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.6	176.7	-73.1	-93.6	0	0	0	110	Y97 K106 H107 G108 Y112 Y120 K128 R129	Y97-F124 HydrophobicContact CD2-CE2 4.4Å; Y97-F124 HydrophobicContact CD2-CZ 4.47Å; Y97-F124 AromaticContact CE2-CD2 3.9Å; Y97-F124 HydrophobicContact CE2-CD2 3.9Å; Y97-F124 AromaticContact CE2-CE2 3.64Å; Y97-F124 HydrophobicContact CE2-CE2 3.64Å; Y97-F124 HydrophobicContact CE2-CZ 4.05Å; K106-F124 HydrophobicContact CB-CB 4.12Å; K106-F124 HydrophobicContact CB-CD1 3.9Å; K106-F124 HydrophobicContact CB-CG 4.03Å; K106-F124 HydrophobicContact CD-CD1 4.19Å; K106-F124 HydrophobicContact CD-CE1 4.07Å; H107-F124 CarbonylContact C-O 3.46Å; H107-F124 WeakPolarHBondContact CA-O 3.28Å; G108-F124 PolarHBondContact N-O 3.47Å; G108-F124 PolarHBondContact O-N 2.91Å; Y112-F124 HydrophobicContact CD2-CZ 4.39Å; Y120-F124 HydrophobicContact CD1-CE1 4.41Å; Y120-F124 AromaticContact CD1-CE2 3.5Å; Y120-F124 HydrophobicContact CD1-CE2 3.5Å; Y120-F124 AromaticContact CD1-CZ 3.41Å; Y120-F124 HydrophobicContact CD1-CZ 3.41Å; Y120-F124 VanDerWaalsContact CD1-CZ 3.41Å; Y120-F124 HydrophobicContact CE1-CD2 4.11Å; Y120-F124 HydrophobicContact CE1-CE1 4.43Å; Y120-F124 AromaticContact CE1-CE2 3.45Å; Y120-F124 HydrophobicContact CE1-CE2 3.45Å; Y120-F124 VanDerWaalsContact CE1-CE2 3.45Å; Y120-F124 AromaticContact CE1-CZ 3.65Å; Y120-F124 HydrophobicContact CE1-CZ 3.65Å; F124-K128 CarbonylContact C-O 3.49Å; F124-K128 VanDerWaalsContact CA-O 3.25Å; F124-K128 WeakPolarHBondContact CA-O 3.44Å; F124-R129 HydrophobicContact CD1-CG 4.18Å; F124-R129 HydrophobicContact CE1-CG 3.64Å; F124-R129 HydrophobicContact CZ-CG 4.01Å
125	Y	88.3	Confident	90.4	Very high	127 Å²	127	43.6 Å²	43.6	50%	0.498	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	103.2	172.1	-175.5	-94.7	0	0	0	109.5	H107 K128	H107-Y125 AromaticContact CE1-CD2 3.52Å; H107-Y125 AromaticContact CE1-CE2 3.78Å; Y125-K128 PolarHBondContact N-O 2.95Å; Y125-K128 PolarHBondContact O-N 3.43Å
126	L	88.2	Confident	90.6	Very high	60 Å²	60	45.8 Å²	45.8	31%	0.314	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	57.8	176.1	-55.8	176.9	0	0	0	112.3	F102 K105 K106 K128	F102-L126 HydrophobicContact CD1-CD2 4.09Å; K105-L126 HydrophobicContact CD-CB 3.99Å; K105-L126 HydrophobicContact CD-CD2 4.12Å; K106-L126 PolarHBondContact O-N 3.35Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 2.95Å
127	D	92.4	Very high	90.6	Very high	54 Å²	54	44.2 Å²	44.2	29%	0.289	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	-18.5	-175.6	-58	-56.6	0	0	0	116.9	K105 K106	K105-D127 WeakPolarHBondContact CA-OD1 3.21Å; K105-D127 WeakPolarHBondContact CB-OD2 3.48Å; K105-D127 WeakPolarHBondContact CD-OD2 3.49Å; K105-D127 WeakPolarHBondContact CE-OD2 3.49Å; K105-D127 WeakPolarHBondContact CG-OD2 3.43Å; K105-D127 IonicContact NZ-OD2 2.86Å; K106-D127 PolarHBondContact N-OD1 3.44Å; K106-D127 PolarHBondContact O-N 3.08Å
128	K	91.8	Very high	90.7	Very high	90 Å²	90	44.9 Å²	44.9	39%	0.391	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	144	-177.7	-55.4	-172.2	-174.2	-177.5	0	113.2	F124 Y125 L126 D149 D150	F124-K128 CarbonylContact C-O 3.49Å; F124-K128 VanDerWaalsContact CA-O 3.25Å; F124-K128 WeakPolarHBondContact CA-O 3.44Å; Y125-K128 PolarHBondContact N-O 2.95Å; Y125-K128 PolarHBondContact O-N 3.43Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 2.95Å; K128-D149 HydrophobicContact CD-CB 4.12Å; K128-D149 WeakPolarHBondContact CD-OD1 3.18Å; K128-D149 WeakPolarHBondContact CE-OD1 3.47Å; K128-D149 IonicContact NZ-OD1 2.7Å; K128-D149 PolarHBondContact NZ-OD1 3.34Å; K128-D150 WeakPolarHBondContact CA-OD2 3.18Å; K128-D150 VanDerWaalsContact CB-OD2 3.23Å; K128-D150 WeakPolarHBondContact CB-OD2 3.27Å; K128-D150 WeakPolarHBondContact CG-OD2 3.1Å
129	R	92.8	Very high	90.3	Very high	40 Å²	40	48.5 Å²	48.5	15%	0.151	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	133.7	169.2	-64.5	166.5	-73.7	139.3	2.9	110.3	Y120 F124 M135 F147 D150	Y120-R129 HydrophobicContact CD1-CG 3.9Å; Y120-R129 HydrophobicContact CD2-CG 4.3Å; Y120-R129 HydrophobicContact CE1-CB 4.25Å; Y120-R129 HydrophobicContact CE1-CG 3.61Å; Y120-R129 HydrophobicContact CE2-CB 4.31Å; Y120-R129 HydrophobicContact CE2-CG 4.05Å; Y120-R129 HydrophobicContact CG-CG 4.21Å; F124-R129 HydrophobicContact CD1-CG 4.18Å; F124-R129 HydrophobicContact CE1-CG 3.64Å; F124-R129 HydrophobicContact CZ-CG 4.01Å; R129-M135 VanDerWaalsContact NH1-CE 3.26Å; R129-F147 HydrophobicContact CB-CB 4.19Å; R129-F147 HydrophobicContact CB-CD1 4.32Å; R129-F147 HydrophobicContact CB-CG 4.28Å; R129-D150 WeakPolarHBondContact CB-OD1 3Å; R129-D150 WeakPolarHBondContact CG-OD1 3.42Å; R129-D150 VanDerWaalsContact CZ-O 3.25Å; R129-D150 IonicContact CZ-OD1 3.38Å; R129-D150 PolarHBondContact N-OD1 2.89Å; R129-D150 IonicContact NE-OD1 3.7Å; R129-D150 PolarHBondContact NE-OD1 3.21Å; R129-D150 PolarHBondContact NH1-O 3.31Å; R129-D150 PolarHBondContact NH2-O 3Å; R129-D150 IonicContact NH2-OD1 3.55Å; R129-D150 PolarHBondContact NH2-OD1 3.29Å; R129-D150 VanDerWaalsContact NH2-OD1 3.12Å; R129-D150 PolarHBondContact O-N 3.35Å
130	S	89	Confident	89.7	Confident	35 Å²	35	54.1 Å²	54.1	25%	0.245	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	153.9	-175.6	-175.3	0	0	0	0	109.9	T123 F147	T123-S130 CarbonylContact C-O 3.55Å; T123-S130 VanDerWaalsContact C-O 3.28Å; T123-S130 VanDerWaalsContact CB-O 3.22Å; T123-S130 WeakPolarHBondContact CB-O 3.49Å; T123-S130 PolarHBondContact O-N 3.09Å; T123-S130 PolarHBondContact OG1-O 3.05Å; S130-F147 CarbonylContact C-O 3.51Å; S130-F147 WeakPolarHBondContact CA-O 3.48Å
131	G	87.5	Confident	89.4	Confident	14 Å²	14	54.1 Å²	54.1	14%	0.144	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	71.1	-154.7	-177.8	0	0	0	0	0	112.6	F146 F147	G131-F146 CarbonylContact O-C 3.5Å; G131-F146 VanDerWaalsContact O-CA 3.3Å; G131-F146 WeakPolarHBondContact O-CA 3.42Å; G131-F147 PolarHBondContact N-O 3.1Å; G131-F147 PolarHBondContact O-N 3.1Å
132	Y	87.6	Confident	89.3	Confident	71 Å²	71	52.2 Å²	52.2	28%	0.278	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	140.4	-177.7	-167.7	-96.3	0	0	0	111.8	G122 T123 E144 F146 I197	G122-Y132 WeakPolarHBondContact CA-O 3.47Å; T123-Y132 PolarHBondContact N-O 3.48Å; T123-Y132 PolarHBondContact OG1-O 3.37Å; Y132-E144 HydrophobicContact CE1-CG 4.28Å; Y132-E144 WeakPolarHBondContact OH-CG 3.4Å; Y132-E144 PolarHBondContact OH-OE1 3.07Å; Y132-F146 HydrophobicContact CD2-CD2 4.14Å; Y132-F146 AromaticContact CD2-CE2 3.96Å; Y132-F146 HydrophobicContact CD2-CE2 3.96Å; Y132-F146 HydrophobicContact CD2-CZ 4.26Å; Y132-I197 HydrophobicContact CE2-CD1 3.87Å; Y132-I197 HydrophobicContact CE2-CG2 4.13Å
133	G	88.8	Confident	89.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	165.1	172.6	0	0	0	0	0	114.5	L121 G145	L121-G133 CarbonylContact O-C 3.59Å; L121-G133 VanDerWaalsContact O-CA 3.25Å; L121-G133 WeakPolarHBondContact O-CA 3.39Å; G133-G145 PolarHBondContact N-O 3.09Å; G133-G145 PolarHBondContact O-N 3.15Å; G133-G145 VanDerWaalsContact O-O 3.05Å
134	I	92.2	Very high	89.4	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.195	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121	177.4	-58.4	168.5	0	0	0	107.7	Y120 L121 R136 I142 Y143 E144	Y120-I134 CarbonylContact C-O 3.59Å; Y120-I134 VanDerWaalsContact CA-O 3.3Å; Y120-I134 WeakPolarHBondContact CA-O 3.4Å; L121-I134 PolarHBondContact N-O 3.5Å; L121-I134 PolarHBondContact O-N 3.38Å; I134-R136 HydrophobicContact CG2-CG 4.44Å; I134-I142 HydrophobicContact CG2-CG2 3.84Å; I134-Y143 CarbonylContact C-O 3.52Å; I134-Y143 VanDerWaalsContact CA-O 3.23Å; I134-Y143 WeakPolarHBondContact CA-O 3.38Å; I134-E144 HydrophobicContact CG1-CB 4.17Å; I134-E144 HydrophobicContact CG1-CG 3.92Å
135	M	94	Very high	89.4	Confident	9 Å²	9	51.7 Å²	51.7	4%	0.044	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	119.4	172.4	175	69.5	77	0	0	108.9	W114 N119 Y120 R129 Y137 I142 Y143 F147	W114-M135 HydrophobicContact CE3-SD 4.45Å; W114-M135 HydrophobicContact CH2-CE 3.61Å; W114-M135 HydrophobicContact CH2-SD 4.06Å; W114-M135 HydrophobicContact CZ3-CE 3.81Å; W114-M135 HydrophobicContact CZ3-SD 3.59Å; W114-M135 VanDerWaalsContact CZ3-SD 3.59Å; N119-M135 CarbonylContact O-C 3.39Å; N119-M135 WeakPolarHBondContact O-CA 3.5Å; N119-M135 VanDerWaalsContact O-SD 3.4Å; Y120-M135 HydrophobicContact CD2-CB 4.19Å; Y120-M135 HydrophobicContact CD2-CE 4.02Å; Y120-M135 HydrophobicContact CG-CE 4.29Å; R129-M135 VanDerWaalsContact NH1-CE 3.26Å; M135-Y137 HydrophobicContact CB-CE2 4.22Å; M135-Y137 HydrophobicContact CG-CD1 4.25Å; M135-Y137 HydrophobicContact CG-CD2 3.99Å; M135-Y137 HydrophobicContact CG-CE1 3.82Å; M135-Y137 HydrophobicContact CG-CE2 3.51Å; M135-Y137 HydrophobicContact CG-CG 4.34Å; M135-Y137 VanDerWaalsContact CG-CZ 3.44Å; M135-I142 CarbonylContact O-C 3.34Å; M135-I142 VanDerWaalsContact O-CA 3.29Å; M135-I142 WeakPolarHBondContact O-CA 3.45Å; M135-Y143 PolarHBondContact N-O 3.48Å; M135-Y143 PolarHBondContact O-N 3.02Å; M135-F147 HydrophobicContact CB-CZ 4.1Å
136	R	92.5	Very high	89.4	Confident	126 Å²	126	46.3 Å²	46.3	48%	0.475	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.2	167.9	-58	-178.9	176.5	-100.9	-0.3	108.3	S118 N119 I134 S141 I142	S118-R136 CarbonylContact C-O 3.58Å; S118-R136 WeakPolarHBondContact CA-O 3.21Å; S118-R136 WeakPolarHBondContact CB-O 3.4Å; N119-R136 PolarHBondContact N-O 2.94Å; N119-R136 PolarHBondContact O-N 2.89Å; N119-R136 VanDerWaalsContact O-O 3.14Å; N119-R136 WeakPolarHBondContact OD1-CD 3.28Å; I134-R136 HydrophobicContact CG2-CG 4.44Å; R136-S141 CarbonylContact C-O 3.47Å; R136-S141 WeakPolarHBondContact CA-O 3.49Å; R136-I142 HydrophobicContact CG-CG1 4.29Å; R136-I142 HydrophobicContact CG-CG2 4.29Å
137	Y	90.1	Very high	89.4	Confident	65 Å²	65	43.6 Å²	43.6	26%	0.255	21%	0.21	S	C	.	.			trans	-95	154.7	178.4	-62.1	-90.5	0	0	0	110.2	M135 N139 H140 S141 F158	M135-Y137 HydrophobicContact CB-CE2 4.22Å; M135-Y137 HydrophobicContact CG-CD1 4.25Å; M135-Y137 HydrophobicContact CG-CD2 3.99Å; M135-Y137 HydrophobicContact CG-CE1 3.82Å; M135-Y137 HydrophobicContact CG-CE2 3.51Å; M135-Y137 HydrophobicContact CG-CG 4.34Å; M135-Y137 VanDerWaalsContact CG-CZ 3.44Å; Y137-N139 WeakPolarHBondContact CB-OD1 3.26Å; Y137-N139 PolarHBondContact O-N 2.97Å; Y137-N139 VanDerWaalsContact O-N 3.17Å; Y137-H140 WeakPolarHBondContact O-CA 3.36Å; Y137-H140 PolarHBondContact O-N 3.1Å; Y137-S141 PolarHBondContact N-O 3.2Å; Y137-F158 HydrophobicContact CD2-CE2 4.23Å; Y137-F158 HydrophobicContact CE2-CD2 4.41Å; Y137-F158 AromaticContact CE2-CE2 3.61Å; Y137-F158 HydrophobicContact CE2-CE2 3.61Å; Y137-F158 HydrophobicContact CE2-CZ 4.4Å
138	S	88.5	Confident	89.2	Confident	61 Å²	61	44.7 Å²	44.7	43%	0.427	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-26.5	177.6	52.9	0	0	0	0	114.6	N116 S118 H140	N116-S138 WeakPolarHBondContact O-CB 3.17Å; S118-S138 PolarHBondContact OG-N 2.86Å; S138-H140 PolarHBondContact O-N 3.23Å
139	N	84	Confident	89.1	Confident	83 Å²	83	44.6 Å²	44.6	44%	0.444	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	24	171.7	75.5	-22	0	0	0	113.3	Y137 S141	Y137-N139 WeakPolarHBondContact CB-OD1 3.26Å; Y137-N139 PolarHBondContact O-N 2.97Å; Y137-N139 VanDerWaalsContact O-N 3.17Å; N139-S141 VanDerWaalsContact CG-OG 3.3Å; N139-S141 PolarHBondContact ND2-OG 3.29Å; N139-S141 PolarHBondContact O-N 3.09Å; N139-S141 WeakPolarHBondContact OD1-CB 3.4Å; N139-S141 PolarHBondContact OD1-N 3.04Å; N139-S141 PolarHBondContact OD1-OG 2.9Å
140	H	81.5	Confident	89	Confident	143 Å²	143	45.1 Å²	45.1	66%	0.662	23%	0.225	S	C	*	.	S	Bend	trans	59.6	2.9	-175.6	-56	83.6	0	0	0	116.4	Y137 S138 N161	Y137-H140 WeakPolarHBondContact O-CA 3.36Å; Y137-H140 PolarHBondContact O-N 3.1Å; S138-H140 PolarHBondContact O-N 3.23Å; H140-N161 HydrophobicContact CB-CB 4.01Å; H140-N161 WeakPolarHBondContact O-CB 3.31Å; H140-N161 PolarHBondContact O-ND2 3.32Å
141	S	87.6	Confident	89.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.			trans	-68.3	151.5	175.1	-58.2	0	0	0	0	111.3	R136 Y137 N139 I159 N160	R136-S141 CarbonylContact C-O 3.47Å; R136-S141 WeakPolarHBondContact CA-O 3.49Å; Y137-S141 PolarHBondContact N-O 3.2Å; N139-S141 VanDerWaalsContact CG-OG 3.3Å; N139-S141 PolarHBondContact ND2-OG 3.29Å; N139-S141 PolarHBondContact O-N 3.09Å; N139-S141 WeakPolarHBondContact OD1-CB 3.4Å; N139-S141 PolarHBondContact OD1-N 3.04Å; N139-S141 PolarHBondContact OD1-OG 2.9Å; S141-I159 CarbonylContact C-O 3.59Å; S141-I159 WeakPolarHBondContact CA-O 3.35Å; S141-I159 VanDerWaalsContact CB-O 3.27Å; S141-I159 WeakPolarHBondContact CB-O 3.4Å; S141-N160 WeakPolarHBondContact OG-CA 3.41Å; S141-N160 PolarHBondContact OG-OD1 3.49Å
142	I	89.8	Confident	89.3	Confident	23 Å²	23	48.5 Å²	48.5	12%	0.118	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.2	-177.1	-50.2	175.8	0	0	0	109.3	I134 M135 R136 F158 I159	I134-I142 HydrophobicContact CG2-CG2 3.84Å; M135-I142 CarbonylContact O-C 3.34Å; M135-I142 VanDerWaalsContact O-CA 3.29Å; M135-I142 WeakPolarHBondContact O-CA 3.45Å; R136-I142 HydrophobicContact CG-CG1 4.29Å; R136-I142 HydrophobicContact CG-CG2 4.29Å; I142-F158 CarbonylContact O-C 3.54Å; I142-F158 WeakPolarHBondContact O-CA 3.27Å; I142-I159 HydrophobicContact CB-CB 4.35Å; I142-I159 PolarHBondContact N-O 3.27Å; I142-I159 PolarHBondContact O-N 3.15Å
143	Y	90.5	Very high	89.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	130.3	162.3	177.6	-95.4	0	0	0	110.1	I134 M135 F146 F147 R152 Y153 I157 F158 W173	I134-Y143 CarbonylContact C-O 3.52Å; I134-Y143 VanDerWaalsContact CA-O 3.23Å; I134-Y143 WeakPolarHBondContact CA-O 3.38Å; M135-Y143 PolarHBondContact N-O 3.48Å; M135-Y143 PolarHBondContact O-N 3.02Å; Y143-F146 PolarHBondContact OH-O 2.85Å; Y143-F147 HydrophobicContact CD1-CE1 4.28Å; Y143-F147 AromaticContact CD1-CE2 3.44Å; Y143-F147 HydrophobicContact CD1-CE2 3.44Å; Y143-F147 VanDerWaalsContact CD1-CE2 3.44Å; Y143-F147 AromaticContact CD1-CZ 3.31Å; Y143-F147 HydrophobicContact CD1-CZ 3.31Å; Y143-F147 HydrophobicContact CE1-CD2 4.08Å; Y143-F147 HydrophobicContact CE1-CE1 4.29Å; Y143-F147 AromaticContact CE1-CE2 3.39Å; Y143-F147 HydrophobicContact CE1-CE2 3.39Å; Y143-F147 AromaticContact CE1-CZ 3.54Å; Y143-F147 HydrophobicContact CE1-CZ 3.54Å; Y143-F147 HydrophobicContact CG-CZ 4.38Å; Y143-R152 HydrophobicContact CD1-CG 3.94Å; Y143-R152 VanDerWaalsContact CD2-CD 3.41Å; Y143-R152 HydrophobicContact CD2-CG 4.04Å; Y143-R152 HydrophobicContact CE1-CB 4.23Å; Y143-R152 HydrophobicContact CE1-CG 3.66Å; Y143-R152 HydrophobicContact CE2-CB 4.04Å; Y143-R152 HydrophobicContact CE2-CG 3.77Å; Y143-R152 HydrophobicContact CG-CG 4.09Å; Y143-Y153 PolarHBondContact OH-O 3.25Å; Y143-I157 CarbonylContact C-O 3.52Å; Y143-I157 VanDerWaalsContact CA-O 3.25Å; Y143-I157 WeakPolarHBondContact CA-O 3.41Å; Y143-I157 WeakPolarHBondContact CD2-O 3.37Å; Y143-F158 HydrophobicContact CD2-CB 4.18Å; Y143-F158 HydrophobicContact CD2-CD2 4.22Å; Y143-W173 HydrophobicContact CD2-CZ2 4.42Å; Y143-W173 AromaticContact CE2-CD1 3.8Å; Y143-W173 AromaticContact CE2-CD2 3.85Å; Y143-W173 HydrophobicContact CE2-CD2 3.85Å; Y143-W173 AromaticContact CE2-CE2 3.68Å; Y143-W173 AromaticContact CE2-CG 3.97Å; Y143-W173 HydrophobicContact CE2-CG 3.97Å; Y143-W173 HydrophobicContact CE2-CZ2 4.26Å; Y143-W173 AromaticContact CE2-NE1 3.64Å
144	E	91.3	Very high	89.1	Confident	46 Å²	46	47.4 Å²	47.4	22%	0.215	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.6	169.9	174.1	169.9	-153.6	0	0	109	Y132 I134 G156 I157 I197	Y132-E144 HydrophobicContact CE1-CG 4.28Å; Y132-E144 WeakPolarHBondContact OH-CG 3.4Å; Y132-E144 PolarHBondContact OH-OE1 3.07Å; I134-E144 HydrophobicContact CG1-CB 4.17Å; I134-E144 HydrophobicContact CG1-CG 3.92Å; E144-G156 CarbonylContact O-C 3.47Å; E144-G156 VanDerWaalsContact O-CA 3.23Å; E144-G156 WeakPolarHBondContact O-CA 3.49Å; E144-I157 PolarHBondContact N-O 2.9Å; E144-I157 PolarHBondContact O-N 3.3Å; E144-I197 HydrophobicContact CG-CD1 4.04Å
145	G	88.2	Confident	88.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.7	-163.8	-176.6	0	0	0	0	0	113.3	G133 P155	G133-G145 PolarHBondContact N-O 3.09Å; G133-G145 PolarHBondContact O-N 3.15Å; G133-G145 VanDerWaalsContact O-O 3.05Å; G145-P155 WeakPolarHBondContact CA-O 3.32Å
146	F	88.3	Confident	88.1	Confident	13 Å²	13	45.4 Å²	45.4	6%	0.057	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	153.9	177.5	-67.4	-103.9	0	0	0	112.3	G131 Y132 Y143 Y153 P155 Y203 Y206	G131-F146 CarbonylContact O-C 3.5Å; G131-F146 VanDerWaalsContact O-CA 3.3Å; G131-F146 WeakPolarHBondContact O-CA 3.42Å; Y132-F146 HydrophobicContact CD2-CD2 4.14Å; Y132-F146 AromaticContact CD2-CE2 3.96Å; Y132-F146 HydrophobicContact CD2-CE2 3.96Å; Y132-F146 HydrophobicContact CD2-CZ 4.26Å; Y143-F146 PolarHBondContact OH-O 2.85Å; F146-Y153 CarbonylContact C-O 3.3Å; F146-Y153 VanDerWaalsContact C-O 3.31Å; F146-Y153 WeakPolarHBondContact CA-O 3.39Å; F146-Y153 WeakPolarHBondContact CB-O 3.29Å; F146-Y153 PolarHBondContact O-N 3.14Å; F146-P155 HydrophobicContact CD2-CG 3.9Å; F146-P155 HydrophobicContact CE2-CG 3.9Å; F146-P155 PolarHBondContact N-O 3.35Å; F146-Y203 HydrophobicContact CE2-CD2 4.42Å; F146-Y203 HydrophobicContact CZ-CD2 4.38Å; F146-Y206 HydrophobicContact CE1-CD1 4.03Å; F146-Y206 HydrophobicContact CE1-CD2 4.27Å; F146-Y206 AromaticContact CE1-CG 3.87Å; F146-Y206 HydrophobicContact CE1-CG 3.87Å; F146-Y206 HydrophobicContact CZ-CD2 4.48Å; F146-Y206 HydrophobicContact CZ-CG 4.23Å
147	F	89.5	Confident	87.7	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.5	173.1	-71.7	-93	0	0	0	109.3	Y120 R129 S130 G131 M135 Y143 Q151 R152	Y120-F147 HydrophobicContact CD2-CE2 4.27Å; Y120-F147 HydrophobicContact CD2-CZ 4.32Å; Y120-F147 AromaticContact CE2-CD2 3.75Å; Y120-F147 HydrophobicContact CE2-CD2 3.75Å; Y120-F147 AromaticContact CE2-CE2 3.52Å; Y120-F147 HydrophobicContact CE2-CE2 3.52Å; Y120-F147 HydrophobicContact CE2-CG 4.36Å; Y120-F147 AromaticContact CE2-CZ 3.95Å; Y120-F147 HydrophobicContact CE2-CZ 3.95Å; R129-F147 HydrophobicContact CB-CB 4.19Å; R129-F147 HydrophobicContact CB-CD1 4.32Å; R129-F147 HydrophobicContact CB-CG 4.28Å; S130-F147 CarbonylContact C-O 3.51Å; S130-F147 WeakPolarHBondContact CA-O 3.48Å; G131-F147 PolarHBondContact N-O 3.1Å; G131-F147 PolarHBondContact O-N 3.1Å; M135-F147 HydrophobicContact CB-CZ 4.1Å; Y143-F147 HydrophobicContact CD1-CE1 4.28Å; Y143-F147 AromaticContact CD1-CE2 3.44Å; Y143-F147 HydrophobicContact CD1-CE2 3.44Å; Y143-F147 VanDerWaalsContact CD1-CE2 3.44Å; Y143-F147 AromaticContact CD1-CZ 3.31Å; Y143-F147 HydrophobicContact CD1-CZ 3.31Å; Y143-F147 HydrophobicContact CE1-CD2 4.08Å; Y143-F147 HydrophobicContact CE1-CE1 4.29Å; Y143-F147 AromaticContact CE1-CE2 3.39Å; Y143-F147 HydrophobicContact CE1-CE2 3.39Å; Y143-F147 AromaticContact CE1-CZ 3.54Å; Y143-F147 HydrophobicContact CE1-CZ 3.54Å; Y143-F147 HydrophobicContact CG-CZ 4.38Å; F147-Q151 CarbonylContact C-O 3.56Å; F147-Q151 VanDerWaalsContact CA-O 3.26Å; F147-Q151 WeakPolarHBondContact CA-O 3.4Å; F147-R152 HydrophobicContact CD1-CG 4.32Å; F147-R152 HydrophobicContact CE1-CG 3.73Å; F147-R152 HydrophobicContact CZ-CG 4.15Å
148	L	88.3	Confident	87.6	Confident	77 Å²	77	38.2 Å²	38.2	40%	0.403	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	124.7	171.4	-178.6	65.2	0	0	0	107.9	D150 Q151 Y153	L148-D150 VanDerWaalsContact C-N 3.31Å; L148-D150 PolarHBondContact O-N 2.99Å; L148-Q151 PolarHBondContact N-O 3.01Å; L148-Q151 PolarHBondContact O-N 2.93Å; L148-Y153 HydrophobicContact CB-CD1 4.4Å; L148-Y153 HydrophobicContact CB-CD2 4.44Å; L148-Y153 HydrophobicContact CB-CG 3.98Å; L148-Y153 HydrophobicContact CD2-CD1 4.46Å; L148-Y153 HydrophobicContact CD2-CD2 4.17Å; L148-Y153 HydrophobicContact CD2-CE2 4.28Å; L148-Y153 HydrophobicContact CD2-CG 4.28Å
149	D	88.8	Confident	87.4	Confident	88 Å²	88	36.1 Å²	36.1	47%	0.471	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	51.8	-176.6	-74.8	-60	0	0	0	113.1	K128 Q151	K128-D149 HydrophobicContact CD-CB 4.12Å; K128-D149 WeakPolarHBondContact CD-OD1 3.18Å; K128-D149 WeakPolarHBondContact CE-OD1 3.47Å; K128-D149 IonicContact NZ-OD1 2.7Å; K128-D149 PolarHBondContact NZ-OD1 3.34Å; D149-Q151 PolarHBondContact O-N 3.17Å; D149-Q151 VanDerWaalsContact O-N 3.12Å
150	D	91.5	Very high	87.2	Confident	50 Å²	50	34.1 Å²	34.1	27%	0.267	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	-6.8	-176.9	-77.9	-61.4	0	0	0	117.4	K128 R129 L148	K128-D150 WeakPolarHBondContact CA-OD2 3.18Å; K128-D150 VanDerWaalsContact CB-OD2 3.23Å; K128-D150 WeakPolarHBondContact CB-OD2 3.27Å; K128-D150 WeakPolarHBondContact CG-OD2 3.1Å; R129-D150 WeakPolarHBondContact CB-OD1 3Å; R129-D150 WeakPolarHBondContact CG-OD1 3.42Å; R129-D150 VanDerWaalsContact CZ-O 3.25Å; R129-D150 IonicContact CZ-OD1 3.38Å; R129-D150 PolarHBondContact N-OD1 2.89Å; R129-D150 IonicContact NE-OD1 3.7Å; R129-D150 PolarHBondContact NE-OD1 3.21Å; R129-D150 PolarHBondContact NH1-O 3.31Å; R129-D150 PolarHBondContact NH2-O 3Å; R129-D150 IonicContact NH2-OD1 3.55Å; R129-D150 PolarHBondContact NH2-OD1 3.29Å; R129-D150 VanDerWaalsContact NH2-OD1 3.12Å; R129-D150 PolarHBondContact O-N 3.35Å; L148-D150 VanDerWaalsContact C-N 3.31Å; L148-D150 PolarHBondContact O-N 2.99Å
151	Q	91.2	Very high	86.6	Confident	80 Å²	80	28.2 Å²	28.2	37%	0.374	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	144.9	-178.9	-59	176.8	12	0	0	111.2	F147 L148 D149 Y153 N175 D176	F147-Q151 CarbonylContact C-O 3.56Å; F147-Q151 VanDerWaalsContact CA-O 3.26Å; F147-Q151 WeakPolarHBondContact CA-O 3.4Å; L148-Q151 PolarHBondContact N-O 3.01Å; L148-Q151 PolarHBondContact O-N 2.93Å; D149-Q151 PolarHBondContact O-N 3.17Å; D149-Q151 VanDerWaalsContact O-N 3.12Å; Q151-Y153 PolarHBondContact O-N 3.04Å; Q151-N175 VanDerWaalsContact OE1-CB 3.25Å; Q151-D176 WeakPolarHBondContact CA-OD2 3.32Å; Q151-D176 WeakPolarHBondContact CB-OD2 3.19Å; Q151-D176 WeakPolarHBondContact CG-OD2 3.47Å
152	R	92.1	Very high	85.4	Confident	40 Å²	40	30 Å²	30	15%	0.151	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	130.2	172	-65.9	169.1	-75.4	178.1	-1.8	110.2	Y143 F147 F158 W173 N175 D176	Y143-R152 HydrophobicContact CD1-CG 3.94Å; Y143-R152 VanDerWaalsContact CD2-CD 3.41Å; Y143-R152 HydrophobicContact CD2-CG 4.04Å; Y143-R152 HydrophobicContact CE1-CB 4.23Å; Y143-R152 HydrophobicContact CE1-CG 3.66Å; Y143-R152 HydrophobicContact CE2-CB 4.04Å; Y143-R152 HydrophobicContact CE2-CG 3.77Å; Y143-R152 HydrophobicContact CG-CG 4.09Å; F147-R152 HydrophobicContact CD1-CG 4.32Å; F147-R152 HydrophobicContact CE1-CG 3.73Å; F147-R152 HydrophobicContact CZ-CG 4.15Å; R152-F158 VanDerWaalsContact NH1-CD2 3.35Å; R152-W173 HydrophobicContact CB-CB 4.08Å; R152-W173 HydrophobicContact CB-CD2 4.35Å; R152-W173 HydrophobicContact CB-CE3 4.16Å; R152-W173 HydrophobicContact CB-CG 4.33Å; R152-N175 PolarHBondContact O-N 3.24Å; R152-D176 WeakPolarHBondContact CB-OD1 3.37Å; R152-D176 VanDerWaalsContact CG-OD1 3.3Å; R152-D176 WeakPolarHBondContact CG-OD1 3.41Å; R152-D176 IonicContact CZ-OD1 2.7Å; R152-D176 PolarHBondContact N-OD1 3.47Å; R152-D176 IonicContact NE-OD1 3.79Å; R152-D176 PolarHBondContact NE-OD1 3.19Å; R152-D176 PolarHBondContact NH2-O 2.98Å; R152-D176 IonicContact NH2-OD1 3.08Å; R152-D176 PolarHBondContact O-N 2.88Å
153	Y	87.4	Confident	83.9	Confident	46 Å²	46	35.4 Å²	35.4	18%	0.18	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	161.6	-174.8	-170.8	-97.2	0	0	0	110.1	Y143 F146 L148 Q151 W173 K174	Y143-Y153 PolarHBondContact OH-O 3.25Å; F146-Y153 CarbonylContact C-O 3.3Å; F146-Y153 VanDerWaalsContact C-O 3.31Å; F146-Y153 WeakPolarHBondContact CA-O 3.39Å; F146-Y153 WeakPolarHBondContact CB-O 3.29Å; F146-Y153 PolarHBondContact O-N 3.14Å; L148-Y153 HydrophobicContact CB-CD1 4.4Å; L148-Y153 HydrophobicContact CB-CD2 4.44Å; L148-Y153 HydrophobicContact CB-CG 3.98Å; L148-Y153 HydrophobicContact CD2-CD1 4.46Å; L148-Y153 HydrophobicContact CD2-CD2 4.17Å; L148-Y153 HydrophobicContact CD2-CE2 4.28Å; L148-Y153 HydrophobicContact CD2-CG 4.28Å; Q151-Y153 PolarHBondContact O-N 3.04Å; Y153-W173 CarbonylContact C-O 3.53Å; Y153-W173 VanDerWaalsContact C-O 3.3Å; Y153-W173 VanDerWaalsContact CA-O 3.32Å; Y153-W173 WeakPolarHBondContact CA-O 3.4Å; Y153-K174 HydrophobicContact CD2-CG 4.41Å; Y153-K174 HydrophobicContact CE2-CG 4.24Å
154	G	83.8	Confident	82.3	Confident	4 Å²	4	41.5 Å²	41.5	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.9	-163.1	171.9	0	0	0	0	0	114.2	Y172 W173	G154-Y172 CarbonylContact O-C 3.55Å; G154-Y172 WeakPolarHBondContact O-CA 3.43Å; G154-W173 PolarHBondContact N-O 3.2Å; G154-W173 PolarHBondContact O-N 3.14Å
155	P	82.4	Confident	80.5	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	136.2	174.6	28.8	-33	0	0	0	111.1	G145 F146 G171 F200	G145-P155 WeakPolarHBondContact CA-O 3.32Å; F146-P155 HydrophobicContact CD2-CG 3.9Å; F146-P155 HydrophobicContact CE2-CG 3.9Å; F146-P155 PolarHBondContact N-O 3.35Å; P155-G171 WeakPolarHBondContact CA-O 3.47Å; P155-F200 HydrophobicContact CB-CB 4.33Å; P155-F200 HydrophobicContact CB-CD1 3.91Å; P155-F200 HydrophobicContact CB-CD2 3.84Å; P155-F200 HydrophobicContact CB-CE1 4.12Å; P155-F200 HydrophobicContact CB-CE2 4.05Å; P155-F200 HydrophobicContact CB-CG 3.76Å; P155-F200 HydrophobicContact CB-CZ 4.18Å; P155-F200 HydrophobicContact CG-CB 4.35Å; P155-F200 HydrophobicContact CG-CG 4.3Å
156	G	83	Confident	79.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	160.5	178.9	0	0	0	0	0	113.6	E144 G171 W173	E144-G156 CarbonylContact O-C 3.47Å; E144-G156 VanDerWaalsContact O-CA 3.23Å; E144-G156 WeakPolarHBondContact O-CA 3.49Å; G156-G171 PolarHBondContact N-O 3.32Å; G156-G171 PolarHBondContact O-N 2.77Å; G156-G171 VanDerWaalsContact O-O 3.05Å; G156-W173 PolarHBondContact O-NE1 3.24Å; G156-W173 VanDerWaalsContact O-NE1 3.07Å
157	I	84.4	Confident	78.3	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.015	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.6	-178.7	-59.7	174.4	0	0	0	107.5	Y143 E144 I159 I168 V170 F194 F196 I197	Y143-I157 CarbonylContact C-O 3.52Å; Y143-I157 VanDerWaalsContact CA-O 3.25Å; Y143-I157 WeakPolarHBondContact CA-O 3.41Å; Y143-I157 WeakPolarHBondContact CD2-O 3.37Å; E144-I157 PolarHBondContact N-O 2.9Å; E144-I157 PolarHBondContact O-N 3.3Å; I157-I159 HydrophobicContact CG2-CG1 3.97Å; I157-I168 HydrophobicContact CG2-CG2 3.9Å; I157-V170 HydrophobicContact CG1-CB 4.38Å; I157-V170 HydrophobicContact CG1-CG1 3.91Å; I157-V170 HydrophobicContact CG1-CG2 4.08Å; I157-V170 HydrophobicContact CG2-CG2 4.1Å; I157-F194 HydrophobicContact CD1-CD1 4.21Å; I157-F196 HydrophobicContact CD1-CB 4.33Å; I157-I197 HydrophobicContact CD1-CD1 4.32Å; I157-I197 HydrophobicContact CD1-CG1 4.14Å; I157-I197 HydrophobicContact CG1-CD1 4.38Å; I157-I197 HydrophobicContact CG1-CG1 4.41Å
158	F	87.6	Confident	77.7	Confident	36 Å²	36	51.5 Å²	51.5	16%	0.158	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.9	169.8	-173.2	-85.4	0	0	0	109.5	Y137 I142 Y143 R152 N160 I168 D169 W173	Y137-F158 HydrophobicContact CD2-CE2 4.23Å; Y137-F158 HydrophobicContact CE2-CD2 4.41Å; Y137-F158 AromaticContact CE2-CE2 3.61Å; Y137-F158 HydrophobicContact CE2-CE2 3.61Å; Y137-F158 HydrophobicContact CE2-CZ 4.4Å; I142-F158 CarbonylContact O-C 3.54Å; I142-F158 WeakPolarHBondContact O-CA 3.27Å; Y143-F158 HydrophobicContact CD2-CB 4.18Å; Y143-F158 HydrophobicContact CD2-CD2 4.22Å; R152-F158 VanDerWaalsContact NH1-CD2 3.35Å; F158-N160 HydrophobicContact CD1-CB 4.4Å; F158-N160 HydrophobicContact CE1-CB 3.99Å; F158-I168 CarbonylContact O-C 3.59Å; F158-I168 WeakPolarHBondContact O-CA 3.33Å; F158-D169 HydrophobicContact CB-CB 4.09Å; F158-D169 PolarHBondContact N-O 3.39Å; F158-D169 PolarHBondContact O-N 3Å; F158-W173 HydrophobicContact CB-CH2 3.74Å; F158-W173 HydrophobicContact CB-CZ2 3.5Å; F158-W173 VanDerWaalsContact CB-CZ2 3.5Å; F158-W173 HydrophobicContact CD2-CH2 4.48Å; F158-W173 HydrophobicContact CG-CH2 4.21Å; F158-W173 HydrophobicContact CG-CZ2 4.44Å
159	I	84.5	Confident	77.3	Confident	18 Å²	18	50.8 Å²	50.8	9%	0.092	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.9	176.2	-53.2	176.1	0	0	0	106.9	S141 I142 I157 N161 E167 I168 F194	S141-I159 CarbonylContact C-O 3.59Å; S141-I159 WeakPolarHBondContact CA-O 3.35Å; S141-I159 VanDerWaalsContact CB-O 3.27Å; S141-I159 WeakPolarHBondContact CB-O 3.4Å; I142-I159 HydrophobicContact CB-CB 4.35Å; I142-I159 PolarHBondContact N-O 3.27Å; I142-I159 PolarHBondContact O-N 3.15Å; I157-I159 HydrophobicContact CG2-CG1 3.97Å; I159-N161 WeakPolarHBondContact CG2-OD1 3.23Å; I159-E167 CarbonylContact C-O 3.56Å; I159-I168 HydrophobicContact CG1-CG1 4.42Å; I159-I168 HydrophobicContact CG1-CG2 4.23Å; I159-I168 HydrophobicContact CG2-CG1 4.23Å; I159-F194 HydrophobicContact CD1-CD2 4.36Å; I159-F194 HydrophobicContact CD1-CE1 4.09Å; I159-F194 HydrophobicContact CD1-CE2 3.75Å; I159-F194 HydrophobicContact CD1-CZ 3.59Å; I159-F194 HydrophobicContact CG1-CZ 4.47Å
160	N	79.6	Confident	76.8	Confident	41 Å²	41	47.1 Å²	47.1	22%	0.219	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	99.7	171.5	-173.5	11.1	0	0	0	108.2	S141 F158 S162 N166 E167	S141-N160 WeakPolarHBondContact OG-CA 3.41Å; S141-N160 PolarHBondContact OG-OD1 3.49Å; F158-N160 HydrophobicContact CD1-CB 4.4Å; F158-N160 HydrophobicContact CE1-CB 3.99Å; N160-S162 PolarHBondContact O-N 3.12Å; N160-N166 WeakPolarHBondContact O-CA 3.43Å; N160-E167 HydrophobicContact CB-CB 4.18Å; N160-E167 PolarHBondContact N-O 3.16Å; N160-E167 PolarHBondContact O-N 2.86Å; N160-E167 VanDerWaalsContact O-N 3.14Å
161	N	68.7	Low	76.3	Confident	19 Å²	19	44.9 Å²	44.9	10%	0.102	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	68.1	176.9	-65.7	-44.7	0	0	0	110.2	H140 I159 N166	H140-N161 HydrophobicContact CB-CB 4.01Å; H140-N161 WeakPolarHBondContact O-CB 3.31Å; H140-N161 PolarHBondContact O-ND2 3.32Å; I159-N161 WeakPolarHBondContact CG2-OD1 3.23Å; N161-N166 PolarHBondContact OD1-OD1 3.31Å
162	S	61.9	Low	75.8	Confident	36 Å²	36	44.3 Å²	44.3	25%	0.252	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	146.1	167.6	179.8	0	0	0	0	109.2	N160 T164 S165	N160-S162 PolarHBondContact O-N 3.12Å; S162-T164 PolarHBondContact O-N 3.23Å; S162-T164 PolarHBondContact OG-N 3.37Å; S162-T164 PolarHBondContact OG-OG1 2.94Å; S162-T164 VanDerWaalsContact OG-OG1 3.08Å; S162-S165 PolarHBondContact N-O 3.38Å; S162-S165 VanDerWaalsContact N-O 3.09Å; S162-S165 CarbonylContact O-C 3.28Å; S162-S165 PolarHBondContact O-N 2.84Å
163	P	58.7	Low	75.5	Confident	138 Å²	138	42.8 Å²	42.8	90%	0.896	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-20.7	170.7	-27.2	35	0	0	0	114.4
164	T	56.6	Low	75.4	Confident	127 Å²	127	44.2 Å²	44.2	78%	0.779	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-12	-178.5	60.3	0	0	0	0	114.9	S162	S162-T164 PolarHBondContact O-N 3.23Å; S162-T164 PolarHBondContact OG-N 3.37Å; S162-T164 PolarHBondContact OG-OG1 2.94Å; S162-T164 VanDerWaalsContact OG-OG1 3.08Å
165	S	53.6	Low	75.4	Confident	39 Å²	39	48.5 Å²	48.5	27%	0.273	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	131.5	179.4	63.1	0	0	0	0	112.8	S162	S162-S165 PolarHBondContact N-O 3.38Å; S162-S165 VanDerWaalsContact N-O 3.09Å; S162-S165 CarbonylContact O-C 3.28Å; S162-S165 PolarHBondContact O-N 2.84Å
166	N	60.3	Low	75.5	Confident	89 Å²	89	51 Å²	51	48%	0.476	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	81.7	165.4	-77.8	6.7	0	0	0	109.8	N160 N161	N160-N166 WeakPolarHBondContact O-CA 3.43Å; N161-N166 PolarHBondContact OD1-OD1 3.31Å
167	E	70.7	Confident	75.4	Confident	115 Å²	115	60.4 Å²	60.4	54%	0.537	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	137.4	174.2	-65.6	-178.1	154.7	0	0	110	I159 N160	I159-E167 CarbonylContact C-O 3.56Å; N160-E167 HydrophobicContact CB-CB 4.18Å; N160-E167 PolarHBondContact N-O 3.16Å; N160-E167 PolarHBondContact O-N 2.86Å; N160-E167 VanDerWaalsContact O-N 3.14Å
168	I	77.5	Confident	75.2	Confident	31 Å²	31	62.4 Å²	62.4	16%	0.159	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	107.8	-178.6	-52.7	177.7	0	0	0	110.1	I157 F158 I159 V170 P184 F194	I157-I168 HydrophobicContact CG2-CG2 3.9Å; F158-I168 CarbonylContact O-C 3.59Å; F158-I168 WeakPolarHBondContact O-CA 3.33Å; I159-I168 HydrophobicContact CG1-CG1 4.42Å; I159-I168 HydrophobicContact CG1-CG2 4.23Å; I159-I168 HydrophobicContact CG2-CG1 4.23Å; I168-V170 HydrophobicContact CG2-CG2 3.87Å; I168-P184 HydrophobicContact CB-CG 3.67Å; I168-P184 HydrophobicContact CG2-CG 3.81Å; I168-P184 VanDerWaalsContact O-CD 3.27Å; I168-P184 WeakPolarHBondContact O-CD 3.23Å; I168-P184 WeakPolarHBondContact O-CG 3.46Å; I168-F194 HydrophobicContact CD1-CE1 4.31Å; I168-F194 HydrophobicContact CD1-CZ 4.2Å
169	D	79.3	Confident	74.5	Confident	62 Å²	62	66 Å²	66	33%	0.332	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	87.1	177.5	-86.9	-13.4	0	0	0	110.1	F158 W173 L178	F158-D169 HydrophobicContact CB-CB 4.09Å; F158-D169 PolarHBondContact N-O 3.39Å; F158-D169 PolarHBondContact O-N 3Å; D169-W173 HydrophobicContact CB-CZ2 4.28Å; D169-L178 HydrophobicContact CB-CD2 3.7Å
170	V	77.6	Confident	73.3	Confident	10 Å²	10	69.2 Å²	69.2	6%	0.061	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	135.7	170.9	-174.1	0	0	0	0	109.6	I157 I168 K182 P184	I157-V170 HydrophobicContact CG1-CB 4.38Å; I157-V170 HydrophobicContact CG1-CG1 3.91Å; I157-V170 HydrophobicContact CG1-CG2 4.08Å; I157-V170 HydrophobicContact CG2-CG2 4.1Å; I168-V170 HydrophobicContact CG2-CG2 3.87Å; V170-K182 WeakPolarHBondContact CB-O 3.39Å; V170-K182 PolarHBondContact O-N 3.33Å; V170-P184 HydrophobicContact CG2-CB 4.2Å; V170-P184 HydrophobicContact CG2-CG 4.12Å
171	G	81.2	Confident	72.1	Confident	3 Å²	3	72 Å²	72	3%	0.031	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	-159.1	173.8	0	0	0	0	0	117	P155 G156 R180	P155-G171 WeakPolarHBondContact CA-O 3.47Å; G156-G171 PolarHBondContact N-O 3.32Å; G156-G171 PolarHBondContact O-N 2.77Å; G156-G171 VanDerWaalsContact O-O 3.05Å; G171-R180 CarbonylContact C-O 3.56Å; G171-R180 WeakPolarHBondContact CA-O 3.31Å
172	Y	81.6	Confident	71.4	Confident	68 Å²	68	74.6 Å²	74.6	27%	0.267	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.4	175.5	-159.5	-81.5	0	0	0	110.4	G154 I179 R180	G154-Y172 CarbonylContact O-C 3.55Å; G154-Y172 WeakPolarHBondContact O-CA 3.43Å; Y172-I179 PolarHBondContact O-N 2.87Å; Y172-R180 PolarHBondContact N-O 2.77Å; Y172-R180 PolarHBondContact O-N 2.87Å
173	W	85.6	Confident	70.5	Confident	9 Å²	9	80.1 Å²	80.1	3%	0.034	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	145.2	-177.2	-61.2	78.4	0	0	0	110.6	Y143 R152 Y153 G154 G156 F158 D169 R177 L178	Y143-W173 HydrophobicContact CD2-CZ2 4.42Å; Y143-W173 AromaticContact CE2-CD1 3.8Å; Y143-W173 AromaticContact CE2-CD2 3.85Å; Y143-W173 HydrophobicContact CE2-CD2 3.85Å; Y143-W173 AromaticContact CE2-CE2 3.68Å; Y143-W173 AromaticContact CE2-CG 3.97Å; Y143-W173 HydrophobicContact CE2-CG 3.97Å; Y143-W173 HydrophobicContact CE2-CZ2 4.26Å; Y143-W173 AromaticContact CE2-NE1 3.64Å; R152-W173 HydrophobicContact CB-CB 4.08Å; R152-W173 HydrophobicContact CB-CD2 4.35Å; R152-W173 HydrophobicContact CB-CE3 4.16Å; R152-W173 HydrophobicContact CB-CG 4.33Å; Y153-W173 CarbonylContact C-O 3.53Å; Y153-W173 VanDerWaalsContact C-O 3.3Å; Y153-W173 VanDerWaalsContact CA-O 3.32Å; Y153-W173 WeakPolarHBondContact CA-O 3.4Å; G154-W173 PolarHBondContact N-O 3.2Å; G154-W173 PolarHBondContact O-N 3.14Å; G156-W173 PolarHBondContact O-NE1 3.24Å; G156-W173 VanDerWaalsContact O-NE1 3.07Å; F158-W173 HydrophobicContact CB-CH2 3.74Å; F158-W173 HydrophobicContact CB-CZ2 3.5Å; F158-W173 VanDerWaalsContact CB-CZ2 3.5Å; F158-W173 HydrophobicContact CD2-CH2 4.48Å; F158-W173 HydrophobicContact CG-CH2 4.21Å; F158-W173 HydrophobicContact CG-CZ2 4.44Å; D169-W173 HydrophobicContact CB-CZ2 4.28Å; W173-R177 CarbonylContact C-O 3.6Å; W173-R177 WeakPolarHBondContact CA-O 3.28Å; W173-L178 HydrophobicContact CD2-CB 4.33Å; W173-L178 HydrophobicContact CD2-CD1 4.19Å; W173-L178 HydrophobicContact CE3-CB 4.15Å; W173-L178 HydrophobicContact CG-CD1 4.49Å; W173-L178 HydrophobicContact CH2-CB 4.07Å; W173-L178 HydrophobicContact CH2-CD2 4.35Å; W173-L178 HydrophobicContact CZ2-CB 4.25Å; W173-L178 HydrophobicContact CZ2-CD1 4Å; W173-L178 HydrophobicContact CZ2-CD2 4.16Å; W173-L178 HydrophobicContact CZ2-CG 4.38Å; W173-L178 HydrophobicContact CZ3-CB 4.02Å
174	K	84.4	Confident	69.7	Low	76 Å²	76	75.8 Å²	75.8	33%	0.33	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	125.5	169.5	-173	179	-175.3	-180	0	108	Y153 D176 R177 I179	Y153-K174 HydrophobicContact CD2-CG 4.41Å; Y153-K174 HydrophobicContact CE2-CG 4.24Å; K174-D176 VanDerWaalsContact C-N 3.31Å; K174-D176 PolarHBondContact O-N 3.38Å; K174-R177 PolarHBondContact N-O 2.96Å; K174-R177 WeakPolarHBondContact O-CB 3.24Å; K174-R177 PolarHBondContact O-N 3.35Å; K174-I179 HydrophobicContact CB-CD1 3.41Å; K174-I179 VanDerWaalsContact CB-CD1 3.41Å; K174-I179 HydrophobicContact CB-CG1 4.01Å; K174-I179 HydrophobicContact CD-CD1 3.74Å; K174-I179 HydrophobicContact CG-CD1 4.19Å
175	N	85.3	Confident	68.8	Low	93 Å²	93	71.8 Å²	71.8	50%	0.497	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	50	178.6	-52.9	14.4	0	0	0	111.8	Q151 R152 R177	Q151-N175 VanDerWaalsContact OE1-CB 3.25Å; R152-N175 PolarHBondContact O-N 3.24Å; N175-R177 PolarHBondContact O-N 3.48Å
176	D	84.5	Confident	68	Low	58 Å²	58	74.9 Å²	74.9	31%	0.31	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	3.7	-175.9	-71.5	-59.4	0	0	0	117	Q151 R152 K174	Q151-D176 WeakPolarHBondContact CA-OD2 3.32Å; Q151-D176 WeakPolarHBondContact CB-OD2 3.19Å; Q151-D176 WeakPolarHBondContact CG-OD2 3.47Å; R152-D176 WeakPolarHBondContact CB-OD1 3.37Å; R152-D176 VanDerWaalsContact CG-OD1 3.3Å; R152-D176 WeakPolarHBondContact CG-OD1 3.41Å; R152-D176 IonicContact CZ-OD1 2.7Å; R152-D176 PolarHBondContact N-OD1 3.47Å; R152-D176 IonicContact NE-OD1 3.79Å; R152-D176 PolarHBondContact NE-OD1 3.19Å; R152-D176 PolarHBondContact NH2-O 2.98Å; R152-D176 IonicContact NH2-OD1 3.08Å; R152-D176 PolarHBondContact O-N 2.88Å; K174-D176 VanDerWaalsContact C-N 3.31Å; K174-D176 PolarHBondContact O-N 3.38Å
177	R	79.3	Confident	66.6	Low	198 Å²	198	74.4 Å²	74.4	75%	0.747	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.1	176	-61.2	-178.8	-177	-171.8	0.1	111	W173 K174 N175 I179	W173-R177 CarbonylContact C-O 3.6Å; W173-R177 WeakPolarHBondContact CA-O 3.28Å; K174-R177 PolarHBondContact N-O 2.96Å; K174-R177 WeakPolarHBondContact O-CB 3.24Å; K174-R177 PolarHBondContact O-N 3.35Å; N175-R177 PolarHBondContact O-N 3.48Å; R177-I179 PolarHBondContact O-N 2.73Å
178	L	81	Confident	64.8	Low	44 Å²	44	78.6 Å²	78.6	23%	0.23	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	105.4	171.1	-176.6	55.7	0	0	0	109.2	D169 W173 L181	D169-L178 HydrophobicContact CB-CD2 3.7Å; W173-L178 HydrophobicContact CD2-CB 4.33Å; W173-L178 HydrophobicContact CD2-CD1 4.19Å; W173-L178 HydrophobicContact CE3-CB 4.15Å; W173-L178 HydrophobicContact CG-CD1 4.49Å; W173-L178 HydrophobicContact CH2-CB 4.07Å; W173-L178 HydrophobicContact CH2-CD2 4.35Å; W173-L178 HydrophobicContact CZ2-CB 4.25Å; W173-L178 HydrophobicContact CZ2-CD1 4Å; W173-L178 HydrophobicContact CZ2-CD2 4.16Å; W173-L178 HydrophobicContact CZ2-CG 4.38Å; W173-L178 HydrophobicContact CZ3-CB 4.02Å; L178-L181 HydrophobicContact CD2-CD1 4.18Å; L178-L181 HydrophobicContact CD2-CD2 3.63Å; L178-L181 HydrophobicContact CD2-CG 3.55Å; L178-L181 HydrophobicContact CG-CG 4.07Å
179	I	72.1	Confident	62.7	Low	111 Å²	111	80 Å²	80	57%	0.569	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	-45	177.3	-67.4	-173.7	0	0	0	110.6	Y172 K174 R177	Y172-I179 PolarHBondContact O-N 2.87Å; K174-I179 HydrophobicContact CB-CD1 3.41Å; K174-I179 VanDerWaalsContact CB-CD1 3.41Å; K174-I179 HydrophobicContact CB-CG1 4.01Å; K174-I179 HydrophobicContact CD-CD1 3.74Å; K174-I179 HydrophobicContact CG-CD1 4.19Å; R177-I179 PolarHBondContact O-N 2.73Å
180	R	59.5	Low	60.4	Low	87 Å²	87	80 Å²	80	33%	0.328	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	105.7	-168.8	-173.3	-166.6	177.6	173	10	111.7	G171 Y172 Q452	G171-R180 CarbonylContact C-O 3.56Å; G171-R180 WeakPolarHBondContact CA-O 3.31Å; Y172-R180 PolarHBondContact N-O 2.77Å; Y172-R180 PolarHBondContact O-N 2.87Å; R180-Q452 VanDerWaalsContact CZ-CB 3.44Å; R180-Q452 VanDerWaalsContact CZ-CD 3.5Å; R180-Q452 PolarHBondContact NH2-O 3.42Å; R180-Q452 VanDerWaalsContact NH2-OE1 3.08Å
181	L	54.3	Low	58.3	Low	99 Å²	99	88.1 Å²	88.1	52%	0.518	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.5	174.5	-94.9	157.4	0	0	0	112.9	L178	L178-L181 HydrophobicContact CD2-CD1 4.18Å; L178-L181 HydrophobicContact CD2-CD2 3.63Å; L178-L181 HydrophobicContact CD2-CG 3.55Å; L178-L181 HydrophobicContact CG-CG 4.07Å
182	K	54	Low	55.9	Low	73 Å²	73	94.6 Å²	94.6	32%	0.317	47%	0.47	S	S	.	.			trans	-118.2	103.6	163.6	-148.6	-178.8	-170.1	-178.3	0	106.6	V170 P184	V170-K182 WeakPolarHBondContact CB-O 3.39Å; V170-K182 PolarHBondContact O-N 3.33Å; K182-P184 WeakPolarHBondContact O-CD 3.44Å
183	K	44.5	Very low	53.5	Low	153 Å²	153	98.3 Å²	98.3	67%	0.665	49%	0.49	S	S	*	.			trans	-63.3	124.7	-176.4	-77.7	-173.6	172.4	-174.8	0	110.9
184	P	41.4	Very low	51.3	Low	47 Å²	47	102 Å²	102	31%	0.305	51%	0.507	S	S	.	.			trans	-74.7	145.2	173.6	27.7	-28.7	0	0	0	110.8	I168 V170 K182 I186	I168-P184 HydrophobicContact CB-CG 3.67Å; I168-P184 HydrophobicContact CG2-CG 3.81Å; I168-P184 VanDerWaalsContact O-CD 3.27Å; I168-P184 WeakPolarHBondContact O-CD 3.23Å; I168-P184 WeakPolarHBondContact O-CG 3.46Å; V170-P184 HydrophobicContact CG2-CB 4.2Å; V170-P184 HydrophobicContact CG2-CG 4.12Å; K182-P184 WeakPolarHBondContact O-CD 3.44Å; P184-I186 HydrophobicContact CG-CG1 4.45Å; P184-I186 PolarHBondContact O-N 2.99Å; P184-I186 VanDerWaalsContact O-N 3.15Å
185	A	37.1	Very low	49.1	Very low	43 Å²	43	103 Å²	103	36%	0.355	51%	0.513	S	S	.	.			trans	-81.6	87.6	171.3	0	0	0	0	0	109.4	N187	A185-N187 PolarHBondContact O-N 3.07Å; A185-N187 VanDerWaalsContact O-N 3.17Å
186	I	36.2	Very low	47	Very low	104 Å²	104	103 Å²	103	53%	0.533	51%	0.508	S	S	.	.			trans	-67.1	110.8	178.6	-57.4	174	0	0	0	109.4	P184	P184-I186 HydrophobicContact CG-CG1 4.45Å; P184-I186 PolarHBondContact O-N 2.99Å; P184-I186 VanDerWaalsContact O-N 3.15Å
187	N	32.1	Very low	44.9	Very low	79 Å²	79	100.6 Å²	100.6	42%	0.422	50%	0.495	S	S	.	.			trans	-103.7	133.7	161.7	-81.3	2.5	0	0	0	108.6	A185 S189 Q825	A185-N187 PolarHBondContact O-N 3.07Å; A185-N187 VanDerWaalsContact O-N 3.17Å; N187-S189 PolarHBondContact O-N 3.18Å; N187-Q825 VanDerWaalsContact ND2-CD 3.34Å; N187-Q825 PolarHBondContact ND2-NE2 3.3Å; N187-Q825 PolarHBondContact ND2-OE1 3.46Å
188	Q	32.4	Very low	43.2	Very low	202 Å²	202	95.7 Å²	95.7	94%	0.944	48%	0.479	S	S	*	.	S	Bend	trans	-76.2	51.3	-173.2	-63	169.7	-47.9	0	0	114
189	S	32.9	Very low	41.3	Very low	62 Å²	62	98.1 Å²	98.1	43%	0.434	49%	0.49	S	S	.	.	S	Bend	trans	-155.7	116.2	179.9	67.9	0	0	0	0	113.7	N187 R828	N187-S189 PolarHBondContact O-N 3.18Å; S189-R828 PolarHBondContact OG-NH1 3.38Å; S189-R828 VanDerWaalsContact OG-NH1 3.13Å
190	G	31.3	Very low	39.8	Very low	60 Å²	60	94 Å²	94	62%	0.619	47%	0.467	S	S	*	.			trans	87.6	137.5	166.8	0	0	0	0	0	114.7	D192	G190-D192 PolarHBondContact O-N 3.46Å
191	Y	32.8	Very low	38.7	Very low	181 Å²	181	93.5 Å²	93.5	71%	0.71	48%	0.475	S	S	*	.			trans	-88.4	21.2	179.2	-104.5	-98	0	0	0	112.3
192	D	31.9	Very low	37.9	Very low	139 Å²	139	92.6 Å²	92.6	74%	0.743	47%	0.469	S	S	*	.			trans	-92.9	124.7	-160.2	-52.4	-51	0	0	0	113.5	G190	G190-D192 PolarHBondContact O-N 3.46Å
193	E	31.7	Very low	37.1	Very low	147 Å²	147	92.4 Å²	92.4	69%	0.687	47%	0.466	S	S	*	.			trans	50	88.1	167.8	-59.6	-156.5	147.9	0	0	119.1	H195	E193-H195 PolarHBondContact O-N 3.23Å
194	F	38	Very low	36.6	Very low	85 Å²	85	89.1 Å²	89.1	37%	0.373	46%	0.456	S	S	.	.			trans	-71.2	59.4	161.9	-77.3	-85.3	0	0	0	113.1	I157 I159 I168 F196	I157-F194 HydrophobicContact CD1-CD1 4.21Å; I159-F194 HydrophobicContact CD1-CD2 4.36Å; I159-F194 HydrophobicContact CD1-CE1 4.09Å; I159-F194 HydrophobicContact CD1-CE2 3.75Å; I159-F194 HydrophobicContact CD1-CZ 3.59Å; I159-F194 HydrophobicContact CG1-CZ 4.47Å; I168-F194 HydrophobicContact CD1-CE1 4.31Å; I168-F194 HydrophobicContact CD1-CZ 4.2Å; F194-F196 PolarHBondContact O-N 3.07Å
195	H	39.1	Very low	36.1	Very low	99 Å²	99	93 Å²	93	46%	0.458	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-75.5	13.6	-178.6	-110.3	19.7	0	0	0	115.6	E193 I197 K198	E193-H195 PolarHBondContact O-N 3.23Å; H195-I197 PolarHBondContact O-N 3.25Å; H195-K198 PolarHBondContact CD2-NZ 3.37Å; H195-K198 PolarHBondContact CE1-NZ 2.97Å; H195-K198 PolarHBondContact NE2-NZ 2.9Å
196	F	40.5	Very low	36	Very low	93 Å²	93	95.5 Å²	95.5	41%	0.408	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-71.4	-29.4	-169.5	-124.7	-83.2	0	0	0	114.8	I157 F194 K198 Q199	I157-F196 HydrophobicContact CD1-CB 4.33Å; F194-F196 PolarHBondContact O-N 3.07Å; F196-K198 PolarHBondContact O-N 3.36Å; F196-Q199 WeakPolarHBondContact O-CB 3.39Å; F196-Q199 PolarHBondContact O-N 3.38Å; F196-Q199 VanDerWaalsContact O-N 3.11Å
197	I	41	Very low	35.8	Very low	6 Å²	6	97.7 Å²	97.7	3%	0.031	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-66.2	-26.7	-175.6	-69.5	179.2	0	0	0	112.2	Y132 E144 I157 H195 Q199 F200 Y203	Y132-I197 HydrophobicContact CE2-CD1 3.87Å; Y132-I197 HydrophobicContact CE2-CG2 4.13Å; E144-I197 HydrophobicContact CG-CD1 4.04Å; I157-I197 HydrophobicContact CD1-CD1 4.32Å; I157-I197 HydrophobicContact CD1-CG1 4.14Å; I157-I197 HydrophobicContact CG1-CD1 4.38Å; I157-I197 HydrophobicContact CG1-CG1 4.41Å; H195-I197 PolarHBondContact O-N 3.25Å; I197-Q199 PolarHBondContact O-N 3.17Å; I197-F200 PolarHBondContact O-N 2.97Å; I197-F200 VanDerWaalsContact O-N 3.15Å; I197-Y203 HydrophobicContact CG2-CD2 3.47Å; I197-Y203 VanDerWaalsContact CG2-CD2 3.47Å; I197-Y203 HydrophobicContact CG2-CE2 3.92Å; I197-Y203 HydrophobicContact CG2-CG 4.04Å; I197-Y203 WeakPolarHBondContact O-CB 3.29Å
198	K	43.5	Very low	35.7	Very low	96 Å²	96	99.9 Å²	99.9	42%	0.417	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-58.8	-19.4	173.8	-66.6	-178	174.3	179.8	0	114.1	H195 F196 Y203	H195-K198 PolarHBondContact CD2-NZ 3.37Å; H195-K198 PolarHBondContact CE1-NZ 2.97Å; H195-K198 PolarHBondContact NE2-NZ 2.9Å; F196-K198 PolarHBondContact O-N 3.36Å; K198-Y203 HydrophobicContact CG-CE1 4.05Å
199	Q	41.4	Very low	35.7	Very low	95 Å²	95	91.2 Å²	91.2	44%	0.444	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-83.3	-8.6	-179.7	-60.9	-175.5	4.5	0	0	114.1	F196 I197	F196-Q199 WeakPolarHBondContact O-CB 3.39Å; F196-Q199 PolarHBondContact O-N 3.38Å; F196-Q199 VanDerWaalsContact O-N 3.11Å; I197-Q199 PolarHBondContact O-N 3.17Å
200	F	40.6	Very low	35.6	Very low	23 Å²	23	91.6 Å²	91.6	10%	0.101	44%	0.444	C	S	.	.			trans	-84	125.1	177.7	-74.2	-88.2	0	0	0	110.7	P155 I197 Q202 Y203	P155-F200 HydrophobicContact CB-CB 4.33Å; P155-F200 HydrophobicContact CB-CD1 3.91Å; P155-F200 HydrophobicContact CB-CD2 3.84Å; P155-F200 HydrophobicContact CB-CE1 4.12Å; P155-F200 HydrophobicContact CB-CE2 4.05Å; P155-F200 HydrophobicContact CB-CG 3.76Å; P155-F200 HydrophobicContact CB-CZ 4.18Å; P155-F200 HydrophobicContact CG-CB 4.35Å; P155-F200 HydrophobicContact CG-CG 4.3Å; I197-F200 PolarHBondContact O-N 2.97Å; I197-F200 VanDerWaalsContact O-N 3.15Å; F200-Q202 PolarHBondContact O-N 3.2Å; F200-Q202 VanDerWaalsContact O-N 3.11Å; F200-Y203 VanDerWaalsContact O-CB 3.3Å; F200-Y203 WeakPolarHBondContact O-CB 3.4Å; F200-Y203 PolarHBondContact O-N 3.29Å
201	P	35.3	Very low	35.6	Very low	77 Å²	77	95.1 Å²	95.1	50%	0.5	45%	0.448	S	S	.	.	H	α-helix	trans	-54.9	-32.9	175.8	-27.4	35	0	0	0	112.7	Y203 N204 F205 F454	P201-Y203 VanDerWaalsContact C-N 3.28Å; P201-Y203 PolarHBondContact O-N 3.44Å; P201-N204 PolarHBondContact O-N 3.05Å; P201-F205 WeakPolarHBondContact O-CB 3.33Å; P201-F205 PolarHBondContact O-N 3.24Å; P201-F454 HydrophobicContact CG-CZ 4.48Å
202	Q	37.5	Very low	35.4	Very low	81 Å²	81	90.9 Å²	90.9	38%	0.379	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-26.1	176.1	-58.1	82.8	2	0	0	113.1	F200 F205 Y206	F200-Q202 PolarHBondContact O-N 3.2Å; F200-Q202 VanDerWaalsContact O-N 3.11Å; Q202-F205 PolarHBondContact O-N 3.01Å; Q202-Y206 WeakPolarHBondContact O-CB 3.44Å; Q202-Y206 WeakPolarHBondContact O-CD2 3.34Å; Q202-Y206 PolarHBondContact O-N 3.4Å
203	Y	38.8	Very low	35.3	Very low	68 Å²	68	88.9 Å²	88.9	27%	0.267	42%	0.424	S	S	.	.	H	α-helix	trans	-68.9	-44.3	174.4	179	-98.8	0	0	0	110.9	F146 I197 K198 F200 P201 Y206 K207	F146-Y203 HydrophobicContact CE2-CD2 4.42Å; F146-Y203 HydrophobicContact CZ-CD2 4.38Å; I197-Y203 HydrophobicContact CG2-CD2 3.47Å; I197-Y203 VanDerWaalsContact CG2-CD2 3.47Å; I197-Y203 HydrophobicContact CG2-CE2 3.92Å; I197-Y203 HydrophobicContact CG2-CG 4.04Å; I197-Y203 WeakPolarHBondContact O-CB 3.29Å; K198-Y203 HydrophobicContact CG-CE1 4.05Å; F200-Y203 VanDerWaalsContact O-CB 3.3Å; F200-Y203 WeakPolarHBondContact O-CB 3.4Å; F200-Y203 PolarHBondContact O-N 3.29Å; P201-Y203 VanDerWaalsContact C-N 3.28Å; P201-Y203 PolarHBondContact O-N 3.44Å; Y203-Y206 PolarHBondContact O-N 3.16Å; Y203-K207 VanDerWaalsContact O-CB 3.32Å; Y203-K207 WeakPolarHBondContact O-CB 3.41Å; Y203-K207 PolarHBondContact O-N 2.84Å
204	N	33.7	Very low	35.1	Very low	85 Å²	85	87.6 Å²	87.6	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-67.7	-37.2	173.2	-72.6	-20.7	0	0	0	111.8	P201 K207 L208	P201-N204 PolarHBondContact O-N 3.05Å; N204-K207 PolarHBondContact O-N 2.92Å; N204-L208 PolarHBondContact O-N 3Å
205	F	30.7	Very low	34.7	Very low	129 Å²	129	88.9 Å²	88.9	57%	0.566	43%	0.425	S	S	*	.	H	α-helix	trans	-61	-52.4	172.8	-163.7	-99.9	0	0	0	110.9	P201 Q202 K207 L208 V209	P201-F205 WeakPolarHBondContact O-CB 3.33Å; P201-F205 PolarHBondContact O-N 3.24Å; Q202-F205 PolarHBondContact O-N 3.01Å; F205-K207 VanDerWaalsContact C-N 3.27Å; F205-K207 PolarHBondContact O-N 3.1Å; F205-L208 PolarHBondContact O-N 3.04Å; F205-L208 VanDerWaalsContact O-N 3.09Å; F205-V209 HydrophobicContact CD1-CB 4.16Å; F205-V209 HydrophobicContact CD1-CG1 4.45Å; F205-V209 HydrophobicContact CD1-CG2 3.92Å; F205-V209 HydrophobicContact CD2-CG2 4.07Å; F205-V209 HydrophobicContact CE1-CB 4.14Å; F205-V209 HydrophobicContact CE1-CG1 3.99Å; F205-V209 HydrophobicContact CE1-CG2 3.82Å; F205-V209 HydrophobicContact CE2-CG2 3.96Å; F205-V209 HydrophobicContact CG-CG2 4.06Å; F205-V209 HydrophobicContact CZ-CG1 4.45Å; F205-V209 HydrophobicContact CZ-CG2 3.84Å; F205-V209 WeakPolarHBondContact O-CB 3.42Å; F205-V209 WeakPolarHBondContact O-CG2 3.39Å; F205-V209 PolarHBondContact O-N 2.88Å
206	Y	34.1	Very low	34.3	Very low	94 Å²	94	89.9 Å²	89.9	37%	0.369	43%	0.428	S	S	.	.	H	α-helix	trans	-60.8	-33.5	175.8	-96	-84.7	0	0	0	113	F146 Q202 Y203 L208 V209 N210	F146-Y206 HydrophobicContact CE1-CD1 4.03Å; F146-Y206 HydrophobicContact CE1-CD2 4.27Å; F146-Y206 AromaticContact CE1-CG 3.87Å; F146-Y206 HydrophobicContact CE1-CG 3.87Å; F146-Y206 HydrophobicContact CZ-CD2 4.48Å; F146-Y206 HydrophobicContact CZ-CG 4.23Å; Q202-Y206 WeakPolarHBondContact O-CB 3.44Å; Q202-Y206 WeakPolarHBondContact O-CD2 3.34Å; Q202-Y206 PolarHBondContact O-N 3.4Å; Y203-Y206 PolarHBondContact O-N 3.16Å; Y206-L208 VanDerWaalsContact C-N 3.33Å; Y206-V209 PolarHBondContact O-N 3.41Å; Y206-N210 WeakPolarHBondContact CD1-OD1 3.46Å; Y206-N210 WeakPolarHBondContact O-CB 3.47Å; Y206-N210 PolarHBondContact O-N 3.23Å
207	K	32.8	Very low	33.8	Very low	151 Å²	151	91.6 Å²	91.6	66%	0.657	44%	0.437	S	S	*	.	H	α-helix	trans	-67	-31.4	175.1	-168.1	-179.4	179.2	-168	0	113.2	Y203 N204 F205	Y203-K207 VanDerWaalsContact O-CB 3.32Å; Y203-K207 WeakPolarHBondContact O-CB 3.41Å; Y203-K207 PolarHBondContact O-N 2.84Å; N204-K207 PolarHBondContact O-N 2.92Å; F205-K207 VanDerWaalsContact C-N 3.27Å; F205-K207 PolarHBondContact O-N 3.1Å
208	L	30.1	Very low	33.2	Very low	125 Å²	125	97.3 Å²	97.3	65%	0.654	46%	0.459	S	S	*	.	H	α-helix	trans	-83.4	-39.1	173.1	-75.2	159.6	0	0	0	112	N204 F205 Y206	N204-L208 PolarHBondContact O-N 3Å; F205-L208 PolarHBondContact O-N 3.04Å; F205-L208 VanDerWaalsContact O-N 3.09Å; Y206-L208 VanDerWaalsContact C-N 3.33Å
209	V	31.6	Very low	32.7	Very low	19 Å²	19	97.2 Å²	97.2	12%	0.115	46%	0.46	C	S	.	.	H	α-helix	trans	-101.1	-19	-160.7	178.1	0	0	0	0	113.8	F205 Y206 L211 E212 L213	F205-V209 HydrophobicContact CD1-CB 4.16Å; F205-V209 HydrophobicContact CD1-CG1 4.45Å; F205-V209 HydrophobicContact CD1-CG2 3.92Å; F205-V209 HydrophobicContact CD2-CG2 4.07Å; F205-V209 HydrophobicContact CE1-CB 4.14Å; F205-V209 HydrophobicContact CE1-CG1 3.99Å; F205-V209 HydrophobicContact CE1-CG2 3.82Å; F205-V209 HydrophobicContact CE2-CG2 3.96Å; F205-V209 HydrophobicContact CG-CG2 4.06Å; F205-V209 HydrophobicContact CZ-CG1 4.45Å; F205-V209 HydrophobicContact CZ-CG2 3.84Å; F205-V209 WeakPolarHBondContact O-CB 3.42Å; F205-V209 WeakPolarHBondContact O-CG2 3.39Å; F205-V209 PolarHBondContact O-N 2.88Å; Y206-V209 PolarHBondContact O-N 3.41Å; V209-L211 PolarHBondContact O-N 3.01Å; V209-E212 PolarHBondContact O-N 3.35Å; V209-E212 VanDerWaalsContact O-N 3.1Å; V209-L213 HydrophobicContact CG1-CB 4.28Å; V209-L213 HydrophobicContact CG1-CD1 3.41Å; V209-L213 VanDerWaalsContact CG1-CD1 3.41Å; V209-L213 HydrophobicContact CG1-CG 3.51Å; V209-L213 PolarHBondContact O-N 3.15Å
210	N	31.5	Very low	32	Very low	70 Å²	70	100.2 Å²	100.2	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-67	-18.8	169.9	-96.4	-4.1	0	0	0	113.1	Y206 M214	Y206-N210 WeakPolarHBondContact CD1-OD1 3.46Å; Y206-N210 WeakPolarHBondContact O-CB 3.47Å; Y206-N210 PolarHBondContact O-N 3.23Å; N210-M214 WeakPolarHBondContact O-CG 3.21Å
211	L	30.7	Very low	31.5	Very low	134 Å²	134	104.8 Å²	104.8	70%	0.702	49%	0.49	S	S	*	.	H	α-helix	trans	-77.4	-33.2	169.9	-75.9	161.6	0	0	0	111.9	V209 F215	V209-L211 PolarHBondContact O-N 3.01Å; L211-F215 VanDerWaalsContact O-CD2 3.32Å; L211-F215 WeakPolarHBondContact O-CD2 3.48Å
212	E	29	Very low	31.3	Very low	92 Å²	92	108.5 Å²	108.5	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-86	-49.8	179.8	-83.6	-169.4	91.8	0	0	114.3	V209 M214 F215 K216	V209-E212 PolarHBondContact O-N 3.35Å; V209-E212 VanDerWaalsContact O-N 3.1Å; E212-M214 PolarHBondContact O-N 2.85Å; E212-F215 PolarHBondContact O-N 2.69Å; E212-K216 PolarHBondContact O-N 3.49Å; E212-K216 WeakPolarHBondContact OE1-CE 3.4Å; E212-K216 IonicContact OE1-NZ 3.26Å; E212-K216 PolarHBondContact OE1-NZ 3.36Å
213	L	29.4	Very low	31	Very low	98 Å²	98	108.3 Å²	108.3	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-72.7	-30.4	-170.5	-77.9	-179.3	0	0	0	113.2	V209 F215 H217	V209-L213 HydrophobicContact CG1-CB 4.28Å; V209-L213 HydrophobicContact CG1-CD1 3.41Å; V209-L213 VanDerWaalsContact CG1-CD1 3.41Å; V209-L213 HydrophobicContact CG1-CG 3.51Å; V209-L213 PolarHBondContact O-N 3.15Å; L213-F215 PolarHBondContact O-N 3.31Å; L213-H217 WeakPolarHBondContact O-CB 3.27Å; L213-H217 PolarHBondContact O-N 3.27Å; L213-H217 VanDerWaalsContact O-N 3.11Å
214	M	27.5	Very low	30.5	Very low	120 Å²	120	110.5 Å²	110.5	59%	0.591	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-27.7	173.1	-70.8	-167.9	69.6	0	0	112.4	N210 E212	N210-M214 WeakPolarHBondContact O-CG 3.21Å; E212-M214 PolarHBondContact O-N 2.85Å
215	F	29.4	Very low	30.3	Very low	112 Å²	112	115 Å²	115	49%	0.491	54%	0.537	S	S	.	.	H	α-helix	trans	-86.1	-48.8	175.7	-82.9	-97	0	0	0	112	L211 E212 L213 H217 Y218 Q219	L211-F215 VanDerWaalsContact O-CD2 3.32Å; L211-F215 WeakPolarHBondContact O-CD2 3.48Å; E212-F215 PolarHBondContact O-N 2.69Å; L213-F215 PolarHBondContact O-N 3.31Å; F215-H217 VanDerWaalsContact C-N 3.32Å; F215-H217 PolarHBondContact O-N 3.02Å; F215-Y218 PolarHBondContact O-N 3.3Å; F215-Q219 PolarHBondContact O-N 3.31Å; F215-Q219 VanDerWaalsContact O-N 3.1Å
216	K	31	Very low	30.3	Very low	120 Å²	120	117.2 Å²	117.2	52%	0.522	55%	0.549	S	S	.	.	H	α-helix	trans	-59.3	-38.3	-178.9	-73.8	177.3	176.9	173.9	0	112.6	E212 Y220	E212-K216 PolarHBondContact O-N 3.49Å; E212-K216 WeakPolarHBondContact OE1-CE 3.4Å; E212-K216 IonicContact OE1-NZ 3.26Å; E212-K216 PolarHBondContact OE1-NZ 3.36Å; K216-Y220 VanDerWaalsContact O-CB 3.25Å; K216-Y220 WeakPolarHBondContact O-CB 3.45Å; K216-Y220 PolarHBondContact O-N 3.14Å
217	H	30.5	Very low	30.1	Very low	129 Å²	129	120.5 Å²	120.5	60%	0.597	57%	0.573	S	S	*	*	H	α-helix	trans	-72.8	-29	-179.5	-139	70	0	0	0	113.8	L213 F215 Q221	L213-H217 WeakPolarHBondContact O-CB 3.27Å; L213-H217 PolarHBondContact O-N 3.27Å; L213-H217 VanDerWaalsContact O-N 3.11Å; F215-H217 VanDerWaalsContact C-N 3.32Å; F215-H217 PolarHBondContact O-N 3.02Å; H217-Q221 WeakPolarHBondContact O-CG 3.43Å; H217-Q221 PolarHBondContact O-N 3.41Å
218	Y	29.1	Very low	29.8	Very low	125 Å²	125	121.6 Å²	121.6	49%	0.49	58%	0.58	S	S	.	*	H	α-helix	trans	-86.2	-33.5	-179.3	-174	-102	0	0	0	113.2	F215 K222	F215-Y218 PolarHBondContact O-N 3.3Å; Y218-K222 PolarHBondContact O-N 2.99Å
219	Q	31.5	Very low	29.7	Very low	94 Å²	94	122.7 Å²	122.7	44%	0.439	59%	0.586	S	S	.	*	H	α-helix	trans	-67.4	-40.8	170.6	-76.2	-175.3	-29.7	0	0	111.3	F215 Q221 K222 S223 D970	F215-Q219 PolarHBondContact O-N 3.31Å; F215-Q219 VanDerWaalsContact O-N 3.1Å; Q219-Q221 PolarHBondContact O-N 2.98Å; Q219-K222 WeakPolarHBondContact O-CB 3.31Å; Q219-K222 PolarHBondContact O-N 2.84Å; Q219-S223 PolarHBondContact O-N 3.06Å; Q219-D970 PolarHBondContact NE2-OD1 2.76Å
220	Y	27	Very low	29.6	Very low	158 Å²	158	129.8 Å²	129.8	62%	0.62	62%	0.623	S	S	*	*	H	α-helix	trans	-63.6	-35.5	176.7	-160.8	-104.2	0	0	0	113.1	K216 K222 S223 I224	K216-Y220 VanDerWaalsContact O-CB 3.25Å; K216-Y220 WeakPolarHBondContact O-CB 3.45Å; K216-Y220 PolarHBondContact O-N 3.14Å; Y220-K222 PolarHBondContact O-N 3.01Å; Y220-S223 PolarHBondContact O-OG 3.31Å; Y220-S223 VanDerWaalsContact O-OG 3.1Å; Y220-I224 HydrophobicContact CD1-CD1 3.62Å; Y220-I224 HydrophobicContact CE1-CD1 3.44Å; Y220-I224 VanDerWaalsContact CE1-CD1 3.44Å; Y220-I224 HydrophobicContact CG-CD1 4.29Å; Y220-I224 WeakPolarHBondContact O-CD1 3.4Å; Y220-I224 WeakPolarHBondContact O-CG1 3.31Å
221	Q	30.4	Very low	29.3	Very low	119 Å²	119	134.4 Å²	134.4	56%	0.556	64%	0.643	S	S	*	*	H	α-helix	trans	-70.8	-11.4	172.8	-77.2	-176.9	3	0	0	114.3	H217 Q219	H217-Q221 WeakPolarHBondContact O-CG 3.43Å; H217-Q221 PolarHBondContact O-N 3.41Å; Q219-Q221 PolarHBondContact O-N 2.98Å
222	K	30.1	Very low	28.9	Very low	155 Å²	155	135 Å²	135	67%	0.674	65%	0.646	S	S	*	*	H	α-helix	trans	-100.2	-26.8	-177.2	-136.7	-176.2	177.7	-157.2	0	113.4	Y218 Q219 Y220	Y218-K222 PolarHBondContact O-N 2.99Å; Q219-K222 WeakPolarHBondContact O-CB 3.31Å; Q219-K222 PolarHBondContact O-N 2.84Å; Y220-K222 PolarHBondContact O-N 3.01Å
223	S	32	Very low	28.8	Very low	78 Å²	78	137.5 Å²	137.5	55%	0.545	66%	0.662	S	S	.	*	H	α-helix	trans	-73.7	-28.7	170.3	49	0	0	0	0	112.7	Q219 Y220 K225	Q219-S223 PolarHBondContact O-N 3.06Å; Y220-S223 PolarHBondContact O-OG 3.31Å; Y220-S223 VanDerWaalsContact O-OG 3.1Å; S223-K225 PolarHBondContact O-N 3.32Å
224	I	28.3	Very low	28.5	Very low	113 Å²	113	139.7 Å²	139.7	58%	0.579	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	25.1	-176.1	-61.1	170	0	0	0	113.1	Y220	Y220-I224 HydrophobicContact CD1-CD1 3.62Å; Y220-I224 HydrophobicContact CE1-CD1 3.44Å; Y220-I224 VanDerWaalsContact CE1-CD1 3.44Å; Y220-I224 HydrophobicContact CG-CD1 4.29Å; Y220-I224 WeakPolarHBondContact O-CD1 3.4Å; Y220-I224 WeakPolarHBondContact O-CG1 3.31Å
225	K	29.2	Very low	28.3	Very low	181 Å²	181	141 Å²	141	79%	0.787	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	16.1	175.4	-74.9	-167.6	174	-177	0	114.9	S223	S223-K225 PolarHBondContact O-N 3.32Å
226	Q	31.2	Very low	28	Very low	174 Å²	174	144 Å²	144	81%	0.813	70%	0.697	S	S	*	*	S	Bend	trans	-137	62.6	170.4	-70.1	-172.9	-50.6	0	0	110.8
227	D	29.1	Very low	27.6	Very low	164 Å²	164	146.6 Å²	146.6	88%	0.877	71%	0.711	S	S	*	*			trans	-156	114.2	143.3	-98.8	-30.5	0	0	0	109.2
228	H	27.3	Very low	27.3	Very low	173 Å²	173	146.8 Å²	146.8	80%	0.801	72%	0.715	S	S	*	*			trans	-81.6	143.6	165.6	-78.2	-87.1	0	0	0	108.1
229	N	27.8	Very low	27.1	Very low	149 Å²	149	149 Å²	149	80%	0.797	72%	0.724	S	S	*	*			trans	84.6	75.2	177.3	-42.9	-28.8	0	0	0	115.6
230	N	29	Very low	26.7	Very low	167 Å²	167	151 Å²	151	89%	0.893	73%	0.733	S	S	*	*				-161.9	146.5	108	-95	-29.1	0	0	0	112.6
231	Q	25.2	Very low	26.5	Very low	168 Å²	168	154.5 Å²	154.5	79%	0.785	75%	0.747	S	S	*	*			trans	-87.1	164	-174.6	-69.8	169.2	-55.7	0	0	112.6
232	L	24	Very low	26.1	Very low	147 Å²	147	154.8 Å²	154.8	77%	0.77	75%	0.752	S	S	*	*			trans	67.8	138.8	157.3	-71.5	141.6	0	0	0	115.2
233	L	25.7	Very low	25.8	Very low	144 Å²	144	155.7 Å²	155.7	75%	0.754	76%	0.759	S	S	*	*			cis	-140.6	150.1	17.4	-138.5	118.4	0	0	0	110.3
234	I	22.4	Very low	25.5	Very low	144 Å²	144	163.1 Å²	163.1	74%	0.738	78%	0.776	S	S	*	*			trans	-70.3	140.5	167.9	-66.9	157.5	0	0	0	108.8
235	N	23.7	Very low	25.3	Very low	146 Å²	146	164.3 Å²	164.3	78%	0.781	78%	0.784	S	S	*	*			trans	-169.7	148.4	139.2	-96.5	-17.8	0	0	0	113.7
236	E	23.1	Very low	25	Very low	175 Å²	175	163.7 Å²	163.7	82%	0.818	78%	0.784	S	S	*	*			trans	-83.9	123.5	-177	-55.6	167.4	130.1	0	0	111.2
237	Q	23	Very low	24.6	Very low	175 Å²	175	163.9 Å²	163.9	82%	0.818	78%	0.784	S	S	*	*			trans	178	139.9	166.1	-94.7	143.4	41.8	0	0	104.5
238	I	24.3	Very low	24.4	Very low	133 Å²	133	166.7 Å²	166.7	68%	0.682	78%	0.784	S	S	*	*			cis	-140.2	106.2	34.9	-63.1	166.3	0	0	0	109.7	H240	I238-H240 WeakPolarHBondContact CG2-O 3.19Å
239	Y	24	Very low	24.1	Very low	172 Å²	172	167.2 Å²	167.2	68%	0.675	79%	0.787	S	S	*	*	S	Bend	trans	-109.6	77.2	147.6	-118.5	-75.6	0	0	0	105.2
240	H	24.1	Very low	23.9	Very low	137 Å²	137	165.2 Å²	165.2	63%	0.634	79%	0.785	S	S	*	*			trans	-171.2	118.5	168.8	-109.6	-86.4	0	0	0	109	I238 D242	I238-H240 WeakPolarHBondContact CG2-O 3.19Å; H240-D242 PolarHBondContact ND1-O 3.37Å
241	Y	23.3	Very low	23.6	Very low	231 Å²	231	164.1 Å²	164.1	91%	0.906	78%	0.784	S	S	*	*			trans	-125.3	44.5	159.7	-107.5	-71.4	0	0	0	108.8
242	D	22.1	Very low	23.5	Very low	125 Å²	125	162.2 Å²	162.2	67%	0.668	78%	0.784	S	S	*	*	S	Bend	trans	-135	135.7	163.9	-82	-49	0	0	0	105.9	H240	H240-D242 PolarHBondContact ND1-O 3.37Å
243	Q	22.9	Very low	23.6	Very low	173 Å²	173	162.4 Å²	162.4	81%	0.808	79%	0.786	S	S	*	*			trans	74.6	94.6	-179.9	-53	-177.7	-22.8	0	0	117.1
244	Y	26.2	Very low	23.6	Very low	234 Å²	234	162.9 Å²	162.9	92%	0.918	79%	0.788	S	S	*	*			trans	-148.8	97.1	136.9	-100.2	-70.9	0	0	0	109.2
245	D	23.1	Very low	23.6	Very low	138 Å²	138	163.1 Å²	163.1	74%	0.738	79%	0.791	S	S	*	*			trans	-106	151.6	172.3	-134.3	-24.6	0	0	0	108.6
246	H	24.4	Very low	23.8	Very low	169 Å²	169	163.6 Å²	163.6	78%	0.782	79%	0.794	S	S	*	*			trans	53.8	103.1	173.5	-60.1	-65.5	0	0	0	119.6
247	Q	22.5	Very low	23.9	Very low	178 Å²	178	161.8 Å²	161.8	83%	0.832	79%	0.788	S	S	*	*				-175.4	159.6	119.8	-101.8	171.3	11.1	0	0	111.5
248	Y	24.4	Very low	24	Very low	222 Å²	222	158.2 Å²	158.2	87%	0.871	78%	0.78	S	S	*	*			trans	103.7	73.2	177.6	-65.1	-70.4	0	0	0	118.1
249	E	21.4	Very low	24	Very low	184 Å²	184	159.2 Å²	159.2	86%	0.86	79%	0.785	S	S	*	*			trans	-71.3	173.1	148.6	-62	175.3	128.7	0	0	111.3
250	S	22.9	Very low	24.3	Very low	108 Å²	108	158.4 Å²	158.4	76%	0.755	79%	0.792	S	S	*	*			trans	79.3	76.7	169.9	73.7	0	0	0	0	119.7
251	V	23.7	Very low	24.8	Very low	144 Å²	144	154.8 Å²	154.8	87%	0.873	78%	0.782	S	S	*	*			trans	-144.1	82.5	130.6	-171.6	0	0	0	0	109.6
252	T	22.8	Very low	25.5	Very low	127 Å²	127	149.1 Å²	149.1	78%	0.779	77%	0.772	S	S	*	*			trans	-96.6	111.4	166.4	47.8	0	0	0	0	109.4
253	N	24.8	Very low	26.4	Very low	151 Å²	151	146.1 Å²	146.1	81%	0.807	76%	0.761	S	S	*	*			trans	160	103.9	151.8	-86.7	-19.7	0	0	0	109.9
254	L	25.7	Very low	27.1	Very low	154 Å²	154	143.3 Å²	143.3	81%	0.806	75%	0.751	S	S	*	*			trans	-169.3	44.1	157	-106.4	161.1	0	0	0	110.9	I257	L254-I257 HydrophobicContact CD2-CD1 4.09Å
255	N	23.8	Very low	28.1	Very low	150 Å²	150	134.8 Å²	134.8	80%	0.802	72%	0.719	S	S	*	*			trans	-84.3	144.4	161.5	-73	-20	0	0	0	108.3
256	N	26.8	Very low	29.3	Very low	156 Å²	156	130.5 Å²	130.5	83%	0.834	70%	0.695	S	S	*	*			trans	78.9	64.9	174.7	-48.1	-19.5	0	0	0	117.7
257	I	25.4	Very low	30.5	Very low	137 Å²	137	127.5 Å²	127.5	70%	0.703	68%	0.682	S	S	*	*			trans	-136.4	123	144	-73	99.2	0	0	0	108.2	L254	L254-I257 HydrophobicContact CD2-CD1 4.09Å
258	P	26.5	Very low	31.7	Very low	100 Å²	100	122.4 Å²	122.4	65%	0.649	66%	0.66	S	S	*	*			trans	-84	178.3	167.2	36.6	-33.6	0	0	0	110.7
259	I	24.2	Very low	32.9	Very low	154 Å²	154	112.6 Å²	112.6	79%	0.79	62%	0.622	S	S	*	*			trans	88.6	108.3	164	-51.6	152.2	0	0	0	116.2
260	N	30.3	Very low	34.2	Very low	154 Å²	154	107.6 Å²	107.6	82%	0.824	60%	0.598	S	S	*	*			trans	46.7	108.6	133.2	-145	2.8	0	0	0	119.7
261	S	34.3	Very low	35.4	Very low	61 Å²	61	106.2 Å²	106.2	43%	0.427	58%	0.583	S	S	.	*			trans	171	154.9	131.5	50	0	0	0	0	112.3	S263 L264	S261-S263 PolarHBondContact O-N 2.98Å; S261-S263 PolarHBondContact OG-OG 3.44Å; S261-L264 PolarHBondContact O-N 2.86Å; S261-L264 VanDerWaalsContact O-N 3.09Å
262	T	38.1	Very low	36.4	Very low	112 Å²	112	101.8 Å²	101.8	69%	0.687	55%	0.554	S	S	*	*	H	α-helix	trans	-50.2	-20.6	166	8.5	0	0	0	0	113.8	L264 F265 I266	T262-L264 PolarHBondContact O-N 3.03Å; T262-F265 PolarHBondContact O-N 3.06Å; T262-I266 WeakPolarHBondContact O-CG1 3.49Å; T262-I266 PolarHBondContact O-N 2.79Å; T262-I266 VanDerWaalsContact O-N 3.07Å
263	S	40.8	Very low	37.6	Very low	63 Å²	63	97.6 Å²	97.6	44%	0.441	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-39.9	175.4	77.6	0	0	0	0	112.7	S261 I266 Q267	S261-S263 PolarHBondContact O-N 2.98Å; S261-S263 PolarHBondContact OG-OG 3.44Å; S263-I266 PolarHBondContact O-N 3.48Å; S263-Q267 WeakPolarHBondContact O-CB 3.19Å; S263-Q267 PolarHBondContact O-N 3.23Å
264	L	37.9	Very low	38.6	Very low	114 Å²	114	97.3 Å²	97.3	60%	0.597	52%	0.518	S	S	*	.	H	α-helix	trans	-69.1	-38.2	-179.5	-161	82.3	0	0	0	111.4	S261 T262 Q267 I268	S261-L264 PolarHBondContact O-N 2.86Å; S261-L264 VanDerWaalsContact O-N 3.09Å; T262-L264 PolarHBondContact O-N 3.03Å; L264-Q267 WeakPolarHBondContact O-CB 3.35Å; L264-Q267 PolarHBondContact O-N 2.8Å; L264-I268 HydrophobicContact CD2-CD1 4.31Å; L264-I268 HydrophobicContact CG-CD1 4.2Å; L264-I268 WeakPolarHBondContact O-CB 3.09Å; L264-I268 WeakPolarHBondContact O-CD1 3.24Å; L264-I268 VanDerWaalsContact O-CG1 3.24Å; L264-I268 WeakPolarHBondContact O-CG1 3.46Å; L264-I268 PolarHBondContact O-N 2.75Å
265	F	45.4	Very low	39.3	Very low	54 Å²	54	97.8 Å²	97.8	24%	0.237	52%	0.516	C	S	.	.	H	α-helix	trans	-62.9	-44.5	174.6	-173.3	-103	0	0	0	111.3	T262 Q267 I268 I269 I296 M328	T262-F265 PolarHBondContact O-N 3.06Å; F265-Q267 PolarHBondContact O-N 3.13Å; F265-I268 PolarHBondContact O-N 2.7Å; F265-I269 HydrophobicContact CD1-CD1 3.98Å; F265-I269 HydrophobicContact CE1-CD1 3.46Å; F265-I269 VanDerWaalsContact CE1-CD1 3.46Å; F265-I269 HydrophobicContact CE2-CD1 4.43Å; F265-I269 HydrophobicContact CZ-CD1 3.73Å; F265-I269 WeakPolarHBondContact O-CG1 3.33Å; F265-I269 PolarHBondContact O-N 3.3Å; F265-I296 HydrophobicContact CE1-CD1 4.15Å; F265-M328 HydrophobicContact CD2-CE 4.47Å
266	I	50.3	Low	40.2	Very low	48 Å²	48	92.5 Å²	92.5	25%	0.246	49%	0.491	C	S	.	.	H	α-helix	trans	-59.5	-44.4	171.5	-71.2	166.5	0	0	0	110.9	T262 S263 I268 I269 Q270 M287	T262-I266 WeakPolarHBondContact O-CG1 3.49Å; T262-I266 PolarHBondContact O-N 2.79Å; T262-I266 VanDerWaalsContact O-N 3.07Å; S263-I266 PolarHBondContact O-N 3.48Å; I266-I268 VanDerWaalsContact C-N 3.35Å; I266-I268 PolarHBondContact O-N 3.41Å; I266-I269 PolarHBondContact O-N 2.96Å; I266-Q270 HydrophobicContact CG2-CG 4.37Å; I266-Q270 WeakPolarHBondContact O-CB 3.1Å; I266-Q270 VanDerWaalsContact O-CG 3.23Å; I266-Q270 WeakPolarHBondContact O-CG 3.33Å; I266-Q270 PolarHBondContact O-N 3.47Å; I266-M287 HydrophobicContact CB-SD 4.36Å; I266-M287 HydrophobicContact CG1-SD 4.39Å; I266-M287 HydrophobicContact CG2-SD 3.88Å
267	Q	48.2	Very low	40.8	Very low	106 Å²	106	93.4 Å²	93.4	50%	0.495	50%	0.495	S	S	.	.	H	α-helix	trans	-61.7	-40.9	178.1	-148	101.3	8.1	0	0	112.1	S263 L264 F265 Q270 N271	S263-Q267 WeakPolarHBondContact O-CB 3.19Å; S263-Q267 PolarHBondContact O-N 3.23Å; L264-Q267 WeakPolarHBondContact O-CB 3.35Å; L264-Q267 PolarHBondContact O-N 2.8Å; F265-Q267 PolarHBondContact O-N 3.13Å; Q267-Q270 PolarHBondContact O-N 3.34Å; Q267-N271 WeakPolarHBondContact O-CB 3.27Å; Q267-N271 PolarHBondContact O-N 2.94Å; Q267-N271 PolarHBondContact O-ND2 2.95Å
268	I	47.2	Very low	41.5	Very low	72 Å²	72	89.8 Å²	89.8	37%	0.369	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-49.3	177.8	-72.3	163.2	0	0	0	110.1	L264 F265 I266 Q270 N271 I272	L264-I268 HydrophobicContact CD2-CD1 4.31Å; L264-I268 HydrophobicContact CG-CD1 4.2Å; L264-I268 WeakPolarHBondContact O-CB 3.09Å; L264-I268 WeakPolarHBondContact O-CD1 3.24Å; L264-I268 VanDerWaalsContact O-CG1 3.24Å; L264-I268 WeakPolarHBondContact O-CG1 3.46Å; L264-I268 PolarHBondContact O-N 2.75Å; F265-I268 PolarHBondContact O-N 2.7Å; I266-I268 VanDerWaalsContact C-N 3.35Å; I266-I268 PolarHBondContact O-N 3.41Å; I268-Q270 VanDerWaalsContact C-N 3.34Å; I268-Q270 PolarHBondContact O-N 3.45Å; I268-N271 PolarHBondContact O-N 2.68Å; I268-I272 HydrophobicContact CG2-CD1 3.67Å; I268-I272 HydrophobicContact CG2-CG1 4.47Å; I268-I272 WeakPolarHBondContact O-CB 3.28Å; I268-I272 VanDerWaalsContact O-CG1 3.28Å; I268-I272 WeakPolarHBondContact O-CG1 3.36Å; I268-I272 PolarHBondContact O-N 2.78Å
269	I	51.2	Low	41.8	Very low	15 Å²	15	88.6 Å²	88.6	8%	0.077	47%	0.469	C	S	.	.	H	α-helix	trans	-65.5	-37.6	177.7	-60	-179.3	0	0	0	111	F265 I266 N271 I272 L273 M287 F292 F301	F265-I269 HydrophobicContact CD1-CD1 3.98Å; F265-I269 HydrophobicContact CE1-CD1 3.46Å; F265-I269 VanDerWaalsContact CE1-CD1 3.46Å; F265-I269 HydrophobicContact CE2-CD1 4.43Å; F265-I269 HydrophobicContact CZ-CD1 3.73Å; F265-I269 WeakPolarHBondContact O-CG1 3.33Å; F265-I269 PolarHBondContact O-N 3.3Å; I266-I269 PolarHBondContact O-N 2.96Å; I269-N271 VanDerWaalsContact C-N 3.34Å; I269-N271 PolarHBondContact O-N 3.08Å; I269-I272 PolarHBondContact O-N 2.76Å; I269-L273 HydrophobicContact CG2-CD1 3.89Å; I269-L273 HydrophobicContact CG2-CG 4.19Å; I269-L273 WeakPolarHBondContact O-CB 3.35Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.47Å; I269-L273 PolarHBondContact O-N 3.18Å; I269-M287 HydrophobicContact CB-CE 3.9Å; I269-M287 HydrophobicContact CB-SD 4.4Å; I269-M287 HydrophobicContact CG2-CE 3.46Å; I269-M287 VanDerWaalsContact CG2-CE 3.46Å; I269-M287 HydrophobicContact CG2-SD 4.42Å; I269-F292 HydrophobicContact CD1-CZ 4.05Å; I269-F292 HydrophobicContact CG2-CZ 4.35Å; I269-F301 HydrophobicContact CD1-CE2 4.32Å; I269-F301 HydrophobicContact CD1-CZ 3.98Å
270	Q	48.5	Very low	42.4	Very low	79 Å²	79	89.6 Å²	89.6	37%	0.369	47%	0.468	S	S	.	.	H	α-helix	trans	-61.1	-39.8	173.7	-77.2	177.7	6.4	0	0	112.6	I266 Q267 I268 K274 M287	I266-Q270 HydrophobicContact CG2-CG 4.37Å; I266-Q270 WeakPolarHBondContact O-CB 3.1Å; I266-Q270 VanDerWaalsContact O-CG 3.23Å; I266-Q270 WeakPolarHBondContact O-CG 3.33Å; I266-Q270 PolarHBondContact O-N 3.47Å; Q267-Q270 PolarHBondContact O-N 3.34Å; I268-Q270 VanDerWaalsContact C-N 3.34Å; I268-Q270 PolarHBondContact O-N 3.45Å; Q270-K274 WeakPolarHBondContact O-CB 2.98Å; Q270-K274 VanDerWaalsContact O-CG 3.27Å; Q270-K274 WeakPolarHBondContact O-CG 3.46Å; Q270-K274 PolarHBondContact O-N 2.78Å; Q270-M287 HydrophobicContact CG-CE 3.88Å; Q270-M287 HydrophobicContact CG-SD 4.1Å
271	N	48.3	Very low	42.7	Very low	80 Å²	80	85.7 Å²	85.7	43%	0.428	45%	0.453	S	S	.	.	H	α-helix	trans	-71.8	-39.4	176.7	-75.3	-18.5	0	0	0	112.1	Q267 I268 I269 K274 Q275	Q267-N271 WeakPolarHBondContact O-CB 3.27Å; Q267-N271 PolarHBondContact O-N 2.94Å; Q267-N271 PolarHBondContact O-ND2 2.95Å; I268-N271 PolarHBondContact O-N 2.68Å; I269-N271 VanDerWaalsContact C-N 3.34Å; I269-N271 PolarHBondContact O-N 3.08Å; N271-K274 PolarHBondContact O-N 2.73Å; N271-Q275 WeakPolarHBondContact O-CG 3.44Å; N271-Q275 PolarHBondContact O-N 3.38Å; N271-Q275 VanDerWaalsContact O-N 3.08Å
272	I	45.1	Very low	43	Very low	51 Å²	51	84.6 Å²	84.6	26%	0.262	44%	0.441	S	S	.	.	H	α-helix	trans	-61.6	-45.3	174.4	-71.2	167.8	0	0	0	110.9	I268 I269 Q275 S276 M308	I268-I272 HydrophobicContact CG2-CD1 3.67Å; I268-I272 HydrophobicContact CG2-CG1 4.47Å; I268-I272 WeakPolarHBondContact O-CB 3.28Å; I268-I272 VanDerWaalsContact O-CG1 3.28Å; I268-I272 WeakPolarHBondContact O-CG1 3.36Å; I268-I272 PolarHBondContact O-N 2.78Å; I269-I272 PolarHBondContact O-N 2.76Å; I272-Q275 PolarHBondContact O-N 3.36Å; I272-S276 PolarHBondContact O-N 2.96Å; I272-M308 HydrophobicContact CG2-CE 3.42Å; I272-M308 VanDerWaalsContact CG2-CE 3.42Å; I272-M308 HydrophobicContact CG2-SD 4.2Å
273	L	46.2	Very low	43.2	Very low	38 Å²	38	84.6 Å²	84.6	20%	0.199	43%	0.433	C	S	.	.	H	α-helix	trans	-65.5	-38	176.8	-71.1	171.3	0	0	0	112.1	I269 Q275 S276 L278 M287	I269-L273 HydrophobicContact CG2-CD1 3.89Å; I269-L273 HydrophobicContact CG2-CG 4.19Å; I269-L273 WeakPolarHBondContact O-CB 3.35Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.47Å; I269-L273 PolarHBondContact O-N 3.18Å; L273-Q275 VanDerWaalsContact C-N 3.29Å; L273-Q275 PolarHBondContact O-N 3.35Å; L273-S276 PolarHBondContact O-N 3.25Å; L273-S276 PolarHBondContact O-OG 3.42Å; L273-L278 HydrophobicContact CD2-CD1 4.13Å; L273-M287 HydrophobicContact CD1-CE 3.61Å
274	K	46.2	Very low	43.2	Very low	145 Å²	145	85.9 Å²	85.9	63%	0.63	44%	0.438	S	S	*	.	H	α-helix	trans	-63.8	-29.3	173.6	-79.8	173.3	-179.1	174.4	0	113.8	Q270 N271	Q270-K274 WeakPolarHBondContact O-CB 2.98Å; Q270-K274 VanDerWaalsContact O-CG 3.27Å; Q270-K274 WeakPolarHBondContact O-CG 3.46Å; Q270-K274 PolarHBondContact O-N 2.78Å; N271-K274 PolarHBondContact O-N 2.73Å
275	Q	40.8	Very low	43.5	Very low	164 Å²	164	83 Å²	83	77%	0.766	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.2	178.6	-71.7	179.9	-7.1	0	0	113.6	N271 I272 L273	N271-Q275 WeakPolarHBondContact O-CG 3.44Å; N271-Q275 PolarHBondContact O-N 3.38Å; N271-Q275 VanDerWaalsContact O-N 3.08Å; I272-Q275 PolarHBondContact O-N 3.36Å; L273-Q275 VanDerWaalsContact C-N 3.29Å; L273-Q275 PolarHBondContact O-N 3.35Å
276	S	42.1	Very low	43.3	Very low	39 Å²	39	84.6 Å²	84.6	27%	0.273	43%	0.43	S	S	.	.	S	Bend	trans	-92.3	141.8	-177.4	73.3	0	0	0	0	112.9	I272 L273 L278	I272-S276 PolarHBondContact O-N 2.96Å; L273-S276 PolarHBondContact O-N 3.25Å; L273-S276 PolarHBondContact O-OG 3.42Å; S276-L278 PolarHBondContact O-N 3.49Å; S276-L278 WeakPolarHBondContact OG-CD1 3.47Å; S276-L278 WeakPolarHBondContact OG-CG 3.26Å
277	N	39.6	Very low	43	Very low	175 Å²	175	83.6 Å²	83.6	94%	0.936	43%	0.425	S	S	*	.			trans	-72.9	34.3	174.2	-82.3	-26.8	0	0	0	113.3
278	L	39.9	Very low	42.7	Very low	61 Å²	61	87 Å²	87	32%	0.319	44%	0.438	S	S	.	.			trans	-79.6	146.5	179.9	-69.9	175.2	0	0	0	111.5	L273 S276 F282	L273-L278 HydrophobicContact CD2-CD1 4.13Å; S276-L278 PolarHBondContact O-N 3.49Å; S276-L278 WeakPolarHBondContact OG-CD1 3.47Å; S276-L278 WeakPolarHBondContact OG-CG 3.26Å; L278-F282 HydrophobicContact CB-CB 3.89Å; L278-F282 HydrophobicContact CB-CD2 4.25Å; L278-F282 HydrophobicContact CB-CG 4.11Å; L278-F282 HydrophobicContact CD1-CB 4.13Å; L278-F282 HydrophobicContact CD1-CD1 4.31Å; L278-F282 HydrophobicContact CD1-CG 4.25Å
279	P	33.4	Very low	42.8	Very low	75 Å²	75	84.5 Å²	84.5	49%	0.487	43%	0.427	S	S	.	.			trans	-53.6	148	172.7	-25.3	32.3	0	0	0	112.7	S281 F282	P279-S281 PolarHBondContact O-N 3.49Å; P279-F282 HydrophobicContact CB-CD2 4.02Å; P279-F282 HydrophobicContact CB-CE2 4.35Å; P279-F282 HydrophobicContact CG-CD2 4.06Å; P279-F282 HydrophobicContact CG-CE2 4.03Å; P279-F282 WeakPolarHBondContact O-CB 3.06Å; P279-F282 PolarHBondContact O-N 2.82Å
280	K	36.6	Very low	42.5	Very low	175 Å²	175	88 Å²	88	76%	0.761	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-54.6	-22.6	-177.6	-76.4	-175	174.9	-179	0	114.8	F282 Q283	K280-F282 VanDerWaalsContact C-N 3.25Å; K280-F282 PolarHBondContact O-N 3Å; K280-Q283 PolarHBondContact O-N 3.19Å
281	S	37.4	Very low	42.3	Very low	73 Å²	73	87 Å²	87	51%	0.51	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-61.1	-28.9	172.2	46.7	0	0	0	0	113.8	P279	P279-S281 PolarHBondContact O-N 3.49Å
282	F	39.6	Very low	42.3	Very low	38 Å²	38	84 Å²	84	17%	0.167	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-76.8	-19	178.9	-74	-90.8	0	0	0	113.8	L278 P279 K280 V284 M381	L278-F282 HydrophobicContact CB-CB 3.89Å; L278-F282 HydrophobicContact CB-CD2 4.25Å; L278-F282 HydrophobicContact CB-CG 4.11Å; L278-F282 HydrophobicContact CD1-CB 4.13Å; L278-F282 HydrophobicContact CD1-CD1 4.31Å; L278-F282 HydrophobicContact CD1-CG 4.25Å; P279-F282 HydrophobicContact CB-CD2 4.02Å; P279-F282 HydrophobicContact CB-CE2 4.35Å; P279-F282 HydrophobicContact CG-CD2 4.06Å; P279-F282 HydrophobicContact CG-CE2 4.03Å; P279-F282 WeakPolarHBondContact O-CB 3.06Å; P279-F282 PolarHBondContact O-N 2.82Å; K280-F282 VanDerWaalsContact C-N 3.25Å; K280-F282 PolarHBondContact O-N 3Å; F282-V284 PolarHBondContact O-N 3.08Å; F282-M381 HydrophobicContact CE1-CE 4.32Å; F282-M381 HydrophobicContact CE1-CG 3.79Å; F282-M381 HydrophobicContact CE1-SD 3.64Å; F282-M381 HydrophobicContact CZ-CG 4.19Å; F282-M381 HydrophobicContact CZ-SD 4.22Å
283	Q	42.5	Very low	42.6	Very low	111 Å²	111	87.9 Å²	87.9	52%	0.519	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-78.9	1.3	-176.7	-64.1	-179.3	-17.4	0	0	113.5	K280	K280-Q283 PolarHBondContact O-N 3.19Å
284	V	40.5	Very low	42.6	Very low	91 Å²	91	93.7 Å²	93.7	55%	0.552	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-107.7	9.6	-169.8	-164.1	0	0	0	0	112.5	F282 N286 F370	F282-V284 PolarHBondContact O-N 3.08Å; V284-N286 PolarHBondContact O-N 2.86Å; V284-F370 HydrophobicContact CG1-CE2 4.32Å
285	W	44.6	Very low	42.7	Very low	54 Å²	54	87.6 Å²	87.6	21%	0.205	45%	0.445	C	S	.	.			trans	-66.3	119.5	-178.3	-85.5	24.4	0	0	0	113.1	M287 F292 F295 M381	W285-M287 PolarHBondContact O-N 2.75Å; W285-F292 AromaticContact CE3-CD2 3.56Å; W285-F292 HydrophobicContact CE3-CD2 3.56Å; W285-F292 AromaticContact CE3-CE2 3.75Å; W285-F292 HydrophobicContact CE3-CE2 3.75Å; W285-F292 AromaticContact CZ3-CD2 3.66Å; W285-F292 HydrophobicContact CZ3-CD2 3.66Å; W285-F292 AromaticContact CZ3-CE2 3.87Å; W285-F292 HydrophobicContact CZ3-CE2 3.87Å; W285-F295 HydrophobicContact CH2-CD1 4.11Å; W285-F295 HydrophobicContact CH2-CD2 4.3Å; W285-F295 HydrophobicContact CH2-CE1 4.06Å; W285-F295 HydrophobicContact CH2-CE2 4.27Å; W285-F295 HydrophobicContact CH2-CG 4.22Å; W285-F295 HydrophobicContact CH2-CZ 4.15Å; W285-F295 AromaticContact CZ3-CD1 3.73Å; W285-F295 HydrophobicContact CZ3-CD1 3.73Å; W285-F295 AromaticContact CZ3-CE1 3.77Å; W285-F295 HydrophobicContact CZ3-CE1 3.77Å; W285-F295 HydrophobicContact CZ3-CG 4.23Å; W285-F295 HydrophobicContact CZ3-CZ 4.32Å; W285-M381 HydrophobicContact CH2-CE 4.37Å
286	N	41.5	Very low	43.1	Very low	86 Å²	86	81.4 Å²	81.4	46%	0.46	42%	0.417	S	S	.	.			trans	-76.1	102.9	169.8	-175.8	-1.3	0	0	0	109.7	V284 K288 S289 F370	V284-N286 PolarHBondContact O-N 2.86Å; N286-K288 PolarHBondContact O-N 3.13Å; N286-K288 PolarHBondContact OD1-N 3.46Å; N286-S289 PolarHBondContact O-N 3.13Å; N286-S289 VanDerWaalsContact O-N 3.07Å; N286-S289 PolarHBondContact O-OG 3.08Å; N286-F370 HydrophobicContact CB-CE1 4Å; N286-F370 HydrophobicContact CB-CZ 4.3Å
287	M	42.8	Very low	43.4	Very low	27 Å²	27	82.6 Å²	82.6	13%	0.133	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	1.7	-176.9	-65.6	-174.8	177.9	0	0	115	I266 I269 Q270 L273 W285 F292	I266-M287 HydrophobicContact CB-SD 4.36Å; I266-M287 HydrophobicContact CG1-SD 4.39Å; I266-M287 HydrophobicContact CG2-SD 3.88Å; I269-M287 HydrophobicContact CB-CE 3.9Å; I269-M287 HydrophobicContact CB-SD 4.4Å; I269-M287 HydrophobicContact CG2-CE 3.46Å; I269-M287 VanDerWaalsContact CG2-CE 3.46Å; I269-M287 HydrophobicContact CG2-SD 4.42Å; Q270-M287 HydrophobicContact CG-CE 3.88Å; Q270-M287 HydrophobicContact CG-SD 4.1Å; L273-M287 HydrophobicContact CD1-CE 3.61Å; W285-M287 PolarHBondContact O-N 2.75Å; M287-F292 HydrophobicContact CB-CD1 4.07Å; M287-F292 HydrophobicContact CB-CE1 3.98Å; M287-F292 HydrophobicContact CG-CD1 4.34Å; M287-F292 HydrophobicContact CG-CE1 3.95Å; M287-F292 HydrophobicContact CG-CZ 4.14Å; M287-F292 HydrophobicContact SD-CE1 4.46Å; M287-F292 HydrophobicContact SD-CZ 4.46Å
288	K	42.6	Very low	43.8	Very low	178 Å²	178	78 Å²	78	77%	0.774	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	8.3	170.2	-64.5	-172.2	175.2	-173.8	0	113.5	N286	N286-K288 PolarHBondContact O-N 3.13Å; N286-K288 PolarHBondContact OD1-N 3.46Å
289	S	49.6	Very low	44.1	Very low	19 Å²	19	81 Å²	81	13%	0.133	42%	0.417	C	S	.	.	S	Bend	trans	-80.9	141.1	179.2	76.6	0	0	0	0	111.5	N286 L291 F292 E293	N286-S289 PolarHBondContact O-N 3.13Å; N286-S289 VanDerWaalsContact O-N 3.07Å; N286-S289 PolarHBondContact O-OG 3.08Å; S289-L291 PolarHBondContact O-N 2.96Å; S289-L291 VanDerWaalsContact O-N 3.14Å; S289-F292 WeakPolarHBondContact O-CB 3.25Å; S289-F292 PolarHBondContact O-N 3.45Å; S289-F292 PolarHBondContact OG-N 3.29Å; S289-E293 PolarHBondContact O-N 3.49Å
290	P	44.9	Very low	44.6	Very low	90 Å²	90	78.8 Å²	78.8	58%	0.584	40%	0.403	S	S	*	.	H	α-helix	trans	-64	-17.4	173.5	24.9	-33.7	0	0	0	112.6	K294	P290-K294 WeakPolarHBondContact O-CB 3.23Å; P290-K294 PolarHBondContact O-N 3.24Å
291	L	43.2	Very low	45	Very low	58 Å²	58	71 Å²	71	30%	0.304	37%	0.369	S	S	.	.	H	α-helix	trans	-68.5	-32.7	169.2	-76.6	165.6	0	0	0	112.5	S289 F295 Q374 L378	S289-L291 PolarHBondContact O-N 2.96Å; S289-L291 VanDerWaalsContact O-N 3.14Å; L291-F295 WeakPolarHBondContact O-CB 3.23Å; L291-F295 PolarHBondContact O-N 3.46Å; L291-Q374 HydrophobicContact CD1-CB 4.22Å; L291-Q374 VanDerWaalsContact CD1-OE1 3.31Å; L291-L378 HydrophobicContact CD2-CD1 4.3Å
292	F	50.1	Low	45.3	Very low	15 Å²	15	70.3 Å²	70.3	7%	0.066	36%	0.36	C	S	.	.	H	α-helix	trans	-74.2	-38.4	175.1	-171.8	-114.7	0	0	0	111.7	I269 W285 M287 S289 K294 F295 I296	I269-F292 HydrophobicContact CD1-CZ 4.05Å; I269-F292 HydrophobicContact CG2-CZ 4.35Å; W285-F292 AromaticContact CE3-CD2 3.56Å; W285-F292 HydrophobicContact CE3-CD2 3.56Å; W285-F292 AromaticContact CE3-CE2 3.75Å; W285-F292 HydrophobicContact CE3-CE2 3.75Å; W285-F292 AromaticContact CZ3-CD2 3.66Å; W285-F292 HydrophobicContact CZ3-CD2 3.66Å; W285-F292 AromaticContact CZ3-CE2 3.87Å; W285-F292 HydrophobicContact CZ3-CE2 3.87Å; M287-F292 HydrophobicContact CB-CD1 4.07Å; M287-F292 HydrophobicContact CB-CE1 3.98Å; M287-F292 HydrophobicContact CG-CD1 4.34Å; M287-F292 HydrophobicContact CG-CE1 3.95Å; M287-F292 HydrophobicContact CG-CZ 4.14Å; M287-F292 HydrophobicContact SD-CE1 4.46Å; M287-F292 HydrophobicContact SD-CZ 4.46Å; S289-F292 WeakPolarHBondContact O-CB 3.25Å; S289-F292 PolarHBondContact O-N 3.45Å; S289-F292 PolarHBondContact OG-N 3.29Å; F292-K294 VanDerWaalsContact C-N 3.34Å; F292-F295 HydrophobicContact CD2-CD1 4.27Å; F292-F295 HydrophobicContact CE2-CD1 4.29Å; F292-F295 WeakPolarHBondContact O-CB 3.38Å; F292-F295 PolarHBondContact O-N 3.18Å; F292-I296 HydrophobicContact CD1-CD1 3.92Å; F292-I296 HydrophobicContact CE1-CD1 3.54Å; F292-I296 HydrophobicContact CE1-CG1 4.47Å; F292-I296 HydrophobicContact CZ-CD1 3.91Å; F292-I296 HydrophobicContact CZ-CG1 4.48Å; F292-I296 WeakPolarHBondContact O-CG1 3.49Å; F292-I296 PolarHBondContact O-N 2.93Å
293	E	50.2	Low	45.4	Very low	133 Å²	133	74.3 Å²	74.3	62%	0.621	38%	0.375	S	S	*	.	H	α-helix	trans	-61.4	-43.3	171	-65.3	178.2	153.1	0	0	111.2	S289 F295 I296 A297	S289-E293 PolarHBondContact O-N 3.49Å; E293-F295 VanDerWaalsContact C-N 3.32Å; E293-F295 PolarHBondContact O-N 3.45Å; E293-I296 PolarHBondContact O-N 3.13Å; E293-A297 WeakPolarHBondContact O-CB 3.45Å; E293-A297 PolarHBondContact O-N 3.34Å
294	K	47.4	Very low	45.3	Very low	161 Å²	161	71.5 Å²	71.5	70%	0.7	36%	0.363	S	S	*	.	H	α-helix	trans	-64.8	-33.5	174.8	-146.6	170.2	-169.4	175.4	0	112.7	P290 F292 D298	P290-K294 WeakPolarHBondContact O-CB 3.23Å; P290-K294 PolarHBondContact O-N 3.24Å; F292-K294 VanDerWaalsContact C-N 3.34Å; K294-D298 WeakPolarHBondContact O-CB 3.21Å; K294-D298 PolarHBondContact O-N 3.33Å; K294-D298 VanDerWaalsContact O-N 3.14Å
295	F	47.6	Very low	45.5	Very low	17 Å²	17	70 Å²	70	8%	0.075	35%	0.351	C	S	.	.	H	α-helix	trans	-70.6	-32.8	174.4	176.7	-104.1	0	0	0	113.3	W285 L291 F292 E293 F301 L304 L378 M381	W285-F295 HydrophobicContact CH2-CD1 4.11Å; W285-F295 HydrophobicContact CH2-CD2 4.3Å; W285-F295 HydrophobicContact CH2-CE1 4.06Å; W285-F295 HydrophobicContact CH2-CE2 4.27Å; W285-F295 HydrophobicContact CH2-CG 4.22Å; W285-F295 HydrophobicContact CH2-CZ 4.15Å; W285-F295 AromaticContact CZ3-CD1 3.73Å; W285-F295 HydrophobicContact CZ3-CD1 3.73Å; W285-F295 AromaticContact CZ3-CE1 3.77Å; W285-F295 HydrophobicContact CZ3-CE1 3.77Å; W285-F295 HydrophobicContact CZ3-CG 4.23Å; W285-F295 HydrophobicContact CZ3-CZ 4.32Å; L291-F295 WeakPolarHBondContact O-CB 3.23Å; L291-F295 PolarHBondContact O-N 3.46Å; F292-F295 HydrophobicContact CD2-CD1 4.27Å; F292-F295 HydrophobicContact CE2-CD1 4.29Å; F292-F295 WeakPolarHBondContact O-CB 3.38Å; F292-F295 PolarHBondContact O-N 3.18Å; E293-F295 VanDerWaalsContact C-N 3.32Å; E293-F295 PolarHBondContact O-N 3.45Å; F295-F301 HydrophobicContact CD1-CD2 4.11Å; F295-F301 AromaticContact CE1-CD2 3.73Å; F295-F301 HydrophobicContact CE1-CD2 3.73Å; F295-F301 HydrophobicContact CE1-CE2 4.4Å; F295-L304 HydrophobicContact CZ-CD2 4.39Å; F295-L378 HydrophobicContact CD2-CD2 4.38Å; F295-M381 HydrophobicContact CE2-CE 4.08Å; F295-M381 HydrophobicContact CZ-CE 4.03Å
296	I	49.3	Very low	45.3	Very low	34 Å²	34	75 Å²	75	17%	0.174	38%	0.377	C	S	.	.	H	α-helix	trans	-75.1	-36.7	173.1	-70.2	171.3	0	0	0	111.5	F265 F292 E293 F301	F265-I296 HydrophobicContact CE1-CD1 4.15Å; F292-I296 HydrophobicContact CD1-CD1 3.92Å; F292-I296 HydrophobicContact CE1-CD1 3.54Å; F292-I296 HydrophobicContact CE1-CG1 4.47Å; F292-I296 HydrophobicContact CZ-CD1 3.91Å; F292-I296 HydrophobicContact CZ-CG1 4.48Å; F292-I296 WeakPolarHBondContact O-CG1 3.49Å; F292-I296 PolarHBondContact O-N 2.93Å; E293-I296 PolarHBondContact O-N 3.13Å; I296-F301 HydrophobicContact CG1-CD2 4.19Å; I296-F301 HydrophobicContact CG1-CE2 4.41Å
297	A	48.9	Very low	45	Very low	64 Å²	64	73 Å²	73	53%	0.529	37%	0.369	S	S	.	.	H	α-helix	trans	-70.6	-31.1	179.2	0	0	0	0	0	113.3	E293	E293-A297 WeakPolarHBondContact O-CB 3.45Å; E293-A297 PolarHBondContact O-N 3.34Å
298	D	46.3	Very low	44.4	Very low	79 Å²	79	75.2 Å²	75.2	42%	0.422	38%	0.38	S	S	.	.	S	Bend	trans	-79.9	148.4	178.5	-172.6	23.4	0	0	0	112	K294 S300 F301	K294-D298 WeakPolarHBondContact O-CB 3.21Å; K294-D298 PolarHBondContact O-N 3.33Å; K294-D298 VanDerWaalsContact O-N 3.14Å; D298-S300 PolarHBondContact O-N 3.49Å; D298-S300 PolarHBondContact OD2-OG 3.49Å; D298-F301 PolarHBondContact O-N 3.5Å
299	Q	46.6	Very low	43.8	Very low	123 Å²	123	71.4 Å²	71.4	58%	0.575	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.2	-176	-68.6	-172.1	-8.1	0	0	113	F301 N302 Y303	Q299-F301 PolarHBondContact O-N 2.82Å; Q299-F301 VanDerWaalsContact O-N 3.14Å; Q299-N302 PolarHBondContact O-N 3.36Å; Q299-Y303 HydrophobicContact CB-CD2 4.35Å; Q299-Y303 HydrophobicContact CB-CE2 3.99Å; Q299-Y303 WeakPolarHBondContact O-CD2 3.14Å; Q299-Y303 PolarHBondContact O-N 2.97Å
300	S	44.2	Very low	43	Very low	28 Å²	28	77.3 Å²	77.3	20%	0.196	41%	0.409	C	S	.	.	H	α-helix	trans	-36.9	-42.8	168.2	-63.9	0	0	0	0	115	D298 L304	D298-S300 PolarHBondContact O-N 3.49Å; D298-S300 PolarHBondContact OD2-OG 3.49Å; S300-L304 PolarHBondContact O-N 2.77Å; S300-L304 VanDerWaalsContact O-N 3.12Å
301	F	44.2	Very low	42.2	Very low	13 Å²	13	77 Å²	77	6%	0.057	41%	0.406	C	S	.	.	H	α-helix	trans	-72.8	-36.5	-179.9	-165.2	-98.4	0	0	0	113.4	I269 F295 I296 D298 Q299 Y303 L304 L305 M329	I269-F301 HydrophobicContact CD1-CE2 4.32Å; I269-F301 HydrophobicContact CD1-CZ 3.98Å; F295-F301 HydrophobicContact CD1-CD2 4.11Å; F295-F301 AromaticContact CE1-CD2 3.73Å; F295-F301 HydrophobicContact CE1-CD2 3.73Å; F295-F301 HydrophobicContact CE1-CE2 4.4Å; I296-F301 HydrophobicContact CG1-CD2 4.19Å; I296-F301 HydrophobicContact CG1-CE2 4.41Å; D298-F301 PolarHBondContact O-N 3.5Å; Q299-F301 PolarHBondContact O-N 2.82Å; Q299-F301 VanDerWaalsContact O-N 3.14Å; F301-Y303 VanDerWaalsContact C-N 3.32Å; F301-Y303 PolarHBondContact O-N 3.06Å; F301-L304 WeakPolarHBondContact O-CA 3.26Å; F301-L304 WeakPolarHBondContact O-CB 3.49Å; F301-L304 PolarHBondContact O-N 2.87Å; F301-L304 VanDerWaalsContact O-N 3.09Å; F301-L305 HydrophobicContact CD1-CD1 4.18Å; F301-L305 HydrophobicContact CE1-CD1 3.62Å; F301-L305 HydrophobicContact CZ-CD1 4.19Å; F301-L305 PolarHBondContact O-N 3.39Å; F301-M329 HydrophobicContact CD1-CE 3.8Å; F301-M329 HydrophobicContact CD1-SD 3.85Å; F301-M329 HydrophobicContact CE1-SD 4.1Å
302	N	45.5	Very low	41.6	Very low	58 Å²	58	84.8 Å²	84.8	31%	0.31	44%	0.437	S	S	.	.	H	α-helix	trans	-65.9	-35.9	175.3	-75.9	-18.6	0	0	0	111.6	Q299 L304 L305 H306 M329	Q299-N302 PolarHBondContact O-N 3.36Å; N302-L304 VanDerWaalsContact C-N 3.34Å; N302-L305 PolarHBondContact O-N 2.96Å; N302-H306 PolarHBondContact O-N 3.32Å; N302-M329 VanDerWaalsContact OD1-CE 3.26Å; N302-M329 WeakPolarHBondContact OD1-CE 3.3Å
303	Y	40.6	Very low	40.5	Very low	122 Å²	122	93 Å²	93	48%	0.478	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-38.3	170	-71.1	-70.6	0	0	0	112	Q299 F301 H306 C307	Q299-Y303 HydrophobicContact CB-CD2 4.35Å; Q299-Y303 HydrophobicContact CB-CE2 3.99Å; Q299-Y303 WeakPolarHBondContact O-CD2 3.14Å; Q299-Y303 PolarHBondContact O-N 2.97Å; F301-Y303 VanDerWaalsContact C-N 3.32Å; F301-Y303 PolarHBondContact O-N 3.06Å; Y303-H306 PolarHBondContact O-N 3.44Å; Y303-C307 PolarHBondContact O-N 3.25Å; Y303-C307 PolarHBondContact O-SG 3.2Å
304	L	39.9	Very low	39.5	Very low	51 Å²	51	90 Å²	90	27%	0.267	47%	0.469	S	S	.	.	H	α-helix	trans	-65	-39.4	175.4	-153.6	90.9	0	0	0	112.2	F295 S300 F301 N302 C307 M381	F295-L304 HydrophobicContact CZ-CD2 4.39Å; S300-L304 PolarHBondContact O-N 2.77Å; S300-L304 VanDerWaalsContact O-N 3.12Å; F301-L304 WeakPolarHBondContact O-CA 3.26Å; F301-L304 WeakPolarHBondContact O-CB 3.49Å; F301-L304 PolarHBondContact O-N 2.87Å; F301-L304 VanDerWaalsContact O-N 3.09Å; N302-L304 VanDerWaalsContact C-N 3.34Å; L304-C307 WeakPolarHBondContact O-CB 3.43Å; L304-C307 PolarHBondContact O-N 3.44Å; L304-M381 HydrophobicContact CD1-CE 4.43Å
305	L	44.8	Very low	38.6	Very low	60 Å²	60	88 Å²	88	31%	0.314	48%	0.475	S	S	.	.	H	α-helix	trans	-63	-43.6	173.8	-127.7	83.4	0	0	0	111.4	F301 N302 C307 M308 I325	F301-L305 HydrophobicContact CD1-CD1 4.18Å; F301-L305 HydrophobicContact CE1-CD1 3.62Å; F301-L305 HydrophobicContact CZ-CD1 4.19Å; F301-L305 PolarHBondContact O-N 3.39Å; N302-L305 PolarHBondContact O-N 2.96Å; L305-C307 PolarHBondContact O-N 2.79Å; L305-M308 WeakPolarHBondContact O-CB 3.5Å; L305-M308 WeakPolarHBondContact O-CG 3.39Å; L305-M308 PolarHBondContact O-N 3.23Å; L305-I325 HydrophobicContact CD2-CG2 4.47Å
306	H	41.3	Very low	37.8	Very low	159 Å²	159	95.5 Å²	95.5	74%	0.736	51%	0.508	S	S	*	.	H	α-helix	trans	-67.7	-16.2	174.9	-92.5	-66.8	0	0	0	114.3	N302 Y303 M308	N302-H306 PolarHBondContact O-N 3.32Å; Y303-H306 PolarHBondContact O-N 3.44Å; H306-M308 VanDerWaalsContact C-N 3.33Å
307	C	34	Very low	36.9	Very low	45 Å²	45	98.3 Å²	98.3	30%	0.304	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-10	174.4	-71	0	0	0	0	114.1	Y303 L304 L305 Q392	Y303-C307 PolarHBondContact O-N 3.25Å; Y303-C307 PolarHBondContact O-SG 3.2Å; L304-C307 WeakPolarHBondContact O-CB 3.43Å; L304-C307 PolarHBondContact O-N 3.44Å; L305-C307 PolarHBondContact O-N 2.79Å; C307-Q392 PolarHBondContact SG-NE2 2.99Å; C307-Q392 PolarHBondContact SG-OE1 2.77Å
308	M	31.2	Very low	36.1	Very low	73 Å²	73	99.8 Å²	99.8	36%	0.36	52%	0.522	S	S	.	.	S	Bend	trans	-69	136.9	-177.3	-64.1	-72	170	0	0	111.6	I272 L305 H306 T310	I272-M308 HydrophobicContact CG2-CE 3.42Å; I272-M308 VanDerWaalsContact CG2-CE 3.42Å; I272-M308 HydrophobicContact CG2-SD 4.2Å; L305-M308 WeakPolarHBondContact O-CB 3.5Å; L305-M308 WeakPolarHBondContact O-CG 3.39Å; L305-M308 PolarHBondContact O-N 3.23Å; H306-M308 VanDerWaalsContact C-N 3.33Å; M308-T310 PolarHBondContact O-N 3.49Å; M308-T310 VanDerWaalsContact O-N 3.11Å
309	P	30.4	Very low	35.4	Very low	97 Å²	97	104.8 Å²	104.8	63%	0.63	54%	0.537	S	S	*	.			trans	-64.7	112.8	178.3	-20	32	0	0	0	112	T311	P309-T311 HydrophobicContact CB-CG2 4.34Å; P309-T311 PolarHBondContact O-N 3.45Å
310	T	32.8	Very low	34.8	Very low	143 Å²	143	103.5 Å²	103.5	88%	0.877	53%	0.534	S	S	*	.			trans	-80.1	44.6	171.6	44.8	0	0	0	0	112	M308	M308-T310 PolarHBondContact O-N 3.49Å; M308-T310 VanDerWaalsContact O-N 3.11Å
311	T	28.2	Very low	34.6	Very low	85 Å²	85	105.5 Å²	105.5	52%	0.521	54%	0.542	S	S	.	.			trans	-76.8	130.2	175.8	42.6	0	0	0	0	110.7	P309 Q313	P309-T311 HydrophobicContact CB-CG2 4.34Å; P309-T311 PolarHBondContact O-N 3.45Å; T311-Q313 PolarHBondContact O-N 3.49Å
312	K	30.6	Very low	34.5	Very low	220 Å²	220	108.4 Å²	108.4	96%	0.957	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	15.6	-176.8	-73.8	-176	171.1	-177.2	0	116.3
313	Q	26.9	Very low	34.4	Very low	187 Å²	187	110.3 Å²	110.3	87%	0.874	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	-1.6	-173.1	-74.3	175.3	-36.7	0	0	114.4	T311	T311-Q313 PolarHBondContact O-N 3.49Å
314	S	28.8	Very low	34.7	Very low	70 Å²	70	110.4 Å²	110.4	49%	0.49	57%	0.569	S	S	.	*			trans	-104.4	92.4	175	57.7	0	0	0	0	111.9	F316	S314-F316 PolarHBondContact O-N 3.38Å
315	S	27.9	Very low	35	Very low	120 Å²	120	110 Å²	110	84%	0.839	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	26.1	-175.4	59.9	0	0	0	0	115.8
316	F	30.8	Very low	35.1	Very low	175 Å²	175	109.9 Å²	109.9	77%	0.768	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	-8.9	-170.1	-97	-87.3	0	0	0	115.4	S314	S314-F316 PolarHBondContact O-N 3.38Å
317	L	30.7	Very low	35.6	Very low	93 Å²	93	107.2 Å²	107.2	49%	0.487	56%	0.559	S	S	.	*			trans	-124.4	91.2	179.9	-80.4	157.1	0	0	0	109.7	I322	L317-I322 HydrophobicContact CB-CD1 4.44Å; L317-I322 HydrophobicContact CD2-CG1 4.35Å
318	N	32.2	Very low	36.3	Very low	95 Å²	95	110 Å²	110	51%	0.508	57%	0.569	S	S	.	*			trans	-65.7	143	172.2	-165.6	-1.9	0	0	0	109.6	N320 N321 I322	N318-N320 PolarHBondContact O-N 3.07Å; N318-N321 WeakPolarHBondContact O-CB 3.27Å; N318-N321 PolarHBondContact O-N 3.4Å; N318-I322 PolarHBondContact O-N 3.48Å
319	Y	31.3	Very low	36.8	Very low	184 Å²	184	107.2 Å²	107.2	72%	0.722	56%	0.555	S	S	*	*	H	α-helix	trans	-57.4	-36.3	-177.4	-153.5	-91.1	0	0	0	111.4	N321 I322 Q323	Y319-N321 VanDerWaalsContact C-N 3.29Å; Y319-N321 PolarHBondContact O-N 3.18Å; Y319-I322 PolarHBondContact O-N 2.92Å; Y319-Q323 PolarHBondContact O-N 2.95Å
320	N	33.6	Very low	37.6	Very low	96 Å²	96	107.9 Å²	107.9	51%	0.513	55%	0.55	S	S	.	.	H	α-helix	trans	-60.3	-33.2	173.8	-64	-0.7	0	0	0	113.3	N318 Q323 Q324	N318-N320 PolarHBondContact O-N 3.07Å; N320-Q323 PolarHBondContact O-N 3.44Å; N320-Q324 WeakPolarHBondContact O-CB 3.36Å; N320-Q324 VanDerWaalsContact O-CG 3.31Å; N320-Q324 WeakPolarHBondContact O-CG 3.3Å; N320-Q324 PolarHBondContact O-N 3.15Å
321	N	41.1	Very low	38.5	Very low	69 Å²	69	105 Å²	105	37%	0.369	54%	0.536	S	S	.	.	H	α-helix	trans	-73.9	-37.3	179.5	-62.1	9.3	0	0	0	110.8	N318 Y319 Q323 I325	N318-N321 WeakPolarHBondContact O-CB 3.27Å; N318-N321 PolarHBondContact O-N 3.4Å; Y319-N321 VanDerWaalsContact C-N 3.29Å; Y319-N321 PolarHBondContact O-N 3.18Å; N321-Q323 VanDerWaalsContact C-N 3.33Å; N321-I325 WeakPolarHBondContact O-CB 3.19Å; N321-I325 WeakPolarHBondContact O-CD1 3.5Å; N321-I325 WeakPolarHBondContact O-CG1 2.96Å; N321-I325 PolarHBondContact O-N 3.36Å
322	I	40.9	Very low	39.3	Very low	74 Å²	74	105.1 Å²	105.1	38%	0.379	53%	0.532	S	S	.	.	H	α-helix	trans	-65.8	-41.1	175.1	-62.2	174.2	0	0	0	109.7	L317 N318 Y319 I325 S326	L317-I322 HydrophobicContact CB-CD1 4.44Å; L317-I322 HydrophobicContact CD2-CG1 4.35Å; N318-I322 PolarHBondContact O-N 3.48Å; Y319-I322 PolarHBondContact O-N 2.92Å; I322-I325 PolarHBondContact O-N 3.36Å; I322-S326 PolarHBondContact O-N 2.83Å
323	Q	44.9	Very low	39.7	Very low	99 Å²	99	98 Å²	98	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-43.5	177.6	-166.2	166.2	-22.4	0	0	112.2	Y319 N320 N321 I325 S326 E327	Y319-Q323 PolarHBondContact O-N 2.95Å; N320-Q323 PolarHBondContact O-N 3.44Å; N321-Q323 VanDerWaalsContact C-N 3.33Å; Q323-I325 VanDerWaalsContact C-N 3.35Å; Q323-I325 PolarHBondContact O-N 3Å; Q323-S326 WeakPolarHBondContact O-CB 3.29Å; Q323-S326 PolarHBondContact O-N 3.11Å; Q323-E327 PolarHBondContact NE2-OE1 3.04Å; Q323-E327 WeakPolarHBondContact O-CG 3.26Å; Q323-E327 PolarHBondContact O-N 3.28Å
324	Q	46.1	Very low	40.5	Very low	124 Å²	124	94.1 Å²	94.1	58%	0.579	49%	0.488	S	S	*	.	H	α-helix	trans	-61.3	-38.5	172.3	-77.2	176.7	-9.6	0	0	113.1	N320 M328	N320-Q324 WeakPolarHBondContact O-CB 3.36Å; N320-Q324 VanDerWaalsContact O-CG 3.31Å; N320-Q324 WeakPolarHBondContact O-CG 3.3Å; N320-Q324 PolarHBondContact O-N 3.15Å; Q324-M328 VanDerWaalsContact O-CB 3.25Å; Q324-M328 WeakPolarHBondContact O-CB 3.41Å; Q324-M328 PolarHBondContact O-N 2.82Å
325	I	46.2	Very low	41	Very low	42 Å²	42	92.9 Å²	92.9	22%	0.215	49%	0.485	C	S	.	.	H	α-helix	trans	-66.2	-39.5	175	-70.6	164	0	0	0	110.7	L305 N321 I322 Q323 M329	L305-I325 HydrophobicContact CD2-CG2 4.47Å; N321-I325 WeakPolarHBondContact O-CB 3.19Å; N321-I325 WeakPolarHBondContact O-CD1 3.5Å; N321-I325 WeakPolarHBondContact O-CG1 2.96Å; N321-I325 PolarHBondContact O-N 3.36Å; I322-I325 PolarHBondContact O-N 3.36Å; Q323-I325 VanDerWaalsContact C-N 3.35Å; Q323-I325 PolarHBondContact O-N 3Å; I325-M329 HydrophobicContact CG2-SD 4.45Å; I325-M329 WeakPolarHBondContact O-CB 3.4Å; I325-M329 WeakPolarHBondContact O-CG 3.38Å; I325-M329 PolarHBondContact O-N 3.36Å
326	S	47.8	Very low	41.4	Very low	58 Å²	58	95.1 Å²	95.1	41%	0.406	48%	0.477	S	S	.	.	H	α-helix	trans	-63.3	-49.7	175.3	-165.6	0	0	0	0	112.1	I322 Q323 M328 M329 E330	I322-S326 PolarHBondContact O-N 2.83Å; Q323-S326 WeakPolarHBondContact O-CB 3.29Å; Q323-S326 PolarHBondContact O-N 3.11Å; S326-M328 VanDerWaalsContact C-N 3.32Å; S326-M328 PolarHBondContact O-N 3.34Å; S326-M329 PolarHBondContact O-N 3.21Å; S326-E330 PolarHBondContact O-N 3.31Å
327	E	51.8	Low	41.7	Very low	102 Å²	102	90.5 Å²	90.5	48%	0.477	47%	0.466	S	S	.	.	H	α-helix	trans	-62.4	-38.3	178.5	-71.4	167.7	-172.8	0	0	111.5	Q323 S331	Q323-E327 PolarHBondContact NE2-OE1 3.04Å; Q323-E327 WeakPolarHBondContact O-CG 3.26Å; Q323-E327 PolarHBondContact O-N 3.28Å; E327-S331 WeakPolarHBondContact O-CB 3.46Å; E327-S331 PolarHBondContact O-N 3.42Å
328	M	47.2	Very low	42	Very low	103 Å²	103	92.4 Å²	92.4	51%	0.507	48%	0.477	S	S	.	.	H	α-helix	trans	-69.9	-32.4	176.2	-160.4	175.6	77.3	0	0	112.4	F265 Q324 S326 I332	F265-M328 HydrophobicContact CD2-CE 4.47Å; Q324-M328 VanDerWaalsContact O-CB 3.25Å; Q324-M328 WeakPolarHBondContact O-CB 3.41Å; Q324-M328 PolarHBondContact O-N 2.82Å; S326-M328 VanDerWaalsContact C-N 3.32Å; S326-M328 PolarHBondContact O-N 3.34Å; M328-I332 WeakPolarHBondContact O-CD1 3.46Å; M328-I332 WeakPolarHBondContact O-CG1 3.47Å; M328-I332 PolarHBondContact O-N 2.99Å
329	M	41.6	Very low	41.9	Very low	15 Å²	15	94.1 Å²	94.1	7%	0.074	48%	0.483	C	S	.	.	H	α-helix	trans	-73.3	-39.6	173.2	-77.8	-173.3	63	0	0	113	F301 N302 I325 S326 S331 I332 Q333	F301-M329 HydrophobicContact CD1-CE 3.8Å; F301-M329 HydrophobicContact CD1-SD 3.85Å; F301-M329 HydrophobicContact CE1-SD 4.1Å; N302-M329 VanDerWaalsContact OD1-CE 3.26Å; N302-M329 WeakPolarHBondContact OD1-CE 3.3Å; I325-M329 HydrophobicContact CG2-SD 4.45Å; I325-M329 WeakPolarHBondContact O-CB 3.4Å; I325-M329 WeakPolarHBondContact O-CG 3.38Å; I325-M329 PolarHBondContact O-N 3.36Å; S326-M329 PolarHBondContact O-N 3.21Å; M329-S331 VanDerWaalsContact C-N 3.31Å; M329-S331 PolarHBondContact O-N 2.99Å; M329-I332 PolarHBondContact O-N 3.49Å; M329-Q333 PolarHBondContact O-N 3.36Å
330	E	48.9	Very low	41.9	Very low	111 Å²	111	89.5 Å²	89.5	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-62.6	-38.6	173.2	-76.1	-174.2	144.7	0	0	111.7	S326 I332 Q333 N334	S326-E330 PolarHBondContact O-N 3.31Å; E330-I332 VanDerWaalsContact C-N 3.33Å; E330-I332 PolarHBondContact O-N 3.32Å; E330-Q333 PolarHBondContact O-N 3.49Å; E330-N334 WeakPolarHBondContact O-CB 3.07Å; E330-N334 PolarHBondContact O-N 3.02Å; E330-N334 PolarHBondContact O-ND2 3.49Å; E330-N334 VanDerWaalsContact O-ND2 3.08Å
331	S	51.6	Low	41.8	Very low	83 Å²	83	91.8 Å²	91.8	58%	0.58	49%	0.49	S	S	*	.	H	α-helix	trans	-58	-43.5	173	-178.6	0	0	0	0	112.3	E327 M329 G335	E327-S331 WeakPolarHBondContact O-CB 3.46Å; E327-S331 PolarHBondContact O-N 3.42Å; M329-S331 VanDerWaalsContact C-N 3.31Å; M329-S331 PolarHBondContact O-N 2.99Å; S331-G335 PolarHBondContact O-N 3.26Å; S331-G335 VanDerWaalsContact O-N 3.1Å
332	I	44.8	Very low	41.2	Very low	88 Å²	88	96 Å²	96	45%	0.451	51%	0.512	S	S	.	.	H	α-helix	trans	-67.3	-45.6	177.8	-66.9	164.8	0	0	0	110.9	M328 M329 E330 N334 G335 Y336	M328-I332 WeakPolarHBondContact O-CD1 3.46Å; M328-I332 WeakPolarHBondContact O-CG1 3.47Å; M328-I332 PolarHBondContact O-N 2.99Å; M329-I332 PolarHBondContact O-N 3.49Å; E330-I332 VanDerWaalsContact C-N 3.33Å; E330-I332 PolarHBondContact O-N 3.32Å; I332-N334 PolarHBondContact O-N 2.94Å; I332-G335 PolarHBondContact O-N 3.28Å; I332-Y336 HydrophobicContact CG2-CD2 4.1Å; I332-Y336 HydrophobicContact CG2-CE2 4.02Å; I332-Y336 WeakPolarHBondContact O-CD2 3.38Å; I332-Y336 PolarHBondContact O-N 3.08Å
333	Q	39.4	Very low	40.6	Very low	71 Å²	71	101.5 Å²	101.5	33%	0.332	53%	0.533	S	S	.	.	H	α-helix	trans	-63.2	-38.5	178.4	-74.6	-174.4	-34.5	0	0	112.9	M329 E330 G335 Y336 S337	M329-Q333 PolarHBondContact O-N 3.36Å; E330-Q333 PolarHBondContact O-N 3.49Å; Q333-G335 VanDerWaalsContact C-N 3.33Å; Q333-G335 PolarHBondContact O-N 2.8Å; Q333-Y336 PolarHBondContact O-N 3.17Å; Q333-S337 PolarHBondContact O-N 2.95Å; Q333-S337 PolarHBondContact O-OG 2.82Å
334	N	43.7	Very low	39.9	Very low	105 Å²	105	104.3 Å²	104.3	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-68.8	-29.7	175.3	-73.7	-37.9	0	0	0	112.8	E330 I332 N338	E330-N334 WeakPolarHBondContact O-CB 3.07Å; E330-N334 PolarHBondContact O-N 3.02Å; E330-N334 PolarHBondContact O-ND2 3.49Å; E330-N334 VanDerWaalsContact O-ND2 3.08Å; I332-N334 PolarHBondContact O-N 2.94Å; N334-N338 PolarHBondContact O-ND2 3.3Å
335	G	38.6	Very low	39	Very low	43 Å²	43	105.1 Å²	105.1	44%	0.443	56%	0.56	S	S	.	*	H	α-helix	trans	-65.1	-46.4	173.8	0	0	0	0	0	113.2	S331 I332 Q333	S331-G335 PolarHBondContact O-N 3.26Å; S331-G335 VanDerWaalsContact O-N 3.1Å; I332-G335 PolarHBondContact O-N 3.28Å; Q333-G335 VanDerWaalsContact C-N 3.33Å; Q333-G335 PolarHBondContact O-N 2.8Å
336	Y	36.6	Very low	38.2	Very low	167 Å²	167	110.4 Å²	110.4	66%	0.655	58%	0.583	S	S	*	*	H	α-helix	trans	-70.2	-30.1	178.7	-80.7	-80.6	0	0	0	113.5	I332 Q333 N338 M339	I332-Y336 HydrophobicContact CG2-CD2 4.1Å; I332-Y336 HydrophobicContact CG2-CE2 4.02Å; I332-Y336 WeakPolarHBondContact O-CD2 3.38Å; I332-Y336 PolarHBondContact O-N 3.08Å; Q333-Y336 PolarHBondContact O-N 3.17Å; Y336-N338 PolarHBondContact O-N 3.45Å; Y336-M339 HydrophobicContact CD1-CE 3.67Å; Y336-M339 HydrophobicContact CE1-CE 3.86Å; Y336-M339 HydrophobicContact CG-CE 4.42Å; Y336-M339 PolarHBondContact O-N 3.04Å
337	S	37	Very low	37.4	Very low	78 Å²	78	117.4 Å²	117.4	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-64.7	-18.9	179.8	-59.6	0	0	0	0	114	Q333 S340	Q333-S337 PolarHBondContact O-N 2.95Å; Q333-S337 PolarHBondContact O-OG 2.82Å; S337-S340 PolarHBondContact O-OG 3.27Å
338	N	36.7	Very low	36.4	Very low	134 Å²	134	120.6 Å²	120.6	72%	0.717	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-5.3	179.7	-74.2	-42	0	0	0	114.4	N334 Y336	N334-N338 PolarHBondContact O-ND2 3.3Å; Y336-N338 PolarHBondContact O-N 3.45Å
339	M	30.5	Very low	35.7	Very low	130 Å²	130	122.7 Å²	122.7	64%	0.64	63%	0.63	S	S	*	*	S	Bend	trans	-88.4	-3.9	178.5	-78.9	-167.1	-76.9	0	0	114.5	Y336 N341	Y336-M339 HydrophobicContact CD1-CE 3.67Å; Y336-M339 HydrophobicContact CE1-CE 3.86Å; Y336-M339 HydrophobicContact CG-CE 4.42Å; Y336-M339 PolarHBondContact O-N 3.04Å; M339-N341 VanDerWaalsContact C-N 3.27Å; M339-N341 PolarHBondContact O-N 3.49Å
340	S	31.4	Very low	35.2	Very low	88 Å²	88	129.4 Å²	129.4	62%	0.615	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	3.9	-174.4	59	0	0	0	0	116	S337	S337-S340 PolarHBondContact O-OG 3.27Å
341	N	31.6	Very low	34.5	Very low	143 Å²	143	132.2 Å²	132.2	77%	0.765	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	12	-170.7	-76.3	-16.2	0	0	0	115.3	M339	M339-N341 VanDerWaalsContact C-N 3.27Å; M339-N341 PolarHBondContact O-N 3.49Å
342	L	28.5	Very low	33.6	Very low	157 Å²	157	136.1 Å²	136.1	82%	0.822	68%	0.684	S	S	*	*			trans	-116.8	66.5	179.1	-76.8	162.3	0	0	0	111.9
343	K	28.5	Very low	32.8	Very low	190 Å²	190	140.6 Å²	140.6	83%	0.826	70%	0.703	S	S	*	*			trans	-100.3	98.9	162.1	-74.4	-177.6	174.7	-177.7	0	108.5
344	N	29.3	Very low	32.5	Very low	158 Å²	158	146.2 Å²	146.2	85%	0.845	73%	0.726	S	S	*	*	S	Bend	trans	-169.1	-22.6	159	-96.2	-21	0	0	0	116.8
345	D	28.3	Very low	31.8	Very low	142 Å²	142	149.3 Å²	149.3	76%	0.759	74%	0.737	S	S	*	*			trans	-113.6	10.6	-162	-64	-39.2	0	0	0	117.7	F347	D345-F347 PolarHBondContact O-N 2.89Å
346	E	28.6	Very low	31.3	Very low	152 Å²	152	156.7 Å²	156.7	71%	0.71	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	35.3	-171.4	-66.9	-170.1	156.6	0	0	116.4
347	F	31	Very low	30.8	Very low	206 Å²	206	158.1 Å²	158.1	90%	0.904	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-9.5	175.7	-139	-94	0	0	0	114.5	D345	D345-F347 PolarHBondContact O-N 2.89Å
348	E	31.6	Very low	30.3	Very low	169 Å²	169	160.6 Å²	160.6	79%	0.79	78%	0.782	S	S	*	*	S	Bend	trans	-112.1	-16.6	-173.9	-68.2	-166.6	136	0	0	115.9
349	Q	31.9	Very low	29.9	Very low	146 Å²	146	159.6 Å²	159.6	68%	0.682	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-88.2	-20.7	-173.4	-67.7	-174.2	1.6	0	0	114.8	Q351 Q352	Q349-Q351 PolarHBondContact O-N 2.75Å; Q349-Q352 PolarHBondContact O-N 3.06Å
350	Q	31.1	Very low	29.8	Very low	157 Å²	157	158.9 Å²	158.9	73%	0.734	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-70	3.1	-179.4	-65.3	-172.8	0.1	0	0	115.1
351	Q	33.8	Very low	29.6	Very low	169 Å²	169	164.6 Å²	164.6	79%	0.79	81%	0.807	S	S	*	*	G	3₁₀ helix	trans	-95.4	-14.1	174.4	-64.9	-166.4	15	0	0	114.3	Q349	Q349-Q351 PolarHBondContact O-N 2.75Å
352	Q	32	Very low	29.5	Very low	165 Å²	165	166.4 Å²	166.4	77%	0.771	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-23	-172.1	-68.2	-173.5	-0.8	0	0	115.2	Q349 K354	Q349-Q352 PolarHBondContact O-N 3.06Å; Q352-K354 VanDerWaalsContact C-N 3.25Å; Q352-K354 PolarHBondContact O-N 3.19Å
353	E	28.8	Very low	29.5	Very low	182 Å²	182	165.2 Å²	165.2	85%	0.85	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-77.8	-1.6	-177.5	-65.5	-168.2	132.4	0	0	114.9	Q355	E353-Q355 VanDerWaalsContact C-N 3.26Å; E353-Q355 PolarHBondContact O-N 3.02Å
354	K	32.6	Very low	29.8	Very low	190 Å²	190	161.3 Å²	161.3	83%	0.826	80%	0.802	S	S	*	*	G	3₁₀ helix	trans	-79.3	12.5	-179	-80.9	-179.8	176	169.3	0	115.7	Q352	Q352-K354 VanDerWaalsContact C-N 3.25Å; Q352-K354 PolarHBondContact O-N 3.19Å
355	Q	29.9	Very low	29.8	Very low	169 Å²	169	160.2 Å²	160.2	79%	0.79	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-119.9	-0.4	-170.3	-75.5	-167.5	-14.9	0	0	117.6	E353	E353-Q355 VanDerWaalsContact C-N 3.26Å; E353-Q355 PolarHBondContact O-N 3.02Å
356	F	28.2	Very low	29.8	Very low	198 Å²	198	161.8 Å²	161.8	87%	0.868	80%	0.796	S	S	*	*			trans	-114.9	10.1	-173.3	-96.5	-82.5	0	0	0	118	T358	F356-T358 PolarHBondContact O-N 3.38Å
357	E	25.5	Very low	30	Very low	197 Å²	197	158.2 Å²	158.2	92%	0.921	78%	0.782	S	S	*	*			trans	-88.2	63.8	174.6	-69.5	-162.8	137.3	0	0	114.1
358	T	26.7	Very low	30.1	Very low	130 Å²	130	151 Å²	151	80%	0.798	76%	0.757	S	S	*	*			trans	-135.2	36.4	178.4	53.9	0	0	0	0	116.6	F356	F356-T358 PolarHBondContact O-N 3.38Å
359	S	27.6	Very low	30	Very low	113 Å²	113	150.1 Å²	150.1	79%	0.79	75%	0.746	S	S	*	*	S	Bend	trans	-160.7	159.2	157.1	50.3	0	0	0	0	113.2
360	S	28.8	Very low	30	Very low	115 Å²	115	146.2 Å²	146.2	80%	0.804	73%	0.727	S	S	*	*			trans	77.2	51.5	-179.2	74.4	0	0	0	0	118.9	Q362	S360-Q362 PolarHBondContact O-N 3.49Å; S360-Q362 VanDerWaalsContact O-N 3.17Å
361	K	28.2	Very low	30.2	Very low	208 Å²	208	143.6 Å²	143.6	90%	0.904	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	85	165.4	-72.4	179.1	175.9	175.1	0	112.2
362	Q	29	Very low	30.2	Very low	181 Å²	181	138.5 Å²	138.5	85%	0.846	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.1	-16.7	163.3	-119.8	163	5.5	0	0	118.3	S360	S360-Q362 PolarHBondContact O-N 3.49Å; S360-Q362 VanDerWaalsContact O-N 3.17Å
363	D	28.9	Very low	30.3	Very low	133 Å²	133	135.1 Å²	135.1	71%	0.711	68%	0.677	S	S	*	*			trans	-103.9	1.2	-169.4	-67.8	-48	0	0	0	117.2	L365 F366	D363-L365 VanDerWaalsContact C-N 3.28Å; D363-L365 PolarHBondContact O-N 3.34Å; D363-L365 VanDerWaalsContact O-N 3.08Å; D363-F366 PolarHBondContact O-N 2.98Å
364	S	33.3	Very low	30.5	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	64%	0.641	S	S	*	*	H	α-helix	trans	-70	-9.8	-165	59.6	0	0	0	0	117.2
365	L	29.9	Very low	30.5	Very low	135 Å²	135	122 Å²	122	71%	0.707	62%	0.624	S	S	*	*	H	α-helix	trans	-90	-17.7	-179	-121.8	158.2	0	0	0	113.5	D363	D363-L365 VanDerWaalsContact C-N 3.28Å; D363-L365 PolarHBondContact O-N 3.34Å; D363-L365 VanDerWaalsContact O-N 3.08Å
366	F	27.9	Very low	30.7	Very low	174 Å²	174	117.7 Å²	117.7	76%	0.763	61%	0.606	S	S	*	*	H	α-helix	trans	-85.8	-39.6	176.4	-117.4	-94.6	0	0	0	111.9	D363 S368 R369 F370	D363-F366 PolarHBondContact O-N 2.98Å; F366-S368 PolarHBondContact O-N 3.35Å; F366-R369 PolarHBondContact O-N 3Å; F366-F370 WeakPolarHBondContact O-CB 3.28Å; F366-F370 PolarHBondContact O-N 3.46Å
367	D	32.3	Very low	30.9	Very low	78 Å²	78	109.9 Å²	109.9	42%	0.417	58%	0.575	S	S	.	*	H	α-helix	trans	-70.9	-30.2	-168.9	-159.6	48.1	0	0	0	113.7	K371	D367-K371 WeakPolarHBondContact O-CB 3.44Å; D367-K371 WeakPolarHBondContact O-CG 3.3Å; D367-K371 PolarHBondContact O-N 3.24Å; D367-K371 WeakPolarHBondContact OD2-CE 3.5Å; D367-K371 IonicContact OD2-NZ 3.29Å; D367-K371 PolarHBondContact OD2-NZ 3.05Å
368	S	33.1	Very low	31.3	Very low	55 Å²	55	103 Å²	103	39%	0.385	54%	0.544	S	S	.	.	H	α-helix	trans	-71.9	-41.2	175.3	66.7	0	0	0	0	112.6	F366 F370 K371 Q372 Y966	F366-S368 PolarHBondContact O-N 3.35Å; S368-F370 VanDerWaalsContact C-N 3.34Å; S368-K371 PolarHBondContact O-N 3.22Å; S368-Q372 WeakPolarHBondContact O-CG 3.47Å; S368-Q372 PolarHBondContact O-N 2.87Å; S368-Y966 VanDerWaalsContact C-OH 3.31Å; S368-Y966 PolarHBondContact O-OH 2.92Å
369	R	30.7	Very low	31.8	Very low	149 Å²	149	101.1 Å²	101.1	56%	0.562	53%	0.533	S	S	*	.	H	α-helix	trans	-67.6	-35.1	173.3	-79.5	-178.5	165.8	179.5	-5.7	111.7	F366 N373 Y966	F366-R369 PolarHBondContact O-N 3Å; R369-N373 WeakPolarHBondContact O-CB 3.3Å; R369-N373 PolarHBondContact O-N 3.25Å; R369-N373 PolarHBondContact O-ND2 2.85Å; R369-N373 VanDerWaalsContact O-ND2 3.14Å; R369-Y966 WeakPolarHBondContact CA-OH 3.32Å; R369-Y966 HydrophobicContact CG-CE1 4.33Å; R369-Y966 WeakPolarHBondContact CG-OH 3.4Å; R369-Y966 PolarHBondContact N-OH 3.35Å; R369-Y966 VanDerWaalsContact N-OH 3.15Å
370	F	32	Very low	32.4	Very low	65 Å²	65	100.7 Å²	100.7	29%	0.285	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-46.4	175.2	-157.7	-106.2	0	0	0	111.7	V284 N286 F366 S368 N373 Q374	V284-F370 HydrophobicContact CG1-CE2 4.32Å; N286-F370 HydrophobicContact CB-CE1 4Å; N286-F370 HydrophobicContact CB-CZ 4.3Å; F366-F370 WeakPolarHBondContact O-CB 3.28Å; F366-F370 PolarHBondContact O-N 3.46Å; S368-F370 VanDerWaalsContact C-N 3.34Å; F370-N373 PolarHBondContact O-N 3Å; F370-Q374 WeakPolarHBondContact O-CG 3.2Å; F370-Q374 PolarHBondContact O-N 3.13Å
371	K	34.5	Very low	32.7	Very low	102 Å²	102	96.1 Å²	96.1	44%	0.443	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-45.7	174.3	-78.9	166.7	176.1	153.2	0	112.6	D367 S368 Q374 T375	D367-K371 WeakPolarHBondContact O-CB 3.44Å; D367-K371 WeakPolarHBondContact O-CG 3.3Å; D367-K371 PolarHBondContact O-N 3.24Å; D367-K371 WeakPolarHBondContact OD2-CE 3.5Å; D367-K371 IonicContact OD2-NZ 3.29Å; D367-K371 PolarHBondContact OD2-NZ 3.05Å; S368-K371 PolarHBondContact O-N 3.22Å; K371-Q374 WeakPolarHBondContact O-CB 3.18Å; K371-Q374 PolarHBondContact O-N 2.91Å; K371-T375 PolarHBondContact O-N 3.07Å; K371-T375 PolarHBondContact O-OG1 2.85Å
372	Q	35.2	Very low	33.3	Very low	62 Å²	62	94.5 Å²	94.5	29%	0.29	48%	0.476	S	S	.	.	H	α-helix	trans	-64.5	-44.4	178.3	-77.1	-120.9	-5.3	0	0	113.3	S368 Q374 T375 I376 I965 Y966	S368-Q372 WeakPolarHBondContact O-CG 3.47Å; S368-Q372 PolarHBondContact O-N 2.87Å; Q372-Q374 VanDerWaalsContact C-N 3.25Å; Q372-Q374 PolarHBondContact O-N 3.25Å; Q372-T375 PolarHBondContact O-N 2.77Å; Q372-T375 VanDerWaalsContact O-N 3.09Å; Q372-I376 WeakPolarHBondContact O-CG1 3.19Å; Q372-I376 PolarHBondContact O-N 3.39Å; Q372-I965 PolarHBondContact NE2-O 3.18Å; Q372-Y966 HydrophobicContact CB-CD1 4.49Å; Q372-Y966 HydrophobicContact CB-CE1 4.01Å; Q372-Y966 VanDerWaalsContact CD-CE2 3.49Å; Q372-Y966 HydrophobicContact CG-CD1 4.31Å; Q372-Y966 HydrophobicContact CG-CD2 4.02Å; Q372-Y966 HydrophobicContact CG-CE1 3.99Å; Q372-Y966 HydrophobicContact CG-CE2 3.68Å; Q372-Y966 HydrophobicContact CG-CG 4.3Å; Q372-Y966 VanDerWaalsContact OE1-CB 3.31Å
373	N	32.2	Very low	33.9	Very low	94 Å²	94	88.8 Å²	88.8	50%	0.503	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-32.7	174.6	-76.2	-34.3	0	0	0	112.3	R369 F370 C377	R369-N373 WeakPolarHBondContact O-CB 3.3Å; R369-N373 PolarHBondContact O-N 3.25Å; R369-N373 PolarHBondContact O-ND2 2.85Å; R369-N373 VanDerWaalsContact O-ND2 3.14Å; F370-N373 PolarHBondContact O-N 3Å; N373-C377 WeakPolarHBondContact O-CB 3.26Å; N373-C377 PolarHBondContact O-N 3.5Å; N373-C377 VanDerWaalsContact O-N 3.08Å; N373-C377 PolarHBondContact O-SG 2.97Å
374	Q	33.1	Very low	34.4	Very low	19 Å²	19	89.2 Å²	89.2	9%	0.089	45%	0.446	C	S	.	.	H	α-helix	trans	-66	-43.5	170.3	-75.2	-178.8	-14	0	0	112.1	L291 F370 K371 Q372 C377 L378	L291-Q374 HydrophobicContact CD1-CB 4.22Å; L291-Q374 VanDerWaalsContact CD1-OE1 3.31Å; F370-Q374 WeakPolarHBondContact O-CG 3.2Å; F370-Q374 PolarHBondContact O-N 3.13Å; K371-Q374 WeakPolarHBondContact O-CB 3.18Å; K371-Q374 PolarHBondContact O-N 2.91Å; Q372-Q374 VanDerWaalsContact C-N 3.25Å; Q372-Q374 PolarHBondContact O-N 3.25Å; Q374-C377 PolarHBondContact O-N 2.84Å; Q374-L378 WeakPolarHBondContact O-CB 3.19Å; Q374-L378 VanDerWaalsContact O-CG 3.28Å; Q374-L378 WeakPolarHBondContact O-CG 3.31Å; Q374-L378 PolarHBondContact O-N 3.34Å
375	T	33.7	Very low	34.8	Very low	76 Å²	76	85.6 Å²	85.6	47%	0.466	42%	0.418	S	S	.	.	H	α-helix	trans	-64.3	-42.1	178.1	-42.8	0	0	0	0	112.5	K371 Q372 L378 V379	K371-T375 PolarHBondContact O-N 3.07Å; K371-T375 PolarHBondContact O-OG1 2.85Å; Q372-T375 PolarHBondContact O-N 2.77Å; Q372-T375 VanDerWaalsContact O-N 3.09Å; T375-L378 WeakPolarHBondContact O-CB 3.21Å; T375-L378 PolarHBondContact O-N 2.78Å; T375-L378 VanDerWaalsContact O-N 3.12Å; T375-V379 PolarHBondContact O-N 2.78Å
376	I	34.2	Very low	35.3	Very low	80 Å²	80	83.2 Å²	83.2	41%	0.41	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-47	176.1	-65.4	165.3	0	0	0	110	Q372 L378 V379 D380	Q372-I376 WeakPolarHBondContact O-CG1 3.19Å; Q372-I376 PolarHBondContact O-N 3.39Å; I376-L378 PolarHBondContact O-N 3.06Å; I376-V379 PolarHBondContact O-N 2.8Å; I376-D380 PolarHBondContact O-N 2.88Å
377	C	32	Very low	35.8	Very low	34 Å²	34	81.4 Å²	81.4	23%	0.23	40%	0.401	C	S	.	.	H	α-helix	trans	-60.3	-29.8	173.7	-70.1	0	0	0	0	113	N373 Q374 M381	N373-C377 WeakPolarHBondContact O-CB 3.26Å; N373-C377 PolarHBondContact O-N 3.5Å; N373-C377 VanDerWaalsContact O-N 3.08Å; N373-C377 PolarHBondContact O-SG 2.97Å; Q374-C377 PolarHBondContact O-N 2.84Å; C377-M381 WeakPolarHBondContact O-CB 3.35Å; C377-M381 WeakPolarHBondContact O-CG 3.4Å; C377-M381 PolarHBondContact O-N 2.76Å
378	L	34.4	Very low	36.2	Very low	52 Å²	52	79.7 Å²	79.7	27%	0.272	39%	0.391	S	S	.	.	H	α-helix	trans	-74.6	-34.7	176.7	-76.8	166.7	0	0	0	112.8	L291 F295 Q374 T375 I376 R382	L291-L378 HydrophobicContact CD2-CD1 4.3Å; F295-L378 HydrophobicContact CD2-CD2 4.38Å; Q374-L378 WeakPolarHBondContact O-CB 3.19Å; Q374-L378 VanDerWaalsContact O-CG 3.28Å; Q374-L378 WeakPolarHBondContact O-CG 3.31Å; Q374-L378 PolarHBondContact O-N 3.34Å; T375-L378 WeakPolarHBondContact O-CB 3.21Å; T375-L378 PolarHBondContact O-N 2.78Å; T375-L378 VanDerWaalsContact O-N 3.12Å; I376-L378 PolarHBondContact O-N 3.06Å; L378-R382 WeakPolarHBondContact O-CB 3.48Å; L378-R382 PolarHBondContact O-N 2.77Å
379	V	37.7	Very low	36.4	Very low	91 Å²	91	78.8 Å²	78.8	55%	0.552	39%	0.387	S	S	*	.	H	α-helix	trans	-70.6	-42.8	174.2	175.8	0	0	0	0	110.9	T375 I376 R382 T383	T375-V379 PolarHBondContact O-N 2.78Å; I376-V379 PolarHBondContact O-N 2.8Å; V379-R382 PolarHBondContact O-N 2.89Å; V379-T383 PolarHBondContact O-N 3.04Å; V379-T383 PolarHBondContact O-OG1 3.4Å
380	D	38.4	Very low	36.8	Very low	104 Å²	104	80.6 Å²	80.6	56%	0.556	40%	0.395	S	S	*	.	H	α-helix	trans	-63.5	-43.2	171.5	-85.5	-13.7	0	0	0	111.4	I376 R382 T383 Y384	I376-D380 PolarHBondContact O-N 2.88Å; D380-R382 PolarHBondContact O-N 2.75Å; D380-T383 PolarHBondContact O-N 2.77Å; D380-T383 PolarHBondContact O-OG1 2.97Å; D380-T383 VanDerWaalsContact O-OG1 3.13Å; D380-Y384 WeakPolarHBondContact O-CB 3.44Å; D380-Y384 PolarHBondContact O-N 2.61Å
381	M	35.9	Very low	37	Very low	18 Å²	18	82.1 Å²	82.1	9%	0.089	41%	0.406	C	S	.	.	H	α-helix	trans	-59	-43.2	171.7	-84.2	-88	-91	0	0	111.9	F282 W285 F295 L304 C377 T383 Y384 I385	F282-M381 HydrophobicContact CE1-CE 4.32Å; F282-M381 HydrophobicContact CE1-CG 3.79Å; F282-M381 HydrophobicContact CE1-SD 3.64Å; F282-M381 HydrophobicContact CZ-CG 4.19Å; F282-M381 HydrophobicContact CZ-SD 4.22Å; W285-M381 HydrophobicContact CH2-CE 4.37Å; F295-M381 HydrophobicContact CE2-CE 4.08Å; F295-M381 HydrophobicContact CZ-CE 4.03Å; L304-M381 HydrophobicContact CD1-CE 4.43Å; C377-M381 WeakPolarHBondContact O-CB 3.35Å; C377-M381 WeakPolarHBondContact O-CG 3.4Å; C377-M381 PolarHBondContact O-N 2.76Å; M381-T383 PolarHBondContact O-N 2.82Å; M381-Y384 PolarHBondContact O-N 2.74Å; M381-I385 HydrophobicContact CB-CD1 4.22Å; M381-I385 HydrophobicContact CE-CD1 4.14Å; M381-I385 WeakPolarHBondContact O-CB 3.18Å; M381-I385 WeakPolarHBondContact O-CD1 3.39Å; M381-I385 WeakPolarHBondContact O-CG1 3.21Å; M381-I385 PolarHBondContact O-N 3.38Å; M381-I385 HydrophobicContact SD-CD1 4.13Å
382	R	40.3	Very low	37	Very low	174 Å²	174	80.4 Å²	80.4	66%	0.657	40%	0.399	S	S	*	.	H	α-helix	trans	-67	-38.2	-179.3	-154.4	174.6	-165.3	-176.9	5	111.7	L378 V379 D380 T386	L378-R382 WeakPolarHBondContact O-CB 3.48Å; L378-R382 PolarHBondContact O-N 2.77Å; V379-R382 PolarHBondContact O-N 2.89Å; D380-R382 PolarHBondContact O-N 2.75Å; R382-T386 WeakPolarHBondContact O-CB 3.48Å; R382-T386 VanDerWaalsContact O-CG2 3.29Å; R382-T386 WeakPolarHBondContact O-CG2 3.26Å; R382-T386 PolarHBondContact O-N 3.03Å; R382-T386 PolarHBondContact O-OG1 2.77Å
383	T	41.7	Very low	37.3	Very low	61 Å²	61	83.4 Å²	83.4	37%	0.374	41%	0.413	S	S	.	.	H	α-helix	trans	-76.1	-25.5	174.4	59.2	0	0	0	0	113.6	V379 D380 M381 T386 K387	V379-T383 PolarHBondContact O-N 3.04Å; V379-T383 PolarHBondContact O-OG1 3.4Å; D380-T383 PolarHBondContact O-N 2.77Å; D380-T383 PolarHBondContact O-OG1 2.97Å; D380-T383 VanDerWaalsContact O-OG1 3.13Å; M381-T383 PolarHBondContact O-N 2.82Å; T383-T386 WeakPolarHBondContact CA-OG1 3.38Å; T383-T386 PolarHBondContact O-OG1 3.09Å; T383-K387 VanDerWaalsContact O-CD 3.22Å; T383-K387 WeakPolarHBondContact O-CD 3.48Å; T383-K387 WeakPolarHBondContact O-CG 3.29Å; T383-K387 PolarHBondContact O-N 3.45Å
384	Y	41	Very low	37.5	Very low	142 Å²	142	84 Å²	84	56%	0.557	41%	0.411	S	S	*	.	H	α-helix	trans	-79.5	-45.3	174.4	-168.1	-113.5	0	0	0	111.6	D380 M381 K387 I388	D380-Y384 WeakPolarHBondContact O-CB 3.44Å; D380-Y384 PolarHBondContact O-N 2.61Å; M381-Y384 PolarHBondContact O-N 2.74Å; Y384-K387 PolarHBondContact O-N 3.25Å; Y384-I388 HydrophobicContact CD1-CD1 3.6Å; Y384-I388 HydrophobicContact CE1-CD1 3.28Å; Y384-I388 HydrophobicContact CE1-CG1 4.4Å; Y384-I388 HydrophobicContact CE2-CD1 4.43Å; Y384-I388 HydrophobicContact CG-CD1 4.3Å; Y384-I388 WeakPolarHBondContact O-CB 3.32Å; Y384-I388 WeakPolarHBondContact O-CG1 3.27Å; Y384-I388 PolarHBondContact O-N 3.47Å
385	I	40.7	Very low	37.6	Very low	33 Å²	33	87.6 Å²	87.6	17%	0.169	43%	0.431	C	S	.	.	H	α-helix	trans	-63.7	-40.2	175.1	-68.7	166.1	0	0	0	110.8	M381 I388 A389	M381-I385 HydrophobicContact CB-CD1 4.22Å; M381-I385 HydrophobicContact CE-CD1 4.14Å; M381-I385 WeakPolarHBondContact O-CB 3.18Å; M381-I385 WeakPolarHBondContact O-CD1 3.39Å; M381-I385 WeakPolarHBondContact O-CG1 3.21Å; M381-I385 PolarHBondContact O-N 3.38Å; M381-I385 HydrophobicContact SD-CD1 4.13Å; I385-I388 PolarHBondContact O-N 2.65Å; I385-A389 WeakPolarHBondContact O-CB 3.35Å; I385-A389 PolarHBondContact O-N 2.84Å
386	T	40.8	Very low	37.9	Very low	85 Å²	85	88.9 Å²	88.9	52%	0.521	43%	0.431	S	S	.	.	H	α-helix	trans	-65.7	-38.9	174.4	44.8	0	0	0	0	112.5	R382 T383 Y390	R382-T386 WeakPolarHBondContact O-CB 3.48Å; R382-T386 VanDerWaalsContact O-CG2 3.29Å; R382-T386 WeakPolarHBondContact O-CG2 3.26Å; R382-T386 PolarHBondContact O-N 3.03Å; R382-T386 PolarHBondContact O-OG1 2.77Å; T383-T386 WeakPolarHBondContact CA-OG1 3.38Å; T383-T386 PolarHBondContact O-OG1 3.09Å; T386-Y390 WeakPolarHBondContact O-CB 3.28Å; T386-Y390 PolarHBondContact O-N 3.34Å
387	K	38.9	Very low	38.1	Very low	135 Å²	135	91.8 Å²	91.8	59%	0.587	44%	0.441	S	S	*	.	H	α-helix	trans	-67	-39.6	172.9	-71.6	167.4	-169.1	161.8	0	112.3	T383 Y384 L391	T383-K387 VanDerWaalsContact O-CD 3.22Å; T383-K387 WeakPolarHBondContact O-CD 3.48Å; T383-K387 WeakPolarHBondContact O-CG 3.29Å; T383-K387 PolarHBondContact O-N 3.45Å; Y384-K387 PolarHBondContact O-N 3.25Å; K387-L391 WeakPolarHBondContact O-CB 3.47Å; K387-L391 WeakPolarHBondContact O-CG 3.34Å; K387-L391 PolarHBondContact O-N 2.84Å
388	I	39.8	Very low	38.4	Very low	43 Å²	43	91.7 Å²	91.7	22%	0.221	44%	0.441	C	S	.	.	H	α-helix	trans	-67.9	-43.2	174.6	-75.1	177.1	0	0	0	111	Y384 I385 Y390 L391 Q392	Y384-I388 HydrophobicContact CD1-CD1 3.6Å; Y384-I388 HydrophobicContact CE1-CD1 3.28Å; Y384-I388 HydrophobicContact CE1-CG1 4.4Å; Y384-I388 HydrophobicContact CE2-CD1 4.43Å; Y384-I388 HydrophobicContact CG-CD1 4.3Å; Y384-I388 WeakPolarHBondContact O-CB 3.32Å; Y384-I388 WeakPolarHBondContact O-CG1 3.27Å; Y384-I388 PolarHBondContact O-N 3.47Å; I385-I388 PolarHBondContact O-N 2.65Å; I388-Y390 VanDerWaalsContact C-N 3.31Å; I388-Y390 PolarHBondContact O-N 3.48Å; I388-L391 CarbonylContact O-C 3.59Å; I388-L391 PolarHBondContact O-N 2.89Å; I388-L391 VanDerWaalsContact O-N 3.16Å; I388-Q392 HydrophobicContact CG2-CG 4.01Å; I388-Q392 VanDerWaalsContact O-CB 3.3Å; I388-Q392 WeakPolarHBondContact O-CB 3.3Å; I388-Q392 PolarHBondContact O-N 2.74Å
389	A	38.2	Very low	38.4	Very low	36 Å²	36	95.9 Å²	95.9	30%	0.298	45%	0.454	S	S	.	.	H	α-helix	trans	-62.8	-38.6	177.5	0	0	0	0	0	111.2	I385 H393	I385-A389 WeakPolarHBondContact O-CB 3.35Å; I385-A389 PolarHBondContact O-N 2.84Å; A389-H393 WeakPolarHBondContact O-CB 3.34Å; A389-H393 PolarHBondContact O-N 3Å
390	Y	38.2	Very low	38.5	Very low	187 Å²	187	97.8 Å²	97.8	73%	0.733	46%	0.455	S	S	*	.	H	α-helix	trans	-62.9	-47	171.9	-166.4	-90	0	0	0	111.7	T386 I388 F394	T386-Y390 WeakPolarHBondContact O-CB 3.28Å; T386-Y390 PolarHBondContact O-N 3.34Å; I388-Y390 VanDerWaalsContact C-N 3.31Å; I388-Y390 PolarHBondContact O-N 3.48Å; Y390-F394 VanDerWaalsContact O-CB 3.32Å; Y390-F394 WeakPolarHBondContact O-CB 3.4Å; Y390-F394 PolarHBondContact O-N 3.21Å
391	L	35.2	Very low	38.4	Very low	96 Å²	96	95 Å²	95	50%	0.503	44%	0.441	S	S	.	.	H	α-helix	trans	-65.4	-39.5	176.7	-79.2	164.1	0	0	0	113.2	K387 I388 F394 L395	K387-L391 WeakPolarHBondContact O-CB 3.47Å; K387-L391 WeakPolarHBondContact O-CG 3.34Å; K387-L391 PolarHBondContact O-N 2.84Å; I388-L391 CarbonylContact O-C 3.59Å; I388-L391 PolarHBondContact O-N 2.89Å; I388-L391 VanDerWaalsContact O-N 3.16Å; L391-F394 WeakPolarHBondContact O-CB 3.39Å; L391-F394 PolarHBondContact O-N 3.31Å; L391-L395 WeakPolarHBondContact O-CB 3.32Å; L391-L395 WeakPolarHBondContact O-CG 3.44Å; L391-L395 PolarHBondContact O-N 3.42Å
392	Q	35.3	Very low	38.4	Very low	66 Å²	66	97.5 Å²	97.5	31%	0.308	46%	0.455	S	S	.	.	H	α-helix	trans	-77.5	-35.4	179.3	-80.3	-179	-8.5	0	0	112.2	C307 I388 F394 L395 H396	C307-Q392 PolarHBondContact SG-NE2 2.99Å; C307-Q392 PolarHBondContact SG-OE1 2.77Å; I388-Q392 HydrophobicContact CG2-CG 4.01Å; I388-Q392 VanDerWaalsContact O-CB 3.3Å; I388-Q392 WeakPolarHBondContact O-CB 3.3Å; I388-Q392 PolarHBondContact O-N 2.74Å; Q392-F394 VanDerWaalsContact C-N 3.26Å; Q392-F394 PolarHBondContact O-N 3.1Å; Q392-L395 PolarHBondContact O-N 2.9Å; Q392-H396 WeakPolarHBondContact O-CA 3.43Å; Q392-H396 WeakPolarHBondContact O-CB 3.38Å; Q392-H396 PolarHBondContact O-N 2.85Å
393	H	40.9	Very low	38.3	Very low	125 Å²	125	92.4 Å²	92.4	58%	0.579	44%	0.44	S	S	*	.	H	α-helix	trans	-63.2	-38.9	170.2	-171.7	-71.9	0	0	0	109.9	A389 K397	A389-H393 WeakPolarHBondContact O-CB 3.34Å; A389-H393 PolarHBondContact O-N 3Å; H393-K397 WeakPolarHBondContact O-CB 3.37Å; H393-K397 PolarHBondContact O-N 3.42Å
394	F	36.9	Very low	38.2	Very low	107 Å²	107	96.4 Å²	96.4	47%	0.469	45%	0.449	S	S	.	.	H	α-helix	trans	-65.1	-45.7	172	-174.4	-94.6	0	0	0	112.7	Y390 L391 Q392 S398 I455	Y390-F394 VanDerWaalsContact O-CB 3.32Å; Y390-F394 WeakPolarHBondContact O-CB 3.4Å; Y390-F394 PolarHBondContact O-N 3.21Å; L391-F394 WeakPolarHBondContact O-CB 3.39Å; L391-F394 PolarHBondContact O-N 3.31Å; Q392-F394 VanDerWaalsContact C-N 3.26Å; Q392-F394 PolarHBondContact O-N 3.1Å; F394-S398 PolarHBondContact O-N 3.27Å; F394-S398 PolarHBondContact O-OG 3.49Å; F394-I455 HydrophobicContact CZ-CG2 4.43Å
395	L	35.9	Very low	37.9	Very low	95 Å²	95	94.8 Å²	94.8	50%	0.497	44%	0.443	S	S	.	.	H	α-helix	trans	-70.3	-36.3	178.7	-74.1	166.4	0	0	0	113.3	L391 Q392 S398 Y399	L391-L395 WeakPolarHBondContact O-CB 3.32Å; L391-L395 WeakPolarHBondContact O-CG 3.44Å; L391-L395 PolarHBondContact O-N 3.42Å; Q392-L395 PolarHBondContact O-N 2.9Å; L395-S398 VanDerWaalsContact CA-OG 3.31Å; L395-S398 WeakPolarHBondContact CA-OG 3.33Å; L395-S398 PolarHBondContact O-OG 2.98Å; L395-S398 VanDerWaalsContact O-OG 3.11Å; L395-Y399 WeakPolarHBondContact O-CB 3.35Å; L395-Y399 PolarHBondContact O-N 3.33Å
396	H	38.5	Very low	37.8	Very low	103 Å²	103	98.7 Å²	98.7	48%	0.477	46%	0.46	S	S	.	.	H	α-helix	trans	-74.6	-37.1	177.6	179	-131.5	0	0	0	111.3	Q392 Y399 K400	Q392-H396 WeakPolarHBondContact O-CA 3.43Å; Q392-H396 WeakPolarHBondContact O-CB 3.38Å; Q392-H396 PolarHBondContact O-N 2.85Å; H396-Y399 PolarHBondContact O-N 3.09Å; H396-K400 VanDerWaalsContact NE2-CE 3.33Å; H396-K400 WeakPolarHBondContact NE2-CE 3.34Å; H396-K400 WeakPolarHBondContact O-CB 3.45Å; H396-K400 PolarHBondContact O-N 2.86Å
397	K	39.2	Very low	37.7	Very low	140 Å²	140	99.8 Å²	99.8	61%	0.609	46%	0.462	S	S	*	.	H	α-helix	trans	-65.1	-40.3	172.7	-158	169.9	-170.2	177.8	0	110.6	H393 T401	H393-K397 WeakPolarHBondContact O-CB 3.37Å; H393-K397 PolarHBondContact O-N 3.42Å; K397-T401 PolarHBondContact O-N 3.17Å; K397-T401 PolarHBondContact O-OG1 3.02Å
398	S	38	Very low	37.6	Very low	32 Å²	32	99.1 Å²	99.1	22%	0.224	46%	0.459	C	S	.	.	H	α-helix	trans	-74.1	-34.6	173.5	47.8	0	0	0	0	114	F394 L395 T401 L402	F394-S398 PolarHBondContact O-N 3.27Å; F394-S398 PolarHBondContact O-OG 3.49Å; L395-S398 VanDerWaalsContact CA-OG 3.31Å; L395-S398 WeakPolarHBondContact CA-OG 3.33Å; L395-S398 PolarHBondContact O-OG 2.98Å; L395-S398 VanDerWaalsContact O-OG 3.11Å; S398-T401 PolarHBondContact O-N 2.83Å; S398-L402 PolarHBondContact O-N 3.47Å
399	Y	35.4	Very low	37.4	Very low	140 Å²	140	102.1 Å²	102.1	55%	0.549	47%	0.471	S	S	.	.	H	α-helix	trans	-67.1	-42.9	173.6	179.8	-102.6	0	0	0	112.1	L395 H396 T401 L402 N403	L395-Y399 WeakPolarHBondContact O-CB 3.35Å; L395-Y399 PolarHBondContact O-N 3.33Å; H396-Y399 PolarHBondContact O-N 3.09Å; Y399-T401 VanDerWaalsContact C-N 3.26Å; Y399-T401 PolarHBondContact O-N 3.13Å; Y399-L402 PolarHBondContact O-N 3.41Å; Y399-N403 HydrophobicContact CE1-CB 4.4Å; Y399-N403 VanDerWaalsContact O-CB 3.29Å; Y399-N403 WeakPolarHBondContact O-CB 3.41Å; Y399-N403 PolarHBondContact O-N 3.48Å
400	K	39	Very low	37.4	Very low	131 Å²	131	102.9 Å²	102.9	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-59.2	-38.2	172	-83.4	-173.7	169	179.2	0	111.5	H396 W404	H396-K400 VanDerWaalsContact NE2-CE 3.33Å; H396-K400 WeakPolarHBondContact NE2-CE 3.34Å; H396-K400 WeakPolarHBondContact O-CB 3.45Å; H396-K400 PolarHBondContact O-N 2.86Å; K400-W404 VanDerWaalsContact O-CB 3.27Å; K400-W404 WeakPolarHBondContact O-CB 3.45Å; K400-W404 PolarHBondContact O-N 3.33Å
401	T	35.7	Very low	37.3	Very low	45 Å²	45	98.5 Å²	98.5	28%	0.276	47%	0.471	S	S	.	.	H	α-helix	trans	-68.6	-38.5	174.6	-50.7	0	0	0	0	112.9	K397 S398 Y399 Y405 W462	K397-T401 PolarHBondContact O-N 3.17Å; K397-T401 PolarHBondContact O-OG1 3.02Å; S398-T401 PolarHBondContact O-N 2.83Å; Y399-T401 VanDerWaalsContact C-N 3.26Å; Y399-T401 PolarHBondContact O-N 3.13Å; T401-Y405 WeakPolarHBondContact O-CB 3.22Å; T401-Y405 PolarHBondContact O-N 3.33Å; T401-W462 HydrophobicContact CG2-CE3 4.47Å; T401-W462 HydrophobicContact CG2-CH2 3.46Å; T401-W462 VanDerWaalsContact CG2-CH2 3.46Å; T401-W462 HydrophobicContact CG2-CZ3 3.44Å; T401-W462 VanDerWaalsContact CG2-CZ3 3.44Å
402	L	36.5	Very low	37.3	Very low	72 Å²	72	99.6 Å²	99.6	38%	0.377	48%	0.476	S	S	.	.	H	α-helix	trans	-67.5	-44.4	173.2	-90.6	158.7	0	0	0	112.3	S398 Y399 W404 Y405 H406 W458	S398-L402 PolarHBondContact O-N 3.47Å; Y399-L402 PolarHBondContact O-N 3.41Å; L402-W404 VanDerWaalsContact C-N 3.35Å; L402-Y405 CarbonylContact O-C 3.44Å; L402-Y405 WeakPolarHBondContact O-CA 3.44Å; L402-Y405 WeakPolarHBondContact O-CB 3.3Å; L402-Y405 PolarHBondContact O-N 3.32Å; L402-Y405 VanDerWaalsContact O-N 3.08Å; L402-H406 PolarHBondContact O-CD2 2.95Å; L402-H406 VanDerWaalsContact O-CD2 3.26Å; L402-H406 PolarHBondContact O-N 3.27Å; L402-W458 HydrophobicContact CD1-CH2 4.39Å; L402-W458 HydrophobicContact CG-CH2 4.39Å
403	N	37.9	Very low	37.3	Very low	66 Å²	66	103.9 Å²	103.9	35%	0.353	49%	0.493	S	S	.	.	H	α-helix	trans	-68.7	-36.2	-179.3	-155.4	10.3	0	0	0	110.9	Y399 H406 L407	Y399-N403 HydrophobicContact CE1-CB 4.4Å; Y399-N403 VanDerWaalsContact O-CB 3.29Å; Y399-N403 WeakPolarHBondContact O-CB 3.41Å; Y399-N403 PolarHBondContact O-N 3.48Å; N403-H406 PolarHBondContact O-N 2.81Å; N403-L407 WeakPolarHBondContact O-CB 3.25Å; N403-L407 WeakPolarHBondContact O-CG 3.46Å; N403-L407 PolarHBondContact O-N 3.38Å
404	W	40.3	Very low	36.9	Very low	146 Å²	146	104.4 Å²	104.4	55%	0.553	50%	0.5	S	S	*	.	H	α-helix	trans	-59.2	-44	166.5	-179	81	0	0	0	111.9	K400 L402 F408 W462	K400-W404 VanDerWaalsContact O-CB 3.27Å; K400-W404 WeakPolarHBondContact O-CB 3.45Å; K400-W404 PolarHBondContact O-N 3.33Å; L402-W404 VanDerWaalsContact C-N 3.35Å; W404-F408 VanDerWaalsContact O-CB 3.26Å; W404-F408 WeakPolarHBondContact O-CB 3.36Å; W404-F408 PolarHBondContact O-N 3.05Å; W404-W462 HydrophobicContact CZ3-CH2 4.49Å
405	Y	33.8	Very low	36.6	Very low	108 Å²	108	102.6 Å²	102.6	42%	0.424	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-36.5	175.8	-173.3	-101.8	0	0	0	112.9	T401 L402 K409	T401-Y405 WeakPolarHBondContact O-CB 3.22Å; T401-Y405 PolarHBondContact O-N 3.33Å; L402-Y405 CarbonylContact O-C 3.44Å; L402-Y405 WeakPolarHBondContact O-CA 3.44Å; L402-Y405 WeakPolarHBondContact O-CB 3.3Å; L402-Y405 PolarHBondContact O-N 3.32Å; L402-Y405 VanDerWaalsContact O-N 3.08Å; Y405-K409 HydrophobicContact CE1-CD 4.33Å; Y405-K409 WeakPolarHBondContact O-CB 3.35Å; Y405-K409 PolarHBondContact O-N 3.46Å
406	H	38.8	Very low	36.2	Very low	115 Å²	115	104.5 Å²	104.5	53%	0.532	53%	0.527	S	S	.	.	H	α-helix	trans	-70	-45.2	175.1	-85.6	-87.2	0	0	0	112.2	L402 N403 F408 K409 S410	L402-H406 PolarHBondContact O-CD2 2.95Å; L402-H406 VanDerWaalsContact O-CD2 3.26Å; L402-H406 PolarHBondContact O-N 3.27Å; N403-H406 PolarHBondContact O-N 2.81Å; H406-F408 VanDerWaalsContact C-N 3.34Å; H406-F408 PolarHBondContact O-N 3.43Å; H406-K409 CarbonylContact O-C 3.44Å; H406-K409 PolarHBondContact O-N 3.18Å; H406-K409 VanDerWaalsContact O-N 3.09Å; H406-S410 PolarHBondContact O-N 3.27Å; H406-S410 PolarHBondContact O-OG 2.99Å
407	L	40.2	Very low	35.7	Very low	107 Å²	107	107.4 Å²	107.4	56%	0.56	55%	0.545	S	S	*	.	H	α-helix	trans	-61.3	-40.4	174.3	-77.6	163	0	0	0	112.1	N403 K409 S410 S411	N403-L407 WeakPolarHBondContact O-CB 3.25Å; N403-L407 WeakPolarHBondContact O-CG 3.46Å; N403-L407 PolarHBondContact O-N 3.38Å; L407-K409 VanDerWaalsContact C-N 3.28Å; L407-K409 PolarHBondContact O-N 3.19Å; L407-S410 WeakPolarHBondContact CA-OG 3.31Å; L407-S410 PolarHBondContact O-N 2.83Å; L407-S410 PolarHBondContact O-OG 2.93Å; L407-S411 VanDerWaalsContact O-CB 3.3Å; L407-S411 WeakPolarHBondContact O-CB 3.39Å; L407-S411 PolarHBondContact O-N 3.38Å
408	F	35.1	Very low	35.3	Very low	121 Å²	121	104.3 Å²	104.3	53%	0.531	55%	0.553	S	S	.	*	H	α-helix	trans	-67.8	-30	174.8	-158.3	-98.9	0	0	0	111.9	W404 H406 I412	W404-F408 VanDerWaalsContact O-CB 3.26Å; W404-F408 WeakPolarHBondContact O-CB 3.36Å; W404-F408 PolarHBondContact O-N 3.05Å; H406-F408 VanDerWaalsContact C-N 3.34Å; H406-F408 PolarHBondContact O-N 3.43Å; F408-I412 HydrophobicContact CD1-CD1 3.67Å; F408-I412 HydrophobicContact CE1-CD1 3.63Å; F408-I412 VanDerWaalsContact O-CD1 3.31Å; F408-I412 WeakPolarHBondContact O-CD1 3.46Å; F408-I412 VanDerWaalsContact O-CG1 3.23Å; F408-I412 WeakPolarHBondContact O-CG1 3.46Å; F408-I412 PolarHBondContact O-N 3.48Å
409	K	36.4	Very low	34.8	Very low	107 Å²	107	112 Å²	112	47%	0.465	59%	0.585	S	S	.	*	H	α-helix	trans	-83.5	-24.5	178.7	-165	177.7	-175.7	-175.1	0	113.6	Y405 H406 L407	Y405-K409 HydrophobicContact CE1-CD 4.33Å; Y405-K409 WeakPolarHBondContact O-CB 3.35Å; Y405-K409 PolarHBondContact O-N 3.46Å; H406-K409 CarbonylContact O-C 3.44Å; H406-K409 PolarHBondContact O-N 3.18Å; H406-K409 VanDerWaalsContact O-N 3.09Å; L407-K409 VanDerWaalsContact C-N 3.28Å; L407-K409 PolarHBondContact O-N 3.19Å
410	S	38.3	Very low	34.6	Very low	51 Å²	51	113.9 Å²	113.9	36%	0.357	60%	0.599	S	S	.	*	H	α-helix	trans	-76.9	-41.9	166.9	52.4	0	0	0	0	111.1	H406 L407 I412 K413 D414	H406-S410 PolarHBondContact O-N 3.27Å; H406-S410 PolarHBondContact O-OG 2.99Å; L407-S410 WeakPolarHBondContact CA-OG 3.31Å; L407-S410 PolarHBondContact O-N 2.83Å; L407-S410 PolarHBondContact O-OG 2.93Å; S410-I412 PolarHBondContact O-N 3.23Å; S410-K413 PolarHBondContact O-N 3.48Å; S410-D414 PolarHBondContact O-N 2.93Å
411	S	35.7	Very low	34	Very low	96 Å²	96	116.3 Å²	116.3	67%	0.671	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-8.9	173.2	-171.2	0	0	0	0	114.7	L407	L407-S411 VanDerWaalsContact O-CB 3.3Å; L407-S411 WeakPolarHBondContact O-CB 3.39Å; L407-S411 PolarHBondContact O-N 3.38Å
412	I	35.8	Very low	33.8	Very low	118 Å²	118	122.2 Å²	122.2	61%	0.605	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-4.8	173.9	-73.4	170.5	0	0	0	112	F408 S410	F408-I412 HydrophobicContact CD1-CD1 3.67Å; F408-I412 HydrophobicContact CE1-CD1 3.63Å; F408-I412 VanDerWaalsContact O-CD1 3.31Å; F408-I412 WeakPolarHBondContact O-CD1 3.46Å; F408-I412 VanDerWaalsContact O-CG1 3.23Å; F408-I412 WeakPolarHBondContact O-CG1 3.46Å; F408-I412 PolarHBondContact O-N 3.48Å; S410-I412 PolarHBondContact O-N 3.23Å
413	K	35.4	Very low	33.3	Very low	157 Å²	157	127.5 Å²	127.5	68%	0.683	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	-20.6	-179.1	-78.8	-170.3	169.1	-162	0	114.9	S410 G415	S410-K413 PolarHBondContact O-N 3.48Å; K413-G415 PolarHBondContact O-N 2.89Å
414	D	31.3	Very low	32.9	Very low	136 Å²	136	133.3 Å²	133.3	73%	0.727	69%	0.685	S	S	*	*	S	Bend	trans	-91.7	31.6	-177	-55.8	-31.5	0	0	0	112.5	S410	S410-D414 PolarHBondContact O-N 2.93Å
415	G	30.5	Very low	32.3	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	70%	0.702	S	S	*	*			trans	-113.8	56.9	-178.3	0	0	0	0	0	112.7	K413 I417	K413-G415 PolarHBondContact O-N 2.89Å; G415-I417 PolarHBondContact O-N 2.95Å
416	T	27.8	Very low	32	Very low	134 Å²	134	134.3 Å²	134.3	82%	0.822	72%	0.721	S	S	*	*			trans	-77.6	111.2	172.7	47.7	0	0	0	0	110.7
417	I	29.2	Very low	31.5	Very low	165 Å²	165	132 Å²	132	85%	0.846	73%	0.728	S	S	*	*			trans	-125.7	127.2	158.6	-62.8	178.9	0	0	0	105.4	G415	G415-I417 PolarHBondContact O-N 2.95Å
418	G	29.8	Very low	30.9	Very low	75 Å²	75	135 Å²	135	77%	0.773	74%	0.739	S	S	*	*			trans	-75.9	159.9	-174.2	0	0	0	0	0	113.4
419	E	27.1	Very low	30.5	Very low	193 Å²	193	135.1 Å²	135.1	90%	0.902	74%	0.742	S	S	*	*			trans	-103.9	128.9	168	-64.3	173	155.7	0	0	108.2
420	E	31.3	Very low	30.2	Very low	180 Å²	180	137 Å²	137	84%	0.841	75%	0.752	S	S	*	*			trans	-134.3	111.5	151.6	-72.2	178.9	169.3	0	0	102.5
421	E	28.1	Very low	29.8	Very low	181 Å²	181	142.9 Å²	142.9	85%	0.846	77%	0.774	S	S	*	*				65.8	135.7	103.3	-64.4	179.4	-179.7	0	0	111.8
422	E	29.6	Very low	29.4	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.794	77%	0.767	S	S	*	*			cis	-147.5	135.9	33.6	-65.1	168.5	149.5	0	0	109
423	E	27.4	Very low	29.2	Very low	182 Å²	182	142.1 Å²	142.1	85%	0.85	78%	0.775	S	S	*	*				95.3	169.1	90.9	-68.2	-152.6	147.9	0	0	116.1
424	E	29.2	Very low	28.8	Very low	189 Å²	189	140.8 Å²	140.8	88%	0.883	78%	0.776	S	S	*	*			trans	68.8	137.7	-173.7	-60.8	-170.7	-179.9	0	0	119.1
425	E	27.7	Very low	28.6	Very low	195 Å²	195	141.4 Å²	141.4	91%	0.911	78%	0.778	S	S	*	*			cis	-168.7	159.9	-43	-122.8	-166.6	-177.5	0	0	109
426	G	28.1	Very low	28.4	Very low	80 Å²	80	146 Å²	146	83%	0.825	78%	0.781	S	S	*	*			trans	107.5	115.3	152.8	0	0	0	0	0	120.1
427	G	28.6	Very low	28.4	Very low	67 Å²	67	145.4 Å²	145.4	69%	0.691	77%	0.773	S	S	*	*			trans	96.6	76.6	159.5	0	0	0	0	0	115.5
428	E	26.4	Very low	28.2	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	76%	0.762	S	S	*	*				63.9	132.4	87.4	-63.1	-152.9	136.1	0	0	114.7
429	Q	27.8	Very low	28	Very low	125 Å²	125	145.3 Å²	145.3	58%	0.584	76%	0.763	S	S	*	*			cis	-167.8	156.4	5.6	-124.3	-177.3	35.6	0	0	111
430	Q	29.4	Very low	28	Very low	146 Å²	146	143.2 Å²	143.2	68%	0.682	76%	0.757	S	S	*	*			trans	64.2	148.9	156.5	-56.2	176.4	32.3	0	0	118.5
431	H	29.5	Very low	27.8	Very low	175 Å²	175	143.8 Å²	143.8	81%	0.81	76%	0.76	S	S	*	*			cis	-164.5	154.3	-20.6	-102.2	-56.3	0	0	0	104
432	G	27.4	Very low	27.8	Very low	52 Å²	52	145.2 Å²	145.2	54%	0.536	76%	0.764	S	S	.	*			cis	174.4	156.1	-1.2	0	0	0	0	0	107.8
433	D	31.6	Very low	27.8	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	75%	0.745	S	S	*	*			trans	63.7	142.3	161.3	-47.2	-26.2	0	0	0	120.3
434	N	27.4	Very low	27.9	Very low	130 Å²	130	137.1 Å²	137.1	70%	0.695	74%	0.736	S	S	*	*			cis	-152.6	155.7	-30	-111.8	-38.6	0	0	0	109.9
435	L	26.4	Very low	27.9	Very low	148 Å²	148	134.7 Å²	134.7	78%	0.775	73%	0.729	S	S	*	*			trans	-37	146.3	160.6	-71.4	77.6	0	0	0	113.6
436	E	26.8	Very low	28	Very low	167 Å²	167	132.7 Å²	132.7	78%	0.78	72%	0.719	S	S	*	*				-170.1	138.5	97.4	-100.8	-171.9	-167.4	0	0	114.3
437	N	28.3	Very low	28.2	Very low	121 Å²	121	135.2 Å²	135.2	65%	0.647	71%	0.714	S	S	*	*			trans	55.1	98.5	147.9	-60.9	-40.8	0	0	0	119
438	S	24.8	Very low	28.3	Very low	89 Å²	89	136.9 Å²	136.9	62%	0.622	72%	0.715	S	S	*	*				72.1	134	67.5	84	0	0	0	0	114.3
439	N	25.6	Very low	28.5	Very low	149 Å²	149	135.7 Å²	135.7	80%	0.797	71%	0.713	S	S	*	*			trans	72.4	75.1	171.8	-53.2	-44.9	0	0	0	119
440	L	26.8	Very low	28.6	Very low	148 Å²	148	136.8 Å²	136.8	78%	0.775	72%	0.723	S	S	*	*			trans	-168.9	40.8	145.1	-106.5	154.2	0	0	0	115.7
441	E	26.7	Very low	28.6	Very low	192 Å²	192	137.4 Å²	137.4	90%	0.897	73%	0.726	S	S	*	*			trans	-103.8	15	178.7	-69.7	-158.6	138	0	0	115.5
442	K	29	Very low	28.6	Very low	211 Å²	211	133.4 Å²	133.4	92%	0.917	71%	0.708	S	S	*	*	S	Bend	trans	-103.9	-2.1	-176.5	-82.1	-178.4	178.9	171.7	0	116.4
443	S	28.3	Very low	28.5	Very low	59 Å²	59	138 Å²	138	41%	0.413	72%	0.72	S	S	.	*	S	Bend	trans	-109.1	-12.6	-174.4	53.4	0	0	0	0	116.2
444	N	30.3	Very low	28.5	Very low	123 Å²	123	134.8 Å²	134.8	66%	0.658	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	8.5	-169.9	-69.2	-22	0	0	0	115.4
445	L	29.9	Very low	28.7	Very low	139 Å²	139	133.6 Å²	133.6	73%	0.728	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-19.9	-179.6	-113.1	99.6	0	0	0	114.8
446	E	29.5	Very low	29.1	Very low	153 Å²	153	132.3 Å²	132.3	72%	0.715	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-37.2	-178.1	-67.1	-178.2	149.6	0	0	111.4	S448 L449	E446-S448 PolarHBondContact O-N 3.17Å; E446-L449 PolarHBondContact O-N 3.08Å
447	D	30.8	Very low	29.4	Very low	132 Å²	132	129.2 Å²	129.2	71%	0.706	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-19.3	174.5	-69.2	-22	0	0	0	113.9	L449	D447-L449 VanDerWaalsContact C-N 3.3Å; D447-L449 PolarHBondContact O-N 3.25Å
448	S	32.3	Very low	29.6	Very low	103 Å²	103	130 Å²	130	72%	0.72	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-5.1	178.8	-176.6	0	0	0	0	114.1	E446	E446-S448 PolarHBondContact O-N 3.17Å
449	L	29.6	Very low	30.1	Very low	143 Å²	143	129.6 Å²	129.6	75%	0.749	67%	0.665	S	S	*	*	S	Bend	trans	-104.7	-13.6	-170.4	-92.4	154.8	0	0	0	114.9	E446 D447	E446-L449 PolarHBondContact O-N 3.08Å; D447-L449 VanDerWaalsContact C-N 3.3Å; D447-L449 PolarHBondContact O-N 3.25Å
450	N	29.5	Very low	30.6	Very low	148 Å²	148	124.6 Å²	124.6	79%	0.791	64%	0.637	S	S	*	*	S	Bend	trans	-90.4	-15.5	-175.7	-79.9	-25.6	0	0	0	115.1	Q452	N450-Q452 PolarHBondContact O-N 2.88Å
451	E	29.6	Very low	31	Very low	159 Å²	159	121.5 Å²	121.5	74%	0.743	62%	0.621	S	S	*	*	S	Bend	trans	-94.2	95.2	179	-69.9	-155.4	140.5	0	0	113.9
452	Q	29.7	Very low	31.4	Very low	90 Å²	90	118.6 Å²	118.6	42%	0.421	60%	0.602	S	S	.	*			trans	84.2	83.5	142.2	-49.2	157.5	-3.9	0	0	119.2	R180 N450	R180-Q452 VanDerWaalsContact CZ-CB 3.44Å; R180-Q452 VanDerWaalsContact CZ-CD 3.5Å; R180-Q452 PolarHBondContact NH2-O 3.42Å; R180-Q452 VanDerWaalsContact NH2-OE1 3.08Å; N450-Q452 PolarHBondContact O-N 2.88Å
453	L	26.5	Very low	31.8	Very low	150 Å²	150	112.8 Å²	112.8	79%	0.785	58%	0.58	S	S	*	*			trans	-46	134.2	167.3	-68.3	79	0	0	0	114
454	F	30.1	Very low	32.3	Very low	77 Å²	77	115.1 Å²	115.1	34%	0.338	58%	0.583	S	S	.	*			trans	-158.7	54.3	157.5	-127.9	-75.5	0	0	0	115.7	P201 N456	P201-F454 HydrophobicContact CG-CZ 4.48Å; F454-N456 VanDerWaalsContact C-N 3.34Å; F454-N456 PolarHBondContact O-N 3.21Å
455	I	31.2	Very low	32.5	Very low	105 Å²	105	112.6 Å²	112.6	54%	0.538	57%	0.569	S	S	.	*	S	Bend	trans	54.5	-35.2	144.1	-61.8	176.5	0	0	0	121.8	F394	F394-I455 HydrophobicContact CZ-CG2 4.43Å
456	N	34.7	Very low	33	Very low	120 Å²	120	108 Å²	108	64%	0.642	55%	0.549	S	S	*	.	S	Bend	trans	-90.4	-15	-165	-75	1	0	0	0	117.1	F454	F454-N456 VanDerWaalsContact C-N 3.34Å; F454-N456 PolarHBondContact O-N 3.21Å
457	D	34.1	Very low	33.5	Very low	103 Å²	103	107.3 Å²	107.3	55%	0.551	54%	0.544	S	S	*	.	S	Bend	trans	-89.3	-8.3	-171.2	-72.9	-38.8	0	0	0	115.6	S459 M460 I461	D457-S459 PolarHBondContact O-N 3.23Å; D457-M460 PolarHBondContact O-N 3.4Å; D457-I461 PolarHBondContact O-N 3.3Å
458	W	32.7	Very low	34	Very low	138 Å²	138	108.5 Å²	108.5	52%	0.523	54%	0.542	S	S	.	.	H	α-helix	trans	-66.8	-34	-169.7	-94.4	75.7	0	0	0	114.5	L402 M460 I461 W462	L402-W458 HydrophobicContact CD1-CH2 4.39Å; L402-W458 HydrophobicContact CG-CH2 4.39Å; W458-M460 VanDerWaalsContact C-N 3.3Å; W458-M460 PolarHBondContact O-N 3.1Å; W458-I461 PolarHBondContact O-N 2.84Å; W458-W462 PolarHBondContact O-N 2.82Å
459	S	35.9	Very low	34.2	Very low	80 Å²	80	108.6 Å²	108.6	56%	0.559	53%	0.534	S	S	*	.	H	α-helix	trans	-65.9	-32.1	179.9	66.4	0	0	0	0	112.9	D457 N463	D457-S459 PolarHBondContact O-N 3.23Å; S459-N463 WeakPolarHBondContact O-CB 3.12Å; S459-N463 PolarHBondContact O-N 3.06Å; S459-N463 VanDerWaalsContact O-N 3.08Å; S459-N463 PolarHBondContact O-ND2 3.37Å
460	M	35.4	Very low	34.5	Very low	43 Å²	43	109 Å²	109	21%	0.212	53%	0.53	C	S	.	.	H	α-helix	trans	-73.8	-38.2	174.2	-84.8	-160.2	75	0	0	112.8	D457 W458 N463 K464 F823	D457-M460 PolarHBondContact O-N 3.4Å; W458-M460 VanDerWaalsContact C-N 3.3Å; W458-M460 PolarHBondContact O-N 3.1Å; M460-N463 PolarHBondContact O-N 3.03Å; M460-K464 WeakPolarHBondContact O-CB 3.03Å; M460-K464 WeakPolarHBondContact O-CG 3.37Å; M460-K464 PolarHBondContact O-N 3.12Å; M460-F823 HydrophobicContact CE-CB 3.63Å; M460-F823 HydrophobicContact CE-CD1 3.26Å; M460-F823 HydrophobicContact CE-CD2 3.82Å; M460-F823 HydrophobicContact CE-CE1 3.8Å; M460-F823 HydrophobicContact CE-CE2 4.29Å; M460-F823 HydrophobicContact CE-CG 3.27Å; M460-F823 HydrophobicContact CE-CZ 4.29Å; M460-F823 HydrophobicContact SD-CB 3.59Å; M460-F823 VanDerWaalsContact SD-CB 3.59Å; M460-F823 HydrophobicContact SD-CD1 3.69Å; M460-F823 HydrophobicContact SD-CG 3.82Å
461	I	35.3	Very low	34.9	Very low	84 Å²	84	110 Å²	110	43%	0.431	53%	0.527	S	S	.	.	H	α-helix	trans	-65.7	-45.7	177.5	-67.5	169.1	0	0	0	109	D457 W458 N463 K464 L465	D457-I461 PolarHBondContact O-N 3.3Å; W458-I461 PolarHBondContact O-N 2.84Å; I461-N463 PolarHBondContact O-N 2.52Å; I461-K464 PolarHBondContact O-N 2.93Å; I461-L465 HydrophobicContact CG2-CD1 3.77Å; I461-L465 WeakPolarHBondContact O-CB 3.37Å; I461-L465 WeakPolarHBondContact O-CG 3.43Å; I461-L465 PolarHBondContact O-N 3.29Å
462	W	34	Very low	35.3	Very low	131 Å²	131	111 Å²	111	50%	0.496	53%	0.529	S	S	.	.	H	α-helix	trans	-58.8	-47.9	174.2	-161.6	-106.2	0	0	0	112.3	T401 W404 W458 K464 L465 S466	T401-W462 HydrophobicContact CG2-CE3 4.47Å; T401-W462 HydrophobicContact CG2-CH2 3.46Å; T401-W462 VanDerWaalsContact CG2-CH2 3.46Å; T401-W462 HydrophobicContact CG2-CZ3 3.44Å; T401-W462 VanDerWaalsContact CG2-CZ3 3.44Å; W404-W462 HydrophobicContact CZ3-CH2 4.49Å; W458-W462 PolarHBondContact O-N 2.82Å; W462-K464 VanDerWaalsContact C-N 3.32Å; W462-K464 PolarHBondContact O-N 3.2Å; W462-L465 PolarHBondContact O-N 2.85Å; W462-S466 WeakPolarHBondContact O-CB 3.27Å; W462-S466 PolarHBondContact O-N 2.98Å; W462-S466 PolarHBondContact O-OG 2.79Å
463	N	37.8	Very low	35.5	Very low	88 Å²	88	110.1 Å²	110.1	47%	0.471	53%	0.533	S	S	.	.	H	α-helix	trans	-67.2	-25.4	177.4	-88.8	-63.7	0	0	0	114.7	S459 M460 I461 S466 K467	S459-N463 WeakPolarHBondContact O-CB 3.12Å; S459-N463 PolarHBondContact O-N 3.06Å; S459-N463 VanDerWaalsContact O-N 3.08Å; S459-N463 PolarHBondContact O-ND2 3.37Å; M460-N463 PolarHBondContact O-N 3.03Å; I461-N463 PolarHBondContact O-N 2.52Å; N463-S466 PolarHBondContact O-OG 2.79Å; N463-K467 WeakPolarHBondContact O-CB 3.48Å; N463-K467 WeakPolarHBondContact O-CD 3.37Å; N463-K467 VanDerWaalsContact O-CG 3.23Å; N463-K467 WeakPolarHBondContact O-CG 3.46Å; N463-K467 PolarHBondContact O-N 3.43Å
464	K	38.8	Very low	35.8	Very low	108 Å²	108	109 Å²	109	47%	0.47	53%	0.528	S	S	.	.	H	α-helix	trans	-83.7	-33.4	174	-78.5	176.6	177.4	173.7	0	112.2	M460 I461 W462 K468	M460-K464 WeakPolarHBondContact O-CB 3.03Å; M460-K464 WeakPolarHBondContact O-CG 3.37Å; M460-K464 PolarHBondContact O-N 3.12Å; I461-K464 PolarHBondContact O-N 2.93Å; W462-K464 VanDerWaalsContact C-N 3.32Å; W462-K464 PolarHBondContact O-N 3.2Å; K464-K468 WeakPolarHBondContact O-CB 3.34Å; K464-K468 WeakPolarHBondContact O-CG 3.39Å; K464-K468 PolarHBondContact O-N 3.35Å; K464-K468 VanDerWaalsContact O-N 3.12Å
465	L	36.1	Very low	36	Very low	70 Å²	70	114.1 Å²	114.1	37%	0.366	55%	0.55	S	S	.	.	H	α-helix	trans	-70.2	-49.8	173.6	-79.2	165.4	0	0	0	111	I461 W462 K467 K468 I469	I461-L465 HydrophobicContact CG2-CD1 3.77Å; I461-L465 WeakPolarHBondContact O-CB 3.37Å; I461-L465 WeakPolarHBondContact O-CG 3.43Å; I461-L465 PolarHBondContact O-N 3.29Å; W462-L465 PolarHBondContact O-N 2.85Å; L465-K467 VanDerWaalsContact C-N 3.33Å; L465-K467 PolarHBondContact O-N 3.25Å; L465-K468 PolarHBondContact O-N 3.23Å; L465-I469 WeakPolarHBondContact O-CB 3.25Å; L465-I469 VanDerWaalsContact O-CG1 3.28Å; L465-I469 WeakPolarHBondContact O-CG1 3.48Å; L465-I469 PolarHBondContact O-N 2.87Å
466	S	39.3	Very low	35.9	Very low	43 Å²	43	116.6 Å²	116.6	30%	0.301	56%	0.559	S	S	.	*	H	α-helix	trans	-56.2	-46	177.5	67.4	0	0	0	0	111.8	W462 N463 K468 I469 F470	W462-S466 WeakPolarHBondContact O-CB 3.27Å; W462-S466 PolarHBondContact O-N 2.98Å; W462-S466 PolarHBondContact O-OG 2.79Å; N463-S466 PolarHBondContact O-OG 2.79Å; S466-K468 VanDerWaalsContact C-N 3.32Å; S466-K468 PolarHBondContact O-N 3.48Å; S466-I469 PolarHBondContact O-N 2.82Å; S466-F470 WeakPolarHBondContact O-CB 3.32Å; S466-F470 PolarHBondContact O-N 2.91Å
467	K	40	Very low	35.7	Very low	139 Å²	139	119.7 Å²	119.7	60%	0.604	57%	0.569	S	S	*	*	H	α-helix	trans	-69	-21.1	175.9	-71	177.7	-177	176.8	0	114.6	N463 L465 K471	N463-K467 WeakPolarHBondContact O-CB 3.48Å; N463-K467 WeakPolarHBondContact O-CD 3.37Å; N463-K467 VanDerWaalsContact O-CG 3.23Å; N463-K467 WeakPolarHBondContact O-CG 3.46Å; N463-K467 PolarHBondContact O-N 3.43Å; L465-K467 VanDerWaalsContact C-N 3.33Å; L465-K467 PolarHBondContact O-N 3.25Å; K467-K471 WeakPolarHBondContact O-CB 3.3Å; K467-K471 VanDerWaalsContact O-CG 3.29Å; K467-K471 WeakPolarHBondContact O-CG 3.5Å
468	K	40.6	Very low	35.2	Very low	156 Å²	156	119.8 Å²	119.8	68%	0.678	58%	0.578	S	S	*	*	H	α-helix	trans	-85.1	-37.3	172.5	-86.1	-173.9	170.7	-171.8	0	112.2	K464 L465 S466 K471 K472	K464-K468 WeakPolarHBondContact O-CB 3.34Å; K464-K468 WeakPolarHBondContact O-CG 3.39Å; K464-K468 PolarHBondContact O-N 3.35Å; K464-K468 VanDerWaalsContact O-N 3.12Å; L465-K468 PolarHBondContact O-N 3.23Å; S466-K468 VanDerWaalsContact C-N 3.32Å; S466-K468 PolarHBondContact O-N 3.48Å; K468-K471 PolarHBondContact O-N 2.96Å; K468-K472 PolarHBondContact O-N 3.48Å; K468-K472 VanDerWaalsContact O-N 3.12Å
469	I	37.1	Very low	35	Very low	106 Å²	106	119.1 Å²	119.1	54%	0.544	59%	0.59	S	S	.	*	H	α-helix	trans	-62.6	-52.1	174.3	-67.1	163.1	0	0	0	109	L465 S466 K471 K472 S473	L465-I469 WeakPolarHBondContact O-CB 3.25Å; L465-I469 VanDerWaalsContact O-CG1 3.28Å; L465-I469 WeakPolarHBondContact O-CG1 3.48Å; L465-I469 PolarHBondContact O-N 2.87Å; S466-I469 PolarHBondContact O-N 2.82Å; I469-K471 PolarHBondContact O-N 3.24Å; I469-K471 VanDerWaalsContact O-N 3.14Å; I469-K472 PolarHBondContact O-N 2.86Å; I469-K472 VanDerWaalsContact O-N 3.12Å; I469-S473 PolarHBondContact O-N 2.87Å; I469-S473 PolarHBondContact O-OG 2.96Å
470	F	35.4	Very low	34.5	Very low	150 Å²	150	121.4 Å²	121.4	66%	0.658	60%	0.6	S	S	*	*	H	α-helix	trans	-60.6	-23.1	175.6	-110.3	-88.8	0	0	0	115.1	S466	S466-F470 WeakPolarHBondContact O-CB 3.32Å; S466-F470 PolarHBondContact O-N 2.91Å
471	K	39.2	Very low	34.2	Very low	170 Å²	170	125.2 Å²	125.2	74%	0.739	63%	0.626	S	S	*	*	H	α-helix	trans	-91.5	-15.6	177.9	-81	-170.6	175.1	-164.9	0	114.2	K467 K468 I469	K467-K471 WeakPolarHBondContact O-CB 3.3Å; K467-K471 VanDerWaalsContact O-CG 3.29Å; K467-K471 WeakPolarHBondContact O-CG 3.5Å; K468-K471 PolarHBondContact O-N 2.96Å; I469-K471 PolarHBondContact O-N 3.24Å; I469-K471 VanDerWaalsContact O-N 3.14Å
472	K	36.9	Very low	33.8	Very low	179 Å²	179	127.2 Å²	127.2	78%	0.778	64%	0.642	S	S	*	*	H	α-helix	trans	-96.1	-29.2	173.5	-82.2	-165.3	165.9	-161.9	0	112.9	K468 I469 N474	K468-K472 PolarHBondContact O-N 3.48Å; K468-K472 VanDerWaalsContact O-N 3.12Å; I469-K472 PolarHBondContact O-N 2.86Å; I469-K472 VanDerWaalsContact O-N 3.12Å; K472-N474 VanDerWaalsContact C-N 3.26Å; K472-N474 PolarHBondContact O-N 2.77Å
473	S	34.7	Very low	33.4	Very low	73 Å²	73	128.1 Å²	128.1	51%	0.51	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.7	-13.3	176	63	0	0	0	0	114.9	I469	I469-S473 PolarHBondContact O-N 2.87Å; I469-S473 PolarHBondContact O-OG 2.96Å
474	N	31.7	Very low	32.8	Very low	126 Å²	126	130.4 Å²	130.4	67%	0.674	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	29.1	-176.5	-76.4	6.1	0	0	0	113.2	K472	K472-N474 VanDerWaalsContact C-N 3.26Å; K472-N474 PolarHBondContact O-N 2.77Å
475	K	34.3	Very low	32.2	Very low	185 Å²	185	132.1 Å²	132.1	80%	0.804	68%	0.684	S	S	*	*	S	Bend	trans	-134	5.3	179.9	-91.5	-162.9	168.3	-160.2	0	115.6
476	Q	30.5	Very low	31.9	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.734	71%	0.705	S	S	*	*	S	Bend	trans	-134.2	149.7	173.2	-72.8	171.1	-47.1	0	0	108.1
477	H	29.8	Very low	31.5	Very low	185 Å²	185	145.4 Å²	145.4	86%	0.856	73%	0.733	S	S	*	*			trans	73.3	61.2	-176	-47.3	-66.8	0	0	0	116.7
478	S	24.3	Very low	31.1	Very low	105 Å²	105	145.7 Å²	145.7	73%	0.734	74%	0.739	S	S	*	*			trans	-71.2	165.1	135.1	48.3	0	0	0	0	110.6
479	T	27.6	Very low	30.7	Very low	124 Å²	124	144 Å²	144	76%	0.761	73%	0.734	S	S	*	*			trans	75.9	101.5	174.3	67	0	0	0	0	119.5
480	T	26.3	Very low	31.1	Very low	127 Å²	127	146.4 Å²	146.4	78%	0.779	75%	0.747	S	S	*	*			trans	83.4	144.7	133.5	46.5	0	0	0	0	123.5
481	T	28.8	Very low	31.9	Very low	123 Å²	123	142.3 Å²	142.3	76%	0.755	74%	0.735	S	S	*	*			trans	70.5	88.7	162.8	44.7	0	0	0	0	121.2
482	T	26.3	Very low	33.1	Very low	126 Å²	126	136 Å²	136	77%	0.773	72%	0.717	S	S	*	*				46.1	133	123.8	52.5	0	0	0	0	123
483	N	26.1	Very low	34.6	Very low	150 Å²	150	132 Å²	132	80%	0.802	70%	0.704	S	S	*	*			trans	93.1	130.9	160.8	-69.1	-16.5	0	0	0	119.9
484	N	25.7	Very low	36.3	Very low	136 Å²	136	133 Å²	133	73%	0.727	70%	0.701	S	S	*	*			trans	74.2	86.4	159.6	-62.7	-22.4	0	0	0	120.6
485	N	24.9	Very low	38.3	Very low	145 Å²	145	132.1 Å²	132.1	78%	0.775	69%	0.693	S	S	*	*				50.6	82.9	111.4	-64	-21.9	0	0	0	119.2
486	K	29.9	Very low	40.3	Very low	190 Å²	190	125.3 Å²	125.3	83%	0.826	67%	0.668	S	S	*	*				164.5	107.6	116.1	-90.1	167.6	-179.9	176.6	0	109.5	I488	K486-I488 PolarHBondContact O-N 3.36Å; K486-I488 VanDerWaalsContact O-N 3.13Å
487	K	32.4	Very low	42.6	Very low	202 Å²	202	118.9 Å²	118.9	88%	0.878	64%	0.639	S	S	*	*			trans	-58.8	117.1	153.1	-85.3	176.7	174.4	170.7	0	106.5	Q489	K487-Q489 PolarHBondContact O-N 2.99Å
488	I	30.2	Very low	45.1	Very low	144 Å²	144	110.8 Å²	110.8	74%	0.738	60%	0.603	S	S	*	*			trans	-71.2	86.9	173.7	-54.2	179.4	0	0	0	107.2	K486 L490	K486-I488 PolarHBondContact O-N 3.36Å; K486-I488 VanDerWaalsContact O-N 3.13Å; I488-L490 HydrophobicContact CG2-CD2 3.86Å; I488-L490 HydrophobicContact CG2-CG 4.03Å; I488-L490 PolarHBondContact O-N 3.42Å; I488-L490 VanDerWaalsContact O-N 3.13Å
489	Q	33.4	Very low	47.8	Very low	120 Å²	120	109.9 Å²	109.9	56%	0.561	59%	0.589	S	S	*	*			trans	-83.7	86.9	-177.4	-171.5	173.2	-13.2	0	0	108.5	K487 T491 N493	K487-Q489 PolarHBondContact O-N 2.99Å; Q489-T491 WeakPolarHBondContact CG-O 3.32Å; Q489-T491 PolarHBondContact NE2-O 2.84Å; Q489-T491 PolarHBondContact O-N 3.28Å; Q489-N493 PolarHBondContact NE2-OD1 2.79Å
490	L	44.6	Very low	50.5	Low	157 Å²	157	107.9 Å²	107.9	82%	0.822	57%	0.57	S	S	*	*			trans	-67.5	5	-173.7	-69.1	167.9	0	0	0	115.4	I488	I488-L490 HydrophobicContact CG2-CD2 3.86Å; I488-L490 HydrophobicContact CG2-CG 4.03Å; I488-L490 PolarHBondContact O-N 3.42Å; I488-L490 VanDerWaalsContact O-N 3.13Å
491	T	52.3	Low	53.4	Low	65 Å²	65	101.9 Å²	101.9	40%	0.399	53%	0.532	S	S	.	.	S	Bend	trans	-146.8	132.3	174.5	57.5	0	0	0	0	109.4	Q489 E495	Q489-T491 WeakPolarHBondContact CG-O 3.32Å; Q489-T491 PolarHBondContact NE2-O 2.84Å; Q489-T491 PolarHBondContact O-N 3.28Å; T491-E495 WeakPolarHBondContact CA-OE2 3.34Å
492	G	64.8	Low	56.1	Low	36 Å²	36	96.7 Å²	96.7	37%	0.371	50%	0.5	S	S	.	.			trans	-60.1	157.2	178.5	0	0	0	0	0	113.4	H494 E495 C496	G492-H494 VanDerWaalsContact C-N 3.26Å; G492-H494 PolarHBondContact O-N 2.8Å; G492-E495 PolarHBondContact N-OE2 2.79Å; G492-E495 PolarHBondContact O-N 2.75Å; G492-C496 PolarHBondContact O-N 2.8Å
493	N	68.7	Low	58.9	Low	96 Å²	96	95.5 Å²	95.5	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-58.3	-39.7	176.5	-78.3	-17.9	0	0	0	111.9	Q489 L497 L523	Q489-N493 PolarHBondContact NE2-OD1 2.79Å; N493-L497 WeakPolarHBondContact O-CG 3.4Å; N493-L497 PolarHBondContact O-N 2.9Å; N493-L497 VanDerWaalsContact O-N 3.11Å; N493-L523 HydrophobicContact CB-CD1 4.03Å
494	H	70.2	Confident	61.9	Low	95 Å²	95	91.2 Å²	91.2	44%	0.44	46%	0.459	S	S	.	.	H	α-helix	trans	-59.4	-53.2	172.5	-81.3	-90.7	0	0	0	111.9	G492 C496 L497 S498	G492-H494 VanDerWaalsContact C-N 3.26Å; G492-H494 PolarHBondContact O-N 2.8Å; H494-C496 VanDerWaalsContact C-N 3.3Å; H494-C496 PolarHBondContact O-N 3.36Å; H494-L497 CarbonylContact O-C 3.48Å; H494-L497 WeakPolarHBondContact O-CA 3.47Å; H494-L497 WeakPolarHBondContact O-CB 3.14Å; H494-L497 PolarHBondContact O-N 3.05Å; H494-S498 PolarHBondContact O-N 2.8Å; H494-S498 PolarHBondContact O-OG 2.8Å
495	E	72.5	Confident	64.8	Low	107 Å²	107	84.7 Å²	84.7	50%	0.5	42%	0.424	S	S	.	.	H	α-helix	trans	-56.9	-43.3	-178.7	-59.1	175.4	150.2	0	0	111.8	T491 G492 L497 S498 I499	T491-E495 WeakPolarHBondContact CA-OE2 3.34Å; G492-E495 PolarHBondContact N-OE2 2.79Å; G492-E495 PolarHBondContact O-N 2.75Å; E495-L497 VanDerWaalsContact C-N 3.33Å; E495-L497 PolarHBondContact O-N 3.26Å; E495-S498 PolarHBondContact O-N 3.32Å; E495-I499 WeakPolarHBondContact O-CB 3.26Å; E495-I499 WeakPolarHBondContact O-CD1 3.26Å; E495-I499 VanDerWaalsContact O-CG1 3.23Å; E495-I499 WeakPolarHBondContact O-CG1 3.45Å; E495-I499 PolarHBondContact O-N 2.75Å
496	C	76.4	Confident	67.7	Low	42 Å²	42	80.5 Å²	80.5	28%	0.284	40%	0.398	S	S	.	.	H	α-helix	trans	-66.5	-32.1	177.4	-173	0	0	0	0	112.9	G492 H494 K500	G492-C496 PolarHBondContact O-N 2.8Å; H494-C496 VanDerWaalsContact C-N 3.3Å; H494-C496 PolarHBondContact O-N 3.36Å; C496-K500 WeakPolarHBondContact O-CD 3.35Å; C496-K500 VanDerWaalsContact O-CG 3.26Å; C496-K500 WeakPolarHBondContact O-CG 3.15Å; C496-K500 PolarHBondContact O-N 3.48Å
497	L	79.7	Confident	70.3	Confident	22 Å²	22	77.8 Å²	77.8	12%	0.115	39%	0.388	C	S	.	.	H	α-helix	trans	-72.7	-45.5	172.5	-73.2	169.9	0	0	0	111.4	N493 H494 E495 I499 K500 F501 L516 I525	N493-L497 WeakPolarHBondContact O-CG 3.4Å; N493-L497 PolarHBondContact O-N 2.9Å; N493-L497 VanDerWaalsContact O-N 3.11Å; H494-L497 CarbonylContact O-C 3.48Å; H494-L497 WeakPolarHBondContact O-CA 3.47Å; H494-L497 WeakPolarHBondContact O-CB 3.14Å; H494-L497 PolarHBondContact O-N 3.05Å; E495-L497 VanDerWaalsContact C-N 3.33Å; E495-L497 PolarHBondContact O-N 3.26Å; L497-I499 PolarHBondContact O-N 3.08Å; L497-K500 PolarHBondContact O-N 2.91Å; L497-F501 WeakPolarHBondContact O-CB 3.31Å; L497-F501 PolarHBondContact O-N 3.44Å; L497-L516 HydrophobicContact CD2-CD2 4.36Å; L497-I525 HydrophobicContact CB-CD1 4.26Å; L497-I525 HydrophobicContact CB-CG1 4.4Å
498	S	81.4	Confident	72.7	Confident	15 Å²	15	69 Å²	69	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-61.5	-43.6	178.1	-56	0	0	0	0	112.4	H494 E495 K500 F501 I502	H494-S498 PolarHBondContact O-N 2.8Å; H494-S498 PolarHBondContact O-OG 2.8Å; E495-S498 PolarHBondContact O-N 3.32Å; S498-K500 VanDerWaalsContact C-N 3.32Å; S498-K500 PolarHBondContact O-N 2.85Å; S498-F501 PolarHBondContact O-N 3.15Å; S498-I502 WeakPolarHBondContact O-CG1 3.45Å; S498-I502 PolarHBondContact O-N 3.07Å
499	I	81.5	Confident	75.4	Confident	85 Å²	85	65.2 Å²	65.2	44%	0.436	34%	0.336	S	S	.	.	H	α-helix	trans	-59.8	-42.3	175	-69.3	164.6	0	0	0	111	E495 L497 Q503	E495-I499 WeakPolarHBondContact O-CB 3.26Å; E495-I499 WeakPolarHBondContact O-CD1 3.26Å; E495-I499 VanDerWaalsContact O-CG1 3.23Å; E495-I499 WeakPolarHBondContact O-CG1 3.45Å; E495-I499 PolarHBondContact O-N 2.75Å; L497-I499 PolarHBondContact O-N 3.08Å; I499-Q503 WeakPolarHBondContact O-CB 3.33Å; I499-Q503 WeakPolarHBondContact O-CG 3.47Å; I499-Q503 PolarHBondContact O-N 3.11Å
500	K	83.5	Confident	78	Confident	83 Å²	83	62.2 Å²	62.2	36%	0.361	32%	0.321	S	S	.	.	H	α-helix	trans	-67.4	-40.7	176.5	-74.1	168.7	-174.1	165.7	0	112.2	C496 L497 S498 Q503 Y504	C496-K500 WeakPolarHBondContact O-CD 3.35Å; C496-K500 VanDerWaalsContact O-CG 3.26Å; C496-K500 WeakPolarHBondContact O-CG 3.15Å; C496-K500 PolarHBondContact O-N 3.48Å; L497-K500 PolarHBondContact O-N 2.91Å; S498-K500 VanDerWaalsContact C-N 3.32Å; S498-K500 PolarHBondContact O-N 2.85Å; K500-Q503 PolarHBondContact O-N 2.77Å; K500-Y504 WeakPolarHBondContact O-CB 3.38Å; K500-Y504 WeakPolarHBondContact O-CD1 3.39Å; K500-Y504 PolarHBondContact O-N 2.87Å
501	F	88.2	Confident	80	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-52.9	177.1	167.4	-104.6	0	0	0	111	L497 S498 Q503 Y504 C505 V513 L516 L517 I525 L527 L553	L497-F501 WeakPolarHBondContact O-CB 3.31Å; L497-F501 PolarHBondContact O-N 3.44Å; S498-F501 PolarHBondContact O-N 3.15Å; F501-Q503 VanDerWaalsContact C-N 3.34Å; F501-Q503 PolarHBondContact O-N 3.26Å; F501-Y504 PolarHBondContact O-N 3.3Å; F501-Y504 VanDerWaalsContact O-N 3.16Å; F501-C505 PolarHBondContact O-N 3.18Å; F501-C505 PolarHBondContact O-SG 3.29Å; F501-V513 HydrophobicContact CD2-CG1 4.45Å; F501-V513 HydrophobicContact CE2-CG1 4.07Å; F501-L516 HydrophobicContact CB-CD1 4.2Å; F501-L517 HydrophobicContact CE2-CD2 4.26Å; F501-I525 HydrophobicContact CB-CG2 4.22Å; F501-I525 HydrophobicContact CD1-CG2 4.28Å; F501-I525 HydrophobicContact CG-CG2 4.11Å; F501-L527 HydrophobicContact CE2-CD2 3.96Å; F501-L527 HydrophobicContact CZ-CD2 3.64Å; F501-L553 HydrophobicContact CE2-CD2 3.76Å; F501-L553 HydrophobicContact CZ-CD2 3.75Å
502	I	85.2	Confident	81.7	Confident	14 Å²	14	61.6 Å²	61.6	7%	0.072	31%	0.311	C	S	.	.	H	α-helix	trans	-57.1	-47.5	176.6	-65	169.4	0	0	0	110.2	S498 Y504 C505 Y506 V529 D531	S498-I502 WeakPolarHBondContact O-CG1 3.45Å; S498-I502 PolarHBondContact O-N 3.07Å; I502-Y504 PolarHBondContact O-N 3.07Å; I502-C505 PolarHBondContact O-N 3.35Å; I502-Y506 HydrophobicContact CG2-CD2 3.8Å; I502-Y506 HydrophobicContact CG2-CE2 3.96Å; I502-Y506 WeakPolarHBondContact O-CD2 3.23Å; I502-Y506 PolarHBondContact O-N 2.9Å; I502-V529 HydrophobicContact CD1-CG1 4.35Å; I502-D531 HydrophobicContact CD1-CB 4.29Å
503	Q	84.7	Confident	82.7	Confident	102 Å²	102	59.9 Å²	59.9	48%	0.477	29%	0.293	S	S	.	.	H	α-helix	trans	-59.1	-42.3	177	-75.2	173.1	6.2	0	0	113.4	I499 K500 F501 H507	I499-Q503 WeakPolarHBondContact O-CB 3.33Å; I499-Q503 WeakPolarHBondContact O-CG 3.47Å; I499-Q503 PolarHBondContact O-N 3.11Å; K500-Q503 PolarHBondContact O-N 2.77Å; F501-Q503 VanDerWaalsContact C-N 3.34Å; F501-Q503 PolarHBondContact O-N 3.26Å; Q503-H507 WeakPolarHBondContact O-CB 3.2Å; Q503-H507 PolarHBondContact O-CD2 3.42Å; Q503-H507 PolarHBondContact O-N 2.86Å
504	Y	89	Confident	83.6	Confident	59 Å²	59	59.2 Å²	59.2	23%	0.231	29%	0.286	C	S	.	.	H	α-helix	trans	-67.9	-35.7	178.6	-67	-12.9	0	0	0	112.4	K500 F501 I502 H507 G508 L509 K512 L516	K500-Y504 WeakPolarHBondContact O-CB 3.38Å; K500-Y504 WeakPolarHBondContact O-CD1 3.39Å; K500-Y504 PolarHBondContact O-N 2.87Å; F501-Y504 PolarHBondContact O-N 3.3Å; F501-Y504 VanDerWaalsContact O-N 3.16Å; I502-Y504 PolarHBondContact O-N 3.07Å; Y504-H507 PolarHBondContact O-N 2.98Å; Y504-G508 PolarHBondContact O-N 3.01Å; Y504-L509 HydrophobicContact CD1-CD1 4.29Å; Y504-L509 PolarHBondContact O-N 2.96Å; Y504-K512 HydrophobicContact CD1-CD 4.15Å; Y504-K512 HydrophobicContact CD2-CB 3.54Å; Y504-K512 HydrophobicContact CD2-CD 4.41Å; Y504-K512 HydrophobicContact CE1-CD 3.88Å; Y504-K512 HydrophobicContact CE2-CB 3.79Å; Y504-K512 HydrophobicContact CE2-CD 4.16Å; Y504-K512 HydrophobicContact CG-CB 3.94Å; Y504-K512 HydrophobicContact CG-CD 4.41Å; Y504-L516 HydrophobicContact CD2-CD1 3.55Å; Y504-L516 HydrophobicContact CD2-CG 4.28Å; Y504-L516 HydrophobicContact CE2-CD1 3.74Å; Y504-L516 HydrophobicContact CE2-CG 4.2Å
505	C	87.9	Confident	84.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-49.3	174.1	-66.4	0	0	0	0	111.8	F501 I502 H507 G508 G537 G540	F501-C505 PolarHBondContact O-N 3.18Å; F501-C505 PolarHBondContact O-SG 3.29Å; I502-C505 PolarHBondContact O-N 3.35Å; C505-H507 PolarHBondContact O-N 3Å; C505-G508 PolarHBondContact O-N 3.11Å; C505-G537 VanDerWaalsContact CB-O 3.27Å; C505-G537 WeakPolarHBondContact CB-O 3.3Å; C505-G540 CarbonylContact O-C 3.59Å
506	Y	85.4	Confident	84.8	Confident	56 Å²	56	55.6 Å²	55.6	22%	0.22	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-24.6	176.3	-89.6	-85.2	0	0	0	114.3	I502 Q535 L539 L543 T544	I502-Y506 HydrophobicContact CG2-CD2 3.8Å; I502-Y506 HydrophobicContact CG2-CE2 3.96Å; I502-Y506 WeakPolarHBondContact O-CD2 3.23Å; I502-Y506 PolarHBondContact O-N 2.9Å; Y506-Q535 HydrophobicContact CE2-CB 3.97Å; Y506-Q535 VanDerWaalsContact CZ-OE1 3.26Å; Y506-Q535 WeakPolarHBondContact OH-CB 3.3Å; Y506-Q535 WeakPolarHBondContact OH-CG 3.39Å; Y506-Q535 PolarHBondContact OH-OE1 3.04Å; Y506-L539 WeakPolarHBondContact OH-CD2 3.17Å; Y506-L539 WeakPolarHBondContact OH-CG 3.31Å; Y506-L543 HydrophobicContact CE1-CD1 3.83Å; Y506-T544 WeakPolarHBondContact O-CG2 3.43Å
507	H	84	Confident	85.1	Confident	134 Å²	134	55 Å²	55	62%	0.62	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-2.6	172.1	-71.7	-49.4	0	0	0	114	Q503 Y504 C505 L509	Q503-H507 WeakPolarHBondContact O-CB 3.2Å; Q503-H507 PolarHBondContact O-CD2 3.42Å; Q503-H507 PolarHBondContact O-N 2.86Å; Y504-H507 PolarHBondContact O-N 2.98Å; C505-H507 PolarHBondContact O-N 3Å; H507-L509 VanDerWaalsContact C-N 3.26Å; H507-L509 HydrophobicContact CB-CD1 3.8Å; H507-L509 HydrophobicContact CB-CG 3.74Å; H507-L509 PolarHBondContact O-N 3.23Å
508	G	83.4	Confident	85.1	Confident	18 Å²	18	59.1 Å²	59.1	19%	0.186	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	19.3	179.3	0	0	0	0	0	114.4	Y504 C505 F510	Y504-G508 PolarHBondContact O-N 3.01Å; C505-G508 PolarHBondContact O-N 3.11Å; G508-F510 PolarHBondContact O-N 2.7Å
509	L	87.5	Confident	84.6	Confident	64 Å²	64	62.4 Å²	62.4	34%	0.335	30%	0.302	S	S	.	.			trans	-82.6	74.5	-169	-63.8	175.9	0	0	0	112.1	Y504 H507 D511 K512 V513	Y504-L509 HydrophobicContact CD1-CD1 4.29Å; Y504-L509 PolarHBondContact O-N 2.96Å; H507-L509 VanDerWaalsContact C-N 3.26Å; H507-L509 HydrophobicContact CB-CD1 3.8Å; H507-L509 HydrophobicContact CB-CG 3.74Å; H507-L509 PolarHBondContact O-N 3.23Å; L509-D511 PolarHBondContact O-N 3.5Å; L509-K512 HydrophobicContact CB-CB 4.17Å; L509-K512 HydrophobicContact CB-CD 4.34Å; L509-K512 HydrophobicContact CB-CG 4.27Å; L509-K512 HydrophobicContact CD1-CD 3.89Å; L509-K512 PolarHBondContact O-N 3.45Å; L509-V513 PolarHBondContact O-N 3.1Å; L509-V513 VanDerWaalsContact O-N 3.1Å
510	F	87.4	Confident	83.4	Confident	56 Å²	56	68 Å²	68	25%	0.246	32%	0.323	C	S	.	.	H	α-helix	trans	-43.1	-55.7	-176.1	-179.6	-98.1	0	0	0	113.9	G508 K512 V513 K514 K548 L549 L552	G508-F510 PolarHBondContact O-N 2.7Å; F510-K512 VanDerWaalsContact C-N 3.29Å; F510-K512 PolarHBondContact O-N 2.94Å; F510-V513 PolarHBondContact O-N 3.47Å; F510-K514 HydrophobicContact CE1-CD 3.91Å; F510-K514 HydrophobicContact CZ-CD 4.17Å; F510-K514 VanDerWaalsContact O-CB 3.32Å; F510-K514 WeakPolarHBondContact O-CB 3.26Å; F510-K514 PolarHBondContact O-N 2.99Å; F510-K548 HydrophobicContact CD2-CB 4.09Å; F510-K548 HydrophobicContact CE2-CB 4.01Å; F510-K548 WeakPolarHBondContact CE2-O 3.48Å; F510-L549 HydrophobicContact CD2-CB 4.41Å; F510-L552 HydrophobicContact CD2-CD2 4.22Å; F510-L552 HydrophobicContact CE2-CB 4.1Å; F510-L552 HydrophobicContact CE2-CD2 3.94Å; F510-L552 HydrophobicContact CE2-CG 4.48Å
511	D	87.2	Confident	82	Confident	108 Å²	108	71.7 Å²	71.7	58%	0.578	35%	0.346	S	S	*	.	H	α-helix	trans	-65.3	-32.1	-175.5	-53.4	-63.3	0	0	0	113	L509 N515	L509-D511 PolarHBondContact O-N 3.5Å; D511-N515 VanDerWaalsContact O-CB 3.24Å; D511-N515 WeakPolarHBondContact O-CB 3.46Å; D511-N515 PolarHBondContact O-N 3.41Å; D511-N515 PolarHBondContact O-ND2 3.43Å; D511-N515 PolarHBondContact O-OD1 3.31Å
512	K	86.9	Confident	80.5	Confident	102 Å²	102	76.4 Å²	76.4	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-73.6	-37.9	177.6	-62	-166	-172.7	176.6	0	112	Y504 L509 F510 L516	Y504-K512 HydrophobicContact CD1-CD 4.15Å; Y504-K512 HydrophobicContact CD2-CB 3.54Å; Y504-K512 HydrophobicContact CD2-CD 4.41Å; Y504-K512 HydrophobicContact CE1-CD 3.88Å; Y504-K512 HydrophobicContact CE2-CB 3.79Å; Y504-K512 HydrophobicContact CE2-CD 4.16Å; Y504-K512 HydrophobicContact CG-CB 3.94Å; Y504-K512 HydrophobicContact CG-CD 4.41Å; L509-K512 HydrophobicContact CB-CB 4.17Å; L509-K512 HydrophobicContact CB-CD 4.34Å; L509-K512 HydrophobicContact CB-CG 4.27Å; L509-K512 HydrophobicContact CD1-CD 3.89Å; L509-K512 PolarHBondContact O-N 3.45Å; F510-K512 VanDerWaalsContact C-N 3.29Å; F510-K512 PolarHBondContact O-N 2.94Å; K512-L516 WeakPolarHBondContact O-CG 3.46Å; K512-L516 PolarHBondContact O-N 3.2Å; K512-L516 VanDerWaalsContact O-N 3.09Å
513	V	86.2	Confident	79	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-66.9	-47.7	173.2	178.8	0	0	0	0	109.7	F501 L509 F510 N515 L516 L517 L549 L552 L553	F501-V513 HydrophobicContact CD2-CG1 4.45Å; F501-V513 HydrophobicContact CE2-CG1 4.07Å; L509-V513 PolarHBondContact O-N 3.1Å; L509-V513 VanDerWaalsContact O-N 3.1Å; F510-V513 PolarHBondContact O-N 3.47Å; V513-N515 VanDerWaalsContact C-N 3.33Å; V513-N515 PolarHBondContact O-N 3.06Å; V513-L516 PolarHBondContact O-N 3.3Å; V513-L516 VanDerWaalsContact O-N 3.1Å; V513-L517 HydrophobicContact CG1-CD1 3.86Å; V513-L517 HydrophobicContact CG1-CG 4.32Å; V513-L517 WeakPolarHBondContact O-CG 3.38Å; V513-L517 PolarHBondContact O-N 3.22Å; V513-L549 HydrophobicContact CB-CD1 3.86Å; V513-L549 HydrophobicContact CG1-CD1 3.88Å; V513-L549 HydrophobicContact CG2-CD1 3.93Å; V513-L552 HydrophobicContact CG1-CD2 4.15Å; V513-L553 HydrophobicContact CG1-CD2 3.97Å
514	K	86.9	Confident	78.2	Confident	81 Å²	81	82.3 Å²	82.3	35%	0.352	40%	0.403	S	S	.	.	H	α-helix	trans	-55.2	-44.7	175.9	-175	174.2	-179.6	-176.6	0	112.5	F510 L517 H518 L552	F510-K514 HydrophobicContact CE1-CD 3.91Å; F510-K514 HydrophobicContact CZ-CD 4.17Å; F510-K514 VanDerWaalsContact O-CB 3.32Å; F510-K514 WeakPolarHBondContact O-CB 3.26Å; F510-K514 PolarHBondContact O-N 2.99Å; K514-L517 PolarHBondContact O-N 3.43Å; K514-H518 PolarHBondContact O-CD2 3.22Å; K514-H518 VanDerWaalsContact O-CD2 3.31Å; K514-H518 PolarHBondContact O-N 3.32Å; K514-L552 HydrophobicContact CB-CD2 3.94Å
515	N	85	Confident	77.5	Confident	104 Å²	104	80.5 Å²	80.5	56%	0.556	40%	0.397	S	S	*	.	H	α-helix	trans	-72	-27.2	178.5	-69.6	-12.9	0	0	0	113.6	D511 V513 N519	D511-N515 VanDerWaalsContact O-CB 3.24Å; D511-N515 WeakPolarHBondContact O-CB 3.46Å; D511-N515 PolarHBondContact O-N 3.41Å; D511-N515 PolarHBondContact O-ND2 3.43Å; D511-N515 PolarHBondContact O-OD1 3.31Å; V513-N515 VanDerWaalsContact C-N 3.33Å; V513-N515 PolarHBondContact O-N 3.06Å; N515-N519 WeakPolarHBondContact O-CB 3.46Å; N515-N519 PolarHBondContact O-ND2 3.1Å; N515-N519 VanDerWaalsContact O-ND2 3.1Å
516	L	84.2	Confident	77.1	Confident	23 Å²	23	84.6 Å²	84.6	12%	0.12	42%	0.419	C	S	.	.	H	α-helix	trans	-69.4	-44.4	169.2	-77.7	-179.3	0	0	0	111.2	L497 F501 Y504 K512 V513 I525	L497-L516 HydrophobicContact CD2-CD2 4.36Å; F501-L516 HydrophobicContact CB-CD1 4.2Å; Y504-L516 HydrophobicContact CD2-CD1 3.55Å; Y504-L516 HydrophobicContact CD2-CG 4.28Å; Y504-L516 HydrophobicContact CE2-CD1 3.74Å; Y504-L516 HydrophobicContact CE2-CG 4.2Å; K512-L516 WeakPolarHBondContact O-CG 3.46Å; K512-L516 PolarHBondContact O-N 3.2Å; K512-L516 VanDerWaalsContact O-N 3.09Å; V513-L516 PolarHBondContact O-N 3.3Å; V513-L516 VanDerWaalsContact O-N 3.1Å; L516-I525 HydrophobicContact CB-CD1 4.23Å; L516-I525 HydrophobicContact CD2-CD1 4.46Å
517	L	82.1	Confident	77	Confident	29 Å²	29	82.8 Å²	82.8	15%	0.152	41%	0.413	C	S	.	.	H	α-helix	trans	-74.5	-34.7	-174.4	-64.6	177.1	0	0	0	114.1	F501 V513 K514 L527 L552 L553 F556	F501-L517 HydrophobicContact CE2-CD2 4.26Å; V513-L517 HydrophobicContact CG1-CD1 3.86Å; V513-L517 HydrophobicContact CG1-CG 4.32Å; V513-L517 WeakPolarHBondContact O-CG 3.38Å; V513-L517 PolarHBondContact O-N 3.22Å; K514-L517 PolarHBondContact O-N 3.43Å; L517-L527 HydrophobicContact CD1-CD2 4.3Å; L517-L527 HydrophobicContact CD2-CD2 3.62Å; L517-L552 HydrophobicContact CD1-CD2 4.39Å; L517-L552 HydrophobicContact CD1-CG 4.32Å; L517-L553 HydrophobicContact CD1-CD2 4.18Å; L517-F556 HydrophobicContact CB-CD1 4.08Å; L517-F556 HydrophobicContact CB-CE1 3.73Å; L517-F556 HydrophobicContact CB-CE2 4.27Å; L517-F556 HydrophobicContact CB-CG 4.49Å; L517-F556 HydrophobicContact CB-CZ 3.82Å; L517-F556 HydrophobicContact CD1-CB 4.43Å; L517-F556 HydrophobicContact CD1-CD1 4.41Å; L517-F556 HydrophobicContact CD1-CD2 4.08Å; L517-F556 HydrophobicContact CD1-CE2 4.4Å; L517-F556 HydrophobicContact CD1-CG 4.06Å
518	H	79.8	Confident	77	Confident	108 Å²	108	78.6 Å²	78.6	50%	0.5	40%	0.395	S	S	.	.	S	Bend	trans	-82.7	-8	177	-74.5	-69.2	0	0	0	114.5	K514 K520 F556	K514-H518 PolarHBondContact O-CD2 3.22Å; K514-H518 VanDerWaalsContact O-CD2 3.31Å; K514-H518 PolarHBondContact O-N 3.32Å; H518-K520 VanDerWaalsContact C-N 3.34Å; H518-K520 PolarHBondContact O-N 3.09Å; H518-F556 AromaticContact CE1-CZ 3.69Å; H518-F556 AromaticContact ND1-CZ 3.86Å
519	N	71	Confident	77	Confident	84 Å²	84	79.6 Å²	79.6	45%	0.449	40%	0.398	S	S	.	.			trans	-75.6	82.9	-178.8	-105.4	-24.7	0	0	0	111.3	N515 N521 Q522	N515-N519 WeakPolarHBondContact O-CB 3.46Å; N515-N519 PolarHBondContact O-ND2 3.1Å; N515-N519 VanDerWaalsContact O-ND2 3.1Å; N519-N521 PolarHBondContact O-N 3.19Å; N519-Q522 PolarHBondContact O-N 3.38Å
520	K	55.6	Low	76.6	Confident	203 Å²	203	79.9 Å²	79.9	88%	0.883	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-16.9	177.7	-67.3	-172.1	176.4	-175	0	115.2	H518	H518-K520 VanDerWaalsContact C-N 3.34Å; H518-K520 PolarHBondContact O-N 3.09Å
521	N	55.4	Low	76.1	Confident	160 Å²	160	79.6 Å²	79.6	86%	0.856	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	7	-177.2	-64.2	-3.4	0	0	0	113.9	N519	N519-N521 PolarHBondContact O-N 3.19Å
522	Q	55.4	Low	75.2	Confident	100 Å²	100	79.3 Å²	79.3	47%	0.467	41%	0.406	S	S	.	.	S	Bend	trans	-117	142.6	171.8	-73.8	-174.8	-12	0	0	111.2	N519 N524	N519-Q522 PolarHBondContact O-N 3.38Å; Q522-N524 PolarHBondContact O-N 3.17Å
523	L	55	Low	73.9	Confident	86 Å²	86	80.9 Å²	80.9	45%	0.45	42%	0.415	S	S	.	.			trans	-44.9	130.9	-176	-69.1	154.1	0	0	0	111.9	N493 I525	N493-L523 HydrophobicContact CB-CD1 4.03Å; L523-I525 PolarHBondContact O-N 3.44Å
524	N	67.4	Low	73	Confident	154 Å²	154	81 Å²	81	82%	0.824	42%	0.416	S	S	*	.			trans	-50.2	111.7	-173.5	-155.6	21.2	0	0	0	110.7	Q522 D526	Q522-N524 PolarHBondContact O-N 3.17Å; N524-D526 PolarHBondContact O-N 2.87Å
525	I	73.7	Confident	72.4	Confident	21 Å²	21	80 Å²	80	11%	0.108	41%	0.413	C	S	.	.			trans	-83.3	116.5	-178.6	-56.9	177.5	0	0	0	107.3	L497 F501 L516 L523 L527	L497-I525 HydrophobicContact CB-CD1 4.26Å; L497-I525 HydrophobicContact CB-CG1 4.4Å; F501-I525 HydrophobicContact CB-CG2 4.22Å; F501-I525 HydrophobicContact CD1-CG2 4.28Å; F501-I525 HydrophobicContact CG-CG2 4.11Å; L516-I525 HydrophobicContact CB-CD1 4.23Å; L516-I525 HydrophobicContact CD2-CD1 4.46Å; L523-I525 PolarHBondContact O-N 3.44Å; I525-L527 PolarHBondContact O-N 2.81Å
526	D	79	Confident	72.4	Confident	85 Å²	85	75 Å²	75	46%	0.455	39%	0.386	S	S	.	.			trans	-67.6	119.7	168.9	173	20.3	0	0	0	109.5	N524 N528 V529	N524-D526 PolarHBondContact O-N 2.87Å; D526-N528 PolarHBondContact O-N 3.37Å; D526-N528 WeakPolarHBondContact OD1-CB 3.21Å; D526-N528 PolarHBondContact OD1-N 3.45Å; D526-N528 PolarHBondContact OD1-ND2 3.46Å; D526-V529 HydrophobicContact CB-CG2 3.74Å; D526-V529 VanDerWaalsContact O-CG2 3.28Å; D526-V529 WeakPolarHBondContact O-CG2 3.35Å; D526-V529 PolarHBondContact O-N 2.94Å
527	L	83.7	Confident	72.4	Confident	18 Å²	18	74 Å²	74	9%	0.094	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.3	-179.2	-67.2	159.4	0	0	0	112.4	F501 L517 I525 L553 F556 A558	F501-L527 HydrophobicContact CE2-CD2 3.96Å; F501-L527 HydrophobicContact CZ-CD2 3.64Å; L517-L527 HydrophobicContact CD1-CD2 4.3Å; L517-L527 HydrophobicContact CD2-CD2 3.62Å; I525-L527 PolarHBondContact O-N 2.81Å; L527-L553 HydrophobicContact CD2-CD2 4.03Å; L527-F556 HydrophobicContact CD1-CB 3.86Å; L527-F556 WeakPolarHBondContact CD1-O 3.46Å; L527-A558 HydrophobicContact CB-CB 4.12Å; L527-A558 HydrophobicContact CD1-CB 4.47Å
528	N	84.3	Confident	72.8	Confident	46 Å²	46	72.7 Å²	72.7	25%	0.246	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	7.8	-173	-50.2	-56.5	0	0	0	112.4	D526 I530 N559 Q562	D526-N528 PolarHBondContact O-N 3.37Å; D526-N528 WeakPolarHBondContact OD1-CB 3.21Å; D526-N528 PolarHBondContact OD1-N 3.45Å; D526-N528 PolarHBondContact OD1-ND2 3.46Å; N528-I530 WeakPolarHBondContact O-CG1 3.44Å; N528-I530 PolarHBondContact O-N 2.97Å; N528-N559 WeakPolarHBondContact OD1-CB 3.44Å; N528-N559 PolarHBondContact OD1-N 2.87Å; N528-Q562 PolarHBondContact O-NE2 3.32Å
529	V	82.9	Confident	73.1	Confident	39 Å²	39	68 Å²	68	24%	0.236	35%	0.353	C	S	.	.			trans	-60.3	131.7	177.6	175.5	0	0	0	0	110.8	I502 D526 F536	I502-V529 HydrophobicContact CD1-CG1 4.35Å; D526-V529 HydrophobicContact CB-CG2 3.74Å; D526-V529 VanDerWaalsContact O-CG2 3.28Å; D526-V529 WeakPolarHBondContact O-CG2 3.35Å; D526-V529 PolarHBondContact O-N 2.94Å; V529-F536 WeakPolarHBondContact O-CA 3.45Å; V529-F536 WeakPolarHBondContact O-CB 3.43Å
530	I	79.6	Confident	73.7	Confident	71 Å²	71	64 Å²	64	36%	0.364	33%	0.331	S	S	.	.			trans	-102.6	139.6	179	-44.8	-177.4	0	0	0	108.9	N528 Q535 Q562	N528-I530 WeakPolarHBondContact O-CG1 3.44Å; N528-I530 PolarHBondContact O-N 2.97Å; I530-Q535 CarbonylContact C-O 3.6Å; I530-Q535 WeakPolarHBondContact CA-O 3.29Å; I530-Q562 VanDerWaalsContact CG1-NE2 3.31Å
531	D	76.8	Confident	75.2	Confident	50 Å²	50	54.4 Å²	54.4	27%	0.267	29%	0.289	S	S	.	.			trans	-82.4	-176.2	169.4	83.5	-16.3	0	0	0	112.5	I502 H533 G534 Q535	I502-D531 HydrophobicContact CD1-CB 4.29Å; D531-H533 PolarHBondContact O-N 3.03Å; D531-H533 VanDerWaalsContact OD1-CA 3.3Å; D531-H533 WeakPolarHBondContact OD1-CA 3.03Å; D531-H533 WeakPolarHBondContact OD1-CB 3.23Å; D531-H533 PolarHBondContact OD1-N 3.11Å; D531-H533 IonicContact OD2-CD2 3.9Å; D531-H533 PolarHBondContact OD2-CD2 3.38Å; D531-G534 PolarHBondContact O-N 3.34Å; D531-G534 PolarHBondContact OD1-N 3.44Å; D531-Q535 PolarHBondContact N-O 3.01Å; D531-Q535 VanDerWaalsContact OD1-CB 3.27Å; D531-Q535 WeakPolarHBondContact OD1-CB 3.44Å; D531-Q535 PolarHBondContact OD1-N 2.92Å
532	S	68.7	Low	76.7	Confident	102 Å²	102	46.8 Å²	46.8	71%	0.713	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	12.5	177.4	60.1	0	0	0	0	115.1
533	H	58.7	Low	78.1	Confident	135 Å²	135	44.9 Å²	44.9	63%	0.625	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.8	16.2	-177.4	-57.5	-57.3	0	0	0	112.4	D531 Q535	D531-H533 PolarHBondContact O-N 3.03Å; D531-H533 VanDerWaalsContact OD1-CA 3.3Å; D531-H533 WeakPolarHBondContact OD1-CA 3.03Å; D531-H533 WeakPolarHBondContact OD1-CB 3.23Å; D531-H533 PolarHBondContact OD1-N 3.11Å; D531-H533 IonicContact OD2-CD2 3.9Å; D531-H533 PolarHBondContact OD2-CD2 3.38Å; H533-Q535 VanDerWaalsContact C-N 3.29Å; H533-Q535 HydrophobicContact CB-CG 4.17Å; H533-Q535 PolarHBondContact O-N 3.06Å
534	G	67.7	Low	79.5	Confident	2 Å²	2	42 Å²	42	2%	0.021	23%	0.227	C	C	.	.	S	Bend	trans	75.5	11.7	-178.6	0	0	0	0	0	114.4	D531 D565	D531-G534 PolarHBondContact O-N 3.34Å; D531-G534 PolarHBondContact OD1-N 3.44Å; G534-D565 VanDerWaalsContact CA-CG 3.5Å; G534-D565 WeakPolarHBondContact CA-OD1 3.22Å; G534-D565 WeakPolarHBondContact CA-OD2 3.27Å; G534-D565 PolarHBondContact N-OD2 3.45Å
535	Q	74	Confident	80.3	Confident	60 Å²	60	36.1 Å²	36.1	28%	0.28	19%	0.194	S	C	.	.			trans	-98.3	131.7	-172.2	-56.2	-178.2	17.5	0	0	112.9	Y506 I530 D531 H533	Y506-Q535 HydrophobicContact CE2-CB 3.97Å; Y506-Q535 VanDerWaalsContact CZ-OE1 3.26Å; Y506-Q535 WeakPolarHBondContact OH-CB 3.3Å; Y506-Q535 WeakPolarHBondContact OH-CG 3.39Å; Y506-Q535 PolarHBondContact OH-OE1 3.04Å; I530-Q535 CarbonylContact C-O 3.6Å; I530-Q535 WeakPolarHBondContact CA-O 3.29Å; D531-Q535 PolarHBondContact N-O 3.01Å; D531-Q535 VanDerWaalsContact OD1-CB 3.27Å; D531-Q535 WeakPolarHBondContact OD1-CB 3.44Å; D531-Q535 PolarHBondContact OD1-N 2.92Å; H533-Q535 VanDerWaalsContact C-N 3.29Å; H533-Q535 HydrophobicContact CB-CG 4.17Å; H533-Q535 PolarHBondContact O-N 3.06Å
536	F	86.2	Confident	80.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.			trans	-127.5	168.2	177.1	55.7	-82.2	0	0	0	112	V529 L538 L539 G540 Q562 T564 V570	V529-F536 WeakPolarHBondContact O-CA 3.45Å; V529-F536 WeakPolarHBondContact O-CB 3.43Å; F536-L538 HydrophobicContact CD2-CB 4.03Å; F536-L538 HydrophobicContact CE2-CB 4.01Å; F536-L538 PolarHBondContact O-N 3.43Å; F536-L539 HydrophobicContact CD1-CB 4.39Å; F536-L539 HydrophobicContact CD2-CB 4.41Å; F536-L539 HydrophobicContact CE1-CB 4.26Å; F536-L539 HydrophobicContact CE2-CB 4.29Å; F536-L539 HydrophobicContact CG-CB 4.47Å; F536-L539 HydrophobicContact CZ-CB 4.21Å; F536-L539 PolarHBondContact O-N 3.31Å; F536-G540 PolarHBondContact O-N 3.29Å; F536-Q562 HydrophobicContact CD1-CG 4.18Å; F536-Q562 HydrophobicContact CD2-CB 4.45Å; F536-Q562 HydrophobicContact CD2-CG 4.29Å; F536-Q562 HydrophobicContact CE1-CB 4.38Å; F536-Q562 HydrophobicContact CE1-CG 3.9Å; F536-Q562 HydrophobicContact CE2-CB 3.81Å; F536-Q562 HydrophobicContact CE2-CG 4Å; F536-Q562 HydrophobicContact CG-CG 4.37Å; F536-Q562 HydrophobicContact CZ-CB 3.77Å; F536-Q562 HydrophobicContact CZ-CG 3.8Å; F536-Q562 WeakPolarHBondContact CZ-O 3.32Å; F536-T564 HydrophobicContact CE1-CG2 3.96Å; F536-V570 HydrophobicContact CE2-CG2 3.41Å; F536-V570 VanDerWaalsContact CE2-CG2 3.41Å; F536-V570 HydrophobicContact CZ-CG2 3.35Å
537	G	84.1	Confident	81.2	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-42.8	-169.5	0	0	0	0	0	114.7	C505 L539 G540 A541	C505-G537 VanDerWaalsContact CB-O 3.27Å; C505-G537 WeakPolarHBondContact CB-O 3.3Å; G537-L539 PolarHBondContact O-N 3.36Å; G537-G540 PolarHBondContact O-N 3.23Å; G537-A541 PolarHBondContact O-N 3.27Å
538	L	89.4	Confident	81.4	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-65.4	-39.2	-178.9	-176.9	62.9	0	0	0	112.5	F536 G540 A541 V542 V550 L553 L554 A558 V570	F536-L538 HydrophobicContact CD2-CB 4.03Å; F536-L538 HydrophobicContact CE2-CB 4.01Å; F536-L538 PolarHBondContact O-N 3.43Å; L538-G540 PolarHBondContact O-N 2.93Å; L538-A541 PolarHBondContact O-N 2.88Å; L538-V542 WeakPolarHBondContact O-CB 3.42Å; L538-V542 PolarHBondContact O-N 2.73Å; L538-V550 HydrophobicContact CD1-CG1 4.26Å; L538-L553 HydrophobicContact CB-CD1 4.44Å; L538-L553 HydrophobicContact CD1-CB 4.11Å; L538-L553 HydrophobicContact CD1-CD1 4.31Å; L538-L554 HydrophobicContact CD1-CD2 4.16Å; L538-L554 HydrophobicContact CD1-CG 4.23Å; L538-L554 HydrophobicContact CD2-CD2 3.95Å; L538-A558 HydrophobicContact CB-CB 4.4Å; L538-A558 HydrophobicContact CD2-CB 4.37Å; L538-V570 HydrophobicContact CD2-CG2 4.2Å; L538-V570 HydrophobicContact CG-CG1 4.48Å; L538-V570 HydrophobicContact CG-CG2 4.21Å
539	L	86	Confident	81.6	Confident	11 Å²	11	40.3 Å²	40.3	6%	0.058	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-45.6	173.5	177.2	59.1	0	0	0	111.3	Y506 F536 G537 A541 V542 L543 T564 V570 I573	Y506-L539 WeakPolarHBondContact OH-CD2 3.17Å; Y506-L539 WeakPolarHBondContact OH-CG 3.31Å; F536-L539 HydrophobicContact CD1-CB 4.39Å; F536-L539 HydrophobicContact CD2-CB 4.41Å; F536-L539 HydrophobicContact CE1-CB 4.26Å; F536-L539 HydrophobicContact CE2-CB 4.29Å; F536-L539 HydrophobicContact CG-CB 4.47Å; F536-L539 HydrophobicContact CZ-CB 4.21Å; F536-L539 PolarHBondContact O-N 3.31Å; G537-L539 PolarHBondContact O-N 3.36Å; L539-A541 PolarHBondContact O-N 3.09Å; L539-V542 PolarHBondContact O-N 3.01Å; L539-L543 HydrophobicContact CD1-CD1 3.97Å; L539-L543 HydrophobicContact CD1-CG 4.15Å; L539-L543 HydrophobicContact CG-CD1 4.03Å; L539-L543 WeakPolarHBondContact O-CG 3.16Å; L539-L543 PolarHBondContact O-N 2.91Å; L539-T564 HydrophobicContact CD2-CG2 3.95Å; L539-V570 HydrophobicContact CB-CG2 4.41Å; L539-I573 HydrophobicContact CD1-CB 4.45Å; L539-I573 HydrophobicContact CD1-CD1 3.62Å; L539-I573 HydrophobicContact CD1-CG2 4.08Å; L539-I573 HydrophobicContact CD2-CD1 4.32Å
540	G	83.9	Confident	81.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.2	-44.7	175.9	0	0	0	0	0	113.1	C505 F536 G537 L538 V542 L543 T544	C505-G540 CarbonylContact O-C 3.59Å; F536-G540 PolarHBondContact O-N 3.29Å; G537-G540 PolarHBondContact O-N 3.23Å; L538-G540 PolarHBondContact O-N 2.93Å; G540-V542 PolarHBondContact O-N 3.46Å; G540-L543 PolarHBondContact O-N 3.14Å; G540-T544 WeakPolarHBondContact O-CG2 3.45Å; G540-T544 PolarHBondContact O-N 3.18Å
541	A	87.9	Confident	82.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-44.9	177	0	0	0	0	0	112.5	G537 L538 L539 T544 L549 V550 L553	G537-A541 PolarHBondContact O-N 3.27Å; L538-A541 PolarHBondContact O-N 2.88Å; L539-A541 PolarHBondContact O-N 3.09Å; A541-T544 PolarHBondContact O-N 2.81Å; A541-T544 PolarHBondContact O-OG1 2.96Å; A541-L549 HydrophobicContact CB-CB 4.44Å; A541-L549 HydrophobicContact CB-CD2 3.75Å; A541-L549 HydrophobicContact CB-CG 3.66Å; A541-V550 HydrophobicContact CB-CG2 4.1Å; A541-L553 HydrophobicContact CB-CD1 3.52Å
542	V	87	Confident	83	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-65	-41.4	179.1	157.3	0	0	0	0	112.4	L538 L539 G540 T544 W545 V550 V570 C574 V902 L906	L538-V542 WeakPolarHBondContact O-CB 3.42Å; L538-V542 PolarHBondContact O-N 2.73Å; L539-V542 PolarHBondContact O-N 3.01Å; G540-V542 PolarHBondContact O-N 3.46Å; V542-T544 PolarHBondContact O-N 2.56Å; V542-W545 WeakPolarHBondContact O-CA 3.37Å; V542-W545 PolarHBondContact O-N 2.78Å; V542-V550 HydrophobicContact CB-CG2 4.44Å; V542-V550 HydrophobicContact CG2-CG1 4.11Å; V542-V550 HydrophobicContact CG2-CG2 3.6Å; V542-V570 HydrophobicContact CB-CG1 3.66Å; V542-V570 HydrophobicContact CG1-CG1 3.7Å; V542-V570 HydrophobicContact CG2-CG1 3.52Å; V542-C574 WeakPolarHBondContact CG1-SG 3.32Å; V542-V902 HydrophobicContact CG1-CG1 4.42Å; V542-V902 HydrophobicContact CG2-CG1 4.28Å; V542-L906 HydrophobicContact CG2-CD1 4.38Å; V542-L906 HydrophobicContact CG2-CD2 4.45Å
543	L	84.7	Confident	84	Confident	59 Å²	59	30.4 Å²	30.4	31%	0.309	15%	0.146	S	C	.	.	H	α-helix	trans	-64.8	-18.7	177.1	-71.2	170.4	0	0	0	113.5	Y506 L539 G540 W545 I573	Y506-L543 HydrophobicContact CE1-CD1 3.83Å; L539-L543 HydrophobicContact CD1-CD1 3.97Å; L539-L543 HydrophobicContact CD1-CG 4.15Å; L539-L543 HydrophobicContact CG-CD1 4.03Å; L539-L543 WeakPolarHBondContact O-CG 3.16Å; L539-L543 PolarHBondContact O-N 2.91Å; G540-L543 PolarHBondContact O-N 3.14Å; L543-W545 VanDerWaalsContact C-N 3.32Å; L543-I573 HydrophobicContact CD2-CG2 4.29Å
544	T	84.2	Confident	85.5	Confident	26 Å²	26	25 Å²	25	16%	0.16	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.6	170.2	70.4	0	0	0	0	113.7	Y506 G540 A541 V542 N546	Y506-T544 WeakPolarHBondContact O-CG2 3.43Å; G540-T544 WeakPolarHBondContact O-CG2 3.45Å; G540-T544 PolarHBondContact O-N 3.18Å; A541-T544 PolarHBondContact O-N 2.81Å; A541-T544 PolarHBondContact O-OG1 2.96Å; V542-T544 PolarHBondContact O-N 2.56Å; T544-N546 PolarHBondContact O-N 2.99Å; T544-N546 VanDerWaalsContact O-N 3.15Å; T544-N546 WeakPolarHBondContact OG1-CB 3.33Å
545	W	84.3	Confident	86.5	Confident	31 Å²	31	29.7 Å²	29.7	12%	0.117	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	24.8	-175.4	-53.8	97.3	0	0	0	114	V542 L543 M547 C574 K577 Q898 M899 V902	V542-W545 WeakPolarHBondContact O-CA 3.37Å; V542-W545 PolarHBondContact O-N 2.78Å; L543-W545 VanDerWaalsContact C-N 3.32Å; W545-M547 PolarHBondContact O-N 3.12Å; W545-C574 HydrophobicContact CH2-CB 4.36Å; W545-K577 HydrophobicContact CH2-CB 4.18Å; W545-K577 HydrophobicContact CZ2-CB 3.85Å; W545-Q898 HydrophobicContact CB-CG 4.04Å; W545-Q898 PolarHBondContact O-NE2 2.78Å; W545-M899 HydrophobicContact CD2-CG 3.89Å; W545-M899 HydrophobicContact CE3-CB 4.11Å; W545-M899 HydrophobicContact CE3-CG 3.7Å; W545-M899 HydrophobicContact CH2-CB 4.15Å; W545-M899 HydrophobicContact CH2-CE 4.27Å; W545-M899 HydrophobicContact CH2-CG 3.65Å; W545-M899 HydrophobicContact CH2-SD 4.15Å; W545-M899 HydrophobicContact CZ2-CE 3.62Å; W545-M899 HydrophobicContact CZ2-CG 3.85Å; W545-M899 HydrophobicContact CZ2-SD 4.1Å; W545-M899 HydrophobicContact CZ3-CB 3.77Å; W545-M899 HydrophobicContact CZ3-CG 3.58Å; W545-V902 HydrophobicContact CE3-CB 3.96Å; W545-V902 HydrophobicContact CE3-CG1 4.22Å; W545-V902 HydrophobicContact CE3-CG2 3.97Å; W545-V902 HydrophobicContact CZ3-CB 4.15Å; W545-V902 HydrophobicContact CZ3-CG1 4.24Å
546	N	84.4	Confident	87	Confident	42 Å²	42	30.7 Å²	30.7	23%	0.225	15%	0.15	C	C	.	.			trans	-89	90.3	-177	-175.1	-11	0	0	0	111.2	T544 K548 L549 V550	T544-N546 PolarHBondContact O-N 2.99Å; T544-N546 VanDerWaalsContact O-N 3.15Å; T544-N546 WeakPolarHBondContact OG1-CB 3.33Å; N546-K548 PolarHBondContact O-N 3.39Å; N546-K548 VanDerWaalsContact O-N 3.09Å; N546-K548 PolarHBondContact OD1-N 2.88Å; N546-K548 VanDerWaalsContact OD1-N 3.15Å; N546-L549 HydrophobicContact CB-CB 4.05Å; N546-L549 PolarHBondContact O-N 2.87Å; N546-L549 PolarHBondContact OD1-N 2.99Å; N546-V550 WeakPolarHBondContact O-CG2 3.42Å; N546-V550 PolarHBondContact O-N 2.85Å
547	M	86.6	Confident	87	Confident	61 Å²	61	33.1 Å²	33.1	30%	0.3	18%	0.175	S	C	.	.	H	α-helix	trans	-46.3	-37.5	175.9	-75.6	-73.6	-74.5	0	0	114.5	W545 N551 N901 V902 L905	W545-M547 PolarHBondContact O-N 3.12Å; M547-N551 WeakPolarHBondContact O-CB 3.48Å; M547-N551 PolarHBondContact O-N 3.29Å; M547-N551 PolarHBondContact O-ND2 2.89Å; M547-N901 HydrophobicContact CE-CB 4.4Å; M547-N901 HydrophobicContact SD-CB 4.33Å; M547-V902 HydrophobicContact CG-CG2 3.96Å; M547-V902 HydrophobicContact SD-CB 4.27Å; M547-V902 HydrophobicContact SD-CG2 3.59Å; M547-V902 VanDerWaalsContact SD-CG2 3.59Å; M547-L905 HydrophobicContact CE-CB 3.95Å; M547-L905 HydrophobicContact CE-CD2 3.89Å; M547-L905 HydrophobicContact CE-CG 4.33Å; M547-L905 HydrophobicContact SD-CB 4.04Å; M547-L905 HydrophobicContact SD-CD2 3.73Å; M547-L905 HydrophobicContact SD-CG 4.49Å
548	K	88	Confident	87.2	Confident	154 Å²	154	33.6 Å²	33.6	67%	0.67	18%	0.179	S	C	*	.	H	α-helix	trans	-69.9	-39.2	-179.8	-65.2	-177.9	179.2	178.4	0	111.7	F510 N546 L552	F510-K548 HydrophobicContact CD2-CB 4.09Å; F510-K548 HydrophobicContact CE2-CB 4.01Å; F510-K548 WeakPolarHBondContact CE2-O 3.48Å; N546-K548 PolarHBondContact O-N 3.39Å; N546-K548 VanDerWaalsContact O-N 3.09Å; N546-K548 PolarHBondContact OD1-N 2.88Å; N546-K548 VanDerWaalsContact OD1-N 3.15Å; K548-L552 WeakPolarHBondContact O-CB 3.33Å; K548-L552 PolarHBondContact O-N 2.95Å; K548-L552 VanDerWaalsContact O-N 3.07Å
549	L	89.1	Confident	87.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-73.7	-38.6	178.1	-179.2	60.7	0	0	0	111.8	F510 V513 A541 N546 L552 L553	F510-L549 HydrophobicContact CD2-CB 4.41Å; V513-L549 HydrophobicContact CB-CD1 3.86Å; V513-L549 HydrophobicContact CG1-CD1 3.88Å; V513-L549 HydrophobicContact CG2-CD1 3.93Å; A541-L549 HydrophobicContact CB-CB 4.44Å; A541-L549 HydrophobicContact CB-CD2 3.75Å; A541-L549 HydrophobicContact CB-CG 3.66Å; N546-L549 HydrophobicContact CB-CB 4.05Å; N546-L549 PolarHBondContact O-N 2.87Å; N546-L549 PolarHBondContact OD1-N 2.99Å; L549-L552 HydrophobicContact CD1-CD2 4.4Å; L549-L552 PolarHBondContact O-N 2.76Å; L549-L553 WeakPolarHBondContact O-CG 3.18Å; L549-L553 PolarHBondContact O-N 3.26Å
550	V	89	Confident	87.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.8	-47.6	174.3	177.3	0	0	0	0	110.7	L538 A541 V542 N546 L552 L553 L554 L905 L906	L538-V550 HydrophobicContact CD1-CG1 4.26Å; A541-V550 HydrophobicContact CB-CG2 4.1Å; V542-V550 HydrophobicContact CB-CG2 4.44Å; V542-V550 HydrophobicContact CG2-CG1 4.11Å; V542-V550 HydrophobicContact CG2-CG2 3.6Å; N546-V550 WeakPolarHBondContact O-CG2 3.42Å; N546-V550 PolarHBondContact O-N 2.85Å; V550-L552 PolarHBondContact O-N 3.01Å; V550-L553 PolarHBondContact O-N 2.56Å; V550-L554 HydrophobicContact CG1-CD1 3.84Å; V550-L554 HydrophobicContact CG1-CG 4.48Å; V550-L554 VanDerWaalsContact O-CG 3.31Å; V550-L554 WeakPolarHBondContact O-CG 3.36Å; V550-L554 PolarHBondContact O-N 2.85Å; V550-L554 VanDerWaalsContact O-N 3.08Å; V550-L905 HydrophobicContact CB-CD2 4.26Å; V550-L905 HydrophobicContact CG1-CD2 3.87Å; V550-L906 HydrophobicContact CG1-CD2 4.27Å
551	N	90.1	Very high	87.5	Confident	39 Å²	39	39.6 Å²	39.6	21%	0.209	21%	0.211	C	C	.	.	H	α-helix	trans	-55.5	-49.9	173.1	-83.9	-65	0	0	0	111.6	M547 L553 L554 D555 L905 R909	M547-N551 WeakPolarHBondContact O-CB 3.48Å; M547-N551 PolarHBondContact O-N 3.29Å; M547-N551 PolarHBondContact O-ND2 2.89Å; N551-L553 VanDerWaalsContact C-N 3.33Å; N551-L553 PolarHBondContact O-N 3.09Å; N551-L554 PolarHBondContact O-N 2.82Å; N551-L554 VanDerWaalsContact O-N 3.13Å; N551-D555 WeakPolarHBondContact O-CB 3.27Å; N551-D555 PolarHBondContact O-N 2.97Å; N551-L905 WeakPolarHBondContact ND2-CD2 3.35Å; N551-L905 WeakPolarHBondContact OD1-CD1 3.49Å; N551-R909 PolarHBondContact OD1-NH2 2.89Å
552	L	89.6	Confident	87.4	Confident	15 Å²	15	40.4 Å²	40.4	8%	0.079	22%	0.215	C	C	.	.	H	α-helix	trans	-55.1	-45.4	179.5	-177.4	72.4	0	0	0	112.7	F510 V513 K514 L517 K548 L549 V550 D555 F556	F510-L552 HydrophobicContact CD2-CD2 4.22Å; F510-L552 HydrophobicContact CE2-CB 4.1Å; F510-L552 HydrophobicContact CE2-CD2 3.94Å; F510-L552 HydrophobicContact CE2-CG 4.48Å; V513-L552 HydrophobicContact CG1-CD2 4.15Å; K514-L552 HydrophobicContact CB-CD2 3.94Å; L517-L552 HydrophobicContact CD1-CD2 4.39Å; L517-L552 HydrophobicContact CD1-CG 4.32Å; K548-L552 WeakPolarHBondContact O-CB 3.33Å; K548-L552 PolarHBondContact O-N 2.95Å; K548-L552 VanDerWaalsContact O-N 3.07Å; L549-L552 HydrophobicContact CD1-CD2 4.4Å; L549-L552 PolarHBondContact O-N 2.76Å; V550-L552 PolarHBondContact O-N 3.01Å; L552-D555 PolarHBondContact O-N 3.04Å; L552-F556 HydrophobicContact CD1-CD2 4.07Å; L552-F556 HydrophobicContact CD1-CE2 3.78Å; L552-F556 HydrophobicContact CG-CD2 4.46Å; L552-F556 VanDerWaalsContact O-CD2 3.32Å; L552-F556 WeakPolarHBondContact O-CD2 3.28Å; L552-F556 PolarHBondContact O-N 3.48Å
553	L	89.3	Confident	87.1	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-37.5	179.4	-67.7	-179.8	0	0	0	112.5	F501 V513 L517 L527 L538 A541 L549 V550 N551 F556 G557 A558	F501-L553 HydrophobicContact CE2-CD2 3.76Å; F501-L553 HydrophobicContact CZ-CD2 3.75Å; V513-L553 HydrophobicContact CG1-CD2 3.97Å; L517-L553 HydrophobicContact CD1-CD2 4.18Å; L527-L553 HydrophobicContact CD2-CD2 4.03Å; L538-L553 HydrophobicContact CB-CD1 4.44Å; L538-L553 HydrophobicContact CD1-CB 4.11Å; L538-L553 HydrophobicContact CD1-CD1 4.31Å; A541-L553 HydrophobicContact CB-CD1 3.52Å; L549-L553 WeakPolarHBondContact O-CG 3.18Å; L549-L553 PolarHBondContact O-N 3.26Å; V550-L553 PolarHBondContact O-N 2.56Å; N551-L553 VanDerWaalsContact C-N 3.33Å; N551-L553 PolarHBondContact O-N 3.09Å; L553-F556 PolarHBondContact O-N 3.41Å; L553-G557 PolarHBondContact O-N 2.81Å; L553-A558 HydrophobicContact CB-CB 4.14Å; L553-A558 WeakPolarHBondContact O-CB 3.48Å; L553-A558 PolarHBondContact O-N 3.03Å
554	L	89.1	Confident	86.6	Confident	20 Å²	20	42.1 Å²	42.1	11%	0.105	22%	0.224	C	C	.	.	H	α-helix	trans	-71.4	-37	176.9	-65.3	172.6	0	0	0	112.1	L538 V550 N551 F556 G557 I560 L906 R909	L538-L554 HydrophobicContact CD1-CD2 4.16Å; L538-L554 HydrophobicContact CD1-CG 4.23Å; L538-L554 HydrophobicContact CD2-CD2 3.95Å; V550-L554 HydrophobicContact CG1-CD1 3.84Å; V550-L554 HydrophobicContact CG1-CG 4.48Å; V550-L554 VanDerWaalsContact O-CG 3.31Å; V550-L554 WeakPolarHBondContact O-CG 3.36Å; V550-L554 PolarHBondContact O-N 2.85Å; V550-L554 VanDerWaalsContact O-N 3.08Å; N551-L554 PolarHBondContact O-N 2.82Å; N551-L554 VanDerWaalsContact O-N 3.13Å; L554-F556 PolarHBondContact O-N 3.3Å; L554-G557 PolarHBondContact O-N 3.11Å; L554-I560 HydrophobicContact CD1-CD1 4.25Å; L554-I560 HydrophobicContact CD2-CB 3.95Å; L554-I560 HydrophobicContact CD2-CD1 3.97Å; L554-I560 HydrophobicContact CD2-CG1 4.1Å; L554-L906 HydrophobicContact CD1-CD2 4.39Å; L554-R909 HydrophobicContact CD1-CB 3.92Å; L554-R909 HydrophobicContact CD1-CG 3.9Å
555	D	88.8	Confident	85.9	Confident	102 Å²	102	46.4 Å²	46.4	55%	0.545	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-28.9	175.4	-64	-20	0	0	0	112.1	N551 L552 R909	N551-D555 WeakPolarHBondContact O-CB 3.27Å; N551-D555 PolarHBondContact O-N 2.97Å; L552-D555 PolarHBondContact O-N 3.04Å; D555-R909 IonicContact OD1-CZ 3.86Å; D555-R909 IonicContact OD1-NH1 3.05Å; D555-R909 PolarHBondContact OD1-NH1 3.3Å; D555-R909 IonicContact OD1-NH2 3.67Å; D555-R909 PolarHBondContact OD1-NH2 3.2Å
556	F	86.3	Confident	84.9	Confident	80 Å²	80	51 Å²	51	35%	0.351	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	0.3	174	-85.4	-98.6	0	0	0	114	L517 H518 L527 L552 L553 L554	L517-F556 HydrophobicContact CB-CD1 4.08Å; L517-F556 HydrophobicContact CB-CE1 3.73Å; L517-F556 HydrophobicContact CB-CE2 4.27Å; L517-F556 HydrophobicContact CB-CG 4.49Å; L517-F556 HydrophobicContact CB-CZ 3.82Å; L517-F556 HydrophobicContact CD1-CB 4.43Å; L517-F556 HydrophobicContact CD1-CD1 4.41Å; L517-F556 HydrophobicContact CD1-CD2 4.08Å; L517-F556 HydrophobicContact CD1-CE2 4.4Å; L517-F556 HydrophobicContact CD1-CG 4.06Å; H518-F556 AromaticContact CE1-CZ 3.69Å; H518-F556 AromaticContact ND1-CZ 3.86Å; L527-F556 HydrophobicContact CD1-CB 3.86Å; L527-F556 WeakPolarHBondContact CD1-O 3.46Å; L552-F556 HydrophobicContact CD1-CD2 4.07Å; L552-F556 HydrophobicContact CD1-CE2 3.78Å; L552-F556 HydrophobicContact CG-CD2 4.46Å; L552-F556 VanDerWaalsContact O-CD2 3.32Å; L552-F556 WeakPolarHBondContact O-CD2 3.28Å; L552-F556 PolarHBondContact O-N 3.48Å; L553-F556 PolarHBondContact O-N 3.41Å; L554-F556 PolarHBondContact O-N 3.3Å
557	G	85.3	Confident	84.1	Confident	52 Å²	52	50.1 Å²	50.1	54%	0.536	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	25.4	173.2	0	0	0	0	0	116.3	L553 L554	L553-G557 PolarHBondContact O-N 2.81Å; L554-G557 PolarHBondContact O-N 3.11Å
558	A	88.7	Confident	83.6	Confident	9 Å²	9	48.3 Å²	48.3	7%	0.074	27%	0.265	C	S	.	.			trans	-61.3	135.6	170.4	0	0	0	0	0	111.5	L527 L538 L553 I560	L527-A558 HydrophobicContact CB-CB 4.12Å; L527-A558 HydrophobicContact CD1-CB 4.47Å; L538-A558 HydrophobicContact CB-CB 4.4Å; L538-A558 HydrophobicContact CD2-CB 4.37Å; L553-A558 HydrophobicContact CB-CB 4.14Å; L553-A558 WeakPolarHBondContact O-CB 3.48Å; L553-A558 PolarHBondContact O-N 3.03Å; A558-I560 PolarHBondContact O-N 2.75Å; A558-I560 VanDerWaalsContact O-N 3.08Å
559	N	88.8	Confident	83.4	Confident	78 Å²	78	41 Å²	41	42%	0.417	23%	0.233	S	C	.	.			trans	-71.5	104.6	-177.6	179.9	4.3	0	0	0	111.2	N528 N561 Q562	N528-N559 WeakPolarHBondContact OD1-CB 3.44Å; N528-N559 PolarHBondContact OD1-N 2.87Å; N559-N561 PolarHBondContact O-N 3.37Å; N559-N561 PolarHBondContact OD1-N 3.11Å; N559-Q562 HydrophobicContact CB-CB 4.12Å; N559-Q562 VanDerWaalsContact O-CB 3.31Å; N559-Q562 WeakPolarHBondContact O-CB 3.49Å; N559-Q562 PolarHBondContact O-N 3.11Å; N559-Q562 PolarHBondContact OD1-N 2.81Å
560	I	88.5	Confident	83.2	Confident	15 Å²	15	41 Å²	41	8%	0.077	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-27	-178.5	-163.3	164.6	0	0	0	114	L554 A558 L906 R909 A911	L554-I560 HydrophobicContact CD1-CD1 4.25Å; L554-I560 HydrophobicContact CD2-CB 3.95Å; L554-I560 HydrophobicContact CD2-CD1 3.97Å; L554-I560 HydrophobicContact CD2-CG1 4.1Å; A558-I560 PolarHBondContact O-N 2.75Å; A558-I560 VanDerWaalsContact O-N 3.08Å; I560-L906 HydrophobicContact CD1-CB 4.25Å; I560-L906 HydrophobicContact CD1-CD2 3.72Å; I560-L906 VanDerWaalsContact CD1-O 3.26Å; I560-L906 WeakPolarHBondContact CD1-O 3.35Å; I560-L906 HydrophobicContact CG1-CD2 3.89Å; I560-R909 HydrophobicContact CD1-CB 3.86Å; I560-A911 HydrophobicContact CD1-CB 3.88Å; I560-A911 HydrophobicContact CG1-CB 4.01Å
561	N	88	Confident	83.2	Confident	46 Å²	46	41 Å²	41	25%	0.246	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	17.8	-179.1	-63.2	-49.8	0	0	0	112.2	N559 L563 G910 A911 N912 T915	N559-N561 PolarHBondContact O-N 3.37Å; N559-N561 PolarHBondContact OD1-N 3.11Å; N561-L563 PolarHBondContact O-N 3.44Å; N561-G910 PolarHBondContact ND2-O 3.02Å; N561-G910 VanDerWaalsContact ND2-O 3.09Å; N561-A911 WeakPolarHBondContact OD1-CA 3.5Å; N561-N912 PolarHBondContact OD1-N 3.02Å; N561-T915 HydrophobicContact CB-CG2 4.39Å
562	Q	85.5	Confident	82.8	Confident	18 Å²	18	39.3 Å²	39.3	8%	0.084	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-62.2	131.9	173.5	-179.2	167.9	5.7	0	0	110.8	N528 I530 F536 N559	N528-Q562 PolarHBondContact O-NE2 3.32Å; I530-Q562 VanDerWaalsContact CG1-NE2 3.31Å; F536-Q562 HydrophobicContact CD1-CG 4.18Å; F536-Q562 HydrophobicContact CD2-CB 4.45Å; F536-Q562 HydrophobicContact CD2-CG 4.29Å; F536-Q562 HydrophobicContact CE1-CB 4.38Å; F536-Q562 HydrophobicContact CE1-CG 3.9Å; F536-Q562 HydrophobicContact CE2-CB 3.81Å; F536-Q562 HydrophobicContact CE2-CG 4Å; F536-Q562 HydrophobicContact CG-CG 4.37Å; F536-Q562 HydrophobicContact CZ-CB 3.77Å; F536-Q562 HydrophobicContact CZ-CG 3.8Å; F536-Q562 WeakPolarHBondContact CZ-O 3.32Å; N559-Q562 HydrophobicContact CB-CB 4.12Å; N559-Q562 VanDerWaalsContact O-CB 3.31Å; N559-Q562 WeakPolarHBondContact O-CB 3.49Å; N559-Q562 PolarHBondContact O-N 3.11Å; N559-Q562 PolarHBondContact OD1-N 2.81Å
563	L	79.9	Confident	82.5	Confident	80 Å²	80	39.8 Å²	39.8	42%	0.419	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-88	140.6	176.6	-62.8	170.2	0	0	0	110.6	N561 L568 T569	N561-L563 PolarHBondContact O-N 3.44Å; L563-L568 CarbonylContact C-O 3.48Å; L563-L568 VanDerWaalsContact CA-O 3.3Å; L563-L568 WeakPolarHBondContact CA-O 3.27Å; L563-T569 HydrophobicContact CD2-CG2 3.59Å
564	T	74.8	Confident	82.3	Confident	15 Å²	15	39.8 Å²	39.8	9%	0.092	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-74.9	167.5	161	63.4	0	0	0	0	110.4	F536 L539 D566 G567 L568 I573	F536-T564 HydrophobicContact CE1-CG2 3.96Å; L539-T564 HydrophobicContact CD2-CG2 3.95Å; T564-D566 PolarHBondContact O-N 3.04Å; T564-D566 PolarHBondContact OG1-N 2.74Å; T564-G567 PolarHBondContact O-N 3.4Å; T564-L568 PolarHBondContact N-O 2.83Å; T564-L568 WeakPolarHBondContact OG1-CB 3.49Å; T564-L568 PolarHBondContact OG1-N 3.05Å; T564-L568 PolarHBondContact OG1-O 2.85Å; T564-I573 HydrophobicContact CG2-CD1 3.97Å
565	D	69.1	Low	82.1	Confident	117 Å²	117	38.9 Å²	38.9	63%	0.626	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-31.5	173.8	-58.5	-4.7	0	0	0	113.5	G534 G567	G534-D565 VanDerWaalsContact CA-CG 3.5Å; G534-D565 WeakPolarHBondContact CA-OD1 3.22Å; G534-D565 WeakPolarHBondContact CA-OD2 3.27Å; G534-D565 PolarHBondContact N-OD2 3.45Å; D565-G567 VanDerWaalsContact C-N 3.29Å; D565-G567 PolarHBondContact O-N 2.77Å
566	D	63.1	Low	81.9	Confident	128 Å²	128	36.4 Å²	36.4	68%	0.684	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-1.8	175.6	-68	-41.1	0	0	0	115.3	T564 L568	T564-D566 PolarHBondContact O-N 3.04Å; T564-D566 PolarHBondContact OG1-N 2.74Å; D566-L568 HydrophobicContact CB-CD1 4.41Å
567	G	68.7	Low	81.8	Confident	22 Å²	22	36.1 Å²	36.1	23%	0.227	21%	0.207	C	C	.	.	S	Bend	trans	80.1	22	-178.1	0	0	0	0	0	115.4	T564 D565	T564-G567 PolarHBondContact O-N 3.4Å; D565-G567 VanDerWaalsContact C-N 3.29Å; D565-G567 PolarHBondContact O-N 2.77Å
568	L	75.1	Confident	81.9	Confident	24 Å²	24	34 Å²	34	13%	0.126	18%	0.183	C	C	.	.			trans	-101.2	141	179.5	-82.6	163.6	0	0	0	111.8	L563 T564 D566 T572 I573 L576 R918 P919	L563-L568 CarbonylContact C-O 3.48Å; L563-L568 VanDerWaalsContact CA-O 3.3Å; L563-L568 WeakPolarHBondContact CA-O 3.27Å; T564-L568 PolarHBondContact N-O 2.83Å; T564-L568 WeakPolarHBondContact OG1-CB 3.49Å; T564-L568 PolarHBondContact OG1-N 3.05Å; T564-L568 PolarHBondContact OG1-O 2.85Å; D566-L568 HydrophobicContact CB-CD1 4.41Å; L568-T572 VanDerWaalsContact CD2-OG1 3.25Å; L568-T572 WeakPolarHBondContact CD2-OG1 3.45Å; L568-I573 HydrophobicContact CB-CD1 3.97Å; L568-I573 HydrophobicContact CB-CG1 3.93Å; L568-I573 HydrophobicContact CD1-CD1 4.46Å; L568-I573 HydrophobicContact CD1-CG1 4.06Å; L568-I573 HydrophobicContact CD2-CG1 4.26Å; L568-I573 HydrophobicContact CG-CG1 4.34Å; L568-L576 HydrophobicContact CD2-CD1 3.99Å; L568-R918 VanDerWaalsContact CD2-O 3.32Å; L568-R918 WeakPolarHBondContact CD2-O 3.33Å; L568-R918 WeakPolarHBondContact CG-O 3.48Å; L568-P919 VanDerWaalsContact CD2-CD 3.41Å
569	T	84	Confident	81.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-90.3	161.5	166.2	56.5	0	0	0	0	111.4	L563 F571 T572 I573 T915	L563-T569 HydrophobicContact CD2-CG2 3.59Å; T569-F571 PolarHBondContact O-N 2.86Å; T569-F571 VanDerWaalsContact O-N 3.17Å; T569-T572 PolarHBondContact N-OG1 3.06Å; T569-T572 VanDerWaalsContact N-OG1 3.09Å; T569-T572 PolarHBondContact O-N 3.39Å; T569-T572 PolarHBondContact O-OG1 2.79Å; T569-T572 VanDerWaalsContact O-OG1 3.1Å; T569-T572 PolarHBondContact OG1-N 2.85Å; T569-T572 PolarHBondContact OG1-OG1 2.72Å; T569-I573 WeakPolarHBondContact O-CG1 3.42Å; T569-I573 PolarHBondContact O-N 2.74Å; T569-T915 VanDerWaalsContact CG2-OG1 3.26Å; T569-T915 WeakPolarHBondContact CG2-OG1 3.21Å
570	V	85.7	Confident	81.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-53.4	-37.1	172.8	-173.5	0	0	0	0	111.4	F536 L538 L539 V542 C574 L906	F536-V570 HydrophobicContact CE2-CG2 3.41Å; F536-V570 VanDerWaalsContact CE2-CG2 3.41Å; F536-V570 HydrophobicContact CZ-CG2 3.35Å; L538-V570 HydrophobicContact CD2-CG2 4.2Å; L538-V570 HydrophobicContact CG-CG1 4.48Å; L538-V570 HydrophobicContact CG-CG2 4.21Å; L539-V570 HydrophobicContact CB-CG2 4.41Å; V542-V570 HydrophobicContact CB-CG1 3.66Å; V542-V570 HydrophobicContact CG1-CG1 3.7Å; V542-V570 HydrophobicContact CG2-CG1 3.52Å; V570-C574 PolarHBondContact O-N 3.08Å; V570-C574 PolarHBondContact O-SG 3.48Å; V570-L906 HydrophobicContact CG1-CD1 4.5Å
571	F	88.7	Confident	80.9	Confident	1 Å²	1	34.1 Å²	34.1	0%	0.004	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-48.6	177.8	-179.6	-108.6	0	0	0	113.4	T569 I573 C574 L575 I903 L906 L907 A911 P913 A922 L938	T569-F571 PolarHBondContact O-N 2.86Å; T569-F571 VanDerWaalsContact O-N 3.17Å; F571-I573 VanDerWaalsContact C-N 3.29Å; F571-I573 PolarHBondContact O-N 3.02Å; F571-C574 VanDerWaalsContact O-CB 3.3Å; F571-C574 WeakPolarHBondContact O-CB 3.45Å; F571-C574 PolarHBondContact O-N 3.07Å; F571-C574 VanDerWaalsContact O-N 3.13Å; F571-L575 HydrophobicContact CD1-CD1 4.15Å; F571-L575 HydrophobicContact CE1-CD1 3.51Å; F571-L575 HydrophobicContact CE1-CG 4.35Å; F571-L575 HydrophobicContact CE2-CD1 4.49Å; F571-L575 HydrophobicContact CZ-CD1 3.7Å; F571-L575 HydrophobicContact CZ-CG 4.19Å; F571-L575 PolarHBondContact O-N 2.87Å; F571-L575 VanDerWaalsContact O-N 3.09Å; F571-I903 HydrophobicContact CE2-CG2 4.08Å; F571-L906 HydrophobicContact CD2-CB 4.16Å; F571-L906 HydrophobicContact CD2-CD1 4.45Å; F571-L907 HydrophobicContact CD2-CD2 4.44Å; F571-L907 HydrophobicContact CD2-CG 4.49Å; F571-L907 HydrophobicContact CE1-CD2 4.29Å; F571-L907 HydrophobicContact CE2-CD1 4.08Å; F571-L907 HydrophobicContact CE2-CD2 3.61Å; F571-L907 HydrophobicContact CE2-CG 3.6Å; F571-L907 HydrophobicContact CZ-CD1 4.19Å; F571-L907 HydrophobicContact CZ-CD2 3.53Å; F571-L907 HydrophobicContact CZ-CG 3.94Å; F571-A911 HydrophobicContact CB-CB 4.02Å; F571-A911 HydrophobicContact CD2-CB 4.03Å; F571-A911 HydrophobicContact CG-CB 4.04Å; F571-P913 HydrophobicContact CE1-CB 3.99Å; F571-A922 HydrophobicContact CD1-CB 4.41Å; F571-A922 HydrophobicContact CE1-CB 3.8Å; F571-L938 HydrophobicContact CE1-CD2 3.84Å; F571-L938 HydrophobicContact CZ-CD2 3.61Å
572	T	82.5	Confident	80.4	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-66.9	-32.5	177.8	49.8	0	0	0	0	111.9	L568 T569 L575 L576 A922	L568-T572 VanDerWaalsContact CD2-OG1 3.25Å; L568-T572 WeakPolarHBondContact CD2-OG1 3.45Å; T569-T572 PolarHBondContact N-OG1 3.06Å; T569-T572 VanDerWaalsContact N-OG1 3.09Å; T569-T572 PolarHBondContact O-N 3.39Å; T569-T572 PolarHBondContact O-OG1 2.79Å; T569-T572 VanDerWaalsContact O-OG1 3.1Å; T569-T572 PolarHBondContact OG1-N 2.85Å; T569-T572 PolarHBondContact OG1-OG1 2.72Å; T572-L575 PolarHBondContact O-N 3.17Å; T572-L576 WeakPolarHBondContact O-CG 3.26Å; T572-L576 PolarHBondContact O-N 3.31Å; T572-A922 HydrophobicContact CG2-CB 4.44Å
573	I	82	Confident	79.8	Confident	25 Å²	25	37.2 Å²	37.2	13%	0.128	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-39.2	171.2	-64.4	168.1	0	0	0	111.5	L539 L543 T564 L568 T569 F571 L576 K577	L539-I573 HydrophobicContact CD1-CB 4.45Å; L539-I573 HydrophobicContact CD1-CD1 3.62Å; L539-I573 HydrophobicContact CD1-CG2 4.08Å; L539-I573 HydrophobicContact CD2-CD1 4.32Å; L543-I573 HydrophobicContact CD2-CG2 4.29Å; T564-I573 HydrophobicContact CG2-CD1 3.97Å; L568-I573 HydrophobicContact CB-CD1 3.97Å; L568-I573 HydrophobicContact CB-CG1 3.93Å; L568-I573 HydrophobicContact CD1-CD1 4.46Å; L568-I573 HydrophobicContact CD1-CG1 4.06Å; L568-I573 HydrophobicContact CD2-CG1 4.26Å; L568-I573 HydrophobicContact CG-CG1 4.34Å; T569-I573 WeakPolarHBondContact O-CG1 3.42Å; T569-I573 PolarHBondContact O-N 2.74Å; F571-I573 VanDerWaalsContact C-N 3.29Å; F571-I573 PolarHBondContact O-N 3.02Å; I573-L576 PolarHBondContact O-N 3.41Å; I573-K577 WeakPolarHBondContact O-CG 3.49Å; I573-K577 PolarHBondContact O-N 3.19Å; I573-K577 VanDerWaalsContact O-N 3.1Å
574	C	86.1	Confident	79.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-59.1	-49.8	172.9	-67.1	0	0	0	0	111.8	V542 W545 V570 F571 L576 K577 Y578 I903 L906	V542-C574 WeakPolarHBondContact CG1-SG 3.32Å; W545-C574 HydrophobicContact CH2-CB 4.36Å; V570-C574 PolarHBondContact O-N 3.08Å; V570-C574 PolarHBondContact O-SG 3.48Å; F571-C574 VanDerWaalsContact O-CB 3.3Å; F571-C574 WeakPolarHBondContact O-CB 3.45Å; F571-C574 PolarHBondContact O-N 3.07Å; F571-C574 VanDerWaalsContact O-N 3.13Å; C574-L576 PolarHBondContact O-N 3.13Å; C574-K577 PolarHBondContact O-N 2.69Å; C574-Y578 WeakPolarHBondContact O-CB 3.16Å; C574-Y578 PolarHBondContact O-N 2.97Å; C574-I903 HydrophobicContact CB-CD1 4.41Å; C574-I903 HydrophobicContact CB-CG1 3.83Å; C574-L906 WeakPolarHBondContact SG-CD1 3.41Å
575	L	85.7	Confident	79.5	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.7	-42.7	-179.1	-73	174.6	0	0	0	111.7	F571 T572 K577 Y578 Y579 I903 A922 M934	F571-L575 HydrophobicContact CD1-CD1 4.15Å; F571-L575 HydrophobicContact CE1-CD1 3.51Å; F571-L575 HydrophobicContact CE1-CG 4.35Å; F571-L575 HydrophobicContact CE2-CD1 4.49Å; F571-L575 HydrophobicContact CZ-CD1 3.7Å; F571-L575 HydrophobicContact CZ-CG 4.19Å; F571-L575 PolarHBondContact O-N 2.87Å; F571-L575 VanDerWaalsContact O-N 3.09Å; T572-L575 PolarHBondContact O-N 3.17Å; L575-K577 VanDerWaalsContact C-N 3.34Å; L575-K577 PolarHBondContact O-N 3.12Å; L575-Y578 PolarHBondContact O-N 2.96Å; L575-Y579 HydrophobicContact CB-CD2 4.4Å; L575-Y579 HydrophobicContact CB-CE2 4.19Å; L575-Y579 HydrophobicContact CD2-CE2 4.21Å; L575-Y579 WeakPolarHBondContact O-CD2 3.15Å; L575-Y579 PolarHBondContact O-N 3.33Å; L575-I903 HydrophobicContact CD2-CD1 4.11Å; L575-I903 HydrophobicContact CD2-CG2 4.45Å; L575-A922 HydrophobicContact CD1-CB 3.57Å; L575-M934 HydrophobicContact CD2-CE 4.48Å; L575-M934 HydrophobicContact CD2-CG 4.22Å; L575-M934 HydrophobicContact CD2-SD 4.14Å
576	L	82.6	Confident	79.5	Confident	50 Å²	50	34 Å²	34	26%	0.262	17%	0.169	S	C	.	.	H	α-helix	trans	-59.9	-42.9	175.3	-71.1	170.2	0	0	0	111.9	L568 T572 I573 C574 Y579 E580 P919 L925	L568-L576 HydrophobicContact CD2-CD1 3.99Å; T572-L576 WeakPolarHBondContact O-CG 3.26Å; T572-L576 PolarHBondContact O-N 3.31Å; I573-L576 PolarHBondContact O-N 3.41Å; C574-L576 PolarHBondContact O-N 3.13Å; L576-Y579 PolarHBondContact O-N 3.39Å; L576-E580 WeakPolarHBondContact O-CG 3.41Å; L576-E580 PolarHBondContact O-N 2.86Å; L576-P919 HydrophobicContact CD1-CG 4.16Å; L576-L925 HydrophobicContact CD2-CD1 3.85Å; L576-L925 HydrophobicContact CD2-CD2 3.94Å; L576-L925 HydrophobicContact CG-CD1 4.12Å
577	K	84.6	Confident	79.7	Confident	75 Å²	75	31.5 Å²	31.5	33%	0.326	16%	0.156	S	C	.	.	H	α-helix	trans	-70.2	-34.4	176.7	-68.3	-70.8	147.4	-151.5	0	113.1	W545 I573 C574 L575 E580 L581	W545-K577 HydrophobicContact CH2-CB 4.18Å; W545-K577 HydrophobicContact CZ2-CB 3.85Å; I573-K577 WeakPolarHBondContact O-CG 3.49Å; I573-K577 PolarHBondContact O-N 3.19Å; I573-K577 VanDerWaalsContact O-N 3.1Å; C574-K577 PolarHBondContact O-N 2.69Å; L575-K577 VanDerWaalsContact C-N 3.34Å; L575-K577 PolarHBondContact O-N 3.12Å; K577-E580 WeakPolarHBondContact CD-OE2 3.06Å; K577-E580 WeakPolarHBondContact CE-OE2 3.2Å; K577-E580 IonicContact NZ-OE1 2.64Å; K577-E580 PolarHBondContact NZ-OE1 3.01Å; K577-E580 IonicContact NZ-OE2 3.71Å; K577-E580 PolarHBondContact NZ-OE2 3.4Å; K577-L581 PolarHBondContact O-N 3.15Å
578	Y	87	Confident	79.4	Confident	8 Å²	8	32.4 Å²	32.4	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-45.6	171.7	169.6	-103.2	0	0	0	111.2	C574 L575 E580 L581 F582 Q896 M899 I900 I903 D931 M934	C574-Y578 WeakPolarHBondContact O-CB 3.16Å; C574-Y578 PolarHBondContact O-N 2.97Å; L575-Y578 PolarHBondContact O-N 2.96Å; Y578-E580 PolarHBondContact O-N 3.12Å; Y578-L581 CarbonylContact O-C 3.51Å; Y578-L581 PolarHBondContact O-N 3.32Å; Y578-F582 WeakPolarHBondContact O-CB 3.37Å; Y578-F582 PolarHBondContact O-N 3.06Å; Y578-Q896 HydrophobicContact CD2-CG 4.29Å; Y578-Q896 HydrophobicContact CE2-CG 3.67Å; Y578-Q896 PolarHBondContact OH-NE2 2.79Å; Y578-M899 HydrophobicContact CD2-CB 4.28Å; Y578-I900 HydrophobicContact CD2-CG1 4.18Å; Y578-I900 HydrophobicContact CE2-CD1 3.9Å; Y578-I900 HydrophobicContact CE2-CG1 3.6Å; Y578-I903 HydrophobicContact CD2-CD1 4.34Å; Y578-I903 HydrophobicContact CG-CD1 3.99Å; Y578-D931 WeakPolarHBondContact CE1-OD2 3.36Å; Y578-D931 PolarHBondContact OH-OD2 2.72Å; Y578-M934 HydrophobicContact CD1-CE 4.44Å; Y578-M934 HydrophobicContact CE1-CE 4.01Å
579	Y	84.3	Confident	78.8	Confident	10 Å²	10	36.4 Å²	36.4	4%	0.039	17%	0.171	C	C	.	.	H	α-helix	trans	-76.1	-18.8	179.2	-66.6	-53.1	0	0	0	114.8	L575 L576 F582 K583 L925 A926 A929 D931 M934	L575-Y579 HydrophobicContact CB-CD2 4.4Å; L575-Y579 HydrophobicContact CB-CE2 4.19Å; L575-Y579 HydrophobicContact CD2-CE2 4.21Å; L575-Y579 WeakPolarHBondContact O-CD2 3.15Å; L575-Y579 PolarHBondContact O-N 3.33Å; L576-Y579 PolarHBondContact O-N 3.39Å; Y579-F582 HydrophobicContact CD1-CB 4.31Å; Y579-K583 VanDerWaalsContact O-CD 3.29Å; Y579-K583 WeakPolarHBondContact O-CD 3.34Å; Y579-K583 WeakPolarHBondContact O-CE 3.29Å; Y579-K583 VanDerWaalsContact O-CG 3.26Å; Y579-K583 WeakPolarHBondContact O-CG 3.4Å; Y579-K583 PolarHBondContact O-N 3.49Å; Y579-L925 HydrophobicContact CD2-CB 4.23Å; Y579-L925 HydrophobicContact CE2-CB 4.02Å; Y579-A926 WeakPolarHBondContact OH-CA 3.12Å; Y579-A926 WeakPolarHBondContact OH-CB 3.34Å; Y579-A929 HydrophobicContact CD1-CB 3.27Å; Y579-A929 HydrophobicContact CD2-CB 4.5Å; Y579-A929 HydrophobicContact CE1-CB 3.24Å; Y579-A929 HydrophobicContact CE2-CB 4.48Å; Y579-A929 HydrophobicContact CG-CB 3.96Å; Y579-D931 HydrophobicContact CE1-CB 4.06Å; Y579-M934 VanDerWaalsContact OH-CG 3.26Å; Y579-M934 WeakPolarHBondContact OH-CG 3.42Å
580	E	78.6	Confident	77.1	Confident	92 Å²	92	38 Å²	38	43%	0.43	18%	0.179	S	C	.	.	H	α-helix	trans	-63.9	-52.7	161.9	-76.4	171.7	-171	0	0	110.2	L576 K577 Y578 F582 K583 E584	L576-E580 WeakPolarHBondContact O-CG 3.41Å; L576-E580 PolarHBondContact O-N 2.86Å; K577-E580 WeakPolarHBondContact CD-OE2 3.06Å; K577-E580 WeakPolarHBondContact CE-OE2 3.2Å; K577-E580 IonicContact NZ-OE1 2.64Å; K577-E580 PolarHBondContact NZ-OE1 3.01Å; K577-E580 IonicContact NZ-OE2 3.71Å; K577-E580 PolarHBondContact NZ-OE2 3.4Å; Y578-E580 PolarHBondContact O-N 3.12Å; E580-F582 PolarHBondContact O-N 2.95Å; E580-K583 WeakPolarHBondContact O-CB 3.25Å; E580-K583 PolarHBondContact O-N 2.86Å; E580-E584 PolarHBondContact O-N 3.48Å
581	L	82.5	Confident	75.1	Confident	2 Å²	2	42 Å²	42	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-63	-38.7	177.8	176.8	62.5	0	0	0	113.2	K577 Y578 K583 E584 I585 L892 K895 Q896 M899	K577-L581 PolarHBondContact O-N 3.15Å; Y578-L581 CarbonylContact O-C 3.51Å; Y578-L581 PolarHBondContact O-N 3.32Å; L581-K583 PolarHBondContact O-N 2.94Å; L581-E584 VanDerWaalsContact CD1-OE2 3.28Å; L581-E584 WeakPolarHBondContact CD1-OE2 3.42Å; L581-E584 WeakPolarHBondContact O-CB 3.42Å; L581-E584 PolarHBondContact O-N 3.3Å; L581-E584 VanDerWaalsContact O-N 3.13Å; L581-I585 HydrophobicContact CD1-CD1 4.04Å; L581-I585 HydrophobicContact CD1-CG1 4.21Å; L581-I585 HydrophobicContact CD2-CD1 4.36Å; L581-I585 HydrophobicContact CG-CD1 3.82Å; L581-I585 HydrophobicContact CG-CG1 4.39Å; L581-I585 WeakPolarHBondContact O-CG1 3.41Å; L581-I585 PolarHBondContact O-N 3.18Å; L581-L892 HydrophobicContact CD1-CB 4.3Å; L581-L892 HydrophobicContact CD1-CD2 3.5Å; L581-L892 HydrophobicContact CD1-CG 4.49Å; L581-K895 HydrophobicContact CD1-CD 3.87Å; L581-K895 HydrophobicContact CD2-CB 4.01Å; L581-K895 HydrophobicContact CD2-CD 3.87Å; L581-K895 HydrophobicContact CD2-CG 3.7Å; L581-Q896 HydrophobicContact CD2-CB 3.95Å; L581-M899 HydrophobicContact CB-CE 4.43Å; L581-M899 HydrophobicContact CB-SD 4.11Å; L581-M899 HydrophobicContact CD2-CE 3.96Å; L581-M899 HydrophobicContact CD2-SD 3.49Å; L581-M899 WeakPolarHBondContact CD2-SD 3.28Å; L581-M899 HydrophobicContact CG-SD 4.46Å
582	F	78.8	Confident	72.7	Confident	38 Å²	38	45.7 Å²	45.7	17%	0.167	22%	0.215	C	C	.	.	H	α-helix	trans	-59.2	-37.5	178	-173.8	-96.1	0	0	0	111.4	Y578 Y579 E580 I585 M586	Y578-F582 WeakPolarHBondContact O-CB 3.37Å; Y578-F582 PolarHBondContact O-N 3.06Å; Y579-F582 HydrophobicContact CD1-CB 4.31Å; E580-F582 PolarHBondContact O-N 2.95Å; F582-I585 PolarHBondContact O-N 3.41Å; F582-M586 HydrophobicContact CD1-CG 3.95Å; F582-M586 HydrophobicContact CE1-CG 3.66Å; F582-M586 HydrophobicContact CE1-SD 4.47Å; F582-M586 HydrophobicContact CE2-CG 4.5Å; F582-M586 HydrophobicContact CG-CG 4.49Å; F582-M586 HydrophobicContact CZ-CG 3.97Å; F582-M586 HydrophobicContact CZ-SD 4.24Å; F582-M586 WeakPolarHBondContact O-CB 3.38Å; F582-M586 VanDerWaalsContact O-CG 3.29Å; F582-M586 WeakPolarHBondContact O-CG 3.33Å; F582-M586 PolarHBondContact O-N 3.07Å
583	K	72.2	Confident	70.4	Confident	90 Å²	90	48.4 Å²	48.4	39%	0.391	23%	0.234	S	C	.	.	H	α-helix	trans	-66.5	-42.2	174.8	-69	163.6	-172.7	159.1	0	111.8	Y579 E580 L581 I585 M586 N587 I672	Y579-K583 VanDerWaalsContact O-CD 3.29Å; Y579-K583 WeakPolarHBondContact O-CD 3.34Å; Y579-K583 WeakPolarHBondContact O-CE 3.29Å; Y579-K583 VanDerWaalsContact O-CG 3.26Å; Y579-K583 WeakPolarHBondContact O-CG 3.4Å; Y579-K583 PolarHBondContact O-N 3.49Å; E580-K583 WeakPolarHBondContact O-CB 3.25Å; E580-K583 PolarHBondContact O-N 2.86Å; L581-K583 PolarHBondContact O-N 2.94Å; K583-I585 VanDerWaalsContact C-N 3.35Å; K583-I585 PolarHBondContact O-N 2.82Å; K583-M586 PolarHBondContact O-N 3.16Å; K583-N587 VanDerWaalsContact O-CB 3.31Å; K583-N587 WeakPolarHBondContact O-CB 3.38Å; K583-N587 PolarHBondContact O-N 2.99Å; K583-N587 PolarHBondContact O-ND2 2.93Å; K583-I672 HydrophobicContact CB-CD1 3.88Å; K583-I672 HydrophobicContact CD-CD1 4.37Å; K583-I672 HydrophobicContact CD-CG2 4.27Å; K583-I672 HydrophobicContact CG-CD1 3.79Å; K583-I672 HydrophobicContact CG-CG1 4.11Å; K583-I672 HydrophobicContact CG-CG2 4.24Å
584	E	74	Confident	68	Low	85 Å²	85	47.9 Å²	47.9	40%	0.397	23%	0.231	S	C	.	.	H	α-helix	trans	-56.8	-48.5	173	-61.5	171.7	177.1	0	0	110.7	E580 L581 N587 M588 K895	E580-E584 PolarHBondContact O-N 3.48Å; L581-E584 VanDerWaalsContact CD1-OE2 3.28Å; L581-E584 WeakPolarHBondContact CD1-OE2 3.42Å; L581-E584 WeakPolarHBondContact O-CB 3.42Å; L581-E584 PolarHBondContact O-N 3.3Å; L581-E584 VanDerWaalsContact O-N 3.13Å; E584-N587 PolarHBondContact O-N 2.98Å; E584-M588 PolarHBondContact O-N 3.34Å; E584-K895 IonicContact OE2-NZ 3.31Å
585	I	75.2	Confident	65.4	Low	3 Å²	3	54.5 Å²	54.5	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-66.5	-43	-178.3	-67.4	171.5	0	0	0	112.2	L581 F582 K583 M588 K589 L892 L893 Q896	L581-I585 HydrophobicContact CD1-CD1 4.04Å; L581-I585 HydrophobicContact CD1-CG1 4.21Å; L581-I585 HydrophobicContact CD2-CD1 4.36Å; L581-I585 HydrophobicContact CG-CD1 3.82Å; L581-I585 HydrophobicContact CG-CG1 4.39Å; L581-I585 WeakPolarHBondContact O-CG1 3.41Å; L581-I585 PolarHBondContact O-N 3.18Å; F582-I585 PolarHBondContact O-N 3.41Å; K583-I585 VanDerWaalsContact C-N 3.35Å; K583-I585 PolarHBondContact O-N 2.82Å; I585-M588 PolarHBondContact O-N 2.65Å; I585-K589 PolarHBondContact O-N 2.83Å; I585-L892 HydrophobicContact CD1-CB 4.28Å; I585-L892 HydrophobicContact CG1-CB 3.9Å; I585-L893 HydrophobicContact CG2-CD2 4.21Å; I585-Q896 HydrophobicContact CD1-CB 3.74Å; I585-Q896 HydrophobicContact CD1-CG 4.13Å; I585-Q896 VanDerWaalsContact CD1-OE1 3.32Å
586	M	69.1	Low	62.9	Low	57 Å²	57	62.9 Å²	62.9	28%	0.281	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-46.5	176.9	-71.8	-61.5	-72	0	0	110.5	F582 K583 M588 K589 N590	F582-M586 HydrophobicContact CD1-CG 3.95Å; F582-M586 HydrophobicContact CE1-CG 3.66Å; F582-M586 HydrophobicContact CE1-SD 4.47Å; F582-M586 HydrophobicContact CE2-CG 4.5Å; F582-M586 HydrophobicContact CG-CG 4.49Å; F582-M586 HydrophobicContact CZ-CG 3.97Å; F582-M586 HydrophobicContact CZ-SD 4.24Å; F582-M586 WeakPolarHBondContact O-CB 3.38Å; F582-M586 VanDerWaalsContact O-CG 3.29Å; F582-M586 WeakPolarHBondContact O-CG 3.33Å; F582-M586 PolarHBondContact O-N 3.07Å; K583-M586 PolarHBondContact O-N 3.16Å; M586-M588 VanDerWaalsContact C-N 3.26Å; M586-M588 PolarHBondContact O-N 2.76Å; M586-K589 WeakPolarHBondContact O-CB 3.32Å; M586-K589 PolarHBondContact O-N 2.88Å; M586-K589 HydrophobicContact SD-CD 4.06Å; M586-N590 PolarHBondContact O-N 3.21Å; M586-N590 PolarHBondContact O-ND2 2.79Å; M586-N590 PolarHBondContact O-OD1 3.32Å
587	N	66.8	Low	60.4	Low	76 Å²	76	64.4 Å²	64.4	41%	0.406	31%	0.313	S	S	.	.	H	α-helix	trans	-52.7	-41.9	177.4	-72.6	-14	0	0	0	112.8	K583 E584 K589 N590	K583-N587 VanDerWaalsContact O-CB 3.31Å; K583-N587 WeakPolarHBondContact O-CB 3.38Å; K583-N587 PolarHBondContact O-N 2.99Å; K583-N587 PolarHBondContact O-ND2 2.93Å; E584-N587 PolarHBondContact O-N 2.98Å; N587-K589 PolarHBondContact O-N 2.81Å; N587-N590 VanDerWaalsContact O-CB 3.28Å; N587-N590 WeakPolarHBondContact O-CB 3.21Å; N587-N590 PolarHBondContact O-N 2.81Å
588	M	61.5	Low	57.7	Low	41 Å²	41	65.8 Å²	65.8	20%	0.202	32%	0.321	C	S	.	.	H	α-helix	trans	-69	-26.7	176.8	-69.1	-170.2	-57	0	0	115.3	E584 I585 M586 N590 Q889 L892	E584-M588 PolarHBondContact O-N 3.34Å; I585-M588 PolarHBondContact O-N 2.65Å; M586-M588 VanDerWaalsContact C-N 3.26Å; M586-M588 PolarHBondContact O-N 2.76Å; M588-N590 PolarHBondContact O-N 3.19Å; M588-Q889 HydrophobicContact CE-CB 4.33Å; M588-Q889 HydrophobicContact CE-CG 4.29Å; M588-L892 HydrophobicContact CE-CB 4.15Å; M588-L892 HydrophobicContact CE-CD1 3.32Å; M588-L892 HydrophobicContact CE-CG 4.34Å; M588-L892 HydrophobicContact SD-CD1 3.72Å
589	K	62.7	Low	54.8	Low	108 Å²	108	68.5 Å²	68.5	47%	0.47	35%	0.352	S	S	.	.	H	α-helix	trans	-67	-31.3	175.5	-72.6	179.4	179	176.9	0	110.8	I585 M586 N587 R592	I585-K589 PolarHBondContact O-N 2.83Å; M586-K589 WeakPolarHBondContact O-CB 3.32Å; M586-K589 PolarHBondContact O-N 2.88Å; M586-K589 HydrophobicContact SD-CD 4.06Å; N587-K589 PolarHBondContact O-N 2.81Å; K589-R592 PolarHBondContact O-N 2.89Å
590	N	49.1	Very low	52.2	Low	32 Å²	32	77.3 Å²	77.3	17%	0.171	39%	0.393	C	S	.	.	H	α-helix	trans	-68.4	-39.4	-172.7	-51.6	-11.9	0	0	0	112.2	M586 N587 M588 R592 S593 N670	M586-N590 PolarHBondContact O-N 3.21Å; M586-N590 PolarHBondContact O-ND2 2.79Å; M586-N590 PolarHBondContact O-OD1 3.32Å; N587-N590 VanDerWaalsContact O-CB 3.28Å; N587-N590 WeakPolarHBondContact O-CB 3.21Å; N587-N590 PolarHBondContact O-N 2.81Å; M588-N590 PolarHBondContact O-N 3.19Å; N590-R592 PolarHBondContact O-N 2.79Å; N590-S593 PolarHBondContact O-N 2.87Å; N590-S593 PolarHBondContact O-OG 3.42Å; N590-N670 HydrophobicContact CB-CB 4.43Å; N590-N670 WeakPolarHBondContact CB-ND2 3.14Å; N590-N670 WeakPolarHBondContact ND2-CB 3.48Å; N590-N670 PolarHBondContact OD1-ND2 2.69Å; N590-N670 PolarHBondContact OD1-OD1 3.42Å
591	D	42.7	Very low	49.8	Very low	86 Å²	86	82.1 Å²	82.1	46%	0.46	42%	0.416	S	S	.	.	H	α-helix	trans	-66.9	-16.6	-178.4	-64.9	-29.5	0	0	0	112.8
592	R	38.1	Very low	47	Very low	78 Å²	78	91.5 Å²	91.5	29%	0.294	46%	0.46	S	S	.	.	H	α-helix	trans	-88.3	-34.7	179.5	-62.2	-166.6	-173.2	174.4	8.9	114.2	K589 N590 D594 Q595 F596 S885	K589-R592 PolarHBondContact O-N 2.89Å; N590-R592 PolarHBondContact O-N 2.79Å; R592-D594 PolarHBondContact O-N 2.73Å; R592-Q595 PolarHBondContact O-N 3.4Å; R592-Q595 VanDerWaalsContact O-N 3.07Å; R592-F596 PolarHBondContact O-N 3.09Å; R592-S885 PolarHBondContact NH2-O 3.1Å
593	S	34.1	Very low	44.6	Very low	60 Å²	60	94.7 Å²	94.7	42%	0.42	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-26.2	176.3	46.4	0	0	0	0	112.7	N590 Q595 S597	N590-S593 PolarHBondContact O-N 2.87Å; N590-S593 PolarHBondContact O-OG 3.42Å; S593-Q595 VanDerWaalsContact C-N 3.35Å; S593-S597 PolarHBondContact O-OG 2.94Å
594	D	31.7	Very low	42.5	Very low	14 Å²	14	95 Å²	95	8%	0.075	50%	0.5	C	S	.	.	H	α-helix	trans	-76.2	-19.6	174.9	-104.4	34.5	0	0	0	113	S15 S16 K18 R592 S597 R669	S15-D594 WeakPolarHBondContact CA-OD2 3.46Å; S15-D594 WeakPolarHBondContact CB-OD2 3.5Å; S16-D594 PolarHBondContact N-OD2 2.57Å; S16-D594 PolarHBondContact OG-OD2 3.36Å; K18-D594 WeakPolarHBondContact CE-O 3.38Å; K18-D594 PolarHBondContact NZ-O 3.18Å; R592-D594 PolarHBondContact O-N 2.73Å; D594-S597 PolarHBondContact O-OG 3.38Å; D594-R669 IonicContact OD1-CZ 3.34Å; D594-R669 IonicContact OD1-NE 3.26Å; D594-R669 IonicContact OD1-NH2 3.74Å; D594-R669 PolarHBondContact OD1-NH2 2.79Å; D594-R669 VanDerWaalsContact OD1-NH2 3.08Å
595	Q	32.2	Very low	40.2	Very low	140 Å²	140	101.5 Å²	101.5	65%	0.654	52%	0.522	S	S	*	.	H	α-helix	trans	-88	-43.1	-178.1	-71.6	-176.3	-5.6	0	0	113.4	K18 R592 S593 S597	K18-Q595 PolarHBondContact NZ-O 3.1Å; R592-Q595 PolarHBondContact O-N 3.4Å; R592-Q595 VanDerWaalsContact O-N 3.07Å; S593-Q595 VanDerWaalsContact C-N 3.35Å; Q595-S597 VanDerWaalsContact C-N 3.33Å; Q595-S597 PolarHBondContact O-N 3.11Å
596	F	32.3	Very low	38.2	Very low	175 Å²	175	109.6 Å²	109.6	77%	0.768	56%	0.56	S	S	*	*	H	α-helix	trans	-74.4	-13.7	-175.6	-83.8	-88.8	0	0	0	115.8	R592 Q598	R592-F596 PolarHBondContact O-N 3.09Å; F596-Q598 PolarHBondContact O-N 3.3Å
597	S	31.3	Very low	36.2	Very low	82 Å²	82	111.6 Å²	111.6	57%	0.573	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	34.2	-175	37.9	0	0	0	0	115.1	S593 D594 Q595	S593-S597 PolarHBondContact O-OG 2.94Å; D594-S597 PolarHBondContact O-OG 3.38Å; Q595-S597 VanDerWaalsContact C-N 3.33Å; Q595-S597 PolarHBondContact O-N 3.11Å
598	Q	26.6	Very low	34.5	Very low	104 Å²	104	115.6 Å²	115.6	49%	0.486	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-140.4	8.3	177.7	-104.4	-173.3	-32.9	0	0	114.9	K18 S19 D20 F596	K18-Q598 HydrophobicContact CD-CG 4.04Å; S19-Q598 PolarHBondContact O-NE2 3.42Å; D20-Q598 PolarHBondContact OD2-NE2 3.16Å; F596-Q598 PolarHBondContact O-N 3.3Å
599	G	27.7	Very low	33	Very low	66 Å²	66	119.3 Å²	119.3	68%	0.68	62%	0.617	S	S	*	*			trans	-111	-23	-164.9	0	0	0	0	0	118.4
600	E	29.5	Very low	31.2	Very low	195 Å²	195	123 Å²	123	91%	0.911	63%	0.629	S	S	*	*			trans	-110.9	112.3	-164.1	-69.1	-179.8	175.7	0	0	112.2
601	Q	28.8	Very low	30.3	Very low	193 Å²	193	129.4 Å²	129.4	90%	0.902	66%	0.658	S	S	*	*			trans	-79.4	157.1	173.8	-67.4	179.1	-54.6	0	0	111.4
602	E	21.9	Very low	29.5	Very low	199 Å²	199	131 Å²	131	93%	0.93	67%	0.673	S	S	*	*			trans	-66.5	128.1	-178.8	-55.2	163.3	133	0	0	112.7
603	S	28.7	Very low	29	Very low	104 Å²	104	136.5 Å²	136.5	73%	0.727	70%	0.702	S	S	*	*			trans	-160.3	114.2	154.7	63.7	0	0	0	0	114.9
604	S	29.6	Very low	28.6	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	72%	0.718	S	S	*	*			trans	55.9	106	140.3	63.6	0	0	0	0	123.3
605	Y	25.8	Very low	28.3	Very low	221 Å²	221	148.3 Å²	148.3	87%	0.867	75%	0.75	S	S	*	*				65.2	152.3	113.5	-72.5	-67.3	0	0	0	125.1
606	Q	31.4	Very low	28	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.813	76%	0.757	S	S	*	*			trans	76.3	103.2	160.7	-74.5	166.9	0.8	0	0	116.6
607	S	27.9	Very low	27.7	Very low	98 Å²	98	150.3 Å²	150.3	69%	0.685	76%	0.762	S	S	*	*				71.3	132.3	80.5	70.8	0	0	0	0	112.1
608	E	31.2	Very low	27.4	Very low	160 Å²	160	154.4 Å²	154.4	75%	0.748	77%	0.772	S	S	*	*				-168.5	156	56.5	-78.5	-169.9	171.5	0	0	114.1
609	N	28.9	Very low	27.3	Very low	119 Å²	119	158 Å²	158	64%	0.636	79%	0.789	S	S	*	*			trans	76.8	123.7	131.1	-74.1	-29.9	0	0	0	125.8
610	Y	26.4	Very low	27.2	Very low	186 Å²	186	165.9 Å²	165.9	73%	0.729	80%	0.798	S	S	*	*			trans	91.6	101.9	136.1	-87.1	-116	0	0	0	123.9
611	Q	28.7	Very low	26.9	Very low	166 Å²	166	164.2 Å²	164.2	78%	0.776	79%	0.79	S	S	*	*			trans	62.1	134.2	130	-61.9	-154.3	-2.5	0	0	123.3
612	P	27.4	Very low	26.7	Very low	121 Å²	121	166.3 Å²	166.3	79%	0.786	79%	0.792	S	S	*	*			trans	-105	138.4	173.4	38	-28.9	0	0	0	113.4
613	E	26.9	Very low	26.8	Very low	193 Å²	193	163.1 Å²	163.1	90%	0.902	78%	0.777	S	S	*	*			trans	-151.6	175.5	156.2	-127.7	169	-147	0	0	112.7
614	Q	25.2	Very low	26.7	Very low	162 Å²	162	163.9 Å²	163.9	76%	0.757	78%	0.779	S	S	*	*			trans	-90.8	165.5	-148.8	-57.1	167	6.9	0	0	115.3
615	Q	26.4	Very low	26.5	Very low	159 Å²	159	165.4 Å²	165.4	74%	0.743	78%	0.78	S	S	*	*			trans	102.6	122	152.7	-54.4	-177.3	24.5	0	0	119.4
616	Q	24.4	Very low	26.7	Very low	169 Å²	169	162 Å²	162	79%	0.79	77%	0.772	S	S	*	*			trans	56.8	100.7	143.7	-60.3	178.2	21.8	0	0	120.7
617	E	26.9	Very low	26.7	Very low	188 Å²	188	160 Å²	160	88%	0.879	77%	0.765	S	S	*	*			trans	-169.9	100.4	139.1	-107.8	165.7	-162.4	0	0	107.9
618	Q	25.9	Very low	26.9	Very low	169 Å²	169	159.7 Å²	159.7	79%	0.79	76%	0.755	S	S	*	*				51.9	113.7	94.6	-63.9	-164.9	27.7	0	0	115.5
619	Q	23.9	Very low	27	Very low	180 Å²	180	155.1 Å²	155.1	84%	0.841	74%	0.739	S	S	*	*			trans	51.5	90.7	150.5	-58	178.7	2.8	0	0	118.2
620	R	24.5	Very low	27	Very low	230 Å²	230	154.8 Å²	154.8	87%	0.868	74%	0.736	S	S	*	*			trans	-136.6	129.7	132.7	-86.6	-155.6	-71.8	-90.2	-0.7	111.8
621	Q	23.5	Very low	27.2	Very low	161 Å²	161	150.6 Å²	150.6	75%	0.752	73%	0.725	S	S	*	*			trans	-64.3	136.5	170.2	-61.9	136.4	-75.9	0	0	109.3	E623	Q621-E623 HydrophobicContact CB-CG 4.24Å; Q621-E623 PolarHBondContact O-N 2.93Å
622	Y	26.2	Very low	27.4	Very low	237 Å²	237	143.9 Å²	143.9	93%	0.929	70%	0.696	S	S	*	*			trans	-89	85.4	161.9	-88.8	-84.9	0	0	0	108.8
623	E	23.7	Very low	27.6	Very low	132 Å²	132	145.6 Å²	145.6	62%	0.617	69%	0.691	S	S	*	*			trans	-74.8	144.5	166.7	-66.6	-167.7	146	0	0	110.6	Q621 D625	Q621-E623 HydrophobicContact CB-CG 4.24Å; Q621-E623 PolarHBondContact O-N 2.93Å; E623-D625 PolarHBondContact O-N 3.33Å
624	P	25.2	Very low	27.9	Very low	119 Å²	119	141.8 Å²	141.8	77%	0.773	68%	0.676	S	S	*	*	S	Bend	trans	-84.4	69.3	-171.2	35	-37.3	0	0	0	112.9
625	D	27.1	Very low	28.3	Very low	129 Å²	129	139.9 Å²	139.9	69%	0.69	67%	0.669	S	S	*	*			trans	-141.2	33.7	-177	-97.9	-40.2	0	0	0	115.8	E623	E623-D625 PolarHBondContact O-N 3.33Å
626	H	28.9	Very low	28.8	Very low	151 Å²	151	140 Å²	140	70%	0.699	67%	0.667	S	S	*	*			trans	-124.8	56.6	-178.1	-75.6	-78.4	0	0	0	116.3
627	I	31.4	Very low	29.2	Very low	131 Å²	131	138 Å²	138	67%	0.672	66%	0.661	S	S	*	*	S	Bend	trans	-119	-26.1	156.3	-65.1	179.4	0	0	0	111.7	I631	I627-I631 HydrophobicContact CG2-CD1 4.43Å
628	L	32.1	Very low	29.4	Very low	92 Å²	92	135.9 Å²	135.9	48%	0.482	66%	0.656	S	S	.	*	H	α-helix	trans	-63.4	-31.4	-179.6	-110.2	64.1	0	0	0	116	T632 Y847	L628-T632 PolarHBondContact O-OG1 3.48Å; L628-Y847 HydrophobicContact CD2-CD2 4.12Å; L628-Y847 HydrophobicContact CD2-CE2 3.91Å; L628-Y847 HydrophobicContact CG-CE2 4.14Å
629	P	32.6	Very low	29.5	Very low	63 Å²	63	134.8 Å²	134.8	41%	0.409	66%	0.655	S	S	.	*	H	α-helix	trans	-80	-23.5	-178.6	-18.7	33.2	0	0	0	115.7	T632 K633	P629-T632 PolarHBondContact O-N 3.28Å; P629-K633 PolarHBondContact O-N 3.48Å
630	I	29.9	Very low	30	Very low	112 Å²	112	135 Å²	135	57%	0.574	65%	0.653	S	S	*	*	H	α-helix	trans	-75	-44.1	-174.3	-67.8	164.9	0	0	0	110.4	T632 K633 I634	I630-T632 PolarHBondContact O-N 2.98Å; I630-K633 PolarHBondContact O-N 2.82Å; I630-K633 VanDerWaalsContact O-N 3.12Å; I630-I634 HydrophobicContact CG2-CD1 4.35Å; I630-I634 PolarHBondContact O-N 2.76Å; I630-I634 VanDerWaalsContact O-N 3.15Å
631	I	31.4	Very low	30.3	Very low	98 Å²	98	129.8 Å²	129.8	50%	0.503	65%	0.647	S	S	.	*	H	α-helix	trans	-60.3	-34.4	174.1	-62.1	174.1	0	0	0	110.4	I627 I635	I627-I631 HydrophobicContact CG2-CD1 4.43Å; I631-I635 HydrophobicContact CG2-CD1 3.92Å; I631-I635 WeakPolarHBondContact O-CG1 3.19Å; I631-I635 PolarHBondContact O-N 3.49Å; I631-I635 VanDerWaalsContact O-N 3.09Å
632	T	32.6	Very low	30.5	Very low	26 Å²	26	127.7 Å²	127.7	16%	0.16	65%	0.645	C	S	.	*	H	α-helix	trans	-76.5	-25.6	177.2	-46.9	0	0	0	0	114.1	L628 P629 I630 K636 Y847	L628-T632 PolarHBondContact O-OG1 3.48Å; P629-T632 PolarHBondContact O-N 3.28Å; I630-T632 PolarHBondContact O-N 2.98Å; T632-K636 HydrophobicContact CG2-CD 4.42Å; T632-K636 WeakPolarHBondContact O-CB 3.32Å; T632-K636 WeakPolarHBondContact O-CG 3.47Å; T632-K636 PolarHBondContact O-N 3.45Å; T632-Y847 HydrophobicContact CG2-CE1 3.62Å; T632-Y847 WeakPolarHBondContact OG1-CE1 3.46Å; T632-Y847 PolarHBondContact OG1-OH 3.48Å
633	K	30.5	Very low	30.7	Very low	156 Å²	156	124.1 Å²	124.1	68%	0.678	64%	0.642	S	S	*	*	H	α-helix	trans	-70.4	-43.3	170.4	-114.1	-175.1	176.8	-173.8	0	110.8	P629 I630 I635 K636 I637	P629-K633 PolarHBondContact O-N 3.48Å; I630-K633 PolarHBondContact O-N 2.82Å; I630-K633 VanDerWaalsContact O-N 3.12Å; K633-I635 VanDerWaalsContact C-N 3.3Å; K633-I635 PolarHBondContact O-N 2.89Å; K633-K636 PolarHBondContact O-N 2.71Å; K633-K636 VanDerWaalsContact O-N 3.1Å; K633-I637 WeakPolarHBondContact O-CG1 3.48Å; K633-I637 PolarHBondContact O-N 3.01Å
634	I	33.1	Very low	31	Very low	114 Å²	114	121 Å²	121	59%	0.585	65%	0.646	S	S	*	*	H	α-helix	trans	-62.1	-39.2	176.7	-63.8	168.6	0	0	0	110.8	I630 K636	I630-I634 HydrophobicContact CG2-CD1 4.35Å; I630-I634 PolarHBondContact O-N 2.76Å; I630-I634 VanDerWaalsContact O-N 3.15Å; I634-K636 VanDerWaalsContact C-N 3.32Å; I634-K636 PolarHBondContact O-N 3.09Å
635	I	35.5	Very low	31.3	Very low	121 Å²	121	121.6 Å²	121.6	62%	0.621	65%	0.647	S	S	*	*	H	α-helix	trans	-76.4	-12.5	176.9	-65.9	169.1	0	0	0	113.4	I631 K633	I631-I635 HydrophobicContact CG2-CD1 3.92Å; I631-I635 WeakPolarHBondContact O-CG1 3.19Å; I631-I635 PolarHBondContact O-N 3.49Å; I631-I635 VanDerWaalsContact O-N 3.09Å; K633-I635 VanDerWaalsContact C-N 3.3Å; K633-I635 PolarHBondContact O-N 2.89Å
636	K	34.9	Very low	31.3	Very low	162 Å²	162	121.5 Å²	121.5	70%	0.704	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	1.8	178	-81.9	-173.3	173	-178	0	115.3	T632 K633 I634	T632-K636 HydrophobicContact CG2-CD 4.42Å; T632-K636 WeakPolarHBondContact O-CB 3.32Å; T632-K636 WeakPolarHBondContact O-CG 3.47Å; T632-K636 PolarHBondContact O-N 3.45Å; K633-K636 PolarHBondContact O-N 2.71Å; K633-K636 VanDerWaalsContact O-N 3.1Å; I634-K636 VanDerWaalsContact C-N 3.32Å; I634-K636 PolarHBondContact O-N 3.09Å
637	I	34.2	Very low	31.5	Very low	128 Å²	128	120.8 Å²	120.8	66%	0.656	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-21.6	178.9	-72.7	166.2	0	0	0	112	K633 D639	K633-I637 WeakPolarHBondContact O-CG1 3.48Å; K633-I637 PolarHBondContact O-N 3.01Å; I637-D639 VanDerWaalsContact C-N 3.29Å; I637-D639 PolarHBondContact O-N 3.04Å
638	N	31.8	Very low	31.3	Very low	143 Å²	143	122.3 Å²	122.3	77%	0.765	67%	0.667	S	S	*	*	S	Bend	trans	-82.8	9.9	-178	-74.7	7.2	0	0	0	115.6
639	D	27.6	Very low	31.3	Very low	146 Å²	146	121.6 Å²	121.6	78%	0.781	68%	0.682	S	S	*	*	S	Bend	trans	-136.5	39.9	-169.8	-105.5	-26.9	0	0	0	114.1	I637	I637-D639 VanDerWaalsContact C-N 3.29Å; I637-D639 PolarHBondContact O-N 3.04Å
640	K	33.7	Very low	31.2	Very low	185 Å²	185	125.5 Å²	125.5	80%	0.804	70%	0.699	S	S	*	*			trans	-144.3	107.4	164.9	-71.8	-160.3	176.8	-171.8	0	115.2
641	T	31.3	Very low	31.3	Very low	119 Å²	119	126.5 Å²	126.5	73%	0.73	71%	0.706	S	S	*	*			trans	56.7	97.1	137.5	59.9	0	0	0	0	119.8
642	T	28	Very low	31.1	Very low	117 Å²	117	128.3 Å²	128.3	72%	0.718	72%	0.717	S	S	*	*				33.6	131.8	116.1	55.9	0	0	0	0	121.2
643	D	28.6	Very low	30.9	Very low	162 Å²	162	133.8 Å²	133.8	87%	0.866	74%	0.74	S	S	*	*			trans	92.2	128.8	150.6	-52.6	-25.5	0	0	0	120.5
644	G	30.6	Very low	30.8	Very low	67 Å²	67	133.8 Å²	133.8	69%	0.691	74%	0.74	S	S	*	*			trans	131.4	58.5	144.7	0	0	0	0	0	122.9
645	T	32.1	Very low	30.6	Very low	131 Å²	131	136.2 Å²	136.2	80%	0.804	75%	0.747	S	S	*	*			trans	45.3	108.6	137.9	53.1	0	0	0	0	124
646	T	27.5	Very low	30.2	Very low	128 Å²	128	138.4 Å²	138.4	79%	0.785	75%	0.754	S	S	*	*				45.4	134.3	122.5	62.2	0	0	0	0	124.4
647	V	32.7	Very low	29.8	Very low	135 Å²	135	135.1 Å²	135.1	82%	0.818	75%	0.752	S	S	*	*				170.9	154	107.3	159.4	0	0	0	0	112.3
648	N	26.5	Very low	29.4	Very low	163 Å²	163	135.8 Å²	135.8	87%	0.872	76%	0.756	S	S	*	*			trans	-91.1	172.3	-167.5	-47	-42.3	0	0	0	116.1
649	G	32.2	Very low	29.1	Very low	77 Å²	77	136.2 Å²	136.2	79%	0.794	76%	0.758	S	S	*	*			trans	179.2	100.2	165.5	0	0	0	0	0	118
650	D	29.8	Very low	29.1	Very low	145 Å²	145	136.8 Å²	136.8	78%	0.775	76%	0.761	S	S	*	*			trans	-55.3	161.5	-175.7	-51.8	-47.3	0	0	0	121.3
651	N	32.5	Very low	28.8	Very low	133 Å²	133	137.5 Å²	137.5	71%	0.711	77%	0.767	S	S	*	*			trans	127.7	99.7	133.4	-72.5	-59.4	0	0	0	121
652	N	27.4	Very low	28.5	Very low	137 Å²	137	137 Å²	137	73%	0.733	77%	0.769	S	S	*	*				68.2	124.1	114.7	-77.9	-35.9	0	0	0	125.5
653	E	28.9	Very low	28.5	Very low	141 Å²	141	137.1 Å²	137.1	66%	0.659	77%	0.772	S	S	*	*			trans	93.7	110.5	135	-73.3	-161.9	158.8	0	0	124.5
654	K	28.8	Very low	28.3	Very low	155 Å²	155	134.5 Å²	134.5	67%	0.674	77%	0.766	S	S	*	*				97.9	128.2	123.2	-79.1	172.1	-174.3	149.3	0	122.6
655	K	29.1	Very low	28	Very low	166 Å²	166	138.4 Å²	138.4	72%	0.722	77%	0.769	S	S	*	*			trans	84.9	112.7	156.7	-66.8	-176.1	172.2	-156.5	0	117.9
656	E	25	Very low	27.7	Very low	167 Å²	167	137 Å²	137	78%	0.78	77%	0.765	S	S	*	*				71.8	128.7	96.6	-67.4	166.6	159.4	0	0	112.2
657	S	27.4	Very low	27.5	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	77%	0.768	S	S	*	*			cis	-157.6	171.9	-1.8	57.6	0	0	0	0	110.7
658	D	26.4	Very low	27.1	Very low	141 Å²	141	136 Å²	136	75%	0.754	75%	0.753	S	S	*	*			trans	75.6	143.8	161.7	-53	-56.7	0	0	0	121
659	L	25.9	Very low	27.1	Very low	153 Å²	153	134.5 Å²	134.5	80%	0.801	74%	0.735	S	S	*	*			trans	72.4	93.4	169.2	-62.4	156.5	0	0	0	118.7
660	N	26.5	Very low	26.7	Very low	157 Å²	157	134.1 Å²	134.1	84%	0.84	72%	0.715	S	S	*	*				160.5	122.3	113.5	-81.3	-42.1	0	0	0	112.2
661	Q	28.5	Very low	26.6	Very low	200 Å²	200	131.5 Å²	131.5	94%	0.935	69%	0.694	S	S	*	*			trans	-128	104.8	162.3	-81	-175	-13.8	0	0	109.5
662	S	24.6	Very low	26.2	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-77.5	132.2	167.1	49.4	0	0	0	0	109.9	S664	S662-S664 PolarHBondContact O-N 3.16Å
663	P	27.3	Very low	26.2	Very low	119 Å²	119	123.8 Å²	123.8	77%	0.773	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-68.4	125.5	174.1	28.7	-32.8	0	0	0	109.8	I665	P663-I665 PolarHBondContact O-N 3.42Å
664	S	25.5	Very low	25.9	Very low	106 Å²	106	125.7 Å²	125.7	74%	0.741	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-56.7	122.3	174.3	49.3	0	0	0	0	111	S662 S666	S662-S664 PolarHBondContact O-N 3.16Å; S664-S666 VanDerWaalsContact C-N 3.28Å; S664-S666 PolarHBondContact O-N 3.06Å
665	I	22.9	Very low	25.8	Very low	149 Å²	149	119.6 Å²	119.6	76%	0.764	63%	0.627	S	S	*	*			trans	-74.1	81	-179	-57.3	171.1	0	0	0	109.4	P663 F667	P663-I665 PolarHBondContact O-N 3.42Å; I665-F667 HydrophobicContact CG2-CD2 3.97Å; I665-F667 HydrophobicContact CG2-CE2 3.8Å; I665-F667 PolarHBondContact O-N 3.01Å
666	S	26.3	Very low	25.6	Very low	101 Å²	101	115.4 Å²	115.4	71%	0.706	61%	0.61	S	S	*	*			trans	-77	106.8	169.4	63.2	0	0	0	0	109.5	S664 G668	S664-S666 VanDerWaalsContact C-N 3.28Å; S664-S666 PolarHBondContact O-N 3.06Å; S666-G668 PolarHBondContact O-N 3.05Å
667	F	22.8	Very low	25.7	Very low	195 Å²	195	109.7 Å²	109.7	86%	0.855	59%	0.585	S	S	*	*			trans	-64.4	81.6	170.9	-89.2	-96.2	0	0	0	110.7	I665 R669	I665-F667 HydrophobicContact CG2-CD2 3.97Å; I665-F667 HydrophobicContact CG2-CE2 3.8Å; I665-F667 PolarHBondContact O-N 3.01Å; F667-R669 PolarHBondContact O-N 3.46Å
668	G	25	Very low	25.5	Very low	48 Å²	48	106.9 Å²	106.9	50%	0.495	56%	0.564	S	S	.	*			trans	-94.4	84.2	-164.8	0	0	0	0	0	115.5	S666	S666-G668 PolarHBondContact O-N 3.05Å
669	R	25.5	Very low	25.6	Very low	132 Å²	132	102.5 Å²	102.5	50%	0.498	54%	0.542	S	S	.	.			trans	52.7	84.7	146.6	-63.2	175.6	168.8	147.6	-3.6	118.1	D594 F667 Y671	D594-R669 IonicContact OD1-CZ 3.34Å; D594-R669 IonicContact OD1-NE 3.26Å; D594-R669 IonicContact OD1-NH2 3.74Å; D594-R669 PolarHBondContact OD1-NH2 2.79Å; D594-R669 VanDerWaalsContact OD1-NH2 3.08Å; F667-R669 PolarHBondContact O-N 3.46Å; R669-Y671 WeakPolarHBondContact O-CE2 3.11Å; R669-Y671 PolarHBondContact O-OH 3.41Å
670	N	25.5	Very low	25.8	Very low	69 Å²	69	95.7 Å²	95.7	37%	0.369	51%	0.507	S	S	.	.				50.6	89.5	117	-47.6	-33.6	0	0	0	119.5	N590	N590-N670 HydrophobicContact CB-CB 4.43Å; N590-N670 WeakPolarHBondContact CB-ND2 3.14Å; N590-N670 WeakPolarHBondContact ND2-CB 3.48Å; N590-N670 PolarHBondContact OD1-ND2 2.69Å; N590-N670 PolarHBondContact OD1-OD1 3.42Å
671	Y	26.1	Very low	25.8	Very low	89 Å²	89	92.1 Å²	92.1	35%	0.349	49%	0.487	S	S	.	.			trans	-122.9	115.1	161.5	-55.3	-61.1	0	0	0	110.8	H11 R669 Y673	H11-Y671 HydrophobicContact CB-CE1 4.36Å; H11-Y671 AromaticContact CD2-CE1 3.92Å; H11-Y671 AromaticContact CE1-CD1 3.57Å; H11-Y671 AromaticContact CE1-CE1 3.12Å; H11-Y671 WeakPolarHBondContact CE1-CE1 3.41Å; H11-Y671 AromaticContact CE1-CE2 3.66Å; H11-Y671 AromaticContact CE1-CZ 3.18Å; H11-Y671 AromaticContact CG-CE1 3.55Å; H11-Y671 AromaticContact ND1-CD1 3.93Å; H11-Y671 AromaticContact ND1-CE1 3.03Å; H11-Y671 WeakPolarHBondContact ND1-CE1 3.34Å; H11-Y671 AromaticContact ND1-CE2 3.95Å; H11-Y671 AromaticContact ND1-CZ 3.05Å; H11-Y671 PolarHBondContact ND1-OH 3.2Å; H11-Y671 AromaticContact NE2-CD1 3.8Å; H11-Y671 AromaticContact NE2-CE1 3.69Å; R669-Y671 WeakPolarHBondContact O-CE2 3.11Å; R669-Y671 PolarHBondContact O-OH 3.41Å; Y671-Y673 PolarHBondContact O-N 2.69Å; Y671-Y673 VanDerWaalsContact O-N 3.11Å
672	I	24.6	Very low	26.1	Very low	83 Å²	83	84.8 Å²	84.8	43%	0.426	46%	0.458	S	S	.	.			trans	-61.3	111.3	150.4	-65.2	170.3	0	0	0	104.6	K583 R674	K583-I672 HydrophobicContact CB-CD1 3.88Å; K583-I672 HydrophobicContact CD-CD1 4.37Å; K583-I672 HydrophobicContact CD-CG2 4.27Å; K583-I672 HydrophobicContact CG-CD1 3.79Å; K583-I672 HydrophobicContact CG-CG1 4.11Å; K583-I672 HydrophobicContact CG-CG2 4.24Å; I672-R674 PolarHBondContact O-N 3.49Å
673	Y	26.7	Very low	26.3	Very low	26 Å²	26	80.2 Å²	80.2	10%	0.102	43%	0.426	C	S	.	.			trans	-69.1	73.5	-176.6	-60.8	-75.8	0	0	0	111.9	Y671 V675 V990 P991 M994	Y671-Y673 PolarHBondContact O-N 2.69Å; Y671-Y673 VanDerWaalsContact O-N 3.11Å; Y673-V675 PolarHBondContact O-N 3.34Å; Y673-V990 HydrophobicContact CD1-CG1 3.99Å; Y673-V990 HydrophobicContact CD2-CG1 4.22Å; Y673-V990 HydrophobicContact CE1-CG1 3.53Å; Y673-V990 HydrophobicContact CE2-CG1 3.8Å; Y673-V990 HydrophobicContact CG-CG1 4.3Å; Y673-V990 VanDerWaalsContact CZ-CG1 3.41Å; Y673-P991 HydrophobicContact CD1-CG 4.28Å; Y673-P991 HydrophobicContact CE1-CG 3.81Å; Y673-P991 PolarHBondContact OH-O 3.04Å; Y673-M994 WeakPolarHBondContact OH-CB 3.08Å
674	R	24.1	Very low	26.5	Very low	181 Å²	181	76 Å²	76	68%	0.683	40%	0.398	S	S	*	.			trans	-69.4	83	142	-85.7	-162.3	-179.9	-172.9	10.8	107.5	I672 E676	I672-R674 PolarHBondContact O-N 3.49Å; R674-E676 HydrophobicContact CB-CG 4.15Å; R674-E676 IonicContact CZ-OE1 3.18Å; R674-E676 IonicContact NH1-OE1 2.72Å; R674-E676 PolarHBondContact NH1-OE1 3.07Å; R674-E676 PolarHBondContact O-N 3Å
675	V	27.1	Very low	27	Very low	26 Å²	26	72.7 Å²	72.7	16%	0.158	38%	0.375	C	S	.	.			trans	-63.6	84.6	140.3	-171.2	0	0	0	0	105.1	Y673 L677 V679 Y986	Y673-V675 PolarHBondContact O-N 3.34Å; V675-L677 PolarHBondContact O-N 3.46Å; V675-V679 HydrophobicContact CG1-CG2 4.31Å; V675-Y986 HydrophobicContact CB-CE2 4.19Å; V675-Y986 WeakPolarHBondContact CB-OH 3.4Å; V675-Y986 HydrophobicContact CG2-CE1 4.21Å
676	E	25	Very low	27.8	Very low	78 Å²	78	67.2 Å²	67.2	36%	0.364	35%	0.35	S	S	.	.			trans	-58.9	135.1	158.8	-65.8	-152.3	162.3	0	0	106	R674 P678	R674-E676 HydrophobicContact CB-CG 4.15Å; R674-E676 IonicContact CZ-OE1 3.18Å; R674-E676 IonicContact NH1-OE1 2.72Å; R674-E676 PolarHBondContact NH1-OE1 3.07Å; R674-E676 PolarHBondContact O-N 3Å; E676-P678 VanDerWaalsContact C-N 3.33Å; E676-P678 WeakPolarHBondContact O-CD 3.47Å; E676-P678 VanDerWaalsContact O-N 3.11Å
677	L	26	Very low	28.2	Very low	48 Å²	48	66.5 Å²	66.5	25%	0.251	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-70	1.5	-167.1	-133.2	94.3	0	0	0	119.1	V675 V679 L680 I975 L978	V675-L677 PolarHBondContact O-N 3.46Å; L677-V679 PolarHBondContact O-N 3.03Å; L677-V679 VanDerWaalsContact O-N 3.08Å; L677-L680 HydrophobicContact CD2-CD1 3.98Å; L677-L680 HydrophobicContact CG-CD1 4.48Å; L677-I975 HydrophobicContact CD2-CG2 4.4Å; L677-L978 HydrophobicContact CD1-CD2 3.63Å; L677-L978 HydrophobicContact CD1-CG 4.41Å; L677-L978 HydrophobicContact CD2-CD1 3.96Å; L677-L978 HydrophobicContact CD2-CD2 3.38Å; L677-L978 HydrophobicContact CD2-CG 3.36Å; L677-L978 HydrophobicContact CG-CD2 4.1Å; L677-L978 HydrophobicContact CG-CG 4.48Å
678	P	24	Very low	28.6	Very low	34 Å²	34	60 Å²	60	22%	0.221	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-61.6	-8.4	174.9	-29	38.3	0	0	0	117.3	R7 E676 L680 L681	R7-P678 VanDerWaalsContact CZ-CG 3.48Å; E676-P678 VanDerWaalsContact C-N 3.33Å; E676-P678 WeakPolarHBondContact O-CD 3.47Å; E676-P678 VanDerWaalsContact O-N 3.11Å; P678-L680 PolarHBondContact O-N 2.93Å; P678-L680 VanDerWaalsContact O-N 3.13Å; P678-L681 WeakPolarHBondContact O-CB 3.33Å; P678-L681 PolarHBondContact O-N 2.84Å
679	V	28.2	Very low	29.1	Very low	48 Å²	48	60.1 Å²	60.1	29%	0.291	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-60.9	-21.9	-178.9	-177.3	0	0	0	0	112.6	V675 L677 L681 L989	V675-V679 HydrophobicContact CG1-CG2 4.31Å; L677-V679 PolarHBondContact O-N 3.03Å; L677-V679 VanDerWaalsContact O-N 3.08Å; V679-L681 PolarHBondContact O-N 3.21Å; V679-L989 HydrophobicContact CG1-CD2 4.39Å
680	L	28.8	Very low	29.7	Very low	11 Å²	11	56.2 Å²	56.2	6%	0.058	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-69.4	-14.5	175.1	-68.7	167.6	0	0	0	114.1	L677 P678 P976 L981 R1054 L1059	L677-L680 HydrophobicContact CD2-CD1 3.98Å; L677-L680 HydrophobicContact CG-CD1 4.48Å; P678-L680 PolarHBondContact O-N 2.93Å; P678-L680 VanDerWaalsContact O-N 3.13Å; L680-P976 HydrophobicContact CB-CB 3.98Å; L680-P976 HydrophobicContact CB-CG 3.8Å; L680-P976 HydrophobicContact CD1-CB 4.1Å; L680-L981 HydrophobicContact CD1-CD1 4.27Å; L680-R1054 PolarHBondContact O-NH2 2.91Å; L680-L1059 HydrophobicContact CD2-CD2 4.04Å
681	L	28.4	Very low	30.3	Very low	81 Å²	81	57.8 Å²	57.8	42%	0.424	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-97.7	-5.3	-169.9	-72	166.4	0	0	0	116.2	P678 V679 P976	P678-L681 WeakPolarHBondContact O-CB 3.33Å; P678-L681 PolarHBondContact O-N 2.84Å; V679-L681 PolarHBondContact O-N 3.21Å; L681-P976 HydrophobicContact CD2-CG 3.58Å; L681-P976 HydrophobicContact CG-CG 3.8Å
682	S	33	Very low	30.7	Very low	47 Å²	47	57.5 Å²	57.5	33%	0.329	30%	0.303	S	S	.	.	S	Bend	trans	-81.8	-20.9	-171.6	54	0	0	0	0	114.8
683	T	29	Very low	31.4	Very low	13 Å²	13	58 Å²	58	8%	0.08	30%	0.3	C	S	.	.	S	Bend	trans	-126.1	73.3	-167.9	61.3	0	0	0	0	113.6	F1020 T1100	T683-F1020 WeakPolarHBondContact O-CZ 3.07Å; T683-T1100 HydrophobicContact CG2-CG2 3.71Å
684	T	31.5	Very low	32	Very low	30 Å²	30	63.9 Å²	63.9	18%	0.184	32%	0.322	C	S	.	.	S	Bend		177.3	162.1	129	28	0	0	0	0	119.5	S686 S1019 F1020	T684-S686 VanDerWaalsContact C-N 3.26Å; T684-S686 PolarHBondContact O-N 3.29Å; T684-S1019 PolarHBondContact OG1-O 3.08Å; T684-F1020 HydrophobicContact CG2-CD1 3.23Å; T684-F1020 HydrophobicContact CG2-CE1 3.32Å; T684-F1020 HydrophobicContact CG2-CG 3.96Å; T684-F1020 HydrophobicContact CG2-CZ 4.13Å; T684-F1020 WeakPolarHBondContact OG1-CA 3.46Å; T684-F1020 WeakPolarHBondContact OG1-CD1 3.49Å; T684-F1020 WeakPolarHBondContact OG1-CD2 3.49Å; T684-F1020 WeakPolarHBondContact OG1-CG 3.31Å
685	S	37.6	Very low	32.7	Very low	37 Å²	37	57.8 Å²	57.8	26%	0.259	31%	0.311	S	S	.	.			trans	25.4	-11.8	148.4	73.4	0	0	0	0	124.7	F1020	S685-F1020 WeakPolarHBondContact OG-CA 3.5Å; S685-F1020 PolarHBondContact OG-O 3.26Å
686	S	38.7	Very low	33.2	Very low	35 Å²	35	58.8 Å²	58.8	25%	0.245	32%	0.321	C	S	.	.			trans	-58.6	143.7	-175.4	64	0	0	0	0	112.8	T684 S688 M689 V690	T684-S686 VanDerWaalsContact C-N 3.26Å; T684-S686 PolarHBondContact O-N 3.29Å; S686-S688 PolarHBondContact O-N 3.46Å; S686-M689 WeakPolarHBondContact O-CA 3.48Å; S686-M689 VanDerWaalsContact O-CB 3.3Å; S686-M689 WeakPolarHBondContact O-CB 3.45Å; S686-M689 PolarHBondContact O-N 3.32Å; S686-M689 PolarHBondContact OG-N 2.68Å; S686-V690 PolarHBondContact O-N 2.85Å
687	E	34.4	Very low	33.9	Very low	86 Å²	86	59.1 Å²	59.1	40%	0.402	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-24.3	173.4	-171.1	162.1	-160.3	0	0	111.3	V690 M691	E687-V690 CarbonylContact O-C 3.54Å; E687-V690 PolarHBondContact O-N 3.12Å; E687-M691 HydrophobicContact CG-CG 4.49Å; E687-M691 VanDerWaalsContact O-CB 3.32Å; E687-M691 WeakPolarHBondContact O-CB 3.43Å; E687-M691 VanDerWaalsContact O-CG 3.27Å; E687-M691 WeakPolarHBondContact O-CG 3.39Å; E687-M691 PolarHBondContact O-N 3.25Å
688	S	32.7	Very low	34.6	Very low	59 Å²	59	61.9 Å²	61.9	41%	0.413	33%	0.334	S	S	.	.	H	α-helix	trans	-54.3	-47.2	165.2	-32	0	0	0	0	112	S686 M691 L692	S686-S688 PolarHBondContact O-N 3.46Å; S688-M691 PolarHBondContact O-N 3.42Å; S688-L692 WeakPolarHBondContact O-CB 3.46Å; S688-L692 VanDerWaalsContact O-CG 3.25Å; S688-L692 WeakPolarHBondContact O-CG 3.41Å; S688-L692 PolarHBondContact O-N 3.32Å
689	M	35	Very low	35.5	Very low	50 Å²	50	61.8 Å²	61.8	25%	0.246	33%	0.334	C	S	.	.	H	α-helix	trans	-69.1	-35.4	174.6	-108.3	-78.1	-139.3	0	0	112.3	S686 L692 R693	S686-M689 WeakPolarHBondContact O-CA 3.48Å; S686-M689 VanDerWaalsContact O-CB 3.3Å; S686-M689 WeakPolarHBondContact O-CB 3.45Å; S686-M689 PolarHBondContact O-N 3.32Å; S686-M689 PolarHBondContact OG-N 2.68Å; M689-L692 PolarHBondContact O-N 2.94Å; M689-R693 VanDerWaalsContact O-CB 3.28Å; M689-R693 WeakPolarHBondContact O-CB 3.13Å; M689-R693 WeakPolarHBondContact O-CG 3.37Å; M689-R693 PolarHBondContact O-N 3.41Å; M689-R693 HydrophobicContact SD-CG 4.49Å
690	V	38.2	Very low	35.9	Very low	49 Å²	49	63 Å²	63	30%	0.297	34%	0.337	S	S	.	.	H	α-helix	trans	-68.5	-37.9	173.2	178.3	0	0	0	0	111.3	S686 E687 R694	S686-V690 PolarHBondContact O-N 2.85Å; E687-V690 CarbonylContact O-C 3.54Å; E687-V690 PolarHBondContact O-N 3.12Å; V690-R694 HydrophobicContact CG1-CG 4.48Å; V690-R694 VanDerWaalsContact O-CB 3.25Å; V690-R694 WeakPolarHBondContact O-CB 3.19Å; V690-R694 VanDerWaalsContact O-CG 3.26Å; V690-R694 WeakPolarHBondContact O-CG 3.34Å; V690-R694 PolarHBondContact O-N 3.05Å
691	M	37.6	Very low	36.6	Very low	103 Å²	103	65.7 Å²	65.7	51%	0.507	35%	0.35	S	S	.	.	H	α-helix	trans	-68.4	-40.8	172.9	-75.1	-69.3	-174.2	0	0	111.4	E687 S688 R694 A695	E687-M691 HydrophobicContact CG-CG 4.49Å; E687-M691 VanDerWaalsContact O-CB 3.32Å; E687-M691 WeakPolarHBondContact O-CB 3.43Å; E687-M691 VanDerWaalsContact O-CG 3.27Å; E687-M691 WeakPolarHBondContact O-CG 3.39Å; E687-M691 PolarHBondContact O-N 3.25Å; S688-M691 PolarHBondContact O-N 3.42Å; M691-R694 PolarHBondContact O-N 2.92Å; M691-A695 WeakPolarHBondContact O-CB 3.49Å; M691-A695 PolarHBondContact O-N 3.27Å
692	L	34.7	Very low	37.2	Very low	83 Å²	83	70.2 Å²	70.2	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-64.6	-42.9	173.1	-77.4	163.7	0	0	0	111.4	Y4 S688 M689 A695 A696	Y4-L692 HydrophobicContact CE2-CD2 4.22Å; S688-L692 WeakPolarHBondContact O-CB 3.46Å; S688-L692 VanDerWaalsContact O-CG 3.25Å; S688-L692 WeakPolarHBondContact O-CG 3.41Å; S688-L692 PolarHBondContact O-N 3.32Å; M689-L692 PolarHBondContact O-N 2.94Å; L692-A695 PolarHBondContact O-N 3.04Å; L692-A696 WeakPolarHBondContact O-CB 3.44Å; L692-A696 PolarHBondContact O-N 3.13Å
693	R	38.6	Very low	37.8	Very low	94 Å²	94	70.1 Å²	70.1	36%	0.355	35%	0.354	S	S	.	.	H	α-helix	trans	-67	-40.9	174.3	-71.3	169.5	-174.7	-150.2	-0.8	112	M689 A696 R697 L1136	M689-R693 VanDerWaalsContact O-CB 3.28Å; M689-R693 WeakPolarHBondContact O-CB 3.13Å; M689-R693 WeakPolarHBondContact O-CG 3.37Å; M689-R693 PolarHBondContact O-N 3.41Å; M689-R693 HydrophobicContact SD-CG 4.49Å; R693-A696 PolarHBondContact O-N 3Å; R693-R697 VanDerWaalsContact O-CB 3.26Å; R693-R697 WeakPolarHBondContact O-CB 3.49Å; R693-R697 PolarHBondContact O-N 3.49Å; R693-L1136 PolarHBondContact NH1-O 3.39Å
694	R	40.6	Very low	38.6	Very low	148 Å²	148	72.6 Å²	72.6	56%	0.558	37%	0.365	S	S	*	.	H	α-helix	trans	-64.4	-40	172.2	-79.8	176.2	174.4	172.6	0.4	111.7	V690 M691 R697 L698	V690-R694 HydrophobicContact CG1-CG 4.48Å; V690-R694 VanDerWaalsContact O-CB 3.25Å; V690-R694 WeakPolarHBondContact O-CB 3.19Å; V690-R694 VanDerWaalsContact O-CG 3.26Å; V690-R694 WeakPolarHBondContact O-CG 3.34Å; V690-R694 PolarHBondContact O-N 3.05Å; M691-R694 PolarHBondContact O-N 2.92Å; R694-R697 PolarHBondContact O-N 3.35Å; R694-L698 VanDerWaalsContact O-CB 3.29Å; R694-L698 WeakPolarHBondContact O-CB 3.48Å; R694-L698 VanDerWaalsContact O-CG 3.27Å; R694-L698 WeakPolarHBondContact O-CG 3.35Å; R694-L698 PolarHBondContact O-N 2.87Å
695	A	37.7	Very low	39.4	Very low	54 Å²	54	76.8 Å²	76.8	45%	0.446	38%	0.383	S	S	.	.	H	α-helix	trans	-69.4	-38.5	176.1	0	0	0	0	0	111.6	M691 L692 S699	M691-A695 WeakPolarHBondContact O-CB 3.49Å; M691-A695 PolarHBondContact O-N 3.27Å; L692-A695 PolarHBondContact O-N 3.04Å; A695-S699 WeakPolarHBondContact O-CA 3.38Å; A695-S699 WeakPolarHBondContact O-CB 3.43Å; A695-S699 PolarHBondContact O-N 3.25Å
696	A	37	Very low	40.1	Very low	46 Å²	46	76.9 Å²	76.9	38%	0.38	38%	0.38	S	S	.	.	H	α-helix	trans	-64.4	-41.7	172.1	0	0	0	0	0	111.2	L692 R693 S699 Q700	L692-A696 WeakPolarHBondContact O-CB 3.44Å; L692-A696 PolarHBondContact O-N 3.13Å; R693-A696 PolarHBondContact O-N 3Å; A696-S699 CarbonylContact O-C 3.53Å; A696-S699 WeakPolarHBondContact O-CA 3.48Å; A696-S699 VanDerWaalsContact O-CB 3.31Å; A696-S699 WeakPolarHBondContact O-CB 3.3Å; A696-S699 PolarHBondContact O-N 3.32Å; A696-Q700 PolarHBondContact O-N 2.84Å
697	R	39.4	Very low	40.6	Very low	85 Å²	85	77.5 Å²	77.5	32%	0.321	38%	0.381	S	S	.	.	H	α-helix	trans	-70.9	-38.2	176.4	-154.1	168.2	-173.4	-161.1	-4.9	112.1	R693 R694 S699 Q700 I701 D1188	R693-R697 VanDerWaalsContact O-CB 3.26Å; R693-R697 WeakPolarHBondContact O-CB 3.49Å; R693-R697 PolarHBondContact O-N 3.49Å; R694-R697 PolarHBondContact O-N 3.35Å; R697-S699 VanDerWaalsContact C-N 3.31Å; R697-Q700 PolarHBondContact O-N 3.35Å; R697-I701 WeakPolarHBondContact O-CB 3.48Å; R697-I701 WeakPolarHBondContact O-CD1 3.47Å; R697-I701 VanDerWaalsContact O-CG1 3.22Å; R697-I701 WeakPolarHBondContact O-CG1 3.4Å; R697-I701 PolarHBondContact O-N 2.93Å; R697-D1188 IonicContact CZ-OD2 3.19Å; R697-D1188 VanDerWaalsContact CZ-OD2 3.27Å; R697-D1188 IonicContact NH1-OD1 3.68Å; R697-D1188 IonicContact NH1-OD2 2.64Å; R697-D1188 PolarHBondContact NH1-OD2 3.45Å; R697-D1188 IonicContact NH2-OD1 3.6Å; R697-D1188 IonicContact NH2-OD2 3.74Å; R697-D1188 PolarHBondContact NH2-OD2 2.88Å
698	L	42.5	Very low	41.5	Very low	106 Å²	106	79.2 Å²	79.2	56%	0.555	39%	0.387	S	S	*	.	H	α-helix	trans	-66.1	-32.5	168.7	-76.7	167.3	0	0	0	112.1	R694 R702	R694-L698 VanDerWaalsContact O-CB 3.29Å; R694-L698 WeakPolarHBondContact O-CB 3.48Å; R694-L698 VanDerWaalsContact O-CG 3.27Å; R694-L698 WeakPolarHBondContact O-CG 3.35Å; R694-L698 PolarHBondContact O-N 2.87Å; L698-R702 VanDerWaalsContact O-CB 3.29Å; L698-R702 WeakPolarHBondContact O-CB 3.23Å; L698-R702 WeakPolarHBondContact O-CG 3.33Å; L698-R702 PolarHBondContact O-N 2.81Å
699	S	41	Very low	42.7	Very low	32 Å²	32	80.1 Å²	80.1	22%	0.224	39%	0.386	C	S	.	.	H	α-helix	trans	-71.5	-37.1	174	165	0	0	0	0	111.8	F79 A695 A696 R697 R703	F79-S699 WeakPolarHBondContact CE2-O 3.48Å; F79-S699 VanDerWaalsContact CE2-OG 3.25Å; F79-S699 WeakPolarHBondContact CE2-OG 3.35Å; A695-S699 WeakPolarHBondContact O-CA 3.38Å; A695-S699 WeakPolarHBondContact O-CB 3.43Å; A695-S699 PolarHBondContact O-N 3.25Å; A696-S699 CarbonylContact O-C 3.53Å; A696-S699 WeakPolarHBondContact O-CA 3.48Å; A696-S699 VanDerWaalsContact O-CB 3.31Å; A696-S699 WeakPolarHBondContact O-CB 3.3Å; A696-S699 PolarHBondContact O-N 3.32Å; R697-S699 VanDerWaalsContact C-N 3.31Å; S699-R703 WeakPolarHBondContact O-CB 3.43Å; S699-R703 PolarHBondContact O-N 3.5Å; S699-R703 PolarHBondContact O-NE 3.5Å; S699-R703 PolarHBondContact OG-NH2 3.29Å
700	Q	38.2	Very low	43.4	Very low	75 Å²	75	80.7 Å²	80.7	35%	0.35	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-49.2	167.9	-87.6	177.6	-31.2	0	0	111.3	A696 R697 R702 R703 M704	A696-Q700 PolarHBondContact O-N 2.84Å; R697-Q700 PolarHBondContact O-N 3.35Å; Q700-R702 VanDerWaalsContact C-N 3.3Å; Q700-R702 PolarHBondContact O-N 3.42Å; Q700-R703 CarbonylContact O-C 3.58Å; Q700-R703 WeakPolarHBondContact O-CA 3.33Å; Q700-R703 WeakPolarHBondContact O-CB 3.44Å; Q700-R703 PolarHBondContact O-N 3.22Å; Q700-M704 WeakPolarHBondContact O-CG 3.38Å; Q700-M704 PolarHBondContact O-N 3.27Å
701	I	43.7	Very low	44.1	Very low	66 Å²	66	84 Å²	84	34%	0.338	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-41.3	177.4	-69.9	163.4	0	0	0	110.7	R697 M704 H705	R697-I701 WeakPolarHBondContact O-CB 3.48Å; R697-I701 WeakPolarHBondContact O-CD1 3.47Å; R697-I701 VanDerWaalsContact O-CG1 3.22Å; R697-I701 WeakPolarHBondContact O-CG1 3.4Å; R697-I701 PolarHBondContact O-N 2.93Å; I701-M704 PolarHBondContact O-N 3.26Å; I701-H705 WeakPolarHBondContact O-CB 3.41Å; I701-H705 PolarHBondContact O-CD2 3.03Å; I701-H705 PolarHBondContact O-N 3.3Å
702	R	40.7	Very low	44.8	Very low	176 Å²	176	85.7 Å²	85.7	66%	0.664	40%	0.4	S	S	*	.	H	α-helix	trans	-61.8	-49.2	170.3	-80.4	-179.9	173.2	174.3	-1.5	111.1	F79 L698 Q700 M704 H705 L706	F79-R702 HydrophobicContact CZ-CB 4.49Å; L698-R702 VanDerWaalsContact O-CB 3.29Å; L698-R702 WeakPolarHBondContact O-CB 3.23Å; L698-R702 WeakPolarHBondContact O-CG 3.33Å; L698-R702 PolarHBondContact O-N 2.81Å; Q700-R702 VanDerWaalsContact C-N 3.3Å; Q700-R702 PolarHBondContact O-N 3.42Å; R702-M704 VanDerWaalsContact C-N 3.32Å; R702-M704 PolarHBondContact O-N 3.38Å; R702-H705 PolarHBondContact O-N 3.49Å; R702-H705 VanDerWaalsContact O-N 3.16Å; R702-L706 HydrophobicContact CB-CD1 4.21Å; R702-L706 WeakPolarHBondContact O-CB 3.43Å; R702-L706 VanDerWaalsContact O-CD1 3.27Å; R702-L706 WeakPolarHBondContact O-CD1 3.37Å; R702-L706 WeakPolarHBondContact O-CG 3.45Å; R702-L706 PolarHBondContact O-N 3Å
703	R	45.1	Very low	46	Very low	46 Å²	46	90.2 Å²	90.2	17%	0.174	41%	0.412	C	S	.	.	H	α-helix	trans	-53.7	-43.9	174	-99.2	175.6	-77.3	-168.1	-5.2	112.9	F79 S699 Q700 L706 N707	F79-R703 VanDerWaalsContact CD2-CD 3.44Å; F79-R703 HydrophobicContact CD2-CG 3.52Å; F79-R703 VanDerWaalsContact CD2-NE 3.3Å; F79-R703 HydrophobicContact CE2-CG 3.52Å; F79-R703 HydrophobicContact CG-CG 4.21Å; F79-R703 HydrophobicContact CZ-CG 4.24Å; S699-R703 WeakPolarHBondContact O-CB 3.43Å; S699-R703 PolarHBondContact O-N 3.5Å; S699-R703 PolarHBondContact O-NE 3.5Å; S699-R703 PolarHBondContact OG-NH2 3.29Å; Q700-R703 CarbonylContact O-C 3.58Å; Q700-R703 WeakPolarHBondContact O-CA 3.33Å; Q700-R703 WeakPolarHBondContact O-CB 3.44Å; Q700-R703 PolarHBondContact O-N 3.22Å; R703-L706 PolarHBondContact O-N 3.17Å; R703-N707 WeakPolarHBondContact O-CB 3.13Å; R703-N707 PolarHBondContact O-N 2.81Å
704	M	45.7	Very low	46.9	Very low	65 Å²	65	88.9 Å²	88.9	32%	0.32	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-43	177	-68.9	179.7	75.8	0	0	111.9	Q700 I701 R702 L706 K708 N1200	Q700-M704 WeakPolarHBondContact O-CG 3.38Å; Q700-M704 PolarHBondContact O-N 3.27Å; I701-M704 PolarHBondContact O-N 3.26Å; R702-M704 VanDerWaalsContact C-N 3.32Å; R702-M704 PolarHBondContact O-N 3.38Å; M704-L706 VanDerWaalsContact C-N 3.31Å; M704-L706 PolarHBondContact O-N 2.87Å; M704-K708 WeakPolarHBondContact O-CB 3.29Å; M704-K708 WeakPolarHBondContact O-CG 3.1Å; M704-K708 PolarHBondContact O-N 3.33Å; M704-N1200 HydrophobicContact CE-CB 4.48Å; M704-N1200 WeakPolarHBondContact CE-ND2 3.48Å
705	H	49.1	Very low	47.7	Very low	118 Å²	118	87.5 Å²	87.5	55%	0.546	42%	0.419	S	S	.	.	H	α-helix	trans	-62.1	-40.1	173.4	-95.8	-80.7	0	0	0	112.1	I701 R702 K708 I709	I701-H705 WeakPolarHBondContact O-CB 3.41Å; I701-H705 PolarHBondContact O-CD2 3.03Å; I701-H705 PolarHBondContact O-N 3.3Å; R702-H705 PolarHBondContact O-N 3.49Å; R702-H705 VanDerWaalsContact O-N 3.16Å; H705-K708 PolarHBondContact O-N 3.01Å; H705-I709 WeakPolarHBondContact O-CD1 3.46Å; H705-I709 VanDerWaalsContact O-CG1 3.25Å; H705-I709 WeakPolarHBondContact O-CG1 3.32Å; H705-I709 PolarHBondContact O-N 2.89Å
706	L	50.9	Low	48.9	Very low	38 Å²	38	89.7 Å²	89.7	20%	0.199	42%	0.423	C	S	.	.	H	α-helix	trans	-75.2	-36.7	-178.3	-65.6	160.5	0	0	0	111.4	F79 D80 R702 R703 M704 I709 K710	F79-L706 HydrophobicContact CE1-CD1 4.42Å; D80-L706 HydrophobicContact CB-CD1 3.85Å; D80-L706 WeakPolarHBondContact OD1-CB 3.45Å; D80-L706 WeakPolarHBondContact OD1-CD2 3.44Å; R702-L706 HydrophobicContact CB-CD1 4.21Å; R702-L706 WeakPolarHBondContact O-CB 3.43Å; R702-L706 VanDerWaalsContact O-CD1 3.27Å; R702-L706 WeakPolarHBondContact O-CD1 3.37Å; R702-L706 WeakPolarHBondContact O-CG 3.45Å; R702-L706 PolarHBondContact O-N 3Å; R703-L706 PolarHBondContact O-N 3.17Å; M704-L706 VanDerWaalsContact C-N 3.31Å; M704-L706 PolarHBondContact O-N 2.87Å; L706-I709 HydrophobicContact CD2-CD1 4.28Å; L706-I709 CarbonylContact O-C 3.54Å; L706-I709 WeakPolarHBondContact O-CB 3.39Å; L706-I709 PolarHBondContact O-N 3.25Å; L706-K710 WeakPolarHBondContact O-CG 3.42Å; L706-K710 PolarHBondContact O-N 2.77Å
707	N	49.7	Very low	49.7	Very low	49 Å²	49	93.5 Å²	93.5	26%	0.262	43%	0.434	S	S	.	.	H	α-helix	trans	-64.9	-41.5	168.6	-80.3	2.4	0	0	0	111.2	R703 I709 K710 E711	R703-N707 WeakPolarHBondContact O-CB 3.13Å; R703-N707 PolarHBondContact O-N 2.81Å; N707-I709 VanDerWaalsContact C-N 3.27Å; N707-I709 PolarHBondContact O-N 3.13Å; N707-K710 CarbonylContact O-C 3.57Å; N707-K710 WeakPolarHBondContact O-CA 3.47Å; N707-K710 WeakPolarHBondContact O-CB 3.48Å; N707-K710 PolarHBondContact O-N 3.02Å; N707-K710 VanDerWaalsContact O-N 3.08Å; N707-K710 PolarHBondContact OD1-NZ 2.78Å; N707-E711 WeakPolarHBondContact O-CG 3.49Å; N707-E711 PolarHBondContact O-N 3.27Å
708	K	52.8	Low	50.6	Low	122 Å²	122	95.7 Å²	95.7	53%	0.53	45%	0.446	S	S	.	.	H	α-helix	trans	-62.6	-31.1	170.7	-76.5	-171.8	175.1	-171.3	0	113.5	M704 H705 R712	M704-K708 WeakPolarHBondContact O-CB 3.29Å; M704-K708 WeakPolarHBondContact O-CG 3.1Å; M704-K708 PolarHBondContact O-N 3.33Å; H705-K708 PolarHBondContact O-N 3.01Å; K708-R712 WeakPolarHBondContact O-CB 3.33Å; K708-R712 WeakPolarHBondContact O-CG 3.44Å; K708-R712 PolarHBondContact O-N 3.17Å
709	I	58.5	Low	51.3	Low	78 Å²	78	93.7 Å²	93.7	40%	0.4	44%	0.441	S	S	.	.	H	α-helix	trans	-72	-37.9	171.8	-71.5	160.5	0	0	0	111	H705 L706 N707 R712 R713	H705-I709 WeakPolarHBondContact O-CD1 3.46Å; H705-I709 VanDerWaalsContact O-CG1 3.25Å; H705-I709 WeakPolarHBondContact O-CG1 3.32Å; H705-I709 PolarHBondContact O-N 2.89Å; L706-I709 HydrophobicContact CD2-CD1 4.28Å; L706-I709 CarbonylContact O-C 3.54Å; L706-I709 WeakPolarHBondContact O-CB 3.39Å; L706-I709 PolarHBondContact O-N 3.25Å; N707-I709 VanDerWaalsContact C-N 3.27Å; N707-I709 PolarHBondContact O-N 3.13Å; I709-R712 PolarHBondContact O-N 3.07Å; I709-R713 WeakPolarHBondContact O-CG 3.3Å; I709-R713 PolarHBondContact O-N 2.97Å
710	K	49.7	Very low	52	Low	62 Å²	62	95.4 Å²	95.4	27%	0.27	45%	0.448	S	S	.	.	H	α-helix	trans	-66.8	-44.4	172.7	-73.1	177	-177.3	171.6	0	112.4	G81 L706 N707 R712 R713 S714	G81-K710 VanDerWaalsContact CA-CE 3.43Å; L706-K710 WeakPolarHBondContact O-CG 3.42Å; L706-K710 PolarHBondContact O-N 2.77Å; N707-K710 CarbonylContact O-C 3.57Å; N707-K710 WeakPolarHBondContact O-CA 3.47Å; N707-K710 WeakPolarHBondContact O-CB 3.48Å; N707-K710 PolarHBondContact O-N 3.02Å; N707-K710 VanDerWaalsContact O-N 3.08Å; N707-K710 PolarHBondContact OD1-NZ 2.78Å; K710-R712 VanDerWaalsContact C-N 3.28Å; K710-R712 PolarHBondContact O-N 3.32Å; K710-R713 CarbonylContact O-C 3.56Å; K710-R713 PolarHBondContact O-N 2.76Å; K710-R713 VanDerWaalsContact O-N 3.09Å; K710-S714 WeakPolarHBondContact O-CB 3.4Å; K710-S714 PolarHBondContact O-N 2.96Å
711	E	53.4	Low	52.9	Low	119 Å²	119	97.6 Å²	97.6	56%	0.556	46%	0.458	S	S	*	.	H	α-helix	trans	-57.1	-45	172.8	-74.3	174.9	152.5	0	0	110.1	N707 R713 S714 L715	N707-E711 WeakPolarHBondContact O-CG 3.49Å; N707-E711 PolarHBondContact O-N 3.27Å; E711-R713 PolarHBondContact O-N 2.94Å; E711-S714 WeakPolarHBondContact O-CB 3.3Å; E711-S714 PolarHBondContact O-N 2.64Å; E711-L715 WeakPolarHBondContact O-CB 3.22Å; E711-L715 WeakPolarHBondContact O-CG 3.19Å; E711-L715 PolarHBondContact O-N 3.44Å
712	R	51.6	Low	53.5	Low	138 Å²	138	99.6 Å²	99.6	52%	0.521	47%	0.468	S	S	.	.	H	α-helix	trans	-60.1	-43.4	172	-84.6	-176	158	-148.5	-15.4	113.1	K708 I709 K710 L715 I716	K708-R712 WeakPolarHBondContact O-CB 3.33Å; K708-R712 WeakPolarHBondContact O-CG 3.44Å; K708-R712 PolarHBondContact O-N 3.17Å; I709-R712 PolarHBondContact O-N 3.07Å; K710-R712 VanDerWaalsContact C-N 3.28Å; K710-R712 PolarHBondContact O-N 3.32Å; R712-L715 PolarHBondContact O-N 2.87Å; R712-I716 WeakPolarHBondContact O-CB 3.44Å; R712-I716 WeakPolarHBondContact O-CD1 3.36Å; R712-I716 WeakPolarHBondContact O-CG1 3.17Å; R712-I716 PolarHBondContact O-N 2.97Å
713	R	60.6	Low	54.2	Low	178 Å²	178	98.9 Å²	98.9	67%	0.672	47%	0.466	S	S	*	.	H	α-helix	trans	-67	-35.4	176.2	-76.3	179.6	174.3	-174.4	-1.5	112.2	I709 K710 E711 I716 M717	I709-R713 WeakPolarHBondContact O-CG 3.3Å; I709-R713 PolarHBondContact O-N 2.97Å; K710-R713 CarbonylContact O-C 3.56Å; K710-R713 PolarHBondContact O-N 2.76Å; K710-R713 VanDerWaalsContact O-N 3.09Å; E711-R713 PolarHBondContact O-N 2.94Å; R713-I716 PolarHBondContact O-N 3.48Å; R713-M717 WeakPolarHBondContact O-CB 3.29Å; R713-M717 VanDerWaalsContact O-CG 3.3Å; R713-M717 WeakPolarHBondContact O-CG 3.4Å; R713-M717 PolarHBondContact O-N 2.93Å
714	S	58.1	Low	54.5	Low	66 Å²	66	105 Å²	105	46%	0.462	49%	0.489	S	S	.	.	H	α-helix	trans	-66.1	-45.6	173.4	175.8	0	0	0	0	111.2	K710 E711 I716 M717 K718	K710-S714 WeakPolarHBondContact O-CB 3.4Å; K710-S714 PolarHBondContact O-N 2.96Å; E711-S714 WeakPolarHBondContact O-CB 3.3Å; E711-S714 PolarHBondContact O-N 2.64Å; S714-I716 VanDerWaalsContact C-N 3.33Å; S714-I716 PolarHBondContact O-N 3.33Å; S714-M717 CarbonylContact O-C 3.51Å; S714-M717 PolarHBondContact O-N 3.44Å; S714-M717 VanDerWaalsContact O-N 3.17Å; S714-K718 PolarHBondContact O-N 3.35Å
715	L	57.5	Low	54.9	Low	118 Å²	118	104.6 Å²	104.6	62%	0.618	49%	0.492	S	S	*	.	H	α-helix	trans	-64.5	-35.4	173.3	-71.6	168.4	0	0	0	112.3	E711 R712 S719	E711-L715 WeakPolarHBondContact O-CB 3.22Å; E711-L715 WeakPolarHBondContact O-CG 3.19Å; E711-L715 PolarHBondContact O-N 3.44Å; R712-L715 PolarHBondContact O-N 2.87Å; L715-S719 WeakPolarHBondContact O-CB 3.49Å; L715-S719 PolarHBondContact O-N 2.88Å
716	I	61	Low	54.9	Low	100 Å²	100	101.9 Å²	101.9	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-69.2	-38.6	171.6	-71.2	159.9	0	0	0	111.1	R712 R713 S714 S719 N720	R712-I716 WeakPolarHBondContact O-CB 3.44Å; R712-I716 WeakPolarHBondContact O-CD1 3.36Å; R712-I716 WeakPolarHBondContact O-CG1 3.17Å; R712-I716 PolarHBondContact O-N 2.97Å; R713-I716 PolarHBondContact O-N 3.48Å; S714-I716 VanDerWaalsContact C-N 3.33Å; S714-I716 PolarHBondContact O-N 3.33Å; I716-S719 PolarHBondContact O-N 2.88Å; I716-N720 WeakPolarHBondContact O-CB 3.41Å; I716-N720 PolarHBondContact O-N 3.28Å; I716-N720 PolarHBondContact O-ND2 3.33Å
717	M	53.9	Low	54.7	Low	127 Å²	127	105.9 Å²	105.9	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-65.8	-50.4	174.6	-77.5	-65	-154.3	0	0	111.2	R713 S714 S719 N720 E721	R713-M717 WeakPolarHBondContact O-CB 3.29Å; R713-M717 VanDerWaalsContact O-CG 3.3Å; R713-M717 WeakPolarHBondContact O-CG 3.4Å; R713-M717 PolarHBondContact O-N 2.93Å; S714-M717 CarbonylContact O-C 3.51Å; S714-M717 PolarHBondContact O-N 3.44Å; S714-M717 VanDerWaalsContact O-N 3.17Å; M717-S719 VanDerWaalsContact C-N 3.3Å; M717-S719 PolarHBondContact O-N 3.11Å; M717-N720 CarbonylContact O-C 3.48Å; M717-N720 WeakPolarHBondContact O-CA 3.47Å; M717-N720 PolarHBondContact O-N 3.1Å; M717-E721 PolarHBondContact O-N 3.4Å
718	K	58.4	Low	54.7	Low	130 Å²	130	109.2 Å²	109.2	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-58.7	-39.9	172.7	-83.9	-171	171.5	-175.5	0	112.1	S714 N720 E721 I722	S714-K718 PolarHBondContact O-N 3.35Å; K718-N720 VanDerWaalsContact C-N 3.34Å; K718-N720 PolarHBondContact O-N 3.21Å; K718-E721 PolarHBondContact O-N 3.15Å; K718-I722 WeakPolarHBondContact O-CB 3.47Å; K718-I722 WeakPolarHBondContact O-CD1 3.48Å; K718-I722 WeakPolarHBondContact O-CG1 3.29Å; K718-I722 PolarHBondContact O-N 2.72Å
719	S	59	Low	54.3	Low	65 Å²	65	109.8 Å²	109.8	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-60	-43.8	172.2	177.6	0	0	0	0	111.4	L715 I716 M717 R723	L715-S719 WeakPolarHBondContact O-CB 3.49Å; L715-S719 PolarHBondContact O-N 2.88Å; I716-S719 PolarHBondContact O-N 2.88Å; M717-S719 VanDerWaalsContact C-N 3.3Å; M717-S719 PolarHBondContact O-N 3.11Å; S719-R723 WeakPolarHBondContact O-CB 3.41Å; S719-R723 PolarHBondContact O-N 3.35Å
720	N	55.6	Low	53.7	Low	67 Å²	67	113.8 Å²	113.8	36%	0.358	54%	0.54	S	S	.	.	H	α-helix	trans	-72.5	-30.4	176.7	-73.2	-23.7	0	0	0	113.6	I716 M717 K718 R723 R724	I716-N720 WeakPolarHBondContact O-CB 3.41Å; I716-N720 PolarHBondContact O-N 3.28Å; I716-N720 PolarHBondContact O-ND2 3.33Å; M717-N720 CarbonylContact O-C 3.48Å; M717-N720 WeakPolarHBondContact O-CA 3.47Å; M717-N720 PolarHBondContact O-N 3.1Å; K718-N720 VanDerWaalsContact C-N 3.34Å; K718-N720 PolarHBondContact O-N 3.21Å; N720-R723 CarbonylContact O-C 3.5Å; N720-R723 WeakPolarHBondContact O-CB 3.45Å; N720-R723 PolarHBondContact O-N 2.8Å; N720-R724 WeakPolarHBondContact O-CB 3.23Å; N720-R724 WeakPolarHBondContact O-CG 3.46Å; N720-R724 PolarHBondContact O-N 2.71Å
721	E	55.8	Low	53.4	Low	122 Å²	122	117.3 Å²	117.3	57%	0.57	56%	0.563	S	S	*	*	H	α-helix	trans	-69.4	-46.1	171.3	-78.8	-178.9	143.9	0	0	110.7	M717 K718 R723 R724 S725	M717-E721 PolarHBondContact O-N 3.4Å; K718-E721 PolarHBondContact O-N 3.15Å; E721-R723 PolarHBondContact O-N 3.23Å; E721-R724 CarbonylContact O-C 3.54Å; E721-R724 WeakPolarHBondContact O-CA 3.44Å; E721-R724 PolarHBondContact O-N 3.4Å; E721-S725 PolarHBondContact O-N 3.05Å; E721-S725 PolarHBondContact O-OG 3.13Å; E721-S725 VanDerWaalsContact O-OG 3.13Å
722	I	57.2	Low	52.3	Low	107 Å²	107	118.3 Å²	118.3	55%	0.549	57%	0.572	S	S	.	*	H	α-helix	trans	-58.4	-36.6	169.8	-67.6	164.2	0	0	0	110.1	K718 S725 T726	K718-I722 WeakPolarHBondContact O-CB 3.47Å; K718-I722 WeakPolarHBondContact O-CD1 3.48Å; K718-I722 WeakPolarHBondContact O-CG1 3.29Å; K718-I722 PolarHBondContact O-N 2.72Å; I722-S725 WeakPolarHBondContact CA-OG 3.41Å; I722-S725 PolarHBondContact O-OG 3.39Å; I722-T726 VanDerWaalsContact O-CB 3.32Å; I722-T726 WeakPolarHBondContact O-CB 3.43Å; I722-T726 WeakPolarHBondContact O-CG2 3.47Å; I722-T726 PolarHBondContact O-N 3.29Å; I722-T726 PolarHBondContact O-OG1 2.67Å
723	R	54.3	Low	51.2	Low	162 Å²	162	120.6 Å²	120.6	61%	0.611	59%	0.588	S	S	*	*	H	α-helix	trans	-69.2	-32.2	174.3	-138.9	171.5	-168.3	162.2	2	113.2	S719 N720 E721 T726 Q727	S719-R723 WeakPolarHBondContact O-CB 3.41Å; S719-R723 PolarHBondContact O-N 3.35Å; N720-R723 CarbonylContact O-C 3.5Å; N720-R723 WeakPolarHBondContact O-CB 3.45Å; N720-R723 PolarHBondContact O-N 2.8Å; E721-R723 PolarHBondContact O-N 3.23Å; R723-T726 WeakPolarHBondContact CA-OG1 3.34Å; R723-T726 PolarHBondContact O-OG1 3.27Å; R723-Q727 WeakPolarHBondContact O-CB 3.24Å; R723-Q727 VanDerWaalsContact O-CG 3.27Å; R723-Q727 WeakPolarHBondContact O-CG 3.46Å; R723-Q727 PolarHBondContact O-N 3.19Å
724	R	51.5	Low	49.8	Very low	175 Å²	175	120.5 Å²	120.5	66%	0.66	60%	0.595	S	S	*	*	H	α-helix	trans	-76.9	-43.2	174.9	-80.8	177.5	173	175.8	-3.1	111.8	N720 E721 Q727 I728	N720-R724 WeakPolarHBondContact O-CB 3.23Å; N720-R724 WeakPolarHBondContact O-CG 3.46Å; N720-R724 PolarHBondContact O-N 2.71Å; E721-R724 CarbonylContact O-C 3.54Å; E721-R724 WeakPolarHBondContact O-CA 3.44Å; E721-R724 PolarHBondContact O-N 3.4Å; R724-Q727 CarbonylContact O-C 3.51Å; R724-Q727 WeakPolarHBondContact O-CA 3.49Å; R724-Q727 WeakPolarHBondContact O-CB 3.5Å; R724-Q727 PolarHBondContact O-N 3.08Å; R724-I728 WeakPolarHBondContact O-CG1 3.45Å; R724-I728 PolarHBondContact O-N 3.21Å
725	S	54.1	Low	48.5	Very low	55 Å²	55	123.5 Å²	123.5	39%	0.385	61%	0.611	S	S	.	*	H	α-helix	trans	-67.3	-35.4	174.1	57.3	0	0	0	0	111.8	E721 I722 Q727 I728 L729	E721-S725 PolarHBondContact O-N 3.05Å; E721-S725 PolarHBondContact O-OG 3.13Å; E721-S725 VanDerWaalsContact O-OG 3.13Å; I722-S725 WeakPolarHBondContact CA-OG 3.41Å; I722-S725 PolarHBondContact O-OG 3.39Å; S725-Q727 VanDerWaalsContact C-N 3.28Å; S725-Q727 PolarHBondContact O-N 3.14Å; S725-I728 PolarHBondContact O-N 2.89Å; S725-L729 WeakPolarHBondContact O-CB 3.38Å; S725-L729 WeakPolarHBondContact O-CG 3.12Å; S725-L729 PolarHBondContact O-N 3.23Å
726	T	48.7	Very low	47	Very low	62 Å²	62	123.7 Å²	123.7	38%	0.38	62%	0.62	S	S	.	*	H	α-helix	trans	-76.3	-5.3	167.4	57.6	0	0	0	0	114.9	I722 R723 K730	I722-T726 VanDerWaalsContact O-CB 3.32Å; I722-T726 WeakPolarHBondContact O-CB 3.43Å; I722-T726 WeakPolarHBondContact O-CG2 3.47Å; I722-T726 PolarHBondContact O-N 3.29Å; I722-T726 PolarHBondContact O-OG1 2.67Å; R723-T726 WeakPolarHBondContact CA-OG1 3.34Å; R723-T726 PolarHBondContact O-OG1 3.27Å; T726-K730 VanDerWaalsContact O-CD 3.27Å; T726-K730 WeakPolarHBondContact O-CD 3.42Å; T726-K730 VanDerWaalsContact O-CG 3.25Å; T726-K730 WeakPolarHBondContact O-CG 3.33Å
727	Q	47.4	Very low	45.7	Very low	122 Å²	122	127.7 Å²	127.7	57%	0.57	64%	0.636	S	S	*	*	H	α-helix	trans	-90.9	-35.2	163.6	-85.2	178.7	-44.8	0	0	111.6	R723 R724 S725 K730	R723-Q727 WeakPolarHBondContact O-CB 3.24Å; R723-Q727 VanDerWaalsContact O-CG 3.27Å; R723-Q727 WeakPolarHBondContact O-CG 3.46Å; R723-Q727 PolarHBondContact O-N 3.19Å; R724-Q727 CarbonylContact O-C 3.51Å; R724-Q727 WeakPolarHBondContact O-CA 3.49Å; R724-Q727 WeakPolarHBondContact O-CB 3.5Å; R724-Q727 PolarHBondContact O-N 3.08Å; S725-Q727 VanDerWaalsContact C-N 3.28Å; S725-Q727 PolarHBondContact O-N 3.14Å; Q727-K730 WeakPolarHBondContact O-CB 3.36Å; Q727-K730 PolarHBondContact O-N 3.42Å
728	I	49	Very low	44.8	Very low	119 Å²	119	129.9 Å²	129.9	61%	0.61	65%	0.648	S	S	*	*	H	α-helix	trans	-66.9	-46.2	174	-67	162.5	0	0	0	109.8	R724 S725 K730 N731	R724-I728 WeakPolarHBondContact O-CG1 3.45Å; R724-I728 PolarHBondContact O-N 3.21Å; S725-I728 PolarHBondContact O-N 2.89Å; I728-K730 PolarHBondContact O-N 3.06Å; I728-N731 PolarHBondContact O-N 3.44Å
729	L	45.4	Very low	43.4	Very low	133 Å²	133	132.9 Å²	132.9	70%	0.696	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	2.7	171.4	-73	165	0	0	0	114.6	S725	S725-L729 WeakPolarHBondContact O-CB 3.38Å; S725-L729 WeakPolarHBondContact O-CG 3.12Å; S725-L729 PolarHBondContact O-N 3.23Å
730	K	44.8	Very low	42.1	Very low	162 Å²	162	136.6 Å²	136.6	70%	0.704	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-4.6	170.3	-82.2	177.2	-178.1	179.9	0	113.8	T726 Q727 I728	T726-K730 VanDerWaalsContact O-CD 3.27Å; T726-K730 WeakPolarHBondContact O-CD 3.42Å; T726-K730 VanDerWaalsContact O-CG 3.25Å; T726-K730 WeakPolarHBondContact O-CG 3.33Å; Q727-K730 WeakPolarHBondContact O-CB 3.36Å; Q727-K730 PolarHBondContact O-N 3.42Å; I728-K730 PolarHBondContact O-N 3.06Å
731	N	43.2	Very low	40.9	Very low	137 Å²	137	140.7 Å²	140.7	73%	0.733	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-16.7	179.5	-74.9	-1.7	0	0	0	113.7	I728	I728-N731 PolarHBondContact O-N 3.44Å
732	D	31.2	Very low	39.9	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	71%	0.714	S	S	*	*	S	Bend	trans	-86.9	111.2	167.7	-76.1	-37.7	0	0	0	110.7	Q734	D732-Q734 PolarHBondContact O-N 3.18Å
733	Q	28.9	Very low	38.5	Very low	185 Å²	185	145.3 Å²	145.3	86%	0.864	73%	0.725	S	S	*	*			trans	-83.5	93	177.5	-67.5	-178.2	-12.7	0	0	110.7
734	Q	31.8	Very low	37.3	Very low	177 Å²	177	143.1 Å²	143.1	83%	0.827	73%	0.73	S	S	*	*			trans	-151.9	125.5	159.4	-114.1	156.5	50.8	0	0	113.7	D732	D732-Q734 PolarHBondContact O-N 3.18Å
735	T	29.2	Very low	36.2	Very low	128 Å²	128	144.5 Å²	144.5	79%	0.785	74%	0.744	S	S	*	*			trans	56.4	114.4	157.6	51.7	0	0	0	0	119.5
736	P	27.8	Very low	35	Very low	123 Å²	123	147.5 Å²	147.5	80%	0.799	77%	0.765	S	S	*	*			trans	-101.5	104	180	36.7	-29.1	0	0	0	113.6
737	E	32.7	Very low	33.9	Very low	184 Å²	184	150.6 Å²	150.6	86%	0.86	78%	0.784	S	S	*	*			trans	-155.3	169.1	158.1	-106.9	153.3	-145.1	0	0	106.9
738	I	35.7	Very low	33.1	Very low	172 Å²	172	154.4 Å²	154.4	88%	0.882	80%	0.802	S	S	*	*			trans	69.7	65	-167.7	-41.7	162.4	0	0	0	113.1
739	K	28.3	Very low	32.2	Very low	194 Å²	194	154.9 Å²	154.9	84%	0.843	82%	0.816	S	S	*	*			trans	-126.2	99.9	154.4	-79	176.4	179.4	166.2	0	108.3
740	N	31	Very low	31.3	Very low	142 Å²	142	152.8 Å²	152.8	76%	0.759	82%	0.817	S	S	*	*	S	Bend	trans	-170.7	-29.9	151.1	-96.1	-18.7	0	0	0	115.6	L742	N740-L742 PolarHBondContact O-N 3.02Å
741	D	31.4	Very low	30.6	Very low	153 Å²	153	151 Å²	151	82%	0.818	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	7	-165.6	-64	-30.9	0	0	0	117.2
742	L	34.1	Very low	29.9	Very low	175 Å²	175	149.7 Å²	149.7	92%	0.916	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	15.4	-179.7	-86.4	153.7	0	0	0	114	N740	N740-L742 PolarHBondContact O-N 3.02Å
743	I	28.2	Very low	30.1	Very low	152 Å²	152	148.6 Å²	148.6	78%	0.779	81%	0.813	S	S	*	*	S	Bend	trans	-130.3	39.3	-177.5	-44.3	179.6	0	0	0	111.9
744	T	29.7	Very low	30.2	Very low	116 Å²	116	143.6 Å²	143.6	71%	0.712	79%	0.788	S	S	*	*	S	Bend	trans	-159.7	80.2	172.4	27.3	0	0	0	0	112.4
745	Q	28.2	Very low	30.3	Very low	204 Å²	204	141 Å²	141	95%	0.953	78%	0.776	S	S	*	*	S	Bend	trans	-169.7	-10.7	153.3	-110.9	161.1	44.5	0	0	116.7
746	S	27.9	Very low	30.7	Very low	118 Å²	118	145 Å²	145	83%	0.825	78%	0.776	S	S	*	*	S	Bend	trans	-118.3	37.4	-170.5	70.5	0	0	0	0	116.3
747	T	26.9	Very low	30.8	Very low	127 Å²	127	145.2 Å²	145.2	78%	0.779	77%	0.765	S	S	*	*			trans	-148.1	72	179.1	53.4	0	0	0	0	114.3
748	Q	29	Very low	31	Very low	201 Å²	201	138.9 Å²	138.9	94%	0.939	74%	0.739	S	S	*	*	S	Bend	trans	-157.2	43	172.3	-124.5	172.3	49.3	0	0	117.7
749	S	30	Very low	31	Very low	130 Å²	130	135.6 Å²	135.6	91%	0.909	72%	0.724	S	S	*	*	S	Bend	trans	-159.2	23.4	171.9	58.4	0	0	0	0	117.8
750	A	28.3	Very low	31.2	Very low	88 Å²	88	130.5 Å²	130.5	73%	0.727	71%	0.711	S	S	*	*			trans	-141.6	22.4	-169.2	0	0	0	0	0	118.7
751	L	28.6	Very low	31.3	Very low	125 Å²	125	127.9 Å²	127.9	65%	0.654	70%	0.697	S	S	*	*			trans	-145.6	86.9	178.5	-121.1	102	0	0	0	114	F754	L751-F754 HydrophobicContact CG-CB 4.4Å
752	P	29.8	Very low	31.5	Very low	109 Å²	109	124.6 Å²	124.6	71%	0.708	68%	0.682	S	S	*	*	S	Bend	trans	-127	-20	131.4	-2.8	23.6	0	0	0	114.4	F754	P752-F754 VanDerWaalsContact C-N 3.33Å; P752-F754 PolarHBondContact O-N 3.1Å
753	T	34.4	Very low	31.5	Very low	118 Å²	118	125.8 Å²	125.8	72%	0.724	68%	0.675	S	S	*	*	H	α-helix	trans	-74.9	-23.5	-173.2	-27.8	0	0	0	0	112.9	F757	T753-F757 PolarHBondContact O-N 2.82Å
754	F	31.2	Very low	31.7	Very low	80 Å²	80	126.6 Å²	126.6	35%	0.351	67%	0.673	S	S	.	*	H	α-helix	trans	-73.9	-40.5	-173	-158	-116.2	0	0	0	113.1	L751 P752 R756 F757 T758	L751-F754 HydrophobicContact CG-CB 4.4Å; P752-F754 VanDerWaalsContact C-N 3.33Å; P752-F754 PolarHBondContact O-N 3.1Å; F754-R756 VanDerWaalsContact C-N 3.3Å; F754-R756 PolarHBondContact O-N 3.47Å; F754-F757 PolarHBondContact O-N 2.84Å; F754-T758 HydrophobicContact CD1-CG2 4.49Å; F754-T758 HydrophobicContact CE1-CG2 4.08Å; F754-T758 HydrophobicContact CZ-CG2 4.21Å; F754-T758 PolarHBondContact O-N 2.66Å; F754-T758 VanDerWaalsContact O-N 3.08Å; F754-T758 PolarHBondContact O-OG1 3.17Å
755	Q	34.5	Very low	31.9	Very low	122 Å²	122	126.3 Å²	126.3	57%	0.57	67%	0.667	S	S	*	*	H	α-helix	trans	-60.8	-35.7	176.7	-133.7	89.2	1.1	0	0	112.9	T758 N759	Q755-T758 WeakPolarHBondContact CA-OG1 3.27Å; Q755-T758 PolarHBondContact O-OG1 3.2Å; Q755-N759 WeakPolarHBondContact O-CB 3.47Å; Q755-N759 VanDerWaalsContact O-CG 3.26Å; Q755-N759 PolarHBondContact O-N 3.36Å; Q755-N759 PolarHBondContact O-OD1 3.42Å
756	R	36.1	Very low	32.1	Very low	211 Å²	211	121.1 Å²	121.1	80%	0.796	65%	0.649	S	S	*	*	H	α-helix	trans	-72.6	-33.2	177.2	-93.7	-177.6	167	179.2	-3.4	112.6	F754 C760	F754-R756 VanDerWaalsContact C-N 3.3Å; F754-R756 PolarHBondContact O-N 3.47Å; R756-C760 PolarHBondContact O-N 3.13Å
757	F	31.7	Very low	32.3	Very low	128 Å²	128	122.3 Å²	122.3	56%	0.561	65%	0.645	S	S	*	*	H	α-helix	trans	-75	-39.8	178.8	-165.9	-106.8	0	0	0	111.9	T753 F754 N759 C760 L761	T753-F757 PolarHBondContact O-N 2.82Å; F754-F757 PolarHBondContact O-N 2.84Å; F757-N759 VanDerWaalsContact C-N 3.34Å; F757-N759 PolarHBondContact O-N 3.16Å; F757-C760 PolarHBondContact O-N 3.4Å; F757-L761 HydrophobicContact CD1-CD1 3.79Å; F757-L761 HydrophobicContact CE1-CD1 3.38Å; F757-L761 HydrophobicContact CZ-CD1 3.95Å; F757-L761 PolarHBondContact O-N 2.83Å; F757-L761 VanDerWaalsContact O-N 3.15Å
758	T	36.4	Very low	32.5	Very low	51 Å²	51	122 Å²	122	31%	0.313	64%	0.643	S	S	.	*	H	α-helix	trans	-61.9	-40.6	172.9	47.9	0	0	0	0	112.1	F754 Q755 C760 L761 T762	F754-T758 HydrophobicContact CD1-CG2 4.49Å; F754-T758 HydrophobicContact CE1-CG2 4.08Å; F754-T758 HydrophobicContact CZ-CG2 4.21Å; F754-T758 PolarHBondContact O-N 2.66Å; F754-T758 VanDerWaalsContact O-N 3.08Å; F754-T758 PolarHBondContact O-OG1 3.17Å; Q755-T758 WeakPolarHBondContact CA-OG1 3.27Å; Q755-T758 PolarHBondContact O-OG1 3.2Å; T758-C760 VanDerWaalsContact C-N 3.27Å; T758-C760 PolarHBondContact O-N 3.02Å; T758-L761 PolarHBondContact O-N 3.17Å; T758-T762 PolarHBondContact O-N 3.4Å; T758-T762 PolarHBondContact O-OG1 3.14Å
759	N	35.2	Very low	32.5	Very low	104 Å²	104	120.4 Å²	120.4	56%	0.556	64%	0.636	S	S	*	*	H	α-helix	trans	-71.5	-16.5	178.8	-70.8	3.4	0	0	0	114.3	Q755 F757 T762	Q755-N759 WeakPolarHBondContact O-CB 3.47Å; Q755-N759 VanDerWaalsContact O-CG 3.26Å; Q755-N759 PolarHBondContact O-N 3.36Å; Q755-N759 PolarHBondContact O-OD1 3.42Å; F757-N759 VanDerWaalsContact C-N 3.34Å; F757-N759 PolarHBondContact O-N 3.16Å; N759-T762 WeakPolarHBondContact CA-OG1 3.25Å; N759-T762 PolarHBondContact O-OG1 3.16Å
760	C	32.6	Very low	32.5	Very low	87 Å²	87	122.1 Å²	122.1	59%	0.588	63%	0.634	S	S	*	*	H	α-helix	trans	-85.6	-35.4	170.9	-113.8	0	0	0	0	112.1	R756 F757 T758 R763 F764	R756-C760 PolarHBondContact O-N 3.13Å; F757-C760 PolarHBondContact O-N 3.4Å; T758-C760 VanDerWaalsContact C-N 3.27Å; T758-C760 PolarHBondContact O-N 3.02Å; C760-R763 PolarHBondContact O-N 3.46Å; C760-F764 PolarHBondContact O-N 3.3Å
761	L	33	Very low	32.5	Very low	87 Å²	87	129.5 Å²	129.5	46%	0.455	64%	0.643	S	S	.	*	H	α-helix	trans	-72.7	-36	176.6	-93.7	155	0	0	0	112.9	F757 T758 R763 F764 N765	F757-L761 HydrophobicContact CD1-CD1 3.79Å; F757-L761 HydrophobicContact CE1-CD1 3.38Å; F757-L761 HydrophobicContact CZ-CD1 3.95Å; F757-L761 PolarHBondContact O-N 2.83Å; F757-L761 VanDerWaalsContact O-N 3.15Å; T758-L761 PolarHBondContact O-N 3.17Å; L761-R763 PolarHBondContact O-N 2.98Å; L761-F764 PolarHBondContact O-N 3.16Å; L761-N765 PolarHBondContact O-N 3.17Å
762	T	35.9	Very low	32.4	Very low	83 Å²	83	131.1 Å²	131.1	51%	0.509	65%	0.652	S	S	.	*	H	α-helix	trans	-65	-27.2	171.3	51.1	0	0	0	0	112.5	T758 N759 T766	T758-T762 PolarHBondContact O-N 3.4Å; T758-T762 PolarHBondContact O-OG1 3.14Å; N759-T762 WeakPolarHBondContact CA-OG1 3.25Å; N759-T762 PolarHBondContact O-OG1 3.16Å; T762-T766 VanDerWaalsContact O-CG2 3.29Å; T762-T766 WeakPolarHBondContact O-CG2 3.27Å; T762-T766 PolarHBondContact O-OG1 3Å
763	R	34.6	Very low	32.4	Very low	200 Å²	200	135.2 Å²	135.2	76%	0.755	66%	0.659	S	S	*	*	H	α-helix	trans	-77.9	-19.4	176.9	-116.2	177.4	176.7	174.1	-1.4	115.1	C760 L761 T766	C760-R763 PolarHBondContact O-N 3.46Å; L761-R763 PolarHBondContact O-N 2.98Å; R763-T766 PolarHBondContact O-OG1 3.12Å
764	F	31.3	Very low	32.2	Very low	170 Å²	170	136.5 Å²	136.5	75%	0.746	66%	0.661	S	S	*	*	H	α-helix	trans	-92	-26.8	175.6	-120.1	-84.9	0	0	0	112.7	C760 L761	C760-F764 PolarHBondContact O-N 3.3Å; L761-F764 PolarHBondContact O-N 3.16Å
765	N	34.4	Very low	32.1	Very low	109 Å²	109	139.6 Å²	139.6	58%	0.583	68%	0.681	S	S	*	*	H	α-helix	trans	-84.5	-7.1	179.5	-72.6	-6.3	0	0	0	114.4	L761 T768	L761-N765 PolarHBondContact O-N 3.17Å; N765-T768 PolarHBondContact O-OG1 3.34Å
766	T	32.3	Very low	31.7	Very low	96 Å²	96	140.6 Å²	140.6	59%	0.589	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	2.7	177.4	50.4	0	0	0	0	114.9	T762 R763	T762-T766 VanDerWaalsContact O-CG2 3.29Å; T762-T766 WeakPolarHBondContact O-CG2 3.27Å; T762-T766 PolarHBondContact O-OG1 3Å; R763-T766 PolarHBondContact O-OG1 3.12Å
767	I	32.6	Very low	31.4	Very low	142 Å²	142	137.6 Å²	137.6	73%	0.728	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-7.2	178.6	-71.7	167.7	0	0	0	112.1
768	T	31.6	Very low	31.3	Very low	121 Å²	121	137.3 Å²	137.3	74%	0.742	69%	0.691	S	S	*	*	S	Bend	trans	-98.5	5.8	-176	23.8	0	0	0	0	116	N765	N765-T768 PolarHBondContact O-OG1 3.34Å
769	E	28.4	Very low	31	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	71%	0.705	S	S	*	*	S	Bend	trans	-122.6	15.4	-174.2	-68.7	-168.9	147.8	0	0	115.8
770	L	29.8	Very low	30.7	Very low	166 Å²	166	141.3 Å²	141.3	87%	0.869	71%	0.71	S	S	*	*	S	Bend	trans	-120.1	40.9	179.1	-73.4	176.1	0	0	0	114.7
771	R	27.6	Very low	30.7	Very low	242 Å²	242	145.7 Å²	145.7	91%	0.913	72%	0.719	S	S	*	*	S	Bend	trans	-145	54.7	163.7	-132.4	-179.4	-157.3	-175.7	6.3	113
772	N	27.1	Very low	30.5	Very low	159 Å²	159	148.4 Å²	148.4	85%	0.85	73%	0.734	S	S	*	*			trans	-143.5	88.8	167.8	-94.9	-22.8	0	0	0	109.6
773	K	29.2	Very low	30	Very low	196 Å²	196	149.2 Å²	149.2	85%	0.852	74%	0.743	S	S	*	*			trans	-171.3	154.8	157.6	-105.5	161.7	-174.4	-179.2	0	108.1
774	D	30.9	Very low	30	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	74%	0.74	S	S	*	*			trans	72	117.4	-175.3	-41.7	-15.3	0	0	0	113.3
775	N	28.8	Very low	29.7	Very low	145 Å²	145	143 Å²	143	78%	0.775	74%	0.743	S	S	*	*			cis	-142.7	138	-8.9	-68	-58.7	0	0	0	105.9
776	L	27.2	Very low	29.5	Very low	143 Å²	143	141.9 Å²	141.9	75%	0.749	75%	0.749	S	S	*	*				66.4	90.1	55.2	-139.4	162.4	0	0	0	113.4
777	M	29.6	Very low	29.3	Very low	149 Å²	149	142.2 Å²	142.2	73%	0.734	76%	0.755	S	S	*	*			trans	172.1	122.6	133.6	-90.6	-64.1	171.7	0	0	111.5
778	N	28.7	Very low	28.9	Very low	122 Å²	122	140.3 Å²	140.3	65%	0.652	76%	0.755	S	S	*	*			trans	46.6	146.8	136.3	-67.4	34.1	0	0	0	121.4
779	D	30.1	Very low	28.8	Very low	113 Å²	113	143.4 Å²	143.4	60%	0.604	76%	0.758	S	S	*	*			cis	-167.2	151.2	4.5	-114.5	-30.5	0	0	0	110.6
780	N	30	Very low	28.5	Very low	125 Å²	125	140.3 Å²	140.3	67%	0.668	75%	0.754	S	S	*	*			trans	50.3	144.5	144.1	-58.4	-47.6	0	0	0	121
781	K	30.9	Very low	28.3	Very low	179 Å²	179	140.5 Å²	140.5	78%	0.778	75%	0.753	S	S	*	*			cis	-169.7	142.7	30.2	-137.3	158.8	-171.6	178.9	0	112.4
782	L	29.9	Very low	28.2	Very low	144 Å²	144	134 Å²	134	75%	0.754	75%	0.745	S	S	*	*			trans	18.5	124.2	150.9	-71.9	90.7	0	0	0	120.6
783	S	24.2	Very low	28.3	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	74%	0.74	S	S	*	*				79.6	169.4	62.6	86.2	0	0	0	0	115.1
784	P	35	Very low	28.2	Very low	106 Å²	106	128.5 Å²	128.5	69%	0.688	73%	0.733	S	S	*	*				-133.5	-164	-109.2	33.5	-9.7	0	0	0	116.7
785	T	25.9	Very low	28.1	Very low	134 Å²	134	126.7 Å²	126.7	82%	0.822	72%	0.723	S	S	*	*			trans	104.6	150.9	153	74.3	0	0	0	0	122.1
786	A	29.5	Very low	28	Very low	86 Å²	86	129.4 Å²	129.4	71%	0.711	72%	0.722	S	S	*	*			trans	89	101.3	147.4	0	0	0	0	0	123.4
787	S	27.4	Very low	28.1	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	73%	0.727	S	S	*	*				53.7	109.8	127	65.2	0	0	0	0	124.7
788	S	25.1	Very low	28	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	73%	0.732	S	S	*	*				74.3	149	123.9	79.3	0	0	0	0	123.2
789	K	29	Very low	27.8	Very low	187 Å²	187	135.6 Å²	135.6	81%	0.813	74%	0.742	S	S	*	*			trans	81.9	92.8	160.6	-66.9	-178	178.1	178	0	120.5
790	S	23.1	Very low	27.6	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	75%	0.752	S	S	*	*				61.3	137.1	115.5	69.5	0	0	0	0	123.9
791	M	24.7	Very low	27.4	Very low	170 Å²	170	140.7 Å²	140.7	84%	0.837	76%	0.76	S	S	*	*			trans	99.4	140.2	151.5	-61.4	-167.3	66.1	0	0	120.5
792	S	26.4	Very low	27	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	77%	0.766	S	S	*	*			trans	61.8	112.9	163.6	36	0	0	0	0	117.8
793	A	28.3	Very low	26.8	Very low	92 Å²	92	139.4 Å²	139.4	76%	0.76	77%	0.766	S	S	*	*				85.5	143.5	86.5	0	0	0	0	0	111.1
794	E	26.8	Very low	26.9	Very low	147 Å²	147	140.1 Å²	140.1	69%	0.687	77%	0.771	S	S	*	*			cis	-162.9	140	7.8	-131.9	-179.5	-165.3	0	0	105.3
795	N	29.2	Very low	26.5	Very low	107 Å²	107	141.2 Å²	141.2	57%	0.572	77%	0.77	S	S	*	*				170.1	130.3	89.1	-97.6	-47.5	0	0	0	111
796	R	26.8	Very low	26.7	Very low	201 Å²	201	139.5 Å²	139.5	76%	0.758	76%	0.756	S	S	*	*				59.3	127.9	113.6	-63.2	178.9	-158	-160.4	3.6	115.9
797	K	29.1	Very low	26.9	Very low	196 Å²	196	146 Å²	146	85%	0.852	76%	0.762	S	S	*	*			cis	-146.5	171.1	14.5	-86.9	145.2	175.8	-179.5	0	107.2
798	S	28.5	Very low	27.2	Very low	119 Å²	119	150.9 Å²	150.9	83%	0.832	76%	0.764	S	S	*	*			cis	-160.4	170.6	-7.6	32.6	0	0	0	0	108.6
799	R	23.9	Very low	27.5	Very low	229 Å²	229	150.6 Å²	150.6	86%	0.864	76%	0.755	S	S	*	*			trans	-158.5	140.6	-176.3	-162.1	-170.9	-161.7	-169.7	8.2	111.4
800	P	25.1	Very low	27.8	Very low	124 Å²	124	149.1 Å²	149.1	81%	0.805	75%	0.749	S	S	*	*			trans	-105.1	111.8	152.1	31.4	-21.3	0	0	0	108.9
801	R	26.1	Very low	28.4	Very low	222 Å²	222	152 Å²	152	84%	0.838	75%	0.748	S	S	*	*				72.4	88.1	76.4	-74.4	-166.5	175.7	-168.9	-0.1	113.7
802	T	22.2	Very low	28.9	Very low	150 Å²	150	146.5 Å²	146.5	92%	0.92	73%	0.73	S	S	*	*			trans	-55.9	133.2	153	26.3	0	0	0	0	110.8
803	I	26	Very low	29.1	Very low	145 Å²	145	147.6 Å²	147.6	74%	0.744	73%	0.725	S	S	*	*			trans	-111.4	125.3	168.9	-62.9	178.4	0	0	0	108.4	I805	I803-I805 HydrophobicContact CG2-CD1 4.49Å; I803-I805 HydrophobicContact CG2-CG1 4.09Å
804	S	26	Very low	29.4	Very low	116 Å²	116	148 Å²	148	81%	0.811	71%	0.714	S	S	*	*			trans	-82.1	120.8	174.9	52.5	0	0	0	0	110.8
805	I	28.4	Very low	29.7	Very low	129 Å²	129	146 Å²	146	66%	0.662	71%	0.707	S	S	*	*			trans	-119.1	104.1	172.7	-59.1	-176.9	0	0	0	110.8	I803	I803-I805 HydrophobicContact CG2-CD1 4.49Å; I803-I805 HydrophobicContact CG2-CG1 4.09Å
806	D	28.2	Very low	29.9	Very low	97 Å²	97	144.8 Å²	144.8	52%	0.519	70%	0.704	S	S	.	*			trans	24.6	134	154.6	-155.7	2.2	0	0	0	121.8	R808 N809	D806-R808 PolarHBondContact O-N 2.83Å; D806-R808 VanDerWaalsContact O-N 3.12Å; D806-N809 PolarHBondContact O-N 3.41Å
807	R	34	Very low	30.2	Very low	224 Å²	224	138.7 Å²	138.7	85%	0.845	69%	0.685	S	S	*	*	H	α-helix	trans	-60.7	-20.5	178.7	-72.5	178.7	170.9	179	-3.6	113.7	K810	R807-K810 WeakPolarHBondContact O-CB 3.4Å; R807-K810 PolarHBondContact O-N 2.67Å
808	R	33.9	Very low	30.3	Very low	203 Å²	203	132.8 Å²	132.8	77%	0.766	67%	0.669	S	S	*	*	H	α-helix	trans	-66.8	-40.2	179.8	-68.9	176.2	175.6	164.1	-1.3	113	D806 K810 K811	D806-R808 PolarHBondContact O-N 2.83Å; D806-R808 VanDerWaalsContact O-N 3.12Å; R808-K810 VanDerWaalsContact C-N 3.29Å; R808-K810 PolarHBondContact O-N 2.91Å; R808-K811 PolarHBondContact O-N 3.31Å
809	N	33	Very low	30.4	Very low	97 Å²	97	135.4 Å²	135.4	52%	0.519	67%	0.665	S	S	.	*	H	α-helix	trans	-70.3	-25.4	177.5	-74.6	-18.3	0	0	0	113	D806 K811 A812 M813	D806-N809 PolarHBondContact O-N 3.41Å; N809-K811 VanDerWaalsContact C-N 3.28Å; N809-K811 PolarHBondContact O-N 2.7Å; N809-A812 PolarHBondContact O-N 3.43Å; N809-M813 PolarHBondContact O-N 3.37Å
810	K	35	Very low	30.7	Very low	155 Å²	155	131.3 Å²	131.3	67%	0.674	65%	0.654	S	S	*	*	H	α-helix	trans	-63.7	-34	175.3	-151	173	-172.7	179.8	0	111.8	R807 R808 I814	R807-K810 WeakPolarHBondContact O-CB 3.4Å; R807-K810 PolarHBondContact O-N 2.67Å; R808-K810 VanDerWaalsContact C-N 3.29Å; R808-K810 PolarHBondContact O-N 2.91Å; K810-I814 WeakPolarHBondContact O-CD1 3.34Å; K810-I814 VanDerWaalsContact O-CG1 3.23Å; K810-I814 WeakPolarHBondContact O-CG1 3.45Å; K810-I814 PolarHBondContact O-N 3.18Å
811	K	35.9	Very low	30.9	Very low	162 Å²	162	127.9 Å²	127.9	70%	0.704	64%	0.636	S	S	*	*	H	α-helix	trans	-73.1	-42.2	177.6	-153	171.9	-175.8	-179.2	0	111.8	R808 N809 I814 D815	R808-K811 PolarHBondContact O-N 3.31Å; N809-K811 VanDerWaalsContact C-N 3.28Å; N809-K811 PolarHBondContact O-N 2.7Å; K811-I814 PolarHBondContact O-N 2.86Å; K811-D815 PolarHBondContact O-N 3.49Å
812	A	34.9	Very low	31	Very low	56 Å²	56	121.2 Å²	121.2	46%	0.463	63%	0.628	S	S	.	*	H	α-helix	trans	-65.7	-37.4	174.4	0	0	0	0	0	113.3	N809 I814 D815 V816	N809-A812 PolarHBondContact O-N 3.43Å; A812-I814 VanDerWaalsContact C-N 3.32Å; A812-I814 PolarHBondContact O-N 3.48Å; A812-D815 PolarHBondContact O-N 2.99Å; A812-V816 WeakPolarHBondContact O-CG2 3.34Å; A812-V816 PolarHBondContact O-N 3.23Å
813	M	29.1	Very low	31.1	Very low	129 Å²	129	120.4 Å²	120.4	64%	0.635	61%	0.612	S	S	*	*	H	α-helix	trans	-64.4	-35.2	172.6	-82.2	-168.6	174.2	0	0	112.7	N809 V816 I817	N809-M813 PolarHBondContact O-N 3.37Å; M813-V816 PolarHBondContact O-N 3.27Å; M813-I817 WeakPolarHBondContact O-CB 3.32Å; M813-I817 WeakPolarHBondContact O-CD1 3.45Å; M813-I817 WeakPolarHBondContact O-CG1 3.39Å; M813-I817 PolarHBondContact O-N 3.02Å
814	I	34.6	Very low	31.1	Very low	101 Å²	101	117.5 Å²	117.5	52%	0.518	61%	0.605	S	S	.	*	H	α-helix	trans	-64.4	-40.7	177.4	-73.1	164.2	0	0	0	111	K810 K811 A812 V816 I817 S818	K810-I814 WeakPolarHBondContact O-CD1 3.34Å; K810-I814 VanDerWaalsContact O-CG1 3.23Å; K810-I814 WeakPolarHBondContact O-CG1 3.45Å; K810-I814 PolarHBondContact O-N 3.18Å; K811-I814 PolarHBondContact O-N 2.86Å; A812-I814 VanDerWaalsContact C-N 3.32Å; A812-I814 PolarHBondContact O-N 3.48Å; I814-V816 PolarHBondContact O-N 3.42Å; I814-I817 PolarHBondContact O-N 3.47Å; I814-S818 WeakPolarHBondContact O-CB 3.33Å; I814-S818 PolarHBondContact O-N 3.04Å; I814-S818 PolarHBondContact O-OG 3.48Å
815	D	33.5	Very low	31.1	Very low	103 Å²	103	116 Å²	116	55%	0.551	59%	0.585	S	S	*	*	H	α-helix	trans	-71.9	-22.8	176.7	-79.9	-19.9	0	0	0	114.9	K811 A812 S818	K811-D815 PolarHBondContact O-N 3.49Å; A812-D815 PolarHBondContact O-N 2.99Å; D815-S818 WeakPolarHBondContact CA-OG 3.47Å; D815-S818 PolarHBondContact O-OG 3.33Å; D815-S818 VanDerWaalsContact O-OG 3.08Å
816	V	32.8	Very low	31	Very low	82 Å²	82	115.4 Å²	115.4	50%	0.497	59%	0.59	S	S	.	*	H	α-helix	trans	-85.2	-30.3	173.4	175.2	0	0	0	0	111.6	A812 M813 I814 K820	A812-V816 WeakPolarHBondContact O-CG2 3.34Å; A812-V816 PolarHBondContact O-N 3.23Å; M813-V816 PolarHBondContact O-N 3.27Å; I814-V816 PolarHBondContact O-N 3.42Å; V816-K820 WeakPolarHBondContact O-CG 3.21Å; V816-K820 PolarHBondContact O-N 2.82Å
817	I	33.5	Very low	30.9	Very low	73 Å²	73	121.3 Å²	121.3	37%	0.374	61%	0.606	S	S	.	*	H	α-helix	trans	-75.7	-39.8	176	-69.8	166.6	0	0	0	110.8	M813 I814 K819 K820 A821	M813-I817 WeakPolarHBondContact O-CB 3.32Å; M813-I817 WeakPolarHBondContact O-CD1 3.45Å; M813-I817 WeakPolarHBondContact O-CG1 3.39Å; M813-I817 PolarHBondContact O-N 3.02Å; I814-I817 PolarHBondContact O-N 3.47Å; I817-K819 VanDerWaalsContact C-N 3.27Å; I817-K819 PolarHBondContact O-N 2.85Å; I817-K820 PolarHBondContact O-N 3.16Å; I817-A821 PolarHBondContact O-N 3.1Å
818	S	32.2	Very low	30.5	Very low	72 Å²	72	118.3 Å²	118.3	50%	0.503	60%	0.595	S	S	.	*	H	α-helix	trans	-59.5	-36.2	174.2	63.9	0	0	0	0	112.4	I814 D815 K820	I814-S818 WeakPolarHBondContact O-CB 3.33Å; I814-S818 PolarHBondContact O-N 3.04Å; I814-S818 PolarHBondContact O-OG 3.48Å; D815-S818 WeakPolarHBondContact CA-OG 3.47Å; D815-S818 PolarHBondContact O-OG 3.33Å; D815-S818 VanDerWaalsContact O-OG 3.08Å; S818-K820 VanDerWaalsContact C-N 3.34Å; S818-K820 PolarHBondContact O-N 3.05Å
819	K	31.1	Very low	30.3	Very low	174 Å²	174	112.4 Å²	112.4	76%	0.757	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-8.8	173.5	-74.6	175.8	178.8	167.6	0	115.1	I817	I817-K819 VanDerWaalsContact C-N 3.27Å; I817-K819 PolarHBondContact O-N 2.85Å
820	K	30.2	Very low	30	Very low	144 Å²	144	117 Å²	117	63%	0.626	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-23.8	178.6	-82.2	-177.8	177.4	-179	0	114.3	V816 I817 S818 A822	V816-K820 WeakPolarHBondContact O-CG 3.21Å; V816-K820 PolarHBondContact O-N 2.82Å; I817-K820 PolarHBondContact O-N 3.16Å; S818-K820 VanDerWaalsContact C-N 3.34Å; S818-K820 PolarHBondContact O-N 3.05Å; K820-A822 PolarHBondContact O-N 3.43Å
821	A	29.3	Very low	30	Very low	51 Å²	51	111.8 Å²	111.8	42%	0.421	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-67.4	-12.6	-179.3	0	0	0	0	0	114.9	I817 F823	I817-A821 PolarHBondContact O-N 3.1Å; A821-F823 PolarHBondContact O-N 3.35Å; A821-F823 VanDerWaalsContact O-N 3.16Å
822	A	26.7	Very low	29.8	Very low	83 Å²	83	109 Å²	109	69%	0.686	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-77.5	8.4	-172.8	0	0	0	0	0	116	K820	K820-A822 PolarHBondContact O-N 3.43Å
823	F	25.6	Very low	29.6	Very low	132 Å²	132	112.1 Å²	112.1	58%	0.579	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-133.8	4	-155.8	-107.9	-70.8	0	0	0	117.1	M460 A821	M460-F823 HydrophobicContact CE-CB 3.63Å; M460-F823 HydrophobicContact CE-CD1 3.26Å; M460-F823 HydrophobicContact CE-CD2 3.82Å; M460-F823 HydrophobicContact CE-CE1 3.8Å; M460-F823 HydrophobicContact CE-CE2 4.29Å; M460-F823 HydrophobicContact CE-CG 3.27Å; M460-F823 HydrophobicContact CE-CZ 4.29Å; M460-F823 HydrophobicContact SD-CB 3.59Å; M460-F823 VanDerWaalsContact SD-CB 3.59Å; M460-F823 HydrophobicContact SD-CD1 3.69Å; M460-F823 HydrophobicContact SD-CG 3.82Å; A821-F823 PolarHBondContact O-N 3.35Å; A821-F823 VanDerWaalsContact O-N 3.16Å
824	S	25.6	Very low	29.9	Very low	85 Å²	85	109.1 Å²	109.1	59%	0.594	57%	0.573	S	S	*	*			trans	-129.2	43.4	-176	63.8	0	0	0	0	113.1
825	Q	25.5	Very low	29.8	Very low	83 Å²	83	114.2 Å²	114.2	39%	0.388	59%	0.586	S	S	.	*			trans	-101	141.7	172.9	-58.6	-146	-53.5	0	0	111	N187	N187-Q825 VanDerWaalsContact ND2-CD 3.34Å; N187-Q825 PolarHBondContact ND2-NE2 3.3Å; N187-Q825 PolarHBondContact ND2-OE1 3.46Å
826	P	26.3	Very low	29.9	Very low	117 Å²	117	114.7 Å²	114.7	76%	0.76	58%	0.584	S	S	*	*	S	Bend	trans	-59.6	144.7	162.1	29.4	-33.7	0	0	0	108.7	R828	P826-R828 PolarHBondContact O-N 2.65Å
827	Y	26	Very low	30	Very low	222 Å²	222	113 Å²	113	87%	0.871	58%	0.579	S	S	*	*			trans	-55.3	87.4	-161.9	-64.1	-90.8	0	0	0	115.3	T829	Y827-T829 PolarHBondContact O-N 2.85Å
828	R	25.7	Very low	29.9	Very low	160 Å²	160	110.7 Å²	110.7	60%	0.604	57%	0.571	S	S	*	*			trans	-74	102.4	161.9	-108.7	-175.6	-178.5	-171.7	4	108.4	S189 P826 K830	S189-R828 PolarHBondContact OG-NH1 3.38Å; S189-R828 VanDerWaalsContact OG-NH1 3.13Å; P826-R828 PolarHBondContact O-N 2.65Å; R828-K830 PolarHBondContact O-N 3.34Å
829	T	29.7	Very low	30	Very low	80 Å²	80	109.9 Å²	109.9	49%	0.491	57%	0.569	S	S	.	*			trans	-66.1	88.4	175.2	37.7	0	0	0	0	111.3	Y827 S831	Y827-T829 PolarHBondContact O-N 2.85Å; T829-S831 PolarHBondContact O-N 2.82Å
830	K	27.7	Very low	30.3	Very low	193 Å²	193	107.2 Å²	107.2	84%	0.839	56%	0.559	S	S	*	*			trans	-72.6	68.3	165.2	-67.2	-175.8	179.3	-179.1	0	110.3	R828	R828-K830 PolarHBondContact O-N 3.34Å
831	S	33.6	Very low	30.6	Very low	46 Å²	46	104.8 Å²	104.8	32%	0.322	55%	0.55	S	S	.	.			trans	-89.4	128.3	166.9	76.1	0	0	0	0	109.6	T829 L833 L834	T829-S831 PolarHBondContact O-N 2.82Å; S831-L833 PolarHBondContact O-N 3.35Å; S831-L834 PolarHBondContact O-N 2.73Å; S831-L834 WeakPolarHBondContact OG-CB 3.37Å; S831-L834 PolarHBondContact OG-N 3.5Å
832	P	31.6	Very low	30.9	Very low	102 Å²	102	105.3 Å²	105.3	66%	0.662	55%	0.545	S	S	*	.	H	α-helix	trans	-56.2	-35.3	168.7	-25.9	35.6	0	0	0	111.6	L834 R835 E836	P832-L834 VanDerWaalsContact C-N 3.28Å; P832-L834 PolarHBondContact O-N 3.03Å; P832-R835 WeakPolarHBondContact O-CA 3.3Å; P832-R835 WeakPolarHBondContact O-CB 3.41Å; P832-R835 PolarHBondContact O-N 3.32Å; P832-E836 PolarHBondContact O-N 3.37Å
833	L	32.1	Very low	31.4	Very low	122 Å²	122	105.3 Å²	105.3	64%	0.639	54%	0.54	S	S	*	.	H	α-helix	trans	-56.9	-31.3	177.9	-68	167.9	0	0	0	114.4	S831 A837	S831-L833 PolarHBondContact O-N 3.35Å; L833-A837 WeakPolarHBondContact O-CB 3.49Å; L833-A837 PolarHBondContact O-N 2.85Å
834	L	34.8	Very low	32	Very low	66 Å²	66	107.7 Å²	107.7	35%	0.346	55%	0.545	S	S	.	.	H	α-helix	trans	-72.7	-32.5	174.5	-103.8	160.3	0	0	0	112.2	S831 P832 A838	S831-L834 PolarHBondContact O-N 2.73Å; S831-L834 WeakPolarHBondContact OG-CB 3.37Å; S831-L834 PolarHBondContact OG-N 3.5Å; P832-L834 VanDerWaalsContact C-N 3.28Å; P832-L834 PolarHBondContact O-N 3.03Å; L834-A838 WeakPolarHBondContact O-CB 3.35Å; L834-A838 PolarHBondContact O-N 2.85Å
835	R	33.3	Very low	32.2	Very low	209 Å²	209	106.5 Å²	106.5	79%	0.789	53%	0.532	S	S	*	.	H	α-helix	trans	-75.8	-35.2	175.1	-165.3	-177	-65.5	172	-4.1	111.2	P832 A839	P832-R835 WeakPolarHBondContact O-CA 3.3Å; P832-R835 WeakPolarHBondContact O-CB 3.41Å; P832-R835 PolarHBondContact O-N 3.32Å; R835-A839 VanDerWaalsContact O-CB 3.24Å; R835-A839 WeakPolarHBondContact O-CB 3.49Å; R835-A839 PolarHBondContact O-N 2.84Å
836	E	34.7	Very low	32.4	Very low	112 Å²	112	107.7 Å²	107.7	52%	0.523	55%	0.547	S	S	.	.	H	α-helix	trans	-74.2	-40.3	177.8	-156.3	164.2	-143.3	0	0	111.8	P832 A839 Q840	P832-E836 PolarHBondContact O-N 3.37Å; E836-A839 PolarHBondContact O-N 3.46Å; E836-Q840 WeakPolarHBondContact O-CB 3.42Å; E836-Q840 VanDerWaalsContact O-CG 3.32Å; E836-Q840 WeakPolarHBondContact O-CG 3.35Å; E836-Q840 PolarHBondContact O-N 2.77Å
837	A	34	Very low	32.6	Very low	47 Å²	47	107.8 Å²	107.8	39%	0.388	53%	0.533	S	S	.	.	H	α-helix	trans	-68.3	-39.7	171.1	0	0	0	0	0	112.3	L833 Q840 E841	L833-A837 WeakPolarHBondContact O-CB 3.49Å; L833-A837 PolarHBondContact O-N 2.85Å; A837-Q840 PolarHBondContact O-N 2.78Å; A837-E841 PolarHBondContact O-N 3.17Å
838	A	31.8	Very low	32.8	Very low	24 Å²	24	102.8 Å²	102.8	20%	0.198	52%	0.516	C	S	.	.	H	α-helix	trans	-62.7	-42	171.6	0	0	0	0	0	111.3	L834 E841 L842	L834-A838 WeakPolarHBondContact O-CB 3.35Å; L834-A838 PolarHBondContact O-N 2.85Å; A838-E841 PolarHBondContact O-N 3.4Å; A838-L842 WeakPolarHBondContact O-CB 3.39Å; A838-L842 WeakPolarHBondContact O-CD1 3.42Å; A838-L842 WeakPolarHBondContact O-CG 3.42Å; A838-L842 PolarHBondContact O-N 3.45Å
839	A	34.8	Very low	32.9	Very low	56 Å²	56	102.1 Å²	102.1	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-38.4	174.9	0	0	0	0	0	112.8	R835 E836 S843	R835-A839 VanDerWaalsContact O-CB 3.24Å; R835-A839 WeakPolarHBondContact O-CB 3.49Å; R835-A839 PolarHBondContact O-N 2.84Å; E836-A839 PolarHBondContact O-N 3.46Å; A839-S843 WeakPolarHBondContact O-CB 3.42Å; A839-S843 PolarHBondContact O-N 2.72Å
840	Q	38.1	Very low	32.9	Very low	117 Å²	117	102.9 Å²	102.9	55%	0.547	54%	0.538	S	S	.	.	H	α-helix	trans	-67.8	-39.9	175.9	-77.7	176.7	-5.5	0	0	112.4	E836 A837 S843 R844	E836-Q840 WeakPolarHBondContact O-CB 3.42Å; E836-Q840 VanDerWaalsContact O-CG 3.32Å; E836-Q840 WeakPolarHBondContact O-CG 3.35Å; E836-Q840 PolarHBondContact O-N 2.77Å; A837-Q840 PolarHBondContact O-N 2.78Å; Q840-S843 PolarHBondContact O-N 3.09Å; Q840-S843 PolarHBondContact O-OG 3.43Å; Q840-R844 WeakPolarHBondContact O-CG 3.34Å; Q840-R844 PolarHBondContact O-N 2.76Å
841	E	36.3	Very low	33	Very low	93 Å²	93	98 Å²	98	44%	0.435	53%	0.528	S	S	.	.	H	α-helix	trans	-77.1	-31.2	175.5	-68.2	-65.9	115.2	0	0	112.5	A837 A838 S843 R844 N845	A837-E841 PolarHBondContact O-N 3.17Å; A838-E841 PolarHBondContact O-N 3.4Å; E841-S843 VanDerWaalsContact C-N 3.33Å; E841-R844 PolarHBondContact O-N 3.4Å; E841-R844 WeakPolarHBondContact OE1-CD 3.32Å; E841-R844 IonicContact OE1-CZ 2.67Å; E841-R844 IonicContact OE1-NE 3.89Å; E841-R844 IonicContact OE1-NH1 2.71Å; E841-R844 PolarHBondContact OE1-NH1 3.19Å; E841-N845 PolarHBondContact O-N 3.35Å
842	L	35.5	Very low	32.7	Very low	62 Å²	62	104.5 Å²	104.5	33%	0.325	55%	0.553	S	S	.	*	H	α-helix	trans	-63.1	-38.2	167.5	-77	163.5	0	0	0	111.4	A838 R844 N845 F848	A838-L842 WeakPolarHBondContact O-CB 3.39Å; A838-L842 WeakPolarHBondContact O-CD1 3.42Å; A838-L842 WeakPolarHBondContact O-CG 3.42Å; A838-L842 PolarHBondContact O-N 3.45Å; L842-R844 PolarHBondContact O-N 2.81Å; L842-N845 PolarHBondContact O-N 3.27Å; L842-N845 VanDerWaalsContact O-N 3.16Å; L842-F848 HydrophobicContact CD2-CD2 4.18Å; L842-F848 HydrophobicContact CD2-CE2 4.01Å
843	S	37.5	Very low	32.4	Very low	83 Å²	83	104.2 Å²	104.2	58%	0.58	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-11.6	175	78.7	0	0	0	0	114.2	A839 Q840 E841	A839-S843 WeakPolarHBondContact O-CB 3.42Å; A839-S843 PolarHBondContact O-N 2.72Å; Q840-S843 PolarHBondContact O-N 3.09Å; Q840-S843 PolarHBondContact O-OG 3.43Å; E841-S843 VanDerWaalsContact C-N 3.33Å
844	R	36.7	Very low	32.1	Very low	182 Å²	182	106.7 Å²	106.7	69%	0.687	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-3.6	175.4	-73.4	169.6	169	177.1	-6	113.3	Q840 E841 L842	Q840-R844 WeakPolarHBondContact O-CG 3.34Å; Q840-R844 PolarHBondContact O-N 2.76Å; E841-R844 PolarHBondContact O-N 3.4Å; E841-R844 WeakPolarHBondContact OE1-CD 3.32Å; E841-R844 IonicContact OE1-CZ 2.67Å; E841-R844 IonicContact OE1-NE 3.89Å; E841-R844 IonicContact OE1-NH1 2.71Å; E841-R844 PolarHBondContact OE1-NH1 3.19Å; L842-R844 PolarHBondContact O-N 2.81Å
845	N	30.1	Very low	31.7	Very low	61 Å²	61	110.3 Å²	110.3	33%	0.326	59%	0.589	S	S	.	*	S	Bend	trans	-91.4	117.6	179.9	-164.6	-21.9	0	0	0	110.4	E841 L842 Y847 F848	E841-N845 PolarHBondContact O-N 3.35Å; L842-N845 PolarHBondContact O-N 3.27Å; L842-N845 VanDerWaalsContact O-N 3.16Å; N845-Y847 PolarHBondContact O-N 3.2Å; N845-Y847 WeakPolarHBondContact OD1-CD2 3.42Å; N845-F848 PolarHBondContact O-N 3.11Å; N845-F848 VanDerWaalsContact O-N 3.09Å
846	P	30.7	Very low	31.3	Very low	108 Å²	108	105.1 Å²	105.1	70%	0.701	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-13.7	-173.7	-26.8	35.8	0	0	0	116
847	Y	29.2	Very low	30.9	Very low	119 Å²	119	105 Å²	105	47%	0.467	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	-9.5	179.1	-66.2	-74.8	0	0	0	114.5	L628 T632 N845	L628-Y847 HydrophobicContact CD2-CD2 4.12Å; L628-Y847 HydrophobicContact CD2-CE2 3.91Å; L628-Y847 HydrophobicContact CG-CE2 4.14Å; T632-Y847 HydrophobicContact CG2-CE1 3.62Å; T632-Y847 WeakPolarHBondContact OG1-CE1 3.46Å; T632-Y847 PolarHBondContact OG1-OH 3.48Å; N845-Y847 PolarHBondContact O-N 3.2Å; N845-Y847 WeakPolarHBondContact OD1-CD2 3.42Å
848	F	30.1	Very low	30.6	Very low	116 Å²	116	110.4 Å²	110.4	51%	0.509	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92	2.3	-172.5	-138.8	-96.1	0	0	0	115	L842 N845	L842-F848 HydrophobicContact CD2-CD2 4.18Å; L842-F848 HydrophobicContact CD2-CE2 4.01Å; N845-F848 PolarHBondContact O-N 3.11Å; N845-F848 VanDerWaalsContact O-N 3.09Å
849	L	29.1	Very low	30.3	Very low	147 Å²	147	114.4 Å²	114.4	77%	0.77	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	10.1	-173.4	-71.2	172.5	0	0	0	115
850	A	28.7	Very low	29.9	Very low	96 Å²	96	115 Å²	115	79%	0.793	65%	0.649	S	S	*	*	S	Bend	trans	-111.7	9.7	-170.9	0	0	0	0	0	116
851	S	30.1	Very low	29.3	Very low	89 Å²	89	117.5 Å²	117.5	62%	0.622	66%	0.661	S	S	*	*	S	Bend	trans	-135.8	8.6	178.9	64.9	0	0	0	0	115.8
852	H	28.1	Very low	28.7	Very low	184 Å²	184	117.3 Å²	117.3	85%	0.852	68%	0.676	S	S	*	*	S	Bend	trans	-138.3	68.1	173.4	-75.5	-52.4	0	0	0	111.7
853	S	25	Very low	28.3	Very low	95 Å²	95	121.3 Å²	121.3	66%	0.664	70%	0.697	S	S	*	*			trans	-155.4	140.6	164.1	-176.4	0	0	0	0	108.1
854	M	26.1	Very low	27.8	Very low	175 Å²	175	123.6 Å²	123.6	86%	0.862	70%	0.702	S	S	*	*	S	Bend	trans	65.7	118	-166.1	-46.5	-73.7	164.6	0	0	112.1
855	T	25.9	Very low	27.4	Very low	142 Å²	142	122.7 Å²	122.7	87%	0.871	71%	0.706	S	S	*	*			cis	-122	135.3	18.2	46.7	0	0	0	0	113.5
856	S	25.7	Very low	27.5	Very low	99 Å²	99	125.3 Å²	125.3	69%	0.692	72%	0.72	S	S	*	*			trans	-88.5	156.1	168.2	48.2	0	0	0	0	111.5
857	S	25.7	Very low	27.4	Very low	111 Å²	111	126.4 Å²	126.4	78%	0.776	72%	0.72	S	S	*	*			trans	70.8	152.8	160.5	98.9	0	0	0	0	114.6
858	M	26.5	Very low	27.2	Very low	159 Å²	159	126.5 Å²	126.5	78%	0.783	73%	0.728	S	S	*	*			cis	-134.6	-166.1	-22.2	-66.1	-154.6	88.7	0	0	106.3
859	T	26.5	Very low	27.4	Very low	108 Å²	108	129.8 Å²	129.8	66%	0.663	74%	0.743	S	S	*	*			cis	-152.4	-170.2	5.9	-25.4	0	0	0	0	108.7	Q861	T859-Q861 HydrophobicContact CG2-CB 4.08Å; T859-Q861 HydrophobicContact CG2-CG 4.36Å
860	G	25.4	Very low	27.4	Very low	69 Å²	69	128.9 Å²	128.9	71%	0.711	74%	0.743	S	S	*	*			trans	125.6	64.4	164.2	0	0	0	0	0	112.9
861	Q	27	Very low	27.6	Very low	169 Å²	169	129.2 Å²	129.2	79%	0.79	74%	0.737	S	S	*	*			cis	44.1	125.9	46	-83	-173.3	-19.9	0	0	113.7	T859	T859-Q861 HydrophobicContact CG2-CB 4.08Å; T859-Q861 HydrophobicContact CG2-CG 4.36Å
862	A	24.2	Very low	27.6	Very low	90 Å²	90	132 Å²	132	74%	0.744	75%	0.745	S	S	*	*	S	Bend	trans	-72	166	-174.8	0	0	0	0	0	112.3
863	L	25.9	Very low	27.6	Very low	146 Å²	146	128.4 Å²	128.4	76%	0.764	74%	0.736	S	S	*	*			trans	85	109.4	165.8	-51.9	173.3	0	0	0	116.3
864	D	28.1	Very low	27.8	Very low	131 Å²	131	132.5 Å²	132.5	70%	0.701	75%	0.745	S	S	*	*				73.9	106.7	127	-50.8	-13.6	0	0	0	120.5
865	E	26.5	Very low	27.7	Very low	162 Å²	162	133.3 Å²	133.3	76%	0.757	75%	0.746	S	S	*	*				75.9	126	122.2	-72.2	-161.1	-171.5	0	0	122.6
866	N	32.2	Very low	27.9	Very low	116 Å²	116	131.4 Å²	131.4	62%	0.62	75%	0.745	S	S	*	*			trans	85.3	104.5	142.6	-59	-28.8	0	0	0	121.1
867	N	28.5	Very low	27.8	Very low	132 Å²	132	134.7 Å²	134.7	71%	0.706	76%	0.755	S	S	*	*				88.1	113.2	121.8	-67.4	-11.8	0	0	0	122.1
868	D	26.8	Very low	27.9	Very low	120 Å²	120	138.7 Å²	138.7	64%	0.642	76%	0.761	S	S	*	*				53.9	103.9	119.5	-74.2	10.8	0	0	0	120.8
869	K	33.2	Very low	27.9	Very low	186 Å²	186	136.8 Å²	136.8	81%	0.809	76%	0.759	S	S	*	*				170.8	142.4	89.1	-98.2	139.7	-170	168.3	0	114.8
870	T	29.8	Very low	28	Very low	127 Å²	127	137.5 Å²	137.5	78%	0.779	77%	0.766	S	S	*	*			trans	-70	167.4	162	46.9	0	0	0	0	110.3
871	P	32.9	Very low	28.3	Very low	103 Å²	103	140 Å²	140	67%	0.669	77%	0.767	S	S	*	*				-157.8	166.9	55.2	45.9	-23.1	0	0	0	121
872	D	29	Very low	29	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	76%	0.759	S	S	*	*				63.8	145.4	129.8	-69.6	3.4	0	0	0	122.8
873	T	28.6	Very low	29.5	Very low	108 Å²	108	141.4 Å²	141.4	66%	0.663	76%	0.759	S	S	*	*			cis	-158.4	-176.4	-8.8	-63.1	0	0	0	0	109.5
874	E	28.5	Very low	30.7	Very low	181 Å²	181	140 Å²	140	85%	0.846	75%	0.752	S	S	*	*			trans	92.1	90	164.1	-54.4	-174.7	174.5	0	0	116.3
875	Q	25.6	Very low	32	Very low	191 Å²	191	136.2 Å²	136.2	89%	0.893	74%	0.736	S	S	*	*				74.9	100.7	71.2	-72.6	-161.9	1.5	0	0	117.6
876	A	28.4	Very low	33.6	Very low	103 Å²	103	133.3 Å²	133.3	85%	0.851	73%	0.726	S	S	*	*			trans	-156.7	145.9	145.3	0	0	0	0	0	110.1
877	N	24.8	Very low	35.4	Very low	167 Å²	167	132.2 Å²	132.2	89%	0.893	72%	0.719	S	S	*	*			trans	-102	130.8	-169.8	-68.4	-59.7	0	0	0	113.6
878	E	28.5	Very low	37.4	Very low	195 Å²	195	131.4 Å²	131.4	91%	0.911	71%	0.712	S	S	*	*			trans	-133.5	141.7	161.2	-71.2	-165.4	162.1	0	0	111.4
879	T	26.6	Very low	39.4	Very low	120 Å²	120	127.3 Å²	127.3	74%	0.736	69%	0.688	S	S	*	*			trans	-96.7	145.7	-170.2	54.1	0	0	0	0	114.1	V881	T879-V881 VanDerWaalsContact C-N 3.31Å; T879-V881 PolarHBondContact O-N 2.84Å
880	P	28.1	Very low	41.3	Very low	123 Å²	123	120.4 Å²	120.4	80%	0.799	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	19	-159.7	-14.5	32.6	0	0	0	117.2
881	V	31	Very low	43.6	Very low	121 Å²	121	119.4 Å²	119.4	73%	0.733	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-13.6	-160	-176.8	0	0	0	0	114.4	T879	T879-V881 VanDerWaalsContact C-N 3.31Å; T879-V881 PolarHBondContact O-N 2.84Å
882	S	41.1	Very low	45.7	Very low	89 Å²	89	116.1 Å²	116.1	62%	0.622	63%	0.632	S	S	*	*	S	Bend	trans	-81.3	-34.5	-168.7	63.1	0	0	0	0	116.5	S885	S882-S885 PolarHBondContact O-OG 3.43Å
883	R	35.7	Very low	48	Very low	200 Å²	200	112.4 Å²	112.4	76%	0.755	61%	0.612	S	S	*	*	H	α-helix	trans	-69.3	-44	-170.1	-81.1	-178.5	171.3	153	-0.2	114.6	S885 L886	R883-S885 VanDerWaalsContact C-N 3.25Å; R883-S885 PolarHBondContact O-N 2.61Å; R883-L886 PolarHBondContact O-N 3.3Å
884	N	50.2	Low	50.4	Low	116 Å²	116	109.6 Å²	109.6	62%	0.62	60%	0.599	S	S	*	*	H	α-helix	trans	-64	-25.6	-173.2	-74.7	-18.3	0	0	0	114.3	Q888	N884-Q888 WeakPolarHBondContact O-CG 3.25Å; N884-Q888 PolarHBondContact O-N 3.44Å
885	S	57.1	Low	52.9	Low	52 Å²	52	104.7 Å²	104.7	36%	0.364	58%	0.575	S	S	.	*	H	α-helix	trans	-79	-22.8	-179.4	71.2	0	0	0	0	113	R592 S882 R883 Q889	R592-S885 PolarHBondContact NH2-O 3.1Å; S882-S885 PolarHBondContact O-OG 3.43Å; R883-S885 VanDerWaalsContact C-N 3.25Å; R883-S885 PolarHBondContact O-N 2.61Å; S885-Q889 PolarHBondContact O-N 3.25Å
886	L	58.5	Low	55.7	Low	101 Å²	101	97 Å²	97	53%	0.529	54%	0.54	S	S	.	.	H	α-helix	trans	-76.5	-44.3	178.5	-158.1	75.6	0	0	0	110.9	R883 Q888 Q889 A890	R883-L886 PolarHBondContact O-N 3.3Å; L886-Q888 PolarHBondContact O-N 2.79Å; L886-Q889 WeakPolarHBondContact O-CB 3.32Å; L886-Q889 PolarHBondContact O-N 3.2Å; L886-A890 PolarHBondContact O-N 3.04Å
887	D	71.3	Confident	58.4	Low	92 Å²	92	98.4 Å²	98.4	49%	0.492	53%	0.526	S	S	.	.	H	α-helix	trans	-63	-40.2	177.7	-69.3	-23.3	0	0	0	112.2	A890 L891	D887-A890 PolarHBondContact O-N 3.02Å; D887-L891 WeakPolarHBondContact O-CB 3.5Å; D887-L891 PolarHBondContact O-N 3.34Å
888	Q	68.8	Low	61.2	Low	116 Å²	116	93 Å²	93	54%	0.542	50%	0.496	S	S	.	.	H	α-helix	trans	-63.6	-41.9	174.9	-72.4	177.5	-0.1	0	0	111.8	N884 L886 L891 L892	N884-Q888 WeakPolarHBondContact O-CG 3.25Å; N884-Q888 PolarHBondContact O-N 3.44Å; L886-Q888 PolarHBondContact O-N 2.79Å; Q888-L891 PolarHBondContact O-N 3.2Å; Q888-L892 WeakPolarHBondContact O-CG 3.4Å; Q888-L892 PolarHBondContact O-N 2.8Å; Q888-L892 VanDerWaalsContact O-N 3.09Å
889	Q	70.3	Confident	64	Low	33 Å²	33	84.1 Å²	84.1	15%	0.154	45%	0.454	C	S	.	.	H	α-helix	trans	-63.1	-45.4	175.5	-169.8	-173.8	24.2	0	0	111.7	M588 S885 L886 L891 L892 L893	M588-Q889 HydrophobicContact CE-CB 4.33Å; M588-Q889 HydrophobicContact CE-CG 4.29Å; S885-Q889 PolarHBondContact O-N 3.25Å; L886-Q889 WeakPolarHBondContact O-CB 3.32Å; L886-Q889 PolarHBondContact O-N 3.2Å; Q889-L891 VanDerWaalsContact C-N 3.34Å; Q889-L891 PolarHBondContact O-N 3.44Å; Q889-L892 PolarHBondContact O-N 3.27Å; Q889-L893 HydrophobicContact CG-CD1 4.03Å; Q889-L893 HydrophobicContact CG-CG 4.46Å; Q889-L893 WeakPolarHBondContact O-CB 3.49Å; Q889-L893 VanDerWaalsContact O-CG 3.32Å; Q889-L893 WeakPolarHBondContact O-CG 3.34Å; Q889-L893 PolarHBondContact O-N 3.12Å
890	A	72.4	Confident	66.9	Low	41 Å²	41	80.2 Å²	80.2	34%	0.339	43%	0.428	S	S	.	.	H	α-helix	trans	-60.4	-42.5	178	0	0	0	0	0	112.1	L886 D887 L893 A894	L886-A890 PolarHBondContact O-N 3.04Å; D887-A890 PolarHBondContact O-N 3.02Å; A890-L893 PolarHBondContact O-N 3.09Å; A890-A894 WeakPolarHBondContact O-CB 3.12Å; A890-A894 PolarHBondContact O-N 3.13Å
891	L	77.7	Confident	69.8	Low	107 Å²	107	77.9 Å²	77.9	56%	0.56	41%	0.409	S	S	*	.	H	α-helix	trans	-63.3	-41.4	176.9	-178.5	63	0	0	0	112.6	D887 Q888 Q889 A894 K895	D887-L891 WeakPolarHBondContact O-CB 3.5Å; D887-L891 PolarHBondContact O-N 3.34Å; Q888-L891 PolarHBondContact O-N 3.2Å; Q889-L891 VanDerWaalsContact C-N 3.34Å; Q889-L891 PolarHBondContact O-N 3.44Å; L891-A894 PolarHBondContact O-N 3.37Å; L891-K895 WeakPolarHBondContact O-CB 3.14Å; L891-K895 PolarHBondContact O-N 3.05Å
892	L	76.9	Confident	72.5	Confident	33 Å²	33	72.1 Å²	72.1	17%	0.173	37%	0.374	C	S	.	.	H	α-helix	trans	-71.8	-37.9	179.7	-70	166.3	0	0	0	111.8	L581 I585 M588 Q888 Q889 K895 Q896	L581-L892 HydrophobicContact CD1-CB 4.3Å; L581-L892 HydrophobicContact CD1-CD2 3.5Å; L581-L892 HydrophobicContact CD1-CG 4.49Å; I585-L892 HydrophobicContact CD1-CB 4.28Å; I585-L892 HydrophobicContact CG1-CB 3.9Å; M588-L892 HydrophobicContact CE-CB 4.15Å; M588-L892 HydrophobicContact CE-CD1 3.32Å; M588-L892 HydrophobicContact CE-CG 4.34Å; M588-L892 HydrophobicContact SD-CD1 3.72Å; Q888-L892 WeakPolarHBondContact O-CG 3.4Å; Q888-L892 PolarHBondContact O-N 2.8Å; Q888-L892 VanDerWaalsContact O-N 3.09Å; Q889-L892 PolarHBondContact O-N 3.27Å; L892-K895 HydrophobicContact CD2-CD 4.39Å; L892-K895 WeakPolarHBondContact O-CB 3.47Å; L892-K895 PolarHBondContact O-N 2.72Å; L892-Q896 PolarHBondContact O-N 3.47Å
893	L	78.5	Confident	74.8	Confident	71 Å²	71	67.9 Å²	67.9	37%	0.372	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-40.7	171.6	-70.3	170.5	0	0	0	112.5	I585 Q889 A890 Q896 K897	I585-L893 HydrophobicContact CG2-CD2 4.21Å; Q889-L893 HydrophobicContact CG-CD1 4.03Å; Q889-L893 HydrophobicContact CG-CG 4.46Å; Q889-L893 WeakPolarHBondContact O-CB 3.49Å; Q889-L893 VanDerWaalsContact O-CG 3.32Å; Q889-L893 WeakPolarHBondContact O-CG 3.34Å; Q889-L893 PolarHBondContact O-N 3.12Å; A890-L893 PolarHBondContact O-N 3.09Å; L893-Q896 WeakPolarHBondContact O-CB 3.17Å; L893-Q896 PolarHBondContact O-N 3.47Å; L893-K897 PolarHBondContact O-N 3.21Å
894	A	78.6	Confident	77.5	Confident	49 Å²	49	59.7 Å²	59.7	41%	0.405	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-42.7	174.9	0	0	0	0	0	111.9	A890 L891 Q896 K897 Q898	A890-A894 WeakPolarHBondContact O-CB 3.12Å; A890-A894 PolarHBondContact O-N 3.13Å; L891-A894 PolarHBondContact O-N 3.37Å; A894-Q896 VanDerWaalsContact C-N 3.33Å; A894-Q896 PolarHBondContact O-N 2.9Å; A894-K897 PolarHBondContact O-N 3.39Å; A894-Q898 PolarHBondContact O-N 3Å
895	K	81.7	Confident	79.4	Confident	78 Å²	78	55.1 Å²	55.1	34%	0.339	29%	0.292	S	S	.	.	H	α-helix	trans	-60.8	-40.5	172.8	-174.3	-171.9	164.8	-164.2	0	111.2	L581 E584 L891 L892 Q898 M899	L581-K895 HydrophobicContact CD1-CD 3.87Å; L581-K895 HydrophobicContact CD2-CB 4.01Å; L581-K895 HydrophobicContact CD2-CD 3.87Å; L581-K895 HydrophobicContact CD2-CG 3.7Å; E584-K895 IonicContact OE2-NZ 3.31Å; L891-K895 WeakPolarHBondContact O-CB 3.14Å; L891-K895 PolarHBondContact O-N 3.05Å; L892-K895 HydrophobicContact CD2-CD 4.39Å; L892-K895 WeakPolarHBondContact O-CB 3.47Å; L892-K895 PolarHBondContact O-N 2.72Å; K895-Q898 PolarHBondContact O-N 3.41Å; K895-M899 HydrophobicContact CD-CE 4.42Å; K895-M899 HydrophobicContact CG-CE 4.09Å; K895-M899 WeakPolarHBondContact O-CG 3.21Å; K895-M899 PolarHBondContact O-N 3.03Å
896	Q	84.2	Confident	81	Confident	30 Å²	30	52.7 Å²	52.7	14%	0.14	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-48.3	176.2	-169.6	-172.3	2.2	0	0	111.4	Y578 L581 I585 L892 L893 A894 Q898 M899 I900	Y578-Q896 HydrophobicContact CD2-CG 4.29Å; Y578-Q896 HydrophobicContact CE2-CG 3.67Å; Y578-Q896 PolarHBondContact OH-NE2 2.79Å; L581-Q896 HydrophobicContact CD2-CB 3.95Å; I585-Q896 HydrophobicContact CD1-CB 3.74Å; I585-Q896 HydrophobicContact CD1-CG 4.13Å; I585-Q896 VanDerWaalsContact CD1-OE1 3.32Å; L892-Q896 PolarHBondContact O-N 3.47Å; L893-Q896 WeakPolarHBondContact O-CB 3.17Å; L893-Q896 PolarHBondContact O-N 3.47Å; A894-Q896 VanDerWaalsContact C-N 3.33Å; A894-Q896 PolarHBondContact O-N 2.9Å; Q896-Q898 VanDerWaalsContact C-N 3.28Å; Q896-Q898 PolarHBondContact O-N 2.83Å; Q896-M899 PolarHBondContact O-N 2.71Å; Q896-M899 VanDerWaalsContact O-N 3.1Å; Q896-I900 HydrophobicContact CG-CD1 4.02Å; Q896-I900 WeakPolarHBondContact O-CG1 3.45Å; Q896-I900 PolarHBondContact O-N 3.32Å
897	K	84.4	Confident	82.5	Confident	132 Å²	132	48.1 Å²	48.1	57%	0.574	25%	0.251	S	S	*	.	H	α-helix	trans	-58.5	-40.3	176.4	-168.8	174.1	-175	175.2	0	111.6	L893 A894 I900 N901	L893-K897 PolarHBondContact O-N 3.21Å; A894-K897 PolarHBondContact O-N 3.39Å; K897-I900 PolarHBondContact O-N 2.69Å; K897-N901 PolarHBondContact O-N 2.67Å; K897-N901 PolarHBondContact O-ND2 3.14Å
898	Q	84	Confident	83.4	Confident	55 Å²	55	50.4 Å²	50.4	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-64.3	-40.5	174.9	-168.7	-178.1	3.7	0	0	112.6	W545 A894 K895 Q896 V902	W545-Q898 HydrophobicContact CB-CG 4.04Å; W545-Q898 PolarHBondContact O-NE2 2.78Å; A894-Q898 PolarHBondContact O-N 3Å; K895-Q898 PolarHBondContact O-N 3.41Å; Q896-Q898 VanDerWaalsContact C-N 3.28Å; Q896-Q898 PolarHBondContact O-N 2.83Å; Q898-V902 PolarHBondContact O-N 3.04Å
899	M	87.3	Confident	84.5	Confident	7 Å²	7	49.5 Å²	49.5	3%	0.034	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-45.4	175.8	-68.7	-178.3	174.2	0	0	112.1	W545 Y578 L581 K895 Q896 N901 V902 I903	W545-M899 HydrophobicContact CD2-CG 3.89Å; W545-M899 HydrophobicContact CE3-CB 4.11Å; W545-M899 HydrophobicContact CE3-CG 3.7Å; W545-M899 HydrophobicContact CH2-CB 4.15Å; W545-M899 HydrophobicContact CH2-CE 4.27Å; W545-M899 HydrophobicContact CH2-CG 3.65Å; W545-M899 HydrophobicContact CH2-SD 4.15Å; W545-M899 HydrophobicContact CZ2-CE 3.62Å; W545-M899 HydrophobicContact CZ2-CG 3.85Å; W545-M899 HydrophobicContact CZ2-SD 4.1Å; W545-M899 HydrophobicContact CZ3-CB 3.77Å; W545-M899 HydrophobicContact CZ3-CG 3.58Å; Y578-M899 HydrophobicContact CD2-CB 4.28Å; L581-M899 HydrophobicContact CB-CE 4.43Å; L581-M899 HydrophobicContact CB-SD 4.11Å; L581-M899 HydrophobicContact CD2-CE 3.96Å; L581-M899 HydrophobicContact CD2-SD 3.49Å; L581-M899 WeakPolarHBondContact CD2-SD 3.28Å; L581-M899 HydrophobicContact CG-SD 4.46Å; K895-M899 HydrophobicContact CD-CE 4.42Å; K895-M899 HydrophobicContact CG-CE 4.09Å; K895-M899 WeakPolarHBondContact O-CG 3.21Å; K895-M899 PolarHBondContact O-N 3.03Å; Q896-M899 PolarHBondContact O-N 2.71Å; Q896-M899 VanDerWaalsContact O-N 3.1Å; M899-N901 VanDerWaalsContact C-N 3.31Å; M899-N901 PolarHBondContact O-N 2.55Å; M899-V902 PolarHBondContact O-N 3.1Å; M899-V902 VanDerWaalsContact O-N 3.14Å; M899-I903 WeakPolarHBondContact O-CG1 3.16Å; M899-I903 PolarHBondContact O-N 3.26Å
900	I	87.4	Confident	85.3	Confident	38 Å²	38	50.1 Å²	50.1	20%	0.195	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-43.1	176.9	-66.8	167.1	0	0	0	110.5	Y578 Q896 K897 V902 I903 D904	Y578-I900 HydrophobicContact CD2-CG1 4.18Å; Y578-I900 HydrophobicContact CE2-CD1 3.9Å; Y578-I900 HydrophobicContact CE2-CG1 3.6Å; Q896-I900 HydrophobicContact CG-CD1 4.02Å; Q896-I900 WeakPolarHBondContact O-CG1 3.45Å; Q896-I900 PolarHBondContact O-N 3.32Å; K897-I900 PolarHBondContact O-N 2.69Å; I900-V902 VanDerWaalsContact C-N 3.29Å; I900-V902 PolarHBondContact O-N 2.79Å; I900-I903 PolarHBondContact O-N 3.27Å; I900-D904 WeakPolarHBondContact O-CB 3.18Å; I900-D904 PolarHBondContact O-N 3.44Å
901	N	88.7	Confident	86.1	Confident	74 Å²	74	48.4 Å²	48.4	40%	0.396	25%	0.248	S	C	.	.	H	α-helix	trans	-60.1	-36.1	177	-71.6	-19.8	0	0	0	113.2	M547 K897 M899 L905	M547-N901 HydrophobicContact CE-CB 4.4Å; M547-N901 HydrophobicContact SD-CB 4.33Å; K897-N901 PolarHBondContact O-N 2.67Å; K897-N901 PolarHBondContact O-ND2 3.14Å; M899-N901 VanDerWaalsContact C-N 3.31Å; M899-N901 PolarHBondContact O-N 2.55Å; N901-L905 WeakPolarHBondContact O-CB 3.36Å; N901-L905 PolarHBondContact O-N 3.29Å
902	V	88.3	Confident	86.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-73.3	-40.1	175.3	173.4	0	0	0	0	111.2	V542 W545 M547 Q898 M899 I900 L905 L906	V542-V902 HydrophobicContact CG1-CG1 4.42Å; V542-V902 HydrophobicContact CG2-CG1 4.28Å; W545-V902 HydrophobicContact CE3-CB 3.96Å; W545-V902 HydrophobicContact CE3-CG1 4.22Å; W545-V902 HydrophobicContact CE3-CG2 3.97Å; W545-V902 HydrophobicContact CZ3-CB 4.15Å; W545-V902 HydrophobicContact CZ3-CG1 4.24Å; M547-V902 HydrophobicContact CG-CG2 3.96Å; M547-V902 HydrophobicContact SD-CB 4.27Å; M547-V902 HydrophobicContact SD-CG2 3.59Å; M547-V902 VanDerWaalsContact SD-CG2 3.59Å; Q898-V902 PolarHBondContact O-N 3.04Å; M899-V902 PolarHBondContact O-N 3.1Å; M899-V902 VanDerWaalsContact O-N 3.14Å; I900-V902 VanDerWaalsContact C-N 3.29Å; I900-V902 PolarHBondContact O-N 2.79Å; V902-L905 PolarHBondContact O-N 3.04Å; V902-L906 HydrophobicContact CG1-CD1 4.16Å; V902-L906 HydrophobicContact CG1-CG 4.46Å; V902-L906 VanDerWaalsContact O-CG 3.31Å; V902-L906 WeakPolarHBondContact O-CG 3.36Å; V902-L906 PolarHBondContact O-N 3.35Å
903	I	89.5	Confident	86.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-49.8	174.6	-74.1	161.6	0	0	0	110.8	F571 C574 L575 Y578 M899 I900 L905 L906 L907 M934	F571-I903 HydrophobicContact CE2-CG2 4.08Å; C574-I903 HydrophobicContact CB-CD1 4.41Å; C574-I903 HydrophobicContact CB-CG1 3.83Å; L575-I903 HydrophobicContact CD2-CD1 4.11Å; L575-I903 HydrophobicContact CD2-CG2 4.45Å; Y578-I903 HydrophobicContact CD2-CD1 4.34Å; Y578-I903 HydrophobicContact CG-CD1 3.99Å; M899-I903 WeakPolarHBondContact O-CG1 3.16Å; M899-I903 PolarHBondContact O-N 3.26Å; I900-I903 PolarHBondContact O-N 3.27Å; I903-L905 VanDerWaalsContact C-N 3.29Å; I903-L905 PolarHBondContact O-N 2.91Å; I903-L906 PolarHBondContact O-N 3.02Å; I903-L907 HydrophobicContact CG2-CD1 4.19Å; I903-L907 WeakPolarHBondContact O-CG 3.31Å; I903-L907 PolarHBondContact O-N 3.5Å; I903-M934 HydrophobicContact CD1-CE 4.42Å; I903-M934 HydrophobicContact CG2-CE 4.04Å; I903-M934 HydrophobicContact CG2-SD 3.98Å
904	D	91	Very high	87.1	Confident	29 Å²	29	44 Å²	44	16%	0.155	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-35.4	176.9	-75.4	-6	0	0	0	111.8	I900 K908 K937	I900-D904 WeakPolarHBondContact O-CB 3.18Å; I900-D904 PolarHBondContact O-N 3.44Å; D904-K908 WeakPolarHBondContact O-CB 3.15Å; D904-K908 WeakPolarHBondContact O-CD 3.46Å; D904-K908 WeakPolarHBondContact O-CG 3.29Å; D904-K908 PolarHBondContact O-N 2.99Å; D904-K937 IonicContact OD1-NZ 3.2Å; D904-K937 PolarHBondContact OD1-NZ 3.31Å; D904-K937 IonicContact OD2-NZ 2.75Å; D904-K937 PolarHBondContact OD2-NZ 3.42Å
905	L	90.1	Very high	87	Confident	20 Å²	20	43.5 Å²	43.5	11%	0.105	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-47	173.7	-179.7	66.8	0	0	0	111.6	M547 V550 N551 N901 V902 I903 L907 K908 R909	M547-L905 HydrophobicContact CE-CB 3.95Å; M547-L905 HydrophobicContact CE-CD2 3.89Å; M547-L905 HydrophobicContact CE-CG 4.33Å; M547-L905 HydrophobicContact SD-CB 4.04Å; M547-L905 HydrophobicContact SD-CD2 3.73Å; M547-L905 HydrophobicContact SD-CG 4.49Å; V550-L905 HydrophobicContact CB-CD2 4.26Å; V550-L905 HydrophobicContact CG1-CD2 3.87Å; N551-L905 WeakPolarHBondContact ND2-CD2 3.35Å; N551-L905 WeakPolarHBondContact OD1-CD1 3.49Å; N901-L905 WeakPolarHBondContact O-CB 3.36Å; N901-L905 PolarHBondContact O-N 3.29Å; V902-L905 PolarHBondContact O-N 3.04Å; I903-L905 VanDerWaalsContact C-N 3.29Å; I903-L905 PolarHBondContact O-N 2.91Å; L905-L907 PolarHBondContact O-N 3.24Å; L905-K908 PolarHBondContact O-N 2.7Å; L905-R909 HydrophobicContact CD1-CG 3.99Å; L905-R909 HydrophobicContact CG-CG 4.3Å; L905-R909 WeakPolarHBondContact O-CB 3.45Å; L905-R909 WeakPolarHBondContact O-CG 3.47Å; L905-R909 PolarHBondContact O-N 2.81Å
906	L	90.7	Very high	86.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-44.7	-178.7	-71.2	171.5	0	0	0	110.9	V542 V550 L554 I560 V570 F571 C574 V902 I903 R909 G910 A911	V542-L906 HydrophobicContact CG2-CD1 4.38Å; V542-L906 HydrophobicContact CG2-CD2 4.45Å; V550-L906 HydrophobicContact CG1-CD2 4.27Å; L554-L906 HydrophobicContact CD1-CD2 4.39Å; I560-L906 HydrophobicContact CD1-CB 4.25Å; I560-L906 HydrophobicContact CD1-CD2 3.72Å; I560-L906 VanDerWaalsContact CD1-O 3.26Å; I560-L906 WeakPolarHBondContact CD1-O 3.35Å; I560-L906 HydrophobicContact CG1-CD2 3.89Å; V570-L906 HydrophobicContact CG1-CD1 4.5Å; F571-L906 HydrophobicContact CD2-CB 4.16Å; F571-L906 HydrophobicContact CD2-CD1 4.45Å; C574-L906 WeakPolarHBondContact SG-CD1 3.41Å; V902-L906 HydrophobicContact CG1-CD1 4.16Å; V902-L906 HydrophobicContact CG1-CG 4.46Å; V902-L906 VanDerWaalsContact O-CG 3.31Å; V902-L906 WeakPolarHBondContact O-CG 3.36Å; V902-L906 PolarHBondContact O-N 3.35Å; I903-L906 PolarHBondContact O-N 3.02Å; L906-R909 CarbonylContact O-C 3.59Å; L906-R909 PolarHBondContact O-N 2.73Å; L906-G910 PolarHBondContact O-N 3.12Å; L906-A911 HydrophobicContact CB-CB 3.97Å; L906-A911 WeakPolarHBondContact O-CB 3.31Å; L906-A911 PolarHBondContact O-N 3.36Å
907	L	90.4	Very high	84.9	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-59.5	-49.9	174.7	-71.1	170.5	0	0	0	111.9	F571 I903 L905 R909 G910 Y941	F571-L907 HydrophobicContact CD2-CD2 4.44Å; F571-L907 HydrophobicContact CD2-CG 4.49Å; F571-L907 HydrophobicContact CE1-CD2 4.29Å; F571-L907 HydrophobicContact CE2-CD1 4.08Å; F571-L907 HydrophobicContact CE2-CD2 3.61Å; F571-L907 HydrophobicContact CE2-CG 3.6Å; F571-L907 HydrophobicContact CZ-CD1 4.19Å; F571-L907 HydrophobicContact CZ-CD2 3.53Å; F571-L907 HydrophobicContact CZ-CG 3.94Å; I903-L907 HydrophobicContact CG2-CD1 4.19Å; I903-L907 WeakPolarHBondContact O-CG 3.31Å; I903-L907 PolarHBondContact O-N 3.5Å; L905-L907 PolarHBondContact O-N 3.24Å; L907-R909 PolarHBondContact O-N 2.88Å; L907-R909 VanDerWaalsContact O-N 3.13Å; L907-G910 PolarHBondContact O-N 3.16Å; L907-Y941 HydrophobicContact CB-CD1 4.05Å; L907-Y941 HydrophobicContact CB-CD2 3.8Å; L907-Y941 HydrophobicContact CB-CE1 4.24Å; L907-Y941 HydrophobicContact CB-CE2 3.99Å; L907-Y941 HydrophobicContact CB-CG 3.85Å; L907-Y941 HydrophobicContact CD1-CD2 3.81Å; L907-Y941 HydrophobicContact CD1-CE2 4.29Å; L907-Y941 HydrophobicContact CD1-CG 4.4Å; L907-Y941 HydrophobicContact CD2-CD2 4.4Å; L907-Y941 HydrophobicContact CD2-CG 4.18Å; L907-Y941 HydrophobicContact CG-CD2 4.21Å; L907-Y941 HydrophobicContact CG-CG 4.36Å
908	K	91	Very high	83.5	Confident	140 Å²	140	44.8 Å²	44.8	61%	0.609	23%	0.225	S	C	*	.	H	α-helix	trans	-61.1	-21.6	176.4	-73.6	169.7	-176.8	170.9	0	114.1	D904 L905 Y941	D904-K908 WeakPolarHBondContact O-CB 3.15Å; D904-K908 WeakPolarHBondContact O-CD 3.46Å; D904-K908 WeakPolarHBondContact O-CG 3.29Å; D904-K908 PolarHBondContact O-N 2.99Å; L905-K908 PolarHBondContact O-N 2.7Å; K908-Y941 WeakPolarHBondContact CE-OH 3.32Å; K908-Y941 HydrophobicContact CG-CE1 4.34Å; K908-Y941 VanDerWaalsContact CG-OH 3.24Å; K908-Y941 WeakPolarHBondContact CG-OH 3.46Å
909	R	91	Very high	82.1	Confident	97 Å²	97	45.5 Å²	45.5	37%	0.366	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	10	178.3	-65.1	-68.5	-159.9	117.6	0	113.5	N551 L554 D555 I560 L905 L906 L907	N551-R909 PolarHBondContact OD1-NH2 2.89Å; L554-R909 HydrophobicContact CD1-CB 3.92Å; L554-R909 HydrophobicContact CD1-CG 3.9Å; D555-R909 IonicContact OD1-CZ 3.86Å; D555-R909 IonicContact OD1-NH1 3.05Å; D555-R909 PolarHBondContact OD1-NH1 3.3Å; D555-R909 IonicContact OD1-NH2 3.67Å; D555-R909 PolarHBondContact OD1-NH2 3.2Å; I560-R909 HydrophobicContact CD1-CB 3.86Å; L905-R909 HydrophobicContact CD1-CG 3.99Å; L905-R909 HydrophobicContact CG-CG 4.3Å; L905-R909 WeakPolarHBondContact O-CB 3.45Å; L905-R909 WeakPolarHBondContact O-CG 3.47Å; L905-R909 PolarHBondContact O-N 2.81Å; L906-R909 CarbonylContact O-C 3.59Å; L906-R909 PolarHBondContact O-N 2.73Å; L907-R909 PolarHBondContact O-N 2.88Å; L907-R909 VanDerWaalsContact O-N 3.13Å
910	G	87.9	Confident	81.1	Confident	46 Å²	46	47.9 Å²	47.9	47%	0.474	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.3	23	172.4	0	0	0	0	0	115.9	N561 L906 L907 N912	N561-G910 PolarHBondContact ND2-O 3.02Å; N561-G910 VanDerWaalsContact ND2-O 3.09Å; L906-G910 PolarHBondContact O-N 3.12Å; L907-G910 PolarHBondContact O-N 3.16Å; G910-N912 PolarHBondContact O-N 2.64Å
911	A	88.9	Confident	80.5	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.033	24%	0.241	C	C	.	.			trans	-63.8	119.3	166.5	0	0	0	0	0	109.8	I560 N561 F571 L906 P913	I560-A911 HydrophobicContact CD1-CB 3.88Å; I560-A911 HydrophobicContact CG1-CB 4.01Å; N561-A911 WeakPolarHBondContact OD1-CA 3.5Å; F571-A911 HydrophobicContact CB-CB 4.02Å; F571-A911 HydrophobicContact CD2-CB 4.03Å; F571-A911 HydrophobicContact CG-CB 4.04Å; L906-A911 HydrophobicContact CB-CB 3.97Å; L906-A911 WeakPolarHBondContact O-CB 3.31Å; L906-A911 PolarHBondContact O-N 3.36Å; A911-P913 WeakPolarHBondContact O-CD 3.44Å
912	N	86.2	Confident	80.2	Confident	69 Å²	69	43 Å²	43	37%	0.369	22%	0.222	S	C	.	.			trans	-88.7	115.2	-179.2	175.6	-12.3	0	0	0	109.5	N561 G910 N914 T915	N561-N912 PolarHBondContact OD1-N 3.02Å; G910-N912 PolarHBondContact O-N 2.64Å; N912-N914 PolarHBondContact O-N 3.34Å; N912-N914 VanDerWaalsContact O-N 3.14Å; N912-N914 WeakPolarHBondContact OD1-CB 3.36Å; N912-N914 PolarHBondContact OD1-N 3.27Å; N912-T915 HydrophobicContact CB-CG2 3.7Å; N912-T915 PolarHBondContact O-N 3.03Å; N912-T915 PolarHBondContact O-OG1 3.01Å
913	P	85.9	Confident	80.2	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.013	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.9	-175.8	27.2	-36.1	0	0	0	114.4	F571 A911 A922 L938 A943	F571-P913 HydrophobicContact CE1-CB 3.99Å; A911-P913 WeakPolarHBondContact O-CD 3.44Å; P913-A922 HydrophobicContact CB-CB 4.04Å; P913-A922 VanDerWaalsContact O-CB 3.31Å; P913-A922 WeakPolarHBondContact O-CB 3.48Å; P913-L938 HydrophobicContact CB-CD2 3.83Å; P913-A943 HydrophobicContact CB-CB 4.04Å; P913-A943 HydrophobicContact CG-CB 3.72Å
914	N	82.3	Confident	79.8	Confident	48 Å²	48	43.3 Å²	43.3	26%	0.257	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	0.7	-175.9	-52.7	-44.2	0	0	0	113.8	N912 G942 A943 D944	N912-N914 PolarHBondContact O-N 3.34Å; N912-N914 VanDerWaalsContact O-N 3.14Å; N912-N914 WeakPolarHBondContact OD1-CB 3.36Å; N912-N914 PolarHBondContact OD1-N 3.27Å; N914-G942 PolarHBondContact ND2-O 2.71Å; N914-A943 WeakPolarHBondContact OD1-CA 3.27Å; N914-D944 PolarHBondContact ND2-N 3.33Å; N914-D944 PolarHBondContact OD1-N 2.82Å
915	T	77	Confident	79.4	Confident	38 Å²	38	42.7 Å²	42.7	23%	0.233	22%	0.22	C	C	.	.			trans	-80.1	-24.5	-174.2	48.2	0	0	0	0	115.1	N561 T569 N912 I917	N561-T915 HydrophobicContact CB-CG2 4.39Å; T569-T915 VanDerWaalsContact CG2-OG1 3.26Å; T569-T915 WeakPolarHBondContact CG2-OG1 3.21Å; N912-T915 HydrophobicContact CB-CG2 3.7Å; N912-T915 PolarHBondContact O-N 3.03Å; N912-T915 PolarHBondContact O-OG1 3.01Å; T915-I917 PolarHBondContact O-N 3.39Å
916	G	62	Low	79.2	Confident	3 Å²	3	41.7 Å²	41.7	3%	0.031	22%	0.215	C	C	.	.			trans	-81.6	110.5	-179.2	0	0	0	0	0	111.9
917	I	58.9	Low	79	Confident	121 Å²	121	41.7 Å²	41.7	62%	0.621	22%	0.215	S	C	*	.			trans	-84.4	-30.4	-179.8	-55.7	175.9	0	0	0	111	T915	T915-I917 PolarHBondContact O-N 3.39Å
918	R	54.5	Low	78.5	Confident	143 Å²	143	44.4 Å²	44.4	54%	0.54	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.3	138.4	-179.9	-61.2	-178.4	-179.1	-178.4	-0.5	110.8	L568 D952	L568-R918 VanDerWaalsContact CD2-O 3.32Å; L568-R918 WeakPolarHBondContact CD2-O 3.33Å; L568-R918 WeakPolarHBondContact CG-O 3.48Å; R918-D952 IonicContact CZ-OD2 3.48Å; R918-D952 IonicContact NE-OD2 2.81Å; R918-D952 IonicContact NH2-OD2 3.12Å; R918-D952 PolarHBondContact NH2-OD2 3.22Å
919	P	54.8	Low	77.9	Confident	71 Å²	71	38.9 Å²	38.9	46%	0.461	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	cis	-92.9	122.5	-12.2	33.5	-22.4	0	0	0	111.6	L568 L576	L568-P919 VanDerWaalsContact CD2-CD 3.41Å; L576-P919 HydrophobicContact CD1-CG 4.16Å
920	L	66	Low	77.4	Confident	56 Å²	56	34.7 Å²	34.7	29%	0.293	19%	0.194	S	C	.	.	S	Bend	trans	60.7	136.7	-177.6	-60.8	174.4	0	0	0	115	F924 L925 L949	L920-F924 HydrophobicContact CB-CB 4.02Å; L920-F924 HydrophobicContact CD2-CB 4.47Å; L920-L925 HydrophobicContact CB-CD2 3.96Å; L920-L925 HydrophobicContact CB-CG 4.15Å; L920-L925 HydrophobicContact CD1-CD2 4.13Å; L920-L949 HydrophobicContact CD2-CD1 4.28Å; L920-L949 HydrophobicContact CD2-CD2 3.45Å; L920-L949 VanDerWaalsContact CD2-CD2 3.45Å
921	P	74.7	Confident	77.3	Confident	11 Å²	11	33 Å²	33	7%	0.071	17%	0.174	C	C	.	.			trans	-55.2	151.8	169.8	-26.6	35	0	0	0	112.5	L923 F924 L925 I947	P921-L923 PolarHBondContact O-N 3.45Å; P921-L923 VanDerWaalsContact O-N 3.12Å; P921-F924 HydrophobicContact CB-CD2 4.21Å; P921-F924 HydrophobicContact CG-CD2 3.95Å; P921-F924 WeakPolarHBondContact O-CB 3.41Å; P921-F924 PolarHBondContact O-N 2.84Å; P921-L925 PolarHBondContact O-N 3.48Å; P921-I947 HydrophobicContact CB-CD1 3.95Å; P921-I947 HydrophobicContact CB-CG2 4.09Å; P921-I947 HydrophobicContact CG-CD1 3.76Å; P921-I947 HydrophobicContact CG-CG1 4.1Å; P921-I947 HydrophobicContact CG-CG2 4.12Å
922	A	83.7	Confident	77.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-53.6	-39.1	-176	0	0	0	0	0	113.5	F571 T572 L575 P913 L925 A926 L938	F571-A922 HydrophobicContact CD1-CB 4.41Å; F571-A922 HydrophobicContact CE1-CB 3.8Å; T572-A922 HydrophobicContact CG2-CB 4.44Å; L575-A922 HydrophobicContact CD1-CB 3.57Å; P913-A922 HydrophobicContact CB-CB 4.04Å; P913-A922 VanDerWaalsContact O-CB 3.31Å; P913-A922 WeakPolarHBondContact O-CB 3.48Å; A922-L925 PolarHBondContact O-N 3.06Å; A922-A926 PolarHBondContact O-N 3.22Å; A922-L938 HydrophobicContact CB-CD2 4.15Å
923	L	87.1	Confident	77.3	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-67.3	-37	178.3	-167.4	61.1	0	0	0	112.7	P921 A926 V927 V935 L938 I939 A943 A945 V983 L1002	P921-L923 PolarHBondContact O-N 3.45Å; P921-L923 VanDerWaalsContact O-N 3.12Å; L923-A926 PolarHBondContact O-N 2.91Å; L923-V927 WeakPolarHBondContact O-CG2 3.22Å; L923-V927 PolarHBondContact O-N 2.87Å; L923-V935 HydrophobicContact CD1-CB 4.45Å; L923-V935 HydrophobicContact CD1-CG1 4Å; L923-V935 HydrophobicContact CD1-CG2 4.45Å; L923-L938 HydrophobicContact CD1-CB 3.94Å; L923-L938 HydrophobicContact CD1-CD1 4.18Å; L923-I939 HydrophobicContact CD1-CG1 4.18Å; L923-A943 HydrophobicContact CB-CB 4.25Å; L923-A943 HydrophobicContact CD1-CB 4.34Å; L923-A943 HydrophobicContact CD2-CB 4.07Å; L923-A943 HydrophobicContact CG-CB 4.47Å; L923-A945 HydrophobicContact CD2-CB 4.33Å; L923-V983 HydrophobicContact CB-CG2 4.39Å; L923-V983 HydrophobicContact CD2-CG1 4.38Å; L923-V983 HydrophobicContact CD2-CG2 4.08Å; L923-V983 HydrophobicContact CG-CG1 4.14Å; L923-V983 HydrophobicContact CG-CG2 4.19Å; L923-L1002 HydrophobicContact CD2-CD2 4.26Å
924	F	81.6	Confident	77.5	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.018	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-40.7	172.4	-95.8	-80.7	0	0	0	112	L920 P921 A926 Q928 I947 L949 L981 V983 Y986	L920-F924 HydrophobicContact CB-CB 4.02Å; L920-F924 HydrophobicContact CD2-CB 4.47Å; P921-F924 HydrophobicContact CB-CD2 4.21Å; P921-F924 HydrophobicContact CG-CD2 3.95Å; P921-F924 WeakPolarHBondContact O-CB 3.41Å; P921-F924 PolarHBondContact O-N 2.84Å; F924-A926 VanDerWaalsContact C-N 3.3Å; F924-A926 PolarHBondContact O-N 3.37Å; F924-Q928 WeakPolarHBondContact O-CB 3.29Å; F924-Q928 PolarHBondContact O-N 3.36Å; F924-I947 HydrophobicContact CD2-CG2 4.27Å; F924-I947 HydrophobicContact CE2-CG2 4.2Å; F924-I947 WeakPolarHBondContact CE2-O 3.38Å; F924-L949 HydrophobicContact CD1-CD2 4.09Å; F924-L949 HydrophobicContact CD2-CD2 3.67Å; F924-L949 HydrophobicContact CD2-CG 4.48Å; F924-L949 HydrophobicContact CE1-CD1 3.91Å; F924-L949 HydrophobicContact CE1-CD2 3.9Å; F924-L949 HydrophobicContact CE1-CG 3.89Å; F924-L949 HydrophobicContact CE2-CD2 3.45Å; F924-L949 VanDerWaalsContact CE2-CD2 3.45Å; F924-L949 HydrophobicContact CE2-CG 3.81Å; F924-L949 HydrophobicContact CG-CD2 3.98Å; F924-L949 HydrophobicContact CZ-CD1 3.99Å; F924-L949 HydrophobicContact CZ-CD2 3.57Å; F924-L949 HydrophobicContact CZ-CG 3.47Å; F924-L949 VanDerWaalsContact CZ-CG 3.47Å; F924-L981 WeakPolarHBondContact CZ-O 3.45Å; F924-V983 HydrophobicContact CD2-CG2 3.52Å; F924-V983 HydrophobicContact CE2-CB 4.37Å; F924-V983 HydrophobicContact CE2-CG2 3.49Å; F924-V983 VanDerWaalsContact CE2-CG2 3.49Å; F924-V983 HydrophobicContact CG-CG2 4.1Å; F924-V983 HydrophobicContact CZ-CB 4.46Å; F924-V983 HydrophobicContact CZ-CG2 4.04Å; F924-V983 VanDerWaalsContact CZ-N 3.31Å; F924-Y986 HydrophobicContact CE1-CG 4.49Å
925	L	82.2	Confident	77.9	Confident	16 Å²	16	35.9 Å²	35.9	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-38.1	177.2	-66	174	0	0	0	111.7	L576 Y579 L920 P921 A922 A929	L576-L925 HydrophobicContact CD2-CD1 3.85Å; L576-L925 HydrophobicContact CD2-CD2 3.94Å; L576-L925 HydrophobicContact CG-CD1 4.12Å; Y579-L925 HydrophobicContact CD2-CB 4.23Å; Y579-L925 HydrophobicContact CE2-CB 4.02Å; L920-L925 HydrophobicContact CB-CD2 3.96Å; L920-L925 HydrophobicContact CB-CG 4.15Å; L920-L925 HydrophobicContact CD1-CD2 4.13Å; P921-L925 PolarHBondContact O-N 3.48Å; A922-L925 PolarHBondContact O-N 3.06Å; L925-A929 WeakPolarHBondContact O-CB 3.32Å; L925-A929 PolarHBondContact O-N 3.46Å
926	A	87.2	Confident	78.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-70.8	-45.1	178.3	0	0	0	0	0	113.3	Y579 A922 L923 F924 Q928 A929 G930 D931 M934 V935 L938	Y579-A926 WeakPolarHBondContact OH-CA 3.12Å; Y579-A926 WeakPolarHBondContact OH-CB 3.34Å; A922-A926 PolarHBondContact O-N 3.22Å; L923-A926 PolarHBondContact O-N 2.91Å; F924-A926 VanDerWaalsContact C-N 3.3Å; F924-A926 PolarHBondContact O-N 3.37Å; A926-Q928 VanDerWaalsContact C-N 3.33Å; A926-Q928 PolarHBondContact O-N 3.29Å; A926-A929 PolarHBondContact O-N 3.23Å; A926-G930 PolarHBondContact O-N 3.44Å; A926-G930 VanDerWaalsContact O-N 3.1Å; A926-D931 PolarHBondContact O-N 3.29Å; A926-M934 HydrophobicContact CB-CB 4.38Å; A926-M934 HydrophobicContact CB-CG 4.29Å; A926-V935 HydrophobicContact CB-CG2 3.58Å; A926-L938 HydrophobicContact CB-CD1 3.66Å
927	V	85.2	Confident	79.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-38.4	174.2	174.7	0	0	0	0	111.1	L923 A929 G930 V935 V983 Y986 A987 L998 L1002	L923-V927 WeakPolarHBondContact O-CG2 3.22Å; L923-V927 PolarHBondContact O-N 2.87Å; V927-A929 VanDerWaalsContact C-N 3.34Å; V927-A929 PolarHBondContact O-N 3.24Å; V927-G930 PolarHBondContact O-N 3.18Å; V927-V935 HydrophobicContact CG2-CG1 4.38Å; V927-V935 HydrophobicContact CG2-CG2 3.61Å; V927-V983 HydrophobicContact CB-CG1 4.14Å; V927-V983 HydrophobicContact CG1-CG1 4.41Å; V927-V983 HydrophobicContact CG2-CG1 3.53Å; V927-Y986 HydrophobicContact CG1-CD1 4.05Å; V927-A987 HydrophobicContact CG1-CB 3.84Å; V927-L998 HydrophobicContact CG1-CD1 4.33Å; V927-L998 HydrophobicContact CG2-CD2 4.48Å; V927-L1002 HydrophobicContact CG2-CD1 4.3Å
928	Q	80.7	Confident	81.4	Confident	63 Å²	63	33.7 Å²	33.7	29%	0.294	17%	0.169	S	C	.	.	H	α-helix	trans	-65.8	-33.1	174.2	178.9	171.3	30	0	0	113.1	F924 A926 G930 Y986	F924-Q928 WeakPolarHBondContact O-CB 3.29Å; F924-Q928 PolarHBondContact O-N 3.36Å; A926-Q928 VanDerWaalsContact C-N 3.33Å; A926-Q928 PolarHBondContact O-N 3.29Å; Q928-G930 VanDerWaalsContact C-N 3.29Å; Q928-Y986 HydrophobicContact CB-CE1 4.1Å; Q928-Y986 HydrophobicContact CG-CE1 4.43Å
929	A	77.4	Confident	83.1	Confident	23 Å²	23	28 Å²	28	19%	0.19	15%	0.149	C	C	.	.	H	α-helix	trans	-74.5	-21.8	174.9	0	0	0	0	0	113.1	Y579 L925 A926 V927 D931	Y579-A929 HydrophobicContact CD1-CB 3.27Å; Y579-A929 HydrophobicContact CD2-CB 4.5Å; Y579-A929 HydrophobicContact CE1-CB 3.24Å; Y579-A929 HydrophobicContact CE2-CB 4.48Å; Y579-A929 HydrophobicContact CG-CB 3.96Å; L925-A929 WeakPolarHBondContact O-CB 3.32Å; L925-A929 PolarHBondContact O-N 3.46Å; A926-A929 PolarHBondContact O-N 3.23Å; V927-A929 VanDerWaalsContact C-N 3.34Å; V927-A929 PolarHBondContact O-N 3.24Å; A929-D931 HydrophobicContact CB-CB 4.48Å
930	G	80.9	Confident	84.8	Confident	9 Å²	9	30.5 Å²	30.5	9%	0.093	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	33.5	-172	0	0	0	0	0	113.1	A926 V927 Q928 P932 M994	A926-G930 PolarHBondContact O-N 3.44Å; A926-G930 VanDerWaalsContact O-N 3.1Å; V927-G930 PolarHBondContact O-N 3.18Å; Q928-G930 VanDerWaalsContact C-N 3.29Å; G930-P932 WeakPolarHBondContact O-CD 3.39Å; G930-M994 WeakPolarHBondContact O-CE 3.34Å
931	D	86.2	Confident	85.9	Confident	10 Å²	10	32.1 Å²	32.1	5%	0.053	16%	0.157	C	C	.	.			trans	-103.2	91.3	-177.7	-171.2	-26.4	0	0	0	110.7	Y578 Y579 A926 A929 E933 M934 V935	Y578-D931 WeakPolarHBondContact CE1-OD2 3.36Å; Y578-D931 PolarHBondContact OH-OD2 2.72Å; Y579-D931 HydrophobicContact CE1-CB 4.06Å; A926-D931 PolarHBondContact O-N 3.29Å; A929-D931 HydrophobicContact CB-CB 4.48Å; D931-E933 VanDerWaalsContact C-N 3.34Å; D931-E933 PolarHBondContact O-N 2.75Å; D931-E933 PolarHBondContact OD1-N 2.75Å; D931-M934 HydrophobicContact CB-CB 4.11Å; D931-M934 VanDerWaalsContact CG-CB 3.5Å; D931-M934 PolarHBondContact O-N 3.2Å; D931-M934 WeakPolarHBondContact OD1-CB 3.38Å; D931-M934 PolarHBondContact OD1-N 2.93Å; D931-V935 VanDerWaalsContact O-CG2 3.3Å; D931-V935 WeakPolarHBondContact O-CG2 3.08Å; D931-V935 PolarHBondContact O-N 3.35Å
932	P	87.4	Confident	86.5	Confident	35 Å²	35	33.9 Å²	33.9	23%	0.227	18%	0.178	C	C	.	.	H	α-helix	trans	-68.5	-30.7	-176	28.1	-35.5	0	0	0	112.9	G930 V935 H936 M994 L998 I1001	G930-P932 WeakPolarHBondContact O-CD 3.39Å; P932-V935 PolarHBondContact O-N 3.35Å; P932-H936 WeakPolarHBondContact O-CB 3.21Å; P932-H936 PolarHBondContact O-N 2.86Å; P932-M994 HydrophobicContact CG-CE 4.06Å; P932-L998 HydrophobicContact CB-CD2 4.3Å; P932-I1001 HydrophobicContact CB-CD1 3.59Å
933	E	88.7	Confident	86.7	Confident	145 Å²	145	34.3 Å²	34.3	68%	0.678	18%	0.181	S	C	*	.	H	α-helix	trans	-65.5	-44.3	177.2	-66.7	179.5	-159.7	0	0	110.6	D931 K937	D931-E933 VanDerWaalsContact C-N 3.34Å; D931-E933 PolarHBondContact O-N 2.75Å; D931-E933 PolarHBondContact OD1-N 2.75Å; E933-K937 WeakPolarHBondContact O-CB 3.4Å; E933-K937 WeakPolarHBondContact O-CG 3.32Å; E933-K937 PolarHBondContact O-N 3.45Å
934	M	88.9	Confident	86.6	Confident	5 Å²	5	37.7 Å²	37.7	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-69	-36.1	175.7	-166.1	63.6	67.8	0	0	112.1	L575 Y578 Y579 I903 A926 D931 K937 L938	L575-M934 HydrophobicContact CD2-CE 4.48Å; L575-M934 HydrophobicContact CD2-CG 4.22Å; L575-M934 HydrophobicContact CD2-SD 4.14Å; Y578-M934 HydrophobicContact CD1-CE 4.44Å; Y578-M934 HydrophobicContact CE1-CE 4.01Å; Y579-M934 VanDerWaalsContact OH-CG 3.26Å; Y579-M934 WeakPolarHBondContact OH-CG 3.42Å; I903-M934 HydrophobicContact CD1-CE 4.42Å; I903-M934 HydrophobicContact CG2-CE 4.04Å; I903-M934 HydrophobicContact CG2-SD 3.98Å; A926-M934 HydrophobicContact CB-CB 4.38Å; A926-M934 HydrophobicContact CB-CG 4.29Å; D931-M934 HydrophobicContact CB-CB 4.11Å; D931-M934 VanDerWaalsContact CG-CB 3.5Å; D931-M934 PolarHBondContact O-N 3.2Å; D931-M934 WeakPolarHBondContact OD1-CB 3.38Å; D931-M934 PolarHBondContact OD1-N 2.93Å; M934-K937 PolarHBondContact O-N 3.48Å; M934-L938 HydrophobicContact CG-CD1 4.15Å; M934-L938 HydrophobicContact CG-CG 4.37Å; M934-L938 WeakPolarHBondContact O-CB 3.41Å; M934-L938 WeakPolarHBondContact O-CG 3.45Å; M934-L938 PolarHBondContact O-N 2.91Å
935	V	90.5	Very high	86.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-49.7	173.5	170.1	0	0	0	0	111	L923 A926 V927 D931 P932 K937 L938 I939 L998 I1001 L1002	L923-V935 HydrophobicContact CD1-CB 4.45Å; L923-V935 HydrophobicContact CD1-CG1 4Å; L923-V935 HydrophobicContact CD1-CG2 4.45Å; A926-V935 HydrophobicContact CB-CG2 3.58Å; V927-V935 HydrophobicContact CG2-CG1 4.38Å; V927-V935 HydrophobicContact CG2-CG2 3.61Å; D931-V935 VanDerWaalsContact O-CG2 3.3Å; D931-V935 WeakPolarHBondContact O-CG2 3.08Å; D931-V935 PolarHBondContact O-N 3.35Å; P932-V935 PolarHBondContact O-N 3.35Å; V935-K937 PolarHBondContact O-N 2.87Å; V935-L938 PolarHBondContact O-N 2.88Å; V935-I939 HydrophobicContact CG1-CD1 3.86Å; V935-I939 WeakPolarHBondContact O-CG1 3.49Å; V935-I939 PolarHBondContact O-N 3.41Å; V935-L998 HydrophobicContact CB-CD2 4.43Å; V935-L998 HydrophobicContact CG2-CD2 3.92Å; V935-I1001 HydrophobicContact CG1-CG2 3.73Å; V935-L1002 HydrophobicContact CG1-CD2 4.42Å
936	H	90.6	Very high	86.9	Confident	63 Å²	63	38.7 Å²	38.7	29%	0.292	21%	0.205	S	C	.	.	H	α-helix	trans	-61.8	-44.1	178.4	-172	81.6	0	0	0	111.5	P932 L938 I939 Q940 I1001 D1005	P932-H936 WeakPolarHBondContact O-CB 3.21Å; P932-H936 PolarHBondContact O-N 2.86Å; H936-L938 PolarHBondContact O-N 3.32Å; H936-I939 PolarHBondContact O-N 3.33Å; H936-Q940 PolarHBondContact CD2-NE2 2.76Å; H936-Q940 PolarHBondContact NE2-NE2 3.48Å; H936-Q940 WeakPolarHBondContact O-CG 3.45Å; H936-Q940 PolarHBondContact O-N 3.42Å; H936-I1001 HydrophobicContact CB-CG2 4.29Å; H936-D1005 VanDerWaalsContact CE1-CG 3.47Å; H936-D1005 IonicContact CE1-OD1 2.75Å; H936-D1005 PolarHBondContact CE1-OD1 3.06Å; H936-D1005 IonicContact CE1-OD2 2.89Å; H936-D1005 PolarHBondContact CE1-OD2 3.44Å; H936-D1005 VanDerWaalsContact CE1-OD2 3.23Å; H936-D1005 IonicContact CG-OD2 3.6Å; H936-D1005 VanDerWaalsContact ND1-CG 3.33Å; H936-D1005 IonicContact ND1-OD1 2.77Å; H936-D1005 IonicContact ND1-OD2 2.8Å; H936-D1005 PolarHBondContact ND1-OD2 3.29Å
937	K	89.8	Confident	86.5	Confident	53 Å²	53	40.3 Å²	40.3	23%	0.23	21%	0.214	C	C	.	.	H	α-helix	trans	-57.3	-47.2	172.2	-78.7	-178.3	172	-167.2	0	112.7	D904 E933 M934 V935 I939 Q940 Y941	D904-K937 IonicContact OD1-NZ 3.2Å; D904-K937 PolarHBondContact OD1-NZ 3.31Å; D904-K937 IonicContact OD2-NZ 2.75Å; D904-K937 PolarHBondContact OD2-NZ 3.42Å; E933-K937 WeakPolarHBondContact O-CB 3.4Å; E933-K937 WeakPolarHBondContact O-CG 3.32Å; E933-K937 PolarHBondContact O-N 3.45Å; M934-K937 PolarHBondContact O-N 3.48Å; V935-K937 PolarHBondContact O-N 2.87Å; K937-I939 VanDerWaalsContact C-N 3.32Å; K937-I939 PolarHBondContact O-N 3.2Å; K937-Q940 PolarHBondContact O-N 3.08Å; K937-Y941 VanDerWaalsContact O-CD2 3.29Å; K937-Y941 WeakPolarHBondContact O-CD2 3.38Å; K937-Y941 PolarHBondContact O-N 2.8Å; K937-Y941 VanDerWaalsContact O-N 3.1Å
938	L	90.7	Very high	85.9	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-42.2	-179.2	-76.7	169.3	0	0	0	111.6	F571 P913 A922 L923 A926 M934 V935 H936 Y941 G942 A943	F571-L938 HydrophobicContact CE1-CD2 3.84Å; F571-L938 HydrophobicContact CZ-CD2 3.61Å; P913-L938 HydrophobicContact CB-CD2 3.83Å; A922-L938 HydrophobicContact CB-CD2 4.15Å; L923-L938 HydrophobicContact CD1-CB 3.94Å; L923-L938 HydrophobicContact CD1-CD1 4.18Å; A926-L938 HydrophobicContact CB-CD1 3.66Å; M934-L938 HydrophobicContact CG-CD1 4.15Å; M934-L938 HydrophobicContact CG-CG 4.37Å; M934-L938 WeakPolarHBondContact O-CB 3.41Å; M934-L938 WeakPolarHBondContact O-CG 3.45Å; M934-L938 PolarHBondContact O-N 2.91Å; V935-L938 PolarHBondContact O-N 2.88Å; H936-L938 PolarHBondContact O-N 3.32Å; L938-Y941 CarbonylContact O-C 3.48Å; L938-Y941 PolarHBondContact O-N 3.27Å; L938-G942 PolarHBondContact O-N 3.24Å; L938-A943 HydrophobicContact CB-CB 3.92Å; L938-A943 WeakPolarHBondContact O-CB 3.25Å; L938-A943 PolarHBondContact O-N 3.08Å
939	I	90.1	Very high	85.3	Confident	22 Å²	22	40.3 Å²	40.3	11%	0.113	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-47.2	176.2	-68	164.6	0	0	0	110.8	L923 V935 H936 K937 Y941 G942 I1001 L1002 D1005	L923-I939 HydrophobicContact CD1-CG1 4.18Å; V935-I939 HydrophobicContact CG1-CD1 3.86Å; V935-I939 WeakPolarHBondContact O-CG1 3.49Å; V935-I939 PolarHBondContact O-N 3.41Å; H936-I939 PolarHBondContact O-N 3.33Å; K937-I939 VanDerWaalsContact C-N 3.32Å; K937-I939 PolarHBondContact O-N 3.2Å; I939-Y941 PolarHBondContact O-N 2.92Å; I939-G942 PolarHBondContact O-N 2.9Å; I939-I1001 HydrophobicContact CD1-CG2 3.82Å; I939-L1002 HydrophobicContact CD1-CD2 4.2Å; I939-D1005 HydrophobicContact CG2-CB 4.03Å; I939-D1005 WeakPolarHBondContact CG2-O 3.42Å
940	Q	90.4	Very high	84.5	Confident	125 Å²	125	49 Å²	49	58%	0.584	25%	0.246	S	C	*	.	H	α-helix	trans	-56.5	-32.6	175.7	-72.7	-179.2	-3.5	0	0	113.3	H936 K937 G942	H936-Q940 PolarHBondContact CD2-NE2 2.76Å; H936-Q940 PolarHBondContact NE2-NE2 3.48Å; H936-Q940 WeakPolarHBondContact O-CG 3.45Å; H936-Q940 PolarHBondContact O-N 3.42Å; K937-Q940 PolarHBondContact O-N 3.08Å; Q940-G942 VanDerWaalsContact C-N 3.34Å
941	Y	90.1	Very high	83.1	Confident	89 Å²	89	52.3 Å²	52.3	35%	0.349	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	18.3	175.5	-73.4	-73.5	0	0	0	114	L907 K908 K937 L938 I939	L907-Y941 HydrophobicContact CB-CD1 4.05Å; L907-Y941 HydrophobicContact CB-CD2 3.8Å; L907-Y941 HydrophobicContact CB-CE1 4.24Å; L907-Y941 HydrophobicContact CB-CE2 3.99Å; L907-Y941 HydrophobicContact CB-CG 3.85Å; L907-Y941 HydrophobicContact CD1-CD2 3.81Å; L907-Y941 HydrophobicContact CD1-CE2 4.29Å; L907-Y941 HydrophobicContact CD1-CG 4.4Å; L907-Y941 HydrophobicContact CD2-CD2 4.4Å; L907-Y941 HydrophobicContact CD2-CG 4.18Å; L907-Y941 HydrophobicContact CG-CD2 4.21Å; L907-Y941 HydrophobicContact CG-CG 4.36Å; K908-Y941 WeakPolarHBondContact CE-OH 3.32Å; K908-Y941 HydrophobicContact CG-CE1 4.34Å; K908-Y941 VanDerWaalsContact CG-OH 3.24Å; K908-Y941 WeakPolarHBondContact CG-OH 3.46Å; K937-Y941 VanDerWaalsContact O-CD2 3.29Å; K937-Y941 WeakPolarHBondContact O-CD2 3.38Å; K937-Y941 PolarHBondContact O-N 2.8Å; K937-Y941 VanDerWaalsContact O-N 3.1Å; L938-Y941 CarbonylContact O-C 3.48Å; L938-Y941 PolarHBondContact O-N 3.27Å; I939-Y941 PolarHBondContact O-N 2.92Å
942	G	86.6	Confident	80.9	Confident	48 Å²	48	56.3 Å²	56.3	50%	0.495	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	25.4	169.2	0	0	0	0	0	115.8	N914 L938 I939 Q940	N914-G942 PolarHBondContact ND2-O 2.71Å; L938-G942 PolarHBondContact O-N 3.24Å; I939-G942 PolarHBondContact O-N 2.9Å; Q940-G942 VanDerWaalsContact C-N 3.34Å
943	A	88.4	Confident	78.2	Confident	9 Å²	9	59.6 Å²	59.6	7%	0.074	31%	0.31	C	S	.	.			trans	-66.5	131.5	169	0	0	0	0	0	111.4	P913 N914 L923 L938 A945	P913-A943 HydrophobicContact CB-CB 4.04Å; P913-A943 HydrophobicContact CG-CB 3.72Å; N914-A943 WeakPolarHBondContact OD1-CA 3.27Å; L923-A943 HydrophobicContact CB-CB 4.25Å; L923-A943 HydrophobicContact CD1-CB 4.34Å; L923-A943 HydrophobicContact CD2-CB 4.07Å; L923-A943 HydrophobicContact CG-CB 4.47Å; L938-A943 HydrophobicContact CB-CB 3.92Å; L938-A943 WeakPolarHBondContact O-CB 3.25Å; L938-A943 PolarHBondContact O-N 3.08Å; A943-A945 PolarHBondContact O-N 3.16Å
944	D	85.8	Confident	75.4	Confident	72 Å²	72	58.5 Å²	58.5	39%	0.385	31%	0.313	S	S	.	.			trans	-79.7	110.9	179.2	178.1	12.9	0	0	0	110.6	N914 N946 I947	N914-D944 PolarHBondContact ND2-N 3.33Å; N914-D944 PolarHBondContact OD1-N 2.82Å; D944-N946 PolarHBondContact O-N 3.33Å; D944-N946 WeakPolarHBondContact OD1-CA 3.38Å; D944-N946 WeakPolarHBondContact OD1-CB 3.38Å; D944-N946 PolarHBondContact OD1-N 3.1Å; D944-I947 HydrophobicContact CB-CB 4.32Å; D944-I947 WeakPolarHBondContact O-CB 3.11Å; D944-I947 WeakPolarHBondContact O-CG2 3.35Å; D944-I947 PolarHBondContact O-N 3.2Å
945	A	85.6	Confident	72.6	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.008	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.7	176.9	0	0	0	0	0	113.4	L923 A943 L1002 G1006 A1008	L923-A945 HydrophobicContact CD2-CB 4.33Å; A943-A945 PolarHBondContact O-N 3.16Å; A945-L1002 HydrophobicContact CB-CD2 4.07Å; A945-G1006 VanDerWaalsContact CB-O 3.3Å; A945-G1006 WeakPolarHBondContact CB-O 3.35Å; A945-A1008 HydrophobicContact CB-CB 3.92Å
946	N	84.2	Confident	69.5	Low	41 Å²	41	72.5 Å²	72.5	22%	0.219	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	6	-179.8	-64.4	-64.3	0	0	0	113.4	D944 C948 L1007 D1009	D944-N946 PolarHBondContact O-N 3.33Å; D944-N946 WeakPolarHBondContact OD1-CA 3.38Å; D944-N946 WeakPolarHBondContact OD1-CB 3.38Å; D944-N946 PolarHBondContact OD1-N 3.1Å; N946-C948 PolarHBondContact O-N 3.3Å; N946-L1007 PolarHBondContact ND2-O 3.37Å; N946-D1009 PolarHBondContact OD1-N 3.44Å
947	I	78.9	Confident	66.6	Low	34 Å²	34	74 Å²	74	17%	0.174	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-60.4	126.8	177.2	-164.3	161.9	0	0	0	110.9	P921 F924 D944 T982 V983	P921-I947 HydrophobicContact CB-CD1 3.95Å; P921-I947 HydrophobicContact CB-CG2 4.09Å; P921-I947 HydrophobicContact CG-CD1 3.76Å; P921-I947 HydrophobicContact CG-CG1 4.1Å; P921-I947 HydrophobicContact CG-CG2 4.12Å; F924-I947 HydrophobicContact CD2-CG2 4.27Å; F924-I947 HydrophobicContact CE2-CG2 4.2Å; F924-I947 WeakPolarHBondContact CE2-O 3.38Å; D944-I947 HydrophobicContact CB-CB 4.32Å; D944-I947 WeakPolarHBondContact O-CB 3.11Å; D944-I947 WeakPolarHBondContact O-CG2 3.35Å; D944-I947 PolarHBondContact O-N 3.2Å; I947-T982 WeakPolarHBondContact O-CA 3.36Å; I947-V983 HydrophobicContact CG2-CG2 3.87Å
948	C	72.8	Confident	63.5	Low	42 Å²	42	80.2 Å²	80.2	28%	0.284	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	-89.6	144.8	176.5	-62.7	0	0	0	0	111.2	N946 R950 L981	N946-C948 PolarHBondContact O-N 3.3Å; C948-R950 PolarHBondContact O-N 3.25Å; C948-L981 WeakPolarHBondContact CA-O 3Å
949	L	68	Low	60.5	Low	20 Å²	20	88 Å²	88	11%	0.105	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-64.1	127.8	161.4	-59.9	-177.1	0	0	0	109.3	L920 F924 L978 D979 G980 L981	L920-L949 HydrophobicContact CD2-CD1 4.28Å; L920-L949 HydrophobicContact CD2-CD2 3.45Å; L920-L949 VanDerWaalsContact CD2-CD2 3.45Å; F924-L949 HydrophobicContact CD1-CD2 4.09Å; F924-L949 HydrophobicContact CD2-CD2 3.67Å; F924-L949 HydrophobicContact CD2-CG 4.48Å; F924-L949 HydrophobicContact CE1-CD1 3.91Å; F924-L949 HydrophobicContact CE1-CD2 3.9Å; F924-L949 HydrophobicContact CE1-CG 3.89Å; F924-L949 HydrophobicContact CE2-CD2 3.45Å; F924-L949 VanDerWaalsContact CE2-CD2 3.45Å; F924-L949 HydrophobicContact CE2-CG 3.81Å; F924-L949 HydrophobicContact CG-CD2 3.98Å; F924-L949 HydrophobicContact CZ-CD1 3.99Å; F924-L949 HydrophobicContact CZ-CD2 3.57Å; F924-L949 HydrophobicContact CZ-CG 3.47Å; F924-L949 VanDerWaalsContact CZ-CG 3.47Å; L949-L978 WeakPolarHBondContact CB-O 3.31Å; L949-L978 HydrophobicContact CD1-CD2 3.76Å; L949-D979 CarbonylContact O-C 3.52Å; L949-D979 WeakPolarHBondContact O-CA 3.42Å; L949-G980 PolarHBondContact O-N 2.91Å; L949-L981 HydrophobicContact CD1-CB 4.43Å; L949-L981 PolarHBondContact N-O 2.92Å
950	R	58.9	Low	57.4	Low	206 Å²	206	94.5 Å²	94.5	78%	0.777	51%	0.512	S	S	*	.			trans	-105.5	128.2	169.5	-70.2	-175	-179.8	173.6	-0.3	109.8	C948 D979	C948-R950 PolarHBondContact O-N 3.25Å; R950-D979 VanDerWaalsContact CA-OD1 3.29Å; R950-D979 WeakPolarHBondContact CA-OD1 3.29Å
951	V	52.1	Low	54.4	Low	79 Å²	79	97.5 Å²	97.5	48%	0.479	53%	0.526	S	S	.	.			trans	-109.9	93.8	169.1	-176.1	0	0	0	0	107.4	S953 L978 D979	V951-S953 PolarHBondContact O-N 3.34Å; V951-L978 HydrophobicContact CG2-CB 3.68Å; V951-D979 HydrophobicContact CB-CB 4.42Å; V951-D979 HydrophobicContact CG2-CB 4.41Å; V951-D979 PolarHBondContact N-OD1 3.39Å
952	D	40.2	Very low	51.4	Low	93 Å²	93	101.3 Å²	101.3	50%	0.497	55%	0.551	S	S	.	*			trans	-60.6	93.1	-172	-54.7	-52	0	0	0	112.7	R918 T954	R918-D952 IonicContact CZ-OD2 3.48Å; R918-D952 IonicContact NE-OD2 2.81Å; R918-D952 IonicContact NH2-OD2 3.12Å; R918-D952 PolarHBondContact NH2-OD2 3.22Å; D952-T954 VanDerWaalsContact C-N 3.34Å; D952-T954 PolarHBondContact O-N 2.87Å
953	S	30.6	Very low	48.5	Very low	105 Å²	105	109.9 Å²	109.9	73%	0.734	58%	0.575	S	S	*	*			trans	-76.1	86.5	167.5	59.1	0	0	0	0	109.5	V951	V951-S953 PolarHBondContact O-N 3.34Å
954	T	29.3	Very low	45.4	Very low	122 Å²	122	111.7 Å²	111.7	75%	0.748	59%	0.594	S	S	*	*	S	Bend	trans	28.6	101.4	161.1	54.6	0	0	0	0	117.7	D952	D952-T954 VanDerWaalsContact C-N 3.34Å; D952-T954 PolarHBondContact O-N 2.87Å
955	S	30.4	Very low	42.4	Very low	92 Å²	92	114.3 Å²	114.3	64%	0.643	61%	0.607	S	S	*	*			trans	55.2	98.7	155	55.4	0	0	0	0	117.6	S957	S955-S957 PolarHBondContact O-N 3.04Å; S955-S957 VanDerWaalsContact O-N 3.09Å
956	E	26	Very low	39.6	Very low	207 Å²	207	118.4 Å²	118.4	97%	0.967	62%	0.623	S	S	*	*			trans	-65	99.9	156.1	-65.8	179.3	145.9	0	0	110
957	S	28.6	Very low	36.8	Very low	94 Å²	94	120.4 Å²	120.4	66%	0.657	63%	0.633	S	S	*	*			trans	-147.6	102.4	158.9	64.5	0	0	0	0	109.2	S955	S955-S957 PolarHBondContact O-N 3.04Å; S955-S957 VanDerWaalsContact O-N 3.09Å
958	E	25.8	Very low	34.3	Very low	183 Å²	183	124 Å²	124	86%	0.855	65%	0.652	S	S	*	*			trans	28.6	96.6	154.5	-60.8	179	161.7	0	0	116.8
959	N	27.2	Very low	32.1	Very low	163 Å²	163	130.6 Å²	130.6	87%	0.872	68%	0.679	S	S	*	*				-170.2	121.7	122	-93.5	-53.1	0	0	0	110.4
960	L	26.1	Very low	30.4	Very low	160 Å²	160	135.1 Å²	135.1	84%	0.838	70%	0.703	S	S	*	*			trans	-65.1	170.7	160.3	-97.9	62.1	0	0	0	109.4
961	E	25.8	Very low	28.9	Very low	187 Å²	187	132.6 Å²	132.6	87%	0.874	70%	0.7	S	S	*	*			trans	74.5	66	175.3	-49.3	-170.7	166.8	0	0	117
962	L	27.4	Very low	27.6	Very low	170 Å²	170	133 Å²	133	89%	0.89	70%	0.704	S	S	*	*			trans	-162.8	42.6	149	-107.6	158.7	0	0	0	113.5	G964	L962-G964 PolarHBondContact O-N 3.19Å
963	K	26	Very low	27.1	Very low	227 Å²	227	133.5 Å²	133.5	99%	0.987	71%	0.713	S	S	*	*			trans	-78	84	166.9	-95.8	-175.6	175.3	174.7	0	109.9
964	G	23.4	Very low	26.9	Very low	47 Å²	47	134.7 Å²	134.7	49%	0.485	71%	0.71	S	S	.	*			trans	-167.4	101.8	179.1	0	0	0	0	0	114.3	L962	L962-G964 PolarHBondContact O-N 3.19Å
965	I	23.7	Very low	26.8	Very low	128 Å²	128	134.4 Å²	134.4	66%	0.656	70%	0.703	S	S	*	*			trans	69.7	123.1	157	-52	160.8	0	0	0	113.9	Q372	Q372-I965 PolarHBondContact NE2-O 3.18Å
966	Y	27	Very low	26.9	Very low	87 Å²	87	130.7 Å²	130.7	34%	0.341	68%	0.677	S	S	.	*				-155.2	141.5	110.1	-119.4	-122.7	0	0	0	110.2	S368 R369 Q372	S368-Y966 VanDerWaalsContact C-OH 3.31Å; S368-Y966 PolarHBondContact O-OH 2.92Å; R369-Y966 WeakPolarHBondContact CA-OH 3.32Å; R369-Y966 HydrophobicContact CG-CE1 4.33Å; R369-Y966 WeakPolarHBondContact CG-OH 3.4Å; R369-Y966 PolarHBondContact N-OH 3.35Å; R369-Y966 VanDerWaalsContact N-OH 3.15Å; Q372-Y966 HydrophobicContact CB-CD1 4.49Å; Q372-Y966 HydrophobicContact CB-CE1 4.01Å; Q372-Y966 VanDerWaalsContact CD-CE2 3.49Å; Q372-Y966 HydrophobicContact CG-CD1 4.31Å; Q372-Y966 HydrophobicContact CG-CD2 4.02Å; Q372-Y966 HydrophobicContact CG-CE1 3.99Å; Q372-Y966 HydrophobicContact CG-CE2 3.68Å; Q372-Y966 HydrophobicContact CG-CG 4.3Å; Q372-Y966 VanDerWaalsContact OE1-CB 3.31Å
967	I	25.1	Very low	27.6	Very low	82 Å²	82	123.4 Å²	123.4	42%	0.421	65%	0.649	S	S	.	*			trans	-121.6	110.7	174.5	-64.4	168.2	0	0	0	104.3	E969 F1026	I967-E969 HydrophobicContact CG2-CG 4Å; I967-F1026 HydrophobicContact CD1-CB 4.32Å; I967-F1026 HydrophobicContact CD1-CD1 3.56Å; I967-F1026 HydrophobicContact CD1-CD2 4.34Å; I967-F1026 HydrophobicContact CD1-CE1 3.86Å; I967-F1026 HydrophobicContact CD1-CG 3.81Å; I967-F1026 HydrophobicContact CD1-CZ 4.37Å
968	D	25.7	Very low	28.7	Very low	109 Å²	109	121.7 Å²	121.7	58%	0.583	63%	0.632	S	S	*	*			trans	-96.3	130.8	152.3	-89	-32.9	0	0	0	107.6	D970	D968-D970 PolarHBondContact O-N 3.43Å
969	E	27.7	Very low	30.2	Very low	181 Å²	181	115.3 Å²	115.3	85%	0.846	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	7.4	-164.7	-65.3	-161.7	128.5	0	0	114.7	I967	I967-E969 HydrophobicContact CG2-CG 4Å
970	D	30.9	Very low	32.1	Very low	115 Å²	115	108 Å²	108	62%	0.615	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	-0.1	-164.2	-83.8	-63.1	0	0	0	116.8	Q219 D968	Q219-D970 PolarHBondContact NE2-OD1 2.76Å; D968-D970 PolarHBondContact O-N 3.43Å
971	E	27.6	Very low	34.5	Very low	154 Å²	154	101.4 Å²	101.4	72%	0.72	53%	0.533	S	S	*	.			trans	-87.1	133.1	176.3	-71.4	-153.2	143.4	0	0	114.2
972	P	25.6	Very low	37.3	Very low	86 Å²	86	92.5 Å²	92.5	56%	0.558	49%	0.491	S	S	*	.			trans	-71.2	144.2	163.2	31.9	-32.6	0	0	0	109.6	L974	P972-L974 PolarHBondContact O-N 2.86Å
973	P	28.8	Very low	40.1	Very low	105 Å²	105	84.4 Å²	84.4	68%	0.682	45%	0.449	S	S	*	.			trans	-62.8	106.8	-175.1	25.3	-33.7	0	0	0	111.2	I975	P973-I975 PolarHBondContact O-N 3.04Å
974	L	26	Very low	43.1	Very low	129 Å²	129	73.6 Å²	73.6	68%	0.675	40%	0.402	S	S	*	.			trans	-62.2	124.3	169.4	-80	149.8	0	0	0	108.8	P972	P972-L974 PolarHBondContact O-N 2.86Å
975	I	27.5	Very low	46.2	Very low	117 Å²	117	71.4 Å²	71.4	60%	0.6	38%	0.379	S	S	*	.			trans	18.5	109	160.4	-47.4	171.4	0	0	0	114.7	L677 P973 S977	L677-I975 HydrophobicContact CD2-CG2 4.4Å; P973-I975 PolarHBondContact O-N 3.04Å; I975-S977 PolarHBondContact O-N 3.36Å
976	P	32.1	Very low	49	Very low	14 Å²	14	66.8 Å²	66.8	9%	0.091	35%	0.353	C	S	.	.			trans	-49.9	138.8	171.4	-27	36.8	0	0	0	110.7	L680 L681 L978 D1017	L680-P976 HydrophobicContact CB-CB 3.98Å; L680-P976 HydrophobicContact CB-CG 3.8Å; L680-P976 HydrophobicContact CD1-CB 4.1Å; L681-P976 HydrophobicContact CD2-CG 3.58Å; L681-P976 HydrophobicContact CG-CG 3.8Å; P976-L978 PolarHBondContact O-N 2.94Å; P976-D1017 HydrophobicContact CB-CB 4.21Å
977	S	40.6	Very low	51.9	Low	54 Å²	54	62.6 Å²	62.6	38%	0.378	34%	0.337	S	S	.	.			trans	-53.1	117.5	-175.1	44.2	0	0	0	0	110.5	I975 D979 T1015	I975-S977 PolarHBondContact O-N 3.36Å; S977-D979 PolarHBondContact O-N 3.23Å; S977-D979 VanDerWaalsContact O-N 3.14Å; S977-T1015 PolarHBondContact OG-OG1 2.77Å; S977-T1015 VanDerWaalsContact OG-OG1 3.1Å
978	L	52.3	Low	54.9	Low	57 Å²	57	58.7 Å²	58.7	30%	0.298	32%	0.317	S	S	.	.			trans	-59.6	-17.4	168.9	-98.7	167.4	0	0	0	112.7	L677 L949 V951 P976 L981	L677-L978 HydrophobicContact CD1-CD2 3.63Å; L677-L978 HydrophobicContact CD1-CG 4.41Å; L677-L978 HydrophobicContact CD2-CD1 3.96Å; L677-L978 HydrophobicContact CD2-CD2 3.38Å; L677-L978 HydrophobicContact CD2-CG 3.36Å; L677-L978 HydrophobicContact CG-CD2 4.1Å; L677-L978 HydrophobicContact CG-CG 4.48Å; L949-L978 WeakPolarHBondContact CB-O 3.31Å; L949-L978 HydrophobicContact CD1-CD2 3.76Å; V951-L978 HydrophobicContact CG2-CB 3.68Å; P976-L978 PolarHBondContact O-N 2.94Å; L978-L981 HydrophobicContact CD2-CD1 4.13Å
979	D	58	Low	57.6	Low	49 Å²	49	54.2 Å²	54.2	26%	0.262	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	136.8	-172.3	-154.8	44.7	0	0	0	112	L949 R950 V951 S977 L981 T1015	L949-D979 CarbonylContact O-C 3.52Å; L949-D979 WeakPolarHBondContact O-CA 3.42Å; R950-D979 VanDerWaalsContact CA-OD1 3.29Å; R950-D979 WeakPolarHBondContact CA-OD1 3.29Å; V951-D979 HydrophobicContact CB-CB 4.42Å; V951-D979 HydrophobicContact CG2-CB 4.41Å; V951-D979 PolarHBondContact N-OD1 3.39Å; S977-D979 PolarHBondContact O-N 3.23Å; S977-D979 VanDerWaalsContact O-N 3.14Å; D979-L981 VanDerWaalsContact C-N 3.28Å; D979-L981 PolarHBondContact O-N 2.91Å; D979-T1015 HydrophobicContact CB-CG2 3.94Å; D979-T1015 WeakPolarHBondContact O-CB 3.46Å; D979-T1015 WeakPolarHBondContact O-CG2 3.35Å; D979-T1015 PolarHBondContact O-N 3.41Å; D979-T1015 PolarHBondContact O-OG1 3.46Å
980	G	67.3	Low	60.2	Low	11 Å²	11	45.6 Å²	45.6	11%	0.113	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-7.2	178.1	0	0	0	0	0	116.6	L949 T982	L949-G980 PolarHBondContact O-N 2.91Å; G980-T982 PolarHBondContact O-N 3.43Å
981	L	75.1	Confident	62.2	Low	21 Å²	21	41.6 Å²	41.6	11%	0.11	23%	0.233	C	C	.	.			trans	-65.7	129.1	173.8	-71.2	166.3	0	0	0	110.3	L680 F924 C948 L949 L978 D979 H985 A1014 L1059	L680-L981 HydrophobicContact CD1-CD1 4.27Å; F924-L981 WeakPolarHBondContact CZ-O 3.45Å; C948-L981 WeakPolarHBondContact CA-O 3Å; L949-L981 HydrophobicContact CD1-CB 4.43Å; L949-L981 PolarHBondContact N-O 2.92Å; L978-L981 HydrophobicContact CD2-CD1 4.13Å; D979-L981 VanDerWaalsContact C-N 3.28Å; D979-L981 PolarHBondContact O-N 2.91Å; L981-H985 HydrophobicContact CB-CB 4.45Å; L981-H985 HydrophobicContact CD2-CB 3.76Å; L981-A1014 HydrophobicContact CD2-CB 3.79Å; L981-A1014 HydrophobicContact CG-CB 4.28Å; L981-L1059 HydrophobicContact CD2-CD1 4.5Å
982	T	84.6	Confident	64.7	Low	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-89	168.3	171.9	67.7	0	0	0	0	112.5	I947 G980 L984 H985 Y986 K1012	I947-T982 WeakPolarHBondContact O-CA 3.36Å; G980-T982 PolarHBondContact O-N 3.43Å; T982-L984 PolarHBondContact O-N 2.9Å; T982-H985 PolarHBondContact N-ND1 2.95Å; T982-H985 WeakPolarHBondContact O-CB 3.48Å; T982-H985 PolarHBondContact O-N 3.5Å; T982-H985 PolarHBondContact OG1-ND1 2.98Å; T982-Y986 PolarHBondContact O-N 2.83Å; T982-K1012 HydrophobicContact CG2-CB 4.37Å; T982-K1012 HydrophobicContact CG2-CG 3.75Å
983	V	86.2	Confident	67.6	Low	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-53.8	-42.1	175.7	-177.2	0	0	0	0	111.4	L923 F924 V927 I947 H985 Y986 A987 L1002	L923-V983 HydrophobicContact CB-CG2 4.39Å; L923-V983 HydrophobicContact CD2-CG1 4.38Å; L923-V983 HydrophobicContact CD2-CG2 4.08Å; L923-V983 HydrophobicContact CG-CG1 4.14Å; L923-V983 HydrophobicContact CG-CG2 4.19Å; F924-V983 HydrophobicContact CD2-CG2 3.52Å; F924-V983 HydrophobicContact CE2-CB 4.37Å; F924-V983 HydrophobicContact CE2-CG2 3.49Å; F924-V983 VanDerWaalsContact CE2-CG2 3.49Å; F924-V983 HydrophobicContact CG-CG2 4.1Å; F924-V983 HydrophobicContact CZ-CB 4.46Å; F924-V983 HydrophobicContact CZ-CG2 4.04Å; F924-V983 VanDerWaalsContact CZ-N 3.31Å; V927-V983 HydrophobicContact CB-CG1 4.14Å; V927-V983 HydrophobicContact CG1-CG1 4.41Å; V927-V983 HydrophobicContact CG2-CG1 3.53Å; I947-V983 HydrophobicContact CG2-CG2 3.87Å; V983-H985 VanDerWaalsContact C-N 3.33Å; V983-H985 PolarHBondContact O-N 3.37Å; V983-Y986 WeakPolarHBondContact O-CB 3.34Å; V983-Y986 PolarHBondContact O-N 3.42Å; V983-A987 PolarHBondContact O-N 3.36Å; V983-L1002 HydrophobicContact CG1-CD1 3.8Å; V983-L1002 HydrophobicContact CG1-CD2 3.85Å
984	L	90.2	Very high	70.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-36.9	177.9	-176.3	61	0	0	0	112.6	T982 Y986 A987 V988 T999 L1002 L1003 A1008 P1010 P1056 L1077	T982-L984 PolarHBondContact O-N 2.9Å; L984-Y986 PolarHBondContact O-N 3.18Å; L984-A987 PolarHBondContact O-N 3.24Å; L984-V988 HydrophobicContact CD1-CG1 4.26Å; L984-V988 WeakPolarHBondContact O-CG1 3.39Å; L984-V988 WeakPolarHBondContact O-CG2 3.39Å; L984-V988 PolarHBondContact O-N 3.19Å; L984-T999 HydrophobicContact CD1-CG2 3.9Å; L984-L1002 HydrophobicContact CD1-CB 4.38Å; L984-L1003 HydrophobicContact CD1-CD2 4.37Å; L984-L1003 HydrophobicContact CD1-CG 4.35Å; L984-L1003 HydrophobicContact CD2-CD2 3.87Å; L984-A1008 HydrophobicContact CB-CB 4.2Å; L984-A1008 HydrophobicContact CD2-CB 3.93Å; L984-P1010 HydrophobicContact CD2-CB 4.25Å; L984-P1056 HydrophobicContact CB-CG 4.38Å; L984-P1056 HydrophobicContact CD2-CB 4.32Å; L984-P1056 HydrophobicContact CD2-CG 3.86Å; L984-P1056 HydrophobicContact CG-CB 4.05Å; L984-P1056 HydrophobicContact CG-CG 3.82Å; L984-L1077 HydrophobicContact CD2-CD2 4.3Å
985	H	87.7	Confident	73.1	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-62.9	-30.2	174.2	-70.3	83.2	0	0	0	112.7	L981 T982 V983 V988 K1012 R1054 P1056 L1059	L981-H985 HydrophobicContact CB-CB 4.45Å; L981-H985 HydrophobicContact CD2-CB 3.76Å; T982-H985 PolarHBondContact N-ND1 2.95Å; T982-H985 WeakPolarHBondContact O-CB 3.48Å; T982-H985 PolarHBondContact O-N 3.5Å; T982-H985 PolarHBondContact OG1-ND1 2.98Å; V983-H985 VanDerWaalsContact C-N 3.33Å; V983-H985 PolarHBondContact O-N 3.37Å; H985-V988 WeakPolarHBondContact O-CG2 3.2Å; H985-K1012 PolarHBondContact CE1-O 3.37Å; H985-K1012 PolarHBondContact NE2-O 2.75Å; H985-R1054 PolarHBondContact NE2-O 3.42Å; H985-P1056 WeakPolarHBondContact NE2-CD 3.48Å; H985-L1059 HydrophobicContact CB-CD1 3.74Å; H985-L1059 WeakPolarHBondContact O-CD1 3.25Å
986	Y	82.6	Confident	76.1	Confident	30 Å²	30	25.2 Å²	25.2	12%	0.118	14%	0.137	C	C	.	.	H	α-helix	trans	-81.8	-44.5	176.9	-165.1	-81.6	0	0	0	111.6	V675 F924 V927 Q928 T982 V983 L984 V988 L989 V990	V675-Y986 HydrophobicContact CB-CE2 4.19Å; V675-Y986 WeakPolarHBondContact CB-OH 3.4Å; V675-Y986 HydrophobicContact CG2-CE1 4.21Å; F924-Y986 HydrophobicContact CE1-CG 4.49Å; V927-Y986 HydrophobicContact CG1-CD1 4.05Å; Q928-Y986 HydrophobicContact CB-CE1 4.1Å; Q928-Y986 HydrophobicContact CG-CE1 4.43Å; T982-Y986 PolarHBondContact O-N 2.83Å; V983-Y986 WeakPolarHBondContact O-CB 3.34Å; V983-Y986 PolarHBondContact O-N 3.42Å; L984-Y986 PolarHBondContact O-N 3.18Å; Y986-V988 VanDerWaalsContact C-N 3.29Å; Y986-V988 PolarHBondContact O-N 2.74Å; Y986-L989 WeakPolarHBondContact O-CB 3.45Å; Y986-L989 PolarHBondContact O-N 3.05Å; Y986-V990 HydrophobicContact CD1-CG2 4.39Å; Y986-V990 HydrophobicContact CE1-CG2 4.45Å
987	A	88.3	Confident	78.9	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.4	-42.2	-179.3	0	0	0	0	0	112.6	V927 V983 L984 L989 V990 L998 L1002	V927-A987 HydrophobicContact CG1-CB 3.84Å; V983-A987 PolarHBondContact O-N 3.36Å; L984-A987 PolarHBondContact O-N 3.24Å; A987-L989 PolarHBondContact O-N 2.83Å; A987-V990 WeakPolarHBondContact O-CB 3.31Å; A987-V990 WeakPolarHBondContact O-CG2 3.47Å; A987-V990 PolarHBondContact O-N 3.14Å; A987-L998 HydrophobicContact CB-CB 4.3Å; A987-L1002 HydrophobicContact CB-CD1 3.48Å; A987-L1002 VanDerWaalsContact CB-CD1 3.48Å
988	V	88.3	Confident	81.3	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.8	179.6	-62	0	0	0	0	114.6	L984 H985 Y986 T999 P1056 L1059 V1060 R1063 I1073 L1077	L984-V988 HydrophobicContact CD1-CG1 4.26Å; L984-V988 WeakPolarHBondContact O-CG1 3.39Å; L984-V988 WeakPolarHBondContact O-CG2 3.39Å; L984-V988 PolarHBondContact O-N 3.19Å; H985-V988 WeakPolarHBondContact O-CG2 3.2Å; Y986-V988 VanDerWaalsContact C-N 3.29Å; Y986-V988 PolarHBondContact O-N 2.74Å; V988-T999 HydrophobicContact CG1-CG2 4.16Å; V988-P1056 HydrophobicContact CG1-CB 4.19Å; V988-P1056 HydrophobicContact CG2-CB 4.26Å; V988-L1059 HydrophobicContact CG2-CB 4.08Å; V988-V1060 HydrophobicContact CB-CG2 3.55Å; V988-V1060 HydrophobicContact CG1-CG2 3.94Å; V988-V1060 HydrophobicContact CG2-CG2 4.07Å; V988-R1063 WeakPolarHBondContact O-CD 3.34Å; V988-R1063 PolarHBondContact O-NH1 3.44Å; V988-I1073 HydrophobicContact CB-CG2 4.2Å; V988-I1073 HydrophobicContact CG1-CG2 3.78Å; V988-L1077 HydrophobicContact CG1-CD1 4.29Å
989	L	82.9	Confident	83.2	Confident	15 Å²	15	23.4 Å²	23.4	8%	0.079	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-5.8	174.9	-65.8	176.6	0	0	0	112.9	V679 Y986 A987 P991 L1059 R1063 Y1065	V679-L989 HydrophobicContact CG1-CD2 4.39Å; Y986-L989 WeakPolarHBondContact O-CB 3.45Å; Y986-L989 PolarHBondContact O-N 3.05Å; A987-L989 PolarHBondContact O-N 2.83Å; L989-P991 WeakPolarHBondContact O-CD 3.2Å; L989-L1059 HydrophobicContact CD1-CD1 4.28Å; L989-L1059 HydrophobicContact CD2-CB 4.17Å; L989-R1063 HydrophobicContact CD2-CG 4.37Å; L989-Y1065 PolarHBondContact O-OH 2.82Å
990	V	81.4	Confident	84.9	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-71.2	124.7	174.3	179.8	0	0	0	0	108.7	Y673 Y986 A987 M994 G995 L998 R1063	Y673-V990 HydrophobicContact CD1-CG1 3.99Å; Y673-V990 HydrophobicContact CD2-CG1 4.22Å; Y673-V990 HydrophobicContact CE1-CG1 3.53Å; Y673-V990 HydrophobicContact CE2-CG1 3.8Å; Y673-V990 HydrophobicContact CG-CG1 4.3Å; Y673-V990 VanDerWaalsContact CZ-CG1 3.41Å; Y986-V990 HydrophobicContact CD1-CG2 4.39Å; Y986-V990 HydrophobicContact CE1-CG2 4.45Å; A987-V990 WeakPolarHBondContact O-CB 3.31Å; A987-V990 WeakPolarHBondContact O-CG2 3.47Å; A987-V990 PolarHBondContact O-N 3.14Å; V990-M994 HydrophobicContact CG1-CB 4.28Å; V990-G995 WeakPolarHBondContact O-CA 3.43Å; V990-L998 HydrophobicContact CG1-CD1 4.29Å; V990-L998 HydrophobicContact CG2-CD1 4.33Å; V990-R1063 PolarHBondContact O-NH1 3.2Å; V990-R1063 VanDerWaalsContact O-NH1 3.08Å
991	P	73.7	Confident	86	Confident	30 Å²	30	25.2 Å²	25.2	20%	0.195	12%	0.123	C	C	.	.			trans	-75.5	158.9	176.1	20.8	-24.7	0	0	0	113.6	Y673 L989 Y1065	Y673-P991 HydrophobicContact CD1-CG 4.28Å; Y673-P991 HydrophobicContact CE1-CG 3.81Å; Y673-P991 PolarHBondContact OH-O 3.04Å; L989-P991 WeakPolarHBondContact O-CD 3.2Å; P991-Y1065 HydrophobicContact CB-CD2 4.1Å; P991-Y1065 HydrophobicContact CB-CE2 3.92Å; P991-Y1065 HydrophobicContact CG-CE2 4.32Å
992	N	80.3	Confident	86.8	Confident	66 Å²	66	24.2 Å²	24.2	35%	0.353	12%	0.118	S	C	.	.	S	Bend	trans	71.5	-177.3	-179.4	-48.3	-17.7	0	0	0	113.1	M994 G995 D1066	N992-M994 PolarHBondContact O-N 3.46Å; N992-G995 PolarHBondContact O-N 2.77Å; N992-D1066 WeakPolarHBondContact CA-OD2 3.12Å; N992-D1066 PolarHBondContact N-OD2 3.22Å
993	E	85.8	Confident	87.1	Confident	115 Å²	115	24.7 Å²	24.7	54%	0.537	12%	0.12	S	C	.	.	H	α-helix	trans	-52.2	-23.8	178.2	-65.7	-174.4	-176.2	0	0	114.2	G995 V996 K997	E993-G995 VanDerWaalsContact C-N 3.3Å; E993-G995 PolarHBondContact O-N 3.17Å; E993-V996 WeakPolarHBondContact O-CB 3.15Å; E993-V996 PolarHBondContact O-N 3.42Å; E993-V996 VanDerWaalsContact O-N 3.11Å; E993-K997 WeakPolarHBondContact O-CG 3.26Å; E993-K997 PolarHBondContact O-N 2.93Å; E993-K997 IonicContact OE2-NZ 3.66Å; E993-K997 PolarHBondContact OE2-NZ 2.81Å
994	M	85	Confident	87.3	Confident	53 Å²	53	29.5 Å²	29.5	26%	0.261	14%	0.143	S	C	.	.	H	α-helix	trans	-61.1	-39.2	176	-62.9	-53.2	-60.4	0	0	111.7	Y673 G930 P932 V990 N992 V996 K997 L998	Y673-M994 WeakPolarHBondContact OH-CB 3.08Å; G930-M994 WeakPolarHBondContact O-CE 3.34Å; P932-M994 HydrophobicContact CG-CE 4.06Å; V990-M994 HydrophobicContact CG1-CB 4.28Å; N992-M994 PolarHBondContact O-N 3.46Å; M994-V996 VanDerWaalsContact C-N 3.28Å; M994-V996 PolarHBondContact O-N 3.27Å; M994-K997 PolarHBondContact O-N 2.84Å; M994-L998 VanDerWaalsContact O-CB 3.32Å; M994-L998 WeakPolarHBondContact O-CB 3.49Å; M994-L998 WeakPolarHBondContact O-CD1 3.25Å; M994-L998 WeakPolarHBondContact O-CG 3.17Å; M994-L998 PolarHBondContact O-N 3.05Å
995	G	84.9	Confident	87	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.1	-31.3	173.8	0	0	0	0	0	113	V990 N992 E993 T999	V990-G995 WeakPolarHBondContact O-CA 3.43Å; N992-G995 PolarHBondContact O-N 2.77Å; E993-G995 VanDerWaalsContact C-N 3.3Å; E993-G995 PolarHBondContact O-N 3.17Å; G995-T999 VanDerWaalsContact O-CB 3.28Å; G995-T999 WeakPolarHBondContact O-CB 3.28Å; G995-T999 PolarHBondContact O-N 2.9Å; G995-T999 VanDerWaalsContact O-N 3.12Å; G995-T999 PolarHBondContact O-OG1 3.14Å
996	V	91.1	Very high	86.4	Confident	13 Å²	13	33.6 Å²	33.6	8%	0.079	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-57.7	172.8	-174.2	0	0	0	0	109.8	E993 M994 L998 T999 E1000 N1069 I1072 I1073	E993-V996 WeakPolarHBondContact O-CB 3.15Å; E993-V996 PolarHBondContact O-N 3.42Å; E993-V996 VanDerWaalsContact O-N 3.11Å; M994-V996 VanDerWaalsContact C-N 3.28Å; M994-V996 PolarHBondContact O-N 3.27Å; V996-L998 VanDerWaalsContact C-N 3.35Å; V996-L998 PolarHBondContact O-N 2.96Å; V996-T999 WeakPolarHBondContact O-CA 3.39Å; V996-T999 WeakPolarHBondContact O-CB 3.19Å; V996-T999 PolarHBondContact O-N 2.77Å; V996-E1000 HydrophobicContact CG1-CG 4.42Å; V996-E1000 WeakPolarHBondContact O-CG 3.36Å; V996-E1000 PolarHBondContact O-N 2.77Å; V996-N1069 HydrophobicContact CG2-CB 3.82Å; V996-N1069 WeakPolarHBondContact CG2-OD1 3.49Å; V996-I1072 HydrophobicContact CG1-CG2 3.66Å; V996-I1072 HydrophobicContact CG2-CB 4.44Å; V996-I1072 HydrophobicContact CG2-CG2 4.29Å; V996-I1073 HydrophobicContact CB-CG1 4.49Å; V996-I1073 HydrophobicContact CG2-CD1 4.37Å; V996-I1073 HydrophobicContact CG2-CG1 3.98Å
997	K	91.3	Very high	86.6	Confident	87 Å²	87	38.8 Å²	38.8	38%	0.378	20%	0.197	S	C	.	.	H	α-helix	trans	-58.4	-42.6	-177.8	-69.1	168.3	-172.3	160.4	0	112.5	E993 M994 E1000 I1001	E993-K997 WeakPolarHBondContact O-CG 3.26Å; E993-K997 PolarHBondContact O-N 2.93Å; E993-K997 IonicContact OE2-NZ 3.66Å; E993-K997 PolarHBondContact OE2-NZ 2.81Å; M994-K997 PolarHBondContact O-N 2.84Å; K997-E1000 PolarHBondContact O-N 3.44Å; K997-I1001 WeakPolarHBondContact O-CD1 3.28Å; K997-I1001 VanDerWaalsContact O-CG1 3.26Å; K997-I1001 WeakPolarHBondContact O-CG1 3.32Å; K997-I1001 PolarHBondContact O-N 3.02Å
998	L	91.2	Very high	86.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-36.9	175.8	-68	167.2	0	0	0	112.1	V927 P932 V935 A987 V990 M994 V996 L1002	V927-L998 HydrophobicContact CG1-CD1 4.33Å; V927-L998 HydrophobicContact CG2-CD2 4.48Å; P932-L998 HydrophobicContact CB-CD2 4.3Å; V935-L998 HydrophobicContact CB-CD2 4.43Å; V935-L998 HydrophobicContact CG2-CD2 3.92Å; A987-L998 HydrophobicContact CB-CB 4.3Å; V990-L998 HydrophobicContact CG1-CD1 4.29Å; V990-L998 HydrophobicContact CG2-CD1 4.33Å; M994-L998 VanDerWaalsContact O-CB 3.32Å; M994-L998 WeakPolarHBondContact O-CB 3.49Å; M994-L998 WeakPolarHBondContact O-CD1 3.25Å; M994-L998 WeakPolarHBondContact O-CG 3.17Å; M994-L998 PolarHBondContact O-N 3.05Å; V996-L998 VanDerWaalsContact C-N 3.35Å; V996-L998 PolarHBondContact O-N 2.96Å; L998-L1002 WeakPolarHBondContact O-CB 3.3Å; L998-L1002 WeakPolarHBondContact O-CD1 2.93Å; L998-L1002 WeakPolarHBondContact O-CG 3.15Å; L998-L1002 PolarHBondContact O-N 3.09Å; L998-L1002 VanDerWaalsContact O-N 3.15Å
999	T	92.2	Very high	86.6	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-69.7	-41.4	176.2	-58.9	0	0	0	0	111.5	L984 V988 G995 V996 L1002 L1003 I1073	L984-T999 HydrophobicContact CD1-CG2 3.9Å; V988-T999 HydrophobicContact CG1-CG2 4.16Å; G995-T999 VanDerWaalsContact O-CB 3.28Å; G995-T999 WeakPolarHBondContact O-CB 3.28Å; G995-T999 PolarHBondContact O-N 2.9Å; G995-T999 VanDerWaalsContact O-N 3.12Å; G995-T999 PolarHBondContact O-OG1 3.14Å; V996-T999 WeakPolarHBondContact O-CA 3.39Å; V996-T999 WeakPolarHBondContact O-CB 3.19Å; V996-T999 PolarHBondContact O-N 2.77Å; T999-L1002 PolarHBondContact O-N 2.81Å; T999-L1003 HydrophobicContact CG2-CD1 3.64Å; T999-L1003 HydrophobicContact CG2-CG 4.3Å; T999-L1003 WeakPolarHBondContact O-CB 3.19Å; T999-L1003 VanDerWaalsContact O-CG 3.27Å; T999-L1003 WeakPolarHBondContact O-CG 3.33Å; T999-L1003 PolarHBondContact O-N 2.98Å; T999-I1073 HydrophobicContact CG2-CG2 4.06Å
1000	E	92.5	Very high	87	Confident	69 Å²	69	41.7 Å²	41.7	32%	0.322	21%	0.214	S	C	.	.	H	α-helix	trans	-60.1	-51.7	175.7	-73.9	169	164.9	0	0	111.2	V996 K997 L1002 L1003 E1004	V996-E1000 HydrophobicContact CG1-CG 4.42Å; V996-E1000 WeakPolarHBondContact O-CG 3.36Å; V996-E1000 PolarHBondContact O-N 2.77Å; K997-E1000 PolarHBondContact O-N 3.44Å; E1000-L1002 VanDerWaalsContact C-N 3.32Å; E1000-L1002 PolarHBondContact O-N 3.43Å; E1000-L1003 PolarHBondContact O-N 3.01Å; E1000-L1003 VanDerWaalsContact O-N 3.16Å; E1000-E1004 WeakPolarHBondContact O-CB 3.29Å; E1000-E1004 PolarHBondContact O-N 3.28Å
1001	I	91	Very high	87.4	Confident	29 Å²	29	43.9 Å²	43.9	15%	0.149	23%	0.226	C	C	.	.	H	α-helix	trans	-57.3	-42.5	177.1	-68.8	164.6	0	0	0	111.9	P932 V935 H936 I939 K997 L1003 D1005 G1006	P932-I1001 HydrophobicContact CB-CD1 3.59Å; V935-I1001 HydrophobicContact CG1-CG2 3.73Å; H936-I1001 HydrophobicContact CB-CG2 4.29Å; I939-I1001 HydrophobicContact CD1-CG2 3.82Å; K997-I1001 WeakPolarHBondContact O-CD1 3.28Å; K997-I1001 VanDerWaalsContact O-CG1 3.26Å; K997-I1001 WeakPolarHBondContact O-CG1 3.32Å; K997-I1001 PolarHBondContact O-N 3.02Å; I1001-L1003 PolarHBondContact O-N 2.96Å; I1001-D1005 WeakPolarHBondContact O-CA 3.48Å; I1001-D1005 WeakPolarHBondContact O-CB 3.29Å; I1001-D1005 PolarHBondContact O-N 3.18Å; I1001-G1006 PolarHBondContact O-N 2.85Å
1002	L	91.5	Very high	87.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-69.2	-31.3	180	-72.4	165.9	0	0	0	113.4	L923 V927 V935 I939 A945 V983 L984 A987 L998 T999 E1000 G1006 L1007 A1008	L923-L1002 HydrophobicContact CD2-CD2 4.26Å; V927-L1002 HydrophobicContact CG2-CD1 4.3Å; V935-L1002 HydrophobicContact CG1-CD2 4.42Å; I939-L1002 HydrophobicContact CD1-CD2 4.2Å; A945-L1002 HydrophobicContact CB-CD2 4.07Å; V983-L1002 HydrophobicContact CG1-CD1 3.8Å; V983-L1002 HydrophobicContact CG1-CD2 3.85Å; L984-L1002 HydrophobicContact CD1-CB 4.38Å; A987-L1002 HydrophobicContact CB-CD1 3.48Å; A987-L1002 VanDerWaalsContact CB-CD1 3.48Å; L998-L1002 WeakPolarHBondContact O-CB 3.3Å; L998-L1002 WeakPolarHBondContact O-CD1 2.93Å; L998-L1002 WeakPolarHBondContact O-CG 3.15Å; L998-L1002 PolarHBondContact O-N 3.09Å; L998-L1002 VanDerWaalsContact O-N 3.15Å; T999-L1002 PolarHBondContact O-N 2.81Å; E1000-L1002 VanDerWaalsContact C-N 3.32Å; E1000-L1002 PolarHBondContact O-N 3.43Å; L1002-G1006 CarbonylContact O-C 3.54Å; L1002-G1006 VanDerWaalsContact O-CA 3.26Å; L1002-G1006 WeakPolarHBondContact O-CA 3.49Å; L1002-G1006 PolarHBondContact O-N 3.4Å; L1002-L1007 PolarHBondContact O-N 3.04Å; L1002-A1008 HydrophobicContact CB-CB 4.23Å; L1002-A1008 WeakPolarHBondContact O-CB 3.43Å; L1002-A1008 PolarHBondContact O-N 2.93Å
1003	L	91.4	Very high	88	Confident	9 Å²	9	46 Å²	46	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-84.2	-43.1	179.1	-68.5	169.8	0	0	0	112.4	L984 T999 E1000 I1001 P1010 L1077 H1080	L984-L1003 HydrophobicContact CD1-CD2 4.37Å; L984-L1003 HydrophobicContact CD1-CG 4.35Å; L984-L1003 HydrophobicContact CD2-CD2 3.87Å; T999-L1003 HydrophobicContact CG2-CD1 3.64Å; T999-L1003 HydrophobicContact CG2-CG 4.3Å; T999-L1003 WeakPolarHBondContact O-CB 3.19Å; T999-L1003 VanDerWaalsContact O-CG 3.27Å; T999-L1003 WeakPolarHBondContact O-CG 3.33Å; T999-L1003 PolarHBondContact O-N 2.98Å; E1000-L1003 PolarHBondContact O-N 3.01Å; E1000-L1003 VanDerWaalsContact O-N 3.16Å; I1001-L1003 PolarHBondContact O-N 2.96Å; L1003-P1010 HydrophobicContact CD2-CB 4.15Å; L1003-P1010 HydrophobicContact CD2-CG 4.48Å; L1003-L1077 HydrophobicContact CD1-CD2 4.04Å; L1003-L1077 HydrophobicContact CD2-CD2 4.39Å; L1003-H1080 HydrophobicContact CB-CB 4.47Å; L1003-H1080 HydrophobicContact CD1-CB 4.29Å; L1003-H1080 HydrophobicContact CD2-CB 4.15Å
1004	E	90.1	Very high	87.4	Confident	102 Å²	102	41.2 Å²	41.2	48%	0.477	21%	0.209	S	C	.	.	H	α-helix	trans	-83.3	-47	-175	-64.9	-170.5	165.2	0	0	112.1	E1000 K1079 H1080	E1000-E1004 WeakPolarHBondContact O-CB 3.29Å; E1000-E1004 PolarHBondContact O-N 3.28Å; E1004-K1079 IonicContact OE1-NZ 2.65Å; E1004-K1079 PolarHBondContact OE1-NZ 2.87Å; E1004-H1080 WeakPolarHBondContact CG-NE2 3.33Å; E1004-H1080 IonicContact OE1-CE1 3.23Å; E1004-H1080 IonicContact OE1-NE2 3.16Å
1005	D	84.6	Confident	86.6	Confident	73 Å²	73	40.7 Å²	40.7	39%	0.39	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-41.3	177.6	-55	-57.9	0	0	0	112.5	H936 I939 I1001	H936-D1005 VanDerWaalsContact CE1-CG 3.47Å; H936-D1005 IonicContact CE1-OD1 2.75Å; H936-D1005 PolarHBondContact CE1-OD1 3.06Å; H936-D1005 IonicContact CE1-OD2 2.89Å; H936-D1005 PolarHBondContact CE1-OD2 3.44Å; H936-D1005 VanDerWaalsContact CE1-OD2 3.23Å; H936-D1005 IonicContact CG-OD2 3.6Å; H936-D1005 VanDerWaalsContact ND1-CG 3.33Å; H936-D1005 IonicContact ND1-OD1 2.77Å; H936-D1005 IonicContact ND1-OD2 2.8Å; H936-D1005 PolarHBondContact ND1-OD2 3.29Å; I939-D1005 HydrophobicContact CG2-CB 4.03Å; I939-D1005 WeakPolarHBondContact CG2-O 3.42Å; I1001-D1005 WeakPolarHBondContact O-CA 3.48Å; I1001-D1005 WeakPolarHBondContact O-CB 3.29Å; I1001-D1005 PolarHBondContact O-N 3.18Å
1006	G	75	Confident	85.5	Confident	13 Å²	13	44.4 Å²	44.4	13%	0.134	23%	0.229	C	C	.	.	S	Bend	trans	-81.3	-12.2	-169.7	0	0	0	0	0	115.8	A945 I1001 L1002 A1008	A945-G1006 VanDerWaalsContact CB-O 3.3Å; A945-G1006 WeakPolarHBondContact CB-O 3.35Å; I1001-G1006 PolarHBondContact O-N 2.85Å; L1002-G1006 CarbonylContact O-C 3.54Å; L1002-G1006 VanDerWaalsContact O-CA 3.26Å; L1002-G1006 WeakPolarHBondContact O-CA 3.49Å; L1002-G1006 PolarHBondContact O-N 3.4Å; G1006-A1008 PolarHBondContact O-N 3.21Å
1007	L	86.2	Confident	83.8	Confident	140 Å²	140	44.2 Å²	44.2	73%	0.733	23%	0.227	S	C	*	.			trans	48.4	38.2	-171.7	-56.4	177.7	0	0	0	112.7	N946 L1002 D1009	N946-L1007 PolarHBondContact ND2-O 3.37Å; L1002-L1007 PolarHBondContact O-N 3.04Å; L1007-D1009 PolarHBondContact O-N 2.99Å
1008	A	88	Confident	81.7	Confident	6 Å²	6	45.4 Å²	45.4	5%	0.05	24%	0.238	C	C	.	.			trans	-65.4	132.8	176.9	0	0	0	0	0	110.8	A945 L984 L1002 G1006 P1010	A945-A1008 HydrophobicContact CB-CB 3.92Å; L984-A1008 HydrophobicContact CB-CB 4.2Å; L984-A1008 HydrophobicContact CD2-CB 3.93Å; L1002-A1008 HydrophobicContact CB-CB 4.23Å; L1002-A1008 WeakPolarHBondContact O-CB 3.43Å; L1002-A1008 PolarHBondContact O-N 2.93Å; G1006-A1008 PolarHBondContact O-N 3.21Å; A1008-P1010 VanDerWaalsContact O-CD 3.23Å; A1008-P1010 WeakPolarHBondContact O-CD 3.32Å
1009	D	88	Confident	79.5	Confident	59 Å²	59	46.7 Å²	46.7	32%	0.316	25%	0.247	S	C	.	.			trans	-76	111.1	178	173.1	16	0	0	0	110.5	N946 L1007 N1011 K1012	N946-D1009 PolarHBondContact OD1-N 3.44Å; L1007-D1009 PolarHBondContact O-N 2.99Å; D1009-N1011 PolarHBondContact O-N 2.94Å; D1009-N1011 WeakPolarHBondContact OD1-CA 3.3Å; D1009-N1011 WeakPolarHBondContact OD1-CB 3.26Å; D1009-N1011 PolarHBondContact OD1-N 3.03Å; D1009-K1012 HydrophobicContact CB-CB 4.22Å; D1009-K1012 WeakPolarHBondContact O-CB 3.43Å; D1009-K1012 PolarHBondContact O-N 3.45Å; D1009-K1012 PolarHBondContact OD1-N 2.7Å; D1009-K1012 PolarHBondContact OD2-N 3.05Å
1010	P	91.2	Very high	77	Confident	10 Å²	10	47.3 Å²	47.3	7%	0.065	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-6.4	179.7	34.2	-36.2	0	0	0	113.2	L984 L1003 A1008 P1056 L1077 H1080 A1082	L984-P1010 HydrophobicContact CD2-CB 4.25Å; L1003-P1010 HydrophobicContact CD2-CB 4.15Å; L1003-P1010 HydrophobicContact CD2-CG 4.48Å; A1008-P1010 VanDerWaalsContact O-CD 3.23Å; A1008-P1010 WeakPolarHBondContact O-CD 3.32Å; P1010-P1056 WeakPolarHBondContact O-CD 3.37Å; P1010-L1077 HydrophobicContact CB-CD2 3.78Å; P1010-H1080 WeakPolarHBondContact CG-O 3.36Å; P1010-A1082 HydrophobicContact CB-CB 3.92Å; P1010-A1082 HydrophobicContact CG-CB 4.24Å
1011	N	89.9	Confident	74.7	Confident	47 Å²	47	47.8 Å²	47.8	25%	0.251	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-4.9	176.7	-62.9	-58.7	0	0	0	113	D1009 Q1013 N1081 N1083 L1086	D1009-N1011 PolarHBondContact O-N 2.94Å; D1009-N1011 WeakPolarHBondContact OD1-CA 3.3Å; D1009-N1011 WeakPolarHBondContact OD1-CB 3.26Å; D1009-N1011 PolarHBondContact OD1-N 3.03Å; N1011-Q1013 PolarHBondContact O-N 2.94Å; N1011-N1081 PolarHBondContact ND2-O 3.43Å; N1011-N1083 WeakPolarHBondContact OD1-CB 3.12Å; N1011-N1083 PolarHBondContact OD1-N 2.93Å; N1011-L1086 HydrophobicContact CB-CD1 3.94Å
1012	K	84.7	Confident	72.1	Confident	84 Å²	84	50.3 Å²	50.3	37%	0.365	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-56.9	133	177.8	-159.5	70	167.4	-170.7	0	110.1	T982 H985 D1009	T982-K1012 HydrophobicContact CG2-CB 4.37Å; T982-K1012 HydrophobicContact CG2-CG 3.75Å; H985-K1012 PolarHBondContact CE1-O 3.37Å; H985-K1012 PolarHBondContact NE2-O 2.75Å; D1009-K1012 HydrophobicContact CB-CB 4.22Å; D1009-K1012 WeakPolarHBondContact O-CB 3.43Å; D1009-K1012 PolarHBondContact O-N 3.45Å; D1009-K1012 PolarHBondContact OD1-N 2.7Å; D1009-K1012 PolarHBondContact OD2-N 3.05Å
1013	Q	81.6	Confident	69.4	Low	57 Å²	57	56.9 Å²	56.9	27%	0.266	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-103	136.2	178.9	-68.5	-178.8	2.7	0	0	110.9	N1011 E1052 R1054 T1055	N1011-Q1013 PolarHBondContact O-N 2.94Å; Q1013-E1052 PolarHBondContact NE2-OE2 2.79Å; Q1013-E1052 VanDerWaalsContact OE1-CG 3.3Å; Q1013-R1054 WeakPolarHBondContact CA-O 3.47Å; Q1013-T1055 HydrophobicContact CG-CG2 3.72Å
1014	A	75	Confident	66.7	Low	13 Å²	13	59.8 Å²	59.8	11%	0.107	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-68.2	173.7	170.2	0	0	0	0	0	112.1	L981 G1053 R1054	L981-A1014 HydrophobicContact CD2-CB 3.79Å; L981-A1014 HydrophobicContact CG-CB 4.28Å; A1014-G1053 WeakPolarHBondContact O-CA 3.43Å; A1014-R1054 PolarHBondContact N-O 2.99Å
1015	T	67.2	Low	64	Low	43 Å²	43	61.3 Å²	61.3	26%	0.264	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-62.2	158.9	169.1	61.4	0	0	0	0	111.5	S977 D979 D1017	S977-T1015 PolarHBondContact OG-OG1 2.77Å; S977-T1015 VanDerWaalsContact OG-OG1 3.1Å; D979-T1015 HydrophobicContact CB-CG2 3.94Å; D979-T1015 WeakPolarHBondContact O-CB 3.46Å; D979-T1015 WeakPolarHBondContact O-CG2 3.35Å; D979-T1015 PolarHBondContact O-N 3.41Å; D979-T1015 PolarHBondContact O-OG1 3.46Å; T1015-D1017 PolarHBondContact O-N 3.24Å
1016	L	61.4	Low	61.3	Low	77 Å²	77	63.2 Å²	63.2	40%	0.403	33%	0.326	S	S	.	.			trans	-69.5	111.4	177.9	-68	171.9	0	0	0	110.9	N1051 E1052	L1016-N1051 HydrophobicContact CD1-CB 3.85Å; L1016-N1051 VanDerWaalsContact CD2-C 3.44Å; L1016-N1051 HydrophobicContact CD2-CB 4.08Å; L1016-N1051 VanDerWaalsContact CD2-O 3.29Å; L1016-N1051 WeakPolarHBondContact CD2-O 3.48Å; L1016-E1052 VanDerWaalsContact CD2-C 3.47Å; L1016-E1052 WeakPolarHBondContact CD2-O 3.29Å
1017	D	55.4	Low	59	Low	9 Å²	9	68.3 Å²	68.3	5%	0.048	35%	0.35	C	S	.	.			trans	-95.7	133.4	170.1	79.8	-49.9	0	0	0	111.4	P976 T1015 S1019 R1054 N1089	P976-D1017 HydrophobicContact CB-CB 4.21Å; T1015-D1017 PolarHBondContact O-N 3.24Å; D1017-S1019 PolarHBondContact O-N 2.87Å; D1017-S1019 WeakPolarHBondContact OD2-CB 3.43Å; D1017-S1019 PolarHBondContact OD2-OG 3.22Å; D1017-R1054 IonicContact OD1-CZ 3.51Å; D1017-R1054 IonicContact OD1-NE 2.65Å; D1017-R1054 PolarHBondContact OD1-NE 3.25Å; D1017-R1054 IonicContact OD1-NH2 3.92Å; D1017-R1054 IonicContact OD2-CZ 3.58Å; D1017-R1054 IonicContact OD2-NE 2.88Å; D1017-R1054 PolarHBondContact OD2-NE 3.08Å; D1017-R1054 IonicContact OD2-NH2 2.77Å; D1017-R1054 PolarHBondContact OD2-NH2 3.5Å; D1017-N1089 PolarHBondContact O-ND2 3.2Å
1018	D	47.7	Very low	56.3	Low	113 Å²	113	66.4 Å²	66.4	60%	0.604	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-68.5	0.2	-176.4	-79	-28.3	0	0	0	114.2	F1020 K1021	D1018-F1020 PolarHBondContact O-N 3.12Å; D1018-K1021 PolarHBondContact O-N 3.16Å; D1018-K1021 VanDerWaalsContact O-N 3.12Å; D1018-K1021 WeakPolarHBondContact OD1-CD 3.49Å; D1018-K1021 WeakPolarHBondContact OD1-CE 3.11Å; D1018-K1021 IonicContact OD1-NZ 3.27Å; D1018-K1021 PolarHBondContact OD1-NZ 2.83Å
1019	S	44.8	Very low	53.4	Low	26 Å²	26	70.3 Å²	70.3	18%	0.182	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-50.8	-28.9	-175.1	-60.4	0	0	0	0	114.4	T684 D1017 R1054	T684-S1019 PolarHBondContact OG1-O 3.08Å; D1017-S1019 PolarHBondContact O-N 2.87Å; D1017-S1019 WeakPolarHBondContact OD2-CB 3.43Å; D1017-S1019 PolarHBondContact OD2-OG 3.22Å; S1019-R1054 PolarHBondContact OG-NH2 3Å
1020	F	40.8	Very low	50.6	Low	14 Å²	14	73.9 Å²	73.9	6%	0.061	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-103.7	-10.8	-175	-71.8	-109.7	0	0	0	115.4	T683 T684 S685 D1018 L1022 N1089 H1091	T683-F1020 WeakPolarHBondContact O-CZ 3.07Å; T684-F1020 HydrophobicContact CG2-CD1 3.23Å; T684-F1020 HydrophobicContact CG2-CE1 3.32Å; T684-F1020 HydrophobicContact CG2-CG 3.96Å; T684-F1020 HydrophobicContact CG2-CZ 4.13Å; T684-F1020 WeakPolarHBondContact OG1-CA 3.46Å; T684-F1020 WeakPolarHBondContact OG1-CD1 3.49Å; T684-F1020 WeakPolarHBondContact OG1-CD2 3.49Å; T684-F1020 WeakPolarHBondContact OG1-CG 3.31Å; S685-F1020 WeakPolarHBondContact OG-CA 3.5Å; S685-F1020 PolarHBondContact OG-O 3.26Å; D1018-F1020 PolarHBondContact O-N 3.12Å; F1020-L1022 PolarHBondContact O-N 3.14Å; F1020-N1089 HydrophobicContact CB-CB 3.19Å; F1020-N1089 HydrophobicContact CD1-CB 4.09Å; F1020-N1089 HydrophobicContact CD2-CB 4.29Å; F1020-N1089 WeakPolarHBondContact CD2-ND2 3.46Å; F1020-N1089 HydrophobicContact CG-CB 3.64Å; F1020-H1091 AromaticContact CD1-CD2 3.71Å; F1020-H1091 HydrophobicContact CE1-CB 4.39Å
1021	K	43.4	Very low	47.6	Very low	80 Å²	80	80.8 Å²	80.8	35%	0.348	42%	0.423	S	S	.	.			trans	-74.4	125.8	-174.8	-71.7	-178.7	-170.4	153.4	0	111.6	D1018 K1023	D1018-K1021 PolarHBondContact O-N 3.16Å; D1018-K1021 VanDerWaalsContact O-N 3.12Å; D1018-K1021 WeakPolarHBondContact OD1-CD 3.49Å; D1018-K1021 WeakPolarHBondContact OD1-CE 3.11Å; D1018-K1021 IonicContact OD1-NZ 3.27Å; D1018-K1021 PolarHBondContact OD1-NZ 2.83Å; K1021-K1023 PolarHBondContact O-N 3.25Å
1022	L	37.2	Very low	44.6	Very low	81 Å²	81	83.1 Å²	83.1	42%	0.424	44%	0.444	S	S	.	.			trans	-67.3	119.7	167	-101	92.1	0	0	0	109.8	F1020 S1024	F1020-L1022 PolarHBondContact O-N 3.14Å; L1022-S1024 PolarHBondContact O-N 3.32Å
1023	K	33.5	Very low	41.7	Very low	138 Å²	138	82.4 Å²	82.4	60%	0.6	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-59	-5.9	172.9	-77.3	-166.8	171.4	-169	0	114.6	K1021 Q1025 F1026	K1021-K1023 PolarHBondContact O-N 3.25Å; K1023-Q1025 PolarHBondContact O-N 3.23Å; K1023-F1026 PolarHBondContact O-N 2.84Å
1024	S	35.9	Very low	39.1	Very low	71 Å²	71	87.8 Å²	87.8	50%	0.497	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-70.6	0.8	-174.8	64.6	0	0	0	0	116	L1022	L1022-S1024 PolarHBondContact O-N 3.32Å
1025	Q	32.4	Very low	36.9	Very low	133 Å²	133	92.9 Å²	92.9	62%	0.621	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-83.7	-16.1	170.2	-68.8	-173.4	2.8	0	0	113.4	K1023 N1027 T1028	K1023-Q1025 PolarHBondContact O-N 3.23Å; Q1025-N1027 PolarHBondContact O-N 2.78Å; Q1025-T1028 PolarHBondContact O-OG1 3.43Å
1026	F	29.2	Very low	35	Very low	114 Å²	114	96.5 Å²	96.5	50%	0.5	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-5.9	-179.6	-84.8	-75.1	0	0	0	115.5	I967 K1023 S1029	I967-F1026 HydrophobicContact CD1-CB 4.32Å; I967-F1026 HydrophobicContact CD1-CD1 3.56Å; I967-F1026 HydrophobicContact CD1-CD2 4.34Å; I967-F1026 HydrophobicContact CD1-CE1 3.86Å; I967-F1026 HydrophobicContact CD1-CG 3.81Å; I967-F1026 HydrophobicContact CD1-CZ 4.37Å; K1023-F1026 PolarHBondContact O-N 2.84Å; F1026-S1029 PolarHBondContact O-OG 2.76Å
1027	N	26.7	Very low	33.4	Very low	119 Å²	119	101.9 Å²	101.9	64%	0.636	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	5.6	176.7	-85.2	-38.3	0	0	0	114.2	Q1025	Q1025-N1027 PolarHBondContact O-N 2.78Å
1028	T	28.1	Very low	32.1	Very low	101 Å²	101	110.4 Å²	110.4	62%	0.62	62%	0.615	S	S	*	*	S	Bend	trans	-91.6	-8.4	173.3	24.6	0	0	0	0	114.3	Q1025	Q1025-T1028 PolarHBondContact O-OG1 3.43Å
1029	S	26.9	Very low	31.2	Very low	87 Å²	87	112.6 Å²	112.6	61%	0.608	63%	0.627	S	S	*	*	S	Bend	trans	-94.1	-7.2	178.4	47	0	0	0	0	114.6	F1026	F1026-S1029 PolarHBondContact O-OG 2.76Å
1030	I	29	Very low	30.3	Very low	134 Å²	134	117.3 Å²	117.3	69%	0.687	66%	0.66	S	S	*	*	S	Bend	trans	-106.9	-7.1	-173	-61	177.3	0	0	0	112.5
1031	I	28.4	Very low	29.6	Very low	155 Å²	155	120 Å²	120	80%	0.795	69%	0.691	S	S	*	*	S	Bend	trans	-132.7	58.4	177.4	-41.5	-179.3	0	0	0	111.6
1032	S	27.3	Very low	28.8	Very low	97 Å²	97	123.7 Å²	123.7	68%	0.678	71%	0.707	S	S	*	*			trans	-145.5	62.5	162	63.8	0	0	0	0	110.4
1033	G	25	Very low	28.3	Very low	69 Å²	69	126.2 Å²	126.2	71%	0.711	73%	0.726	S	S	*	*			trans	-67.7	133.5	168.3	0	0	0	0	0	110.9
1034	N	25.4	Very low	28.1	Very low	169 Å²	169	122 Å²	122	90%	0.904	71%	0.712	S	S	*	*			trans	63.5	78.8	160.8	-55.1	-10.9	0	0	0	117.9
1035	S	30.2	Very low	27.9	Very low	121 Å²	121	123.8 Å²	123.8	85%	0.846	72%	0.722	S	S	*	*			trans	-149.9	107.1	135.5	59.7	0	0	0	0	110.2
1036	S	26.3	Very low	27.8	Very low	119 Å²	119	121.4 Å²	121.4	83%	0.832	71%	0.711	S	S	*	*			trans	-72.6	124.5	173.1	49.6	0	0	0	0	111.1
1037	E	29.1	Very low	28.1	Very low	190 Å²	190	121.2 Å²	121.2	89%	0.888	71%	0.712	S	S	*	*			trans	-153.2	125	146.7	-117.9	165.8	-143.3	0	0	108.9
1038	Q	26.9	Very low	28.6	Very low	188 Å²	188	121.8 Å²	121.8	88%	0.879	72%	0.715	S	S	*	*			trans	-78.7	129.2	179.3	-66.7	170.6	-29.2	0	0	108.8
1039	N	28.6	Very low	29.2	Very low	158 Å²	158	124.1 Å²	124.1	85%	0.845	71%	0.712	S	S	*	*			trans	-153.9	115.6	153.4	-97.6	-43.2	0	0	0	110.6
1040	S	26.3	Very low	30.3	Very low	126 Å²	126	123.1 Å²	123.1	88%	0.881	70%	0.699	S	S	*	*			trans	-69.8	125.6	169.9	40.1	0	0	0	0	110
1041	G	25.9	Very low	31.5	Very low	69 Å²	69	120 Å²	120	71%	0.711	68%	0.684	S	S	*	*			trans	-143.8	120.7	-179.6	0	0	0	0	0	111.5	T1043	G1041-T1043 PolarHBondContact O-N 3.32Å
1042	K	26.9	Very low	33.3	Very low	159 Å²	159	115.3 Å²	115.3	69%	0.691	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-54	123.8	-177.4	-63.6	164.4	177.8	172.4	0	111.3	I1423	K1042-I1423 PolarHBondContact NZ-O 3.22Å
1043	T	27.3	Very low	35.4	Very low	133 Å²	133	110.8 Å²	110.8	82%	0.816	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-68.1	125.4	170.4	48.4	0	0	0	0	110.6	G1041	G1041-T1043 PolarHBondContact O-N 3.32Å
1044	T	28.8	Very low	38	Very low	50 Å²	50	107.8 Å²	107.8	31%	0.307	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-81	153.8	179.4	52.5	0	0	0	0	112.1	E1046	T1044-E1046 PolarHBondContact O-N 3.44Å; T1044-E1046 VanDerWaalsContact O-N 3.13Å
1045	P	30.7	Very low	41	Very low	108 Å²	108	99.9 Å²	99.9	70%	0.701	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-65.2	-14.3	-178.3	-23.5	34.9	0	0	0	115.7
1046	E	31.5	Very low	43.9	Very low	84 Å²	84	94.1 Å²	94.1	39%	0.393	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-75.7	-31.7	-171	-65.3	-177	132.2	0	0	113.6	T1044 N1048 R1049	T1044-E1046 PolarHBondContact O-N 3.44Å; T1044-E1046 VanDerWaalsContact O-N 3.13Å; E1046-N1048 PolarHBondContact O-N 3.44Å; E1046-R1049 PolarHBondContact O-N 2.82Å
1047	E	35.9	Very low	47	Very low	110 Å²	110	88.5 Å²	88.5	51%	0.514	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-71.3	-12.9	-178.8	-62.7	-170.2	155.7	0	0	112.8	H1388	E1047-H1388 IonicContact OE1-CE1 2.81Å; E1047-H1388 PolarHBondContact OE1-CE1 3.26Å; E1047-H1388 VanDerWaalsContact OE1-CE1 3.32Å; E1047-H1388 IonicContact OE1-ND1 3.93Å; E1047-H1388 PolarHBondContact OE1-ND1 3.41Å
1048	N	36.1	Very low	49.9	Very low	131 Å²	131	79.8 Å²	79.8	70%	0.701	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-80.5	-12.6	174.3	-73.5	-32.9	0	0	0	114.3	E1046 I1050	E1046-N1048 PolarHBondContact O-N 3.44Å; N1048-I1050 VanDerWaalsContact C-N 3.26Å; N1048-I1050 PolarHBondContact O-N 3.5Å
1049	R	40.5	Very low	52.7	Low	149 Å²	149	70.9 Å²	70.9	56%	0.562	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-77.7	-2.2	-179.4	-66.9	-174	178.1	179.1	-3	114.9	E1046	E1046-R1049 PolarHBondContact O-N 2.82Å
1050	I	50.8	Low	55.7	Low	66 Å²	66	63.4 Å²	63.4	34%	0.338	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-83.5	-17.4	-172	-60.9	174.6	0	0	0	112.2	N1048	N1048-I1050 VanDerWaalsContact C-N 3.26Å; N1048-I1050 PolarHBondContact O-N 3.5Å
1051	N	52.9	Low	58.6	Low	68 Å²	68	57.4 Å²	57.4	36%	0.364	31%	0.308	S	S	.	.			trans	-113	84.6	179.2	-57.8	-59.7	0	0	0	109.2	L1016	L1016-N1051 HydrophobicContact CD1-CB 3.85Å; L1016-N1051 VanDerWaalsContact CD2-C 3.44Å; L1016-N1051 HydrophobicContact CD2-CB 4.08Å; L1016-N1051 VanDerWaalsContact CD2-O 3.29Å; L1016-N1051 WeakPolarHBondContact CD2-O 3.48Å
1052	E	66	Low	61.5	Low	58 Å²	58	54.4 Å²	54.4	27%	0.271	28%	0.277	S	S	.	.			trans	-107.2	152.6	172.8	-90.2	-178.4	-156	0	0	110.5	Q1013 L1016 L1087 C1088 N1089	Q1013-E1052 PolarHBondContact NE2-OE2 2.79Å; Q1013-E1052 VanDerWaalsContact OE1-CG 3.3Å; L1016-E1052 VanDerWaalsContact CD2-C 3.47Å; L1016-E1052 WeakPolarHBondContact CD2-O 3.29Å; E1052-L1087 WeakPolarHBondContact CB-O 3.49Å; E1052-C1088 WeakPolarHBondContact O-CA 3.35Å; E1052-N1089 PolarHBondContact O-N 3.2Å; E1052-N1089 VanDerWaalsContact O-N 3.16Å
1053	G	71.4	Confident	64.1	Low	2 Å²	2	47 Å²	47	2%	0.021	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-80	167.8	-170.5	0	0	0	0	0	114.2	A1014	A1014-G1053 WeakPolarHBondContact O-CA 3.43Å
1054	R	79.9	Confident	66.3	Low	6 Å²	6	45.1 Å²	45.1	2%	0.023	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-63.1	137.9	172.9	-63.3	-178.7	-167.5	-144	9.2	109.2	L680 H985 Q1013 A1014 D1017 S1019 C1088	L680-R1054 PolarHBondContact O-NH2 2.91Å; H985-R1054 PolarHBondContact NE2-O 3.42Å; Q1013-R1054 WeakPolarHBondContact CA-O 3.47Å; A1014-R1054 PolarHBondContact N-O 2.99Å; D1017-R1054 IonicContact OD1-CZ 3.51Å; D1017-R1054 IonicContact OD1-NE 2.65Å; D1017-R1054 PolarHBondContact OD1-NE 3.25Å; D1017-R1054 IonicContact OD1-NH2 3.92Å; D1017-R1054 IonicContact OD2-CZ 3.58Å; D1017-R1054 IonicContact OD2-NE 2.88Å; D1017-R1054 PolarHBondContact OD2-NE 3.08Å; D1017-R1054 IonicContact OD2-NH2 2.77Å; D1017-R1054 PolarHBondContact OD2-NH2 3.5Å; S1019-R1054 PolarHBondContact OG-NH2 3Å; R1054-C1088 VanDerWaalsContact CA-SG 3.53Å; R1054-C1088 WeakPolarHBondContact CG-SG 3.37Å; R1054-C1088 PolarHBondContact N-SG 3.39Å; R1054-C1088 VanDerWaalsContact N-SG 3.37Å
1055	T	88.8	Confident	68.7	Low	2 Å²	2	46.4 Å²	46.4	1%	0.012	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-100.6	165	165.4	69.6	0	0	0	0	110.3	Q1013 L1057 H1058 L1059 L1086	Q1013-T1055 HydrophobicContact CG-CG2 3.72Å; T1055-L1057 PolarHBondContact O-N 3.28Å; T1055-H1058 WeakPolarHBondContact O-CB 3.36Å; T1055-H1058 PolarHBondContact O-N 3.21Å; T1055-H1058 PolarHBondContact OG1-N 2.76Å; T1055-H1058 PolarHBondContact OG1-ND1 3.32Å; T1055-L1059 PolarHBondContact O-N 2.98Å; T1055-L1086 HydrophobicContact CG2-CB 4.4Å; T1055-L1086 HydrophobicContact CG2-CD1 3.93Å
1056	P	90.3	Very high	71.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-54.3	-37.3	173.8	-26.5	35.6	0	0	0	113	L984 H985 V988 P1010 H1058 L1059 V1060 L1077	L984-P1056 HydrophobicContact CB-CG 4.38Å; L984-P1056 HydrophobicContact CD2-CB 4.32Å; L984-P1056 HydrophobicContact CD2-CG 3.86Å; L984-P1056 HydrophobicContact CG-CB 4.05Å; L984-P1056 HydrophobicContact CG-CG 3.82Å; H985-P1056 WeakPolarHBondContact NE2-CD 3.48Å; V988-P1056 HydrophobicContact CG1-CB 4.19Å; V988-P1056 HydrophobicContact CG2-CB 4.26Å; P1010-P1056 WeakPolarHBondContact O-CD 3.37Å; P1056-H1058 PolarHBondContact O-N 3.1Å; P1056-L1059 WeakPolarHBondContact O-CB 3.46Å; P1056-L1059 PolarHBondContact O-N 3.21Å; P1056-L1059 VanDerWaalsContact O-N 3.16Å; P1056-V1060 WeakPolarHBondContact O-CG2 3.27Å; P1056-V1060 PolarHBondContact O-N 3.35Å; P1056-L1077 HydrophobicContact CB-CD1 4.42Å; P1056-L1077 HydrophobicContact CB-CD2 4.28Å
1057	L	92.9	Very high	73.7	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-37.8	177.4	-173.6	62.5	0	0	0	112.7	T1055 C1061 T1074 L1077 L1078 A1082 P1084 A1093 L1109	T1055-L1057 PolarHBondContact O-N 3.28Å; L1057-C1061 WeakPolarHBondContact O-CB 3.36Å; L1057-C1061 PolarHBondContact O-N 3.3Å; L1057-C1061 VanDerWaalsContact O-N 3.13Å; L1057-C1061 PolarHBondContact O-SG 3.24Å; L1057-T1074 HydrophobicContact CD1-CG2 4.03Å; L1057-L1077 HydrophobicContact CB-CD1 4.35Å; L1057-L1077 HydrophobicContact CD1-CB 4.42Å; L1057-L1077 HydrophobicContact CD1-CD1 4.19Å; L1057-L1078 HydrophobicContact CD2-CD2 4.21Å; L1057-A1082 HydrophobicContact CD2-CB 4.19Å; L1057-P1084 HydrophobicContact CD2-CB 4.16Å; L1057-A1093 HydrophobicContact CD2-CB 3.98Å; L1057-A1093 HydrophobicContact CG-CB 3.86Å; L1057-L1109 HydrophobicContact CD2-CD2 4.43Å
1058	H	89.8	Confident	76.2	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-64.6	-40.2	172.3	-70.9	95.3	0	0	0	111.8	T1055 P1056 C1061 S1062 L1086 H1091 A1093	T1055-H1058 WeakPolarHBondContact O-CB 3.36Å; T1055-H1058 PolarHBondContact O-N 3.21Å; T1055-H1058 PolarHBondContact OG1-N 2.76Å; T1055-H1058 PolarHBondContact OG1-ND1 3.32Å; P1056-H1058 PolarHBondContact O-N 3.1Å; H1058-C1061 PolarHBondContact O-N 3.37Å; H1058-S1062 WeakPolarHBondContact O-CB 3.43Å; H1058-S1062 PolarHBondContact O-N 2.94Å; H1058-L1086 PolarHBondContact CE1-O 3.05Å; H1058-L1086 PolarHBondContact NE2-O 3.44Å; H1058-H1091 PolarHBondContact NE2-O 3.41Å; H1058-H1091 VanDerWaalsContact NE2-O 3.08Å; H1058-A1093 PolarHBondContact NE2-N 3.27Å
1059	L	86.2	Confident	78.8	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-43.6	178.1	-70.6	179.9	0	0	0	112	L680 L981 H985 V988 L989 T1055 P1056 C1061 S1062 R1063	L680-L1059 HydrophobicContact CD2-CD2 4.04Å; L981-L1059 HydrophobicContact CD2-CD1 4.5Å; H985-L1059 HydrophobicContact CB-CD1 3.74Å; H985-L1059 WeakPolarHBondContact O-CD1 3.25Å; V988-L1059 HydrophobicContact CG2-CB 4.08Å; L989-L1059 HydrophobicContact CD1-CD1 4.28Å; L989-L1059 HydrophobicContact CD2-CB 4.17Å; T1055-L1059 PolarHBondContact O-N 2.98Å; P1056-L1059 WeakPolarHBondContact O-CB 3.46Å; P1056-L1059 PolarHBondContact O-N 3.21Å; P1056-L1059 VanDerWaalsContact O-N 3.16Å; L1059-C1061 PolarHBondContact O-N 2.91Å; L1059-S1062 WeakPolarHBondContact O-CB 3.43Å; L1059-S1062 PolarHBondContact O-N 3.24Å; L1059-S1062 VanDerWaalsContact O-N 3.1Å; L1059-S1062 PolarHBondContact O-OG 3.4Å; L1059-R1063 PolarHBondContact O-N 2.99Å
1060	V	89.9	Confident	81.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59	-47.9	174.2	177.9	0	0	0	0	111.2	V988 P1056 S1062 R1063 S1070 I1073 T1074 L1077	V988-V1060 HydrophobicContact CB-CG2 3.55Å; V988-V1060 HydrophobicContact CG1-CG2 3.94Å; V988-V1060 HydrophobicContact CG2-CG2 4.07Å; P1056-V1060 WeakPolarHBondContact O-CG2 3.27Å; P1056-V1060 PolarHBondContact O-N 3.35Å; V1060-S1062 PolarHBondContact O-N 2.88Å; V1060-R1063 VanDerWaalsContact O-CB 3.31Å; V1060-R1063 WeakPolarHBondContact O-CB 3.46Å; V1060-R1063 WeakPolarHBondContact O-CG 3.48Å; V1060-R1063 PolarHBondContact O-N 3.44Å; V1060-S1070 WeakPolarHBondContact CG1-O 3.46Å; V1060-I1073 HydrophobicContact CG1-CB 4.42Å; V1060-I1073 HydrophobicContact CG1-CG2 4.43Å; V1060-I1073 HydrophobicContact CG2-CB 4.35Å; V1060-I1073 HydrophobicContact CG2-CG2 3.54Å; V1060-T1074 VanDerWaalsContact CG1-OG1 3.23Å; V1060-T1074 WeakPolarHBondContact CG1-OG1 3.46Å; V1060-L1077 HydrophobicContact CG2-CD1 3.86Å
1061	C	89.1	Confident	83.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-21.5	178.2	-65.7	0	0	0	0	113.2	L1057 H1058 L1059 V1096 A1097 T1100	L1057-C1061 WeakPolarHBondContact O-CB 3.36Å; L1057-C1061 PolarHBondContact O-N 3.3Å; L1057-C1061 VanDerWaalsContact O-N 3.13Å; L1057-C1061 PolarHBondContact O-SG 3.24Å; H1058-C1061 PolarHBondContact O-N 3.37Å; L1059-C1061 PolarHBondContact O-N 2.91Å; C1061-V1096 HydrophobicContact CB-CB 4.21Å; C1061-V1096 HydrophobicContact CB-CG1 4.09Å; C1061-A1097 HydrophobicContact CB-CB 3.99Å; C1061-T1100 PolarHBondContact O-OG1 2.88Å
1062	S	85.2	Confident	85.1	Confident	7 Å²	7	29.1 Å²	29.1	5%	0.049	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-11.3	175.9	79.8	0	0	0	0	114.2	H1058 L1059 V1060 E1064	H1058-S1062 WeakPolarHBondContact O-CB 3.43Å; H1058-S1062 PolarHBondContact O-N 2.94Å; L1059-S1062 WeakPolarHBondContact O-CB 3.43Å; L1059-S1062 PolarHBondContact O-N 3.24Å; L1059-S1062 VanDerWaalsContact O-N 3.1Å; L1059-S1062 PolarHBondContact O-OG 3.4Å; V1060-S1062 PolarHBondContact O-N 2.88Å; S1062-E1064 PolarHBondContact O-N 2.84Å
1063	R	81.5	Confident	86.4	Confident	3 Å²	3	26.4 Å²	26.4	1%	0.011	13%	0.133	C	C	.	.			trans	-66.2	126.2	-179.3	-68.8	173.5	55.5	154.4	-7.2	111.3	V988 L989 V990 L1059 V1060 Y1065 D1066 S1070 N1102	V988-R1063 WeakPolarHBondContact O-CD 3.34Å; V988-R1063 PolarHBondContact O-NH1 3.44Å; L989-R1063 HydrophobicContact CD2-CG 4.37Å; V990-R1063 PolarHBondContact O-NH1 3.2Å; V990-R1063 VanDerWaalsContact O-NH1 3.08Å; L1059-R1063 PolarHBondContact O-N 2.99Å; V1060-R1063 VanDerWaalsContact O-CB 3.31Å; V1060-R1063 WeakPolarHBondContact O-CB 3.46Å; V1060-R1063 WeakPolarHBondContact O-CG 3.48Å; V1060-R1063 PolarHBondContact O-N 3.44Å; R1063-Y1065 HydrophobicContact CG-CE1 4.35Å; R1063-D1066 IonicContact CZ-OD2 3.83Å; R1063-D1066 VanDerWaalsContact NH2-CB 3.32Å; R1063-D1066 VanDerWaalsContact NH2-CG 3.27Å; R1063-D1066 PolarHBondContact NH2-O 2.74Å; R1063-D1066 IonicContact NH2-OD2 3.63Å; R1063-D1066 PolarHBondContact NH2-OD2 3.11Å; R1063-S1070 PolarHBondContact NE-OG 3.25Å; R1063-N1102 PolarHBondContact O-ND2 3.17Å
1064	E	75	Confident	87.5	Confident	93 Å²	93	26.3 Å²	26.3	44%	0.435	13%	0.132	S	C	.	.			trans	-98.3	1.3	171.9	-57.2	-171.1	144.6	0	0	112.4	S1062 R1140	S1062-E1064 PolarHBondContact O-N 2.84Å; E1064-R1140 IonicContact OE1-CZ 2.78Å; E1064-R1140 IonicContact OE1-NH1 3.32Å; E1064-R1140 PolarHBondContact OE1-NH1 3.33Å; E1064-R1140 IonicContact OE1-NH2 3.8Å; E1064-R1140 PolarHBondContact OE1-NH2 3.37Å
1065	Y	78.8	Confident	88.2	Confident	78 Å²	78	32.5 Å²	32.5	31%	0.306	16%	0.159	S	C	.	.	S	Bend	trans	-128.2	151.2	-178.9	60.2	-87.9	0	0	0	110.8	L989 P991 R1063 L1067	L989-Y1065 PolarHBondContact O-OH 2.82Å; P991-Y1065 HydrophobicContact CB-CD2 4.1Å; P991-Y1065 HydrophobicContact CB-CE2 3.92Å; P991-Y1065 HydrophobicContact CG-CE2 4.32Å; R1063-Y1065 HydrophobicContact CG-CE1 4.35Å; Y1065-L1067 PolarHBondContact O-N 2.91Å
1066	D	80.5	Confident	88.4	Confident	40 Å²	40	33 Å²	33	21%	0.214	16%	0.162	C	C	.	.			trans	52.1	60.3	174.3	173.9	31.8	0	0	0	111.8	N992 R1063 L1068 N1069 S1070	N992-D1066 WeakPolarHBondContact CA-OD2 3.12Å; N992-D1066 PolarHBondContact N-OD2 3.22Å; R1063-D1066 IonicContact CZ-OD2 3.83Å; R1063-D1066 VanDerWaalsContact NH2-CB 3.32Å; R1063-D1066 VanDerWaalsContact NH2-CG 3.27Å; R1063-D1066 PolarHBondContact NH2-O 2.74Å; R1063-D1066 IonicContact NH2-OD2 3.63Å; R1063-D1066 PolarHBondContact NH2-OD2 3.11Å; D1066-L1068 VanDerWaalsContact C-N 3.32Å; D1066-L1068 PolarHBondContact O-N 3.13Å; D1066-N1069 WeakPolarHBondContact OD1-CB 3.31Å; D1066-N1069 PolarHBondContact OD1-ND2 2.88Å; D1066-N1069 WeakPolarHBondContact OD2-CB 3.41Å; D1066-S1070 WeakPolarHBondContact O-CB 3.42Å; D1066-S1070 PolarHBondContact O-N 2.97Å; D1066-S1070 PolarHBondContact O-OG 3Å
1067	L	86.2	Confident	88.6	Confident	64 Å²	64	33 Å²	33	34%	0.335	16%	0.162	S	C	.	.	H	α-helix	trans	-68.7	-29.9	-171.8	-54.3	178.1	0	0	0	112.5	Y1065 S1070 A1071 N1102 P1104	Y1065-L1067 PolarHBondContact O-N 2.91Å; L1067-S1070 WeakPolarHBondContact O-CB 3.28Å; L1067-S1070 PolarHBondContact O-N 2.79Å; L1067-A1071 PolarHBondContact O-N 2.74Å; L1067-A1071 VanDerWaalsContact O-N 3.08Å; L1067-N1102 HydrophobicContact CD2-CB 4.34Å; L1067-P1104 HydrophobicContact CB-CG 4.14Å
1068	L	88.8	Confident	88.6	Confident	136 Å²	136	33.4 Å²	33.4	71%	0.712	16%	0.164	S	C	*	.	H	α-helix	trans	-65.4	-54.7	178.1	-66.8	175.4	0	0	0	110.9	D1066 S1070 A1071 I1072	D1066-L1068 VanDerWaalsContact C-N 3.32Å; D1066-L1068 PolarHBondContact O-N 3.13Å; L1068-S1070 VanDerWaalsContact C-N 3.28Å; L1068-S1070 PolarHBondContact O-N 3.43Å; L1068-A1071 PolarHBondContact O-N 3.17Å; L1068-A1071 VanDerWaalsContact O-N 3.13Å; L1068-I1072 PolarHBondContact O-N 3.08Å
1069	N	89.7	Confident	88.8	Confident	25 Å²	25	39.8 Å²	39.8	13%	0.134	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-31.6	176.1	-66.3	-63.5	0	0	0	111.6	V996 D1066 A1071 I1072 I1073	V996-N1069 HydrophobicContact CG2-CB 3.82Å; V996-N1069 WeakPolarHBondContact CG2-OD1 3.49Å; D1066-N1069 WeakPolarHBondContact OD1-CB 3.31Å; D1066-N1069 PolarHBondContact OD1-ND2 2.88Å; D1066-N1069 WeakPolarHBondContact OD2-CB 3.41Å; N1069-A1071 VanDerWaalsContact C-N 3.27Å; N1069-A1071 PolarHBondContact O-N 3.31Å; N1069-I1072 PolarHBondContact O-N 3.38Å; N1069-I1072 VanDerWaalsContact O-N 3.12Å; N1069-I1073 VanDerWaalsContact O-CG1 3.27Å; N1069-I1073 WeakPolarHBondContact O-CG1 3.4Å; N1069-I1073 PolarHBondContact O-N 2.91Å
1070	S	89.7	Confident	89.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.4	-40.6	171.7	-56.3	0	0	0	0	112.2	V1060 R1063 D1066 L1067 L1068 T1074	V1060-S1070 WeakPolarHBondContact CG1-O 3.46Å; R1063-S1070 PolarHBondContact NE-OG 3.25Å; D1066-S1070 WeakPolarHBondContact O-CB 3.42Å; D1066-S1070 PolarHBondContact O-N 2.97Å; D1066-S1070 PolarHBondContact O-OG 3Å; L1067-S1070 WeakPolarHBondContact O-CB 3.28Å; L1067-S1070 PolarHBondContact O-N 2.79Å; L1068-S1070 VanDerWaalsContact C-N 3.28Å; L1068-S1070 PolarHBondContact O-N 3.43Å; S1070-T1074 WeakPolarHBondContact O-CB 3.43Å; S1070-T1074 PolarHBondContact O-N 3.12Å; S1070-T1074 PolarHBondContact O-OG1 2.97Å
1071	A	92.8	Very high	89.1	Confident	11 Å²	11	48.2 Å²	48.2	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-71.4	-34.2	175.9	0	0	0	0	0	113.1	L1067 L1068 N1069 T1074 K1075 P1104	L1067-A1071 PolarHBondContact O-N 2.74Å; L1067-A1071 VanDerWaalsContact O-N 3.08Å; L1068-A1071 PolarHBondContact O-N 3.17Å; L1068-A1071 VanDerWaalsContact O-N 3.13Å; N1069-A1071 VanDerWaalsContact C-N 3.27Å; N1069-A1071 PolarHBondContact O-N 3.31Å; A1071-T1074 WeakPolarHBondContact O-CB 3.29Å; A1071-T1074 PolarHBondContact O-N 2.95Å; A1071-K1075 WeakPolarHBondContact O-CG 3.25Å; A1071-K1075 PolarHBondContact O-N 2.71Å; A1071-P1104 HydrophobicContact CB-CB 3.66Å
1072	I	93.6	Very high	89.3	Confident	76 Å²	76	48.4 Å²	48.4	39%	0.39	24%	0.237	S	C	.	.	H	α-helix	trans	-65.1	-49.8	174.1	-60.8	171	0	0	0	110.2	V996 L1068 N1069 T1074 K1075 C1076	V996-I1072 HydrophobicContact CG1-CG2 3.66Å; V996-I1072 HydrophobicContact CG2-CB 4.44Å; V996-I1072 HydrophobicContact CG2-CG2 4.29Å; L1068-I1072 PolarHBondContact O-N 3.08Å; N1069-I1072 PolarHBondContact O-N 3.38Å; N1069-I1072 VanDerWaalsContact O-N 3.12Å; I1072-T1074 VanDerWaalsContact C-N 3.28Å; I1072-T1074 PolarHBondContact O-N 3.26Å; I1072-K1075 PolarHBondContact O-N 2.84Å; I1072-K1075 VanDerWaalsContact O-N 3.13Å; I1072-C1076 PolarHBondContact O-N 3.04Å
1073	I	93.6	Very high	89.6	Confident	1 Å²	1	51 Å²	51	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-59.1	-41	175.9	-63.2	167.8	0	0	0	110.4	V988 V996 T999 V1060 N1069 K1075 C1076 L1077	V988-I1073 HydrophobicContact CB-CG2 4.2Å; V988-I1073 HydrophobicContact CG1-CG2 3.78Å; V996-I1073 HydrophobicContact CB-CG1 4.49Å; V996-I1073 HydrophobicContact CG2-CD1 4.37Å; V996-I1073 HydrophobicContact CG2-CG1 3.98Å; T999-I1073 HydrophobicContact CG2-CG2 4.06Å; V1060-I1073 HydrophobicContact CG1-CB 4.42Å; V1060-I1073 HydrophobicContact CG1-CG2 4.43Å; V1060-I1073 HydrophobicContact CG2-CB 4.35Å; V1060-I1073 HydrophobicContact CG2-CG2 3.54Å; N1069-I1073 VanDerWaalsContact O-CG1 3.27Å; N1069-I1073 WeakPolarHBondContact O-CG1 3.4Å; N1069-I1073 PolarHBondContact O-N 2.91Å; I1073-K1075 PolarHBondContact O-N 2.81Å; I1073-C1076 PolarHBondContact O-N 2.96Å; I1073-L1077 HydrophobicContact CG2-CD1 4.03Å; I1073-L1077 HydrophobicContact CG2-CG 4.39Å; I1073-L1077 WeakPolarHBondContact O-CB 3.46Å; I1073-L1077 WeakPolarHBondContact O-CG 3.27Å; I1073-L1077 PolarHBondContact O-N 2.85Å
1074	T	94.8	Very high	90.2	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.3	-47.9	174.9	-61.1	0	0	0	0	111.6	L1057 V1060 S1070 A1071 I1072 L1077 L1078 C1105 A1108 L1109	L1057-T1074 HydrophobicContact CD1-CG2 4.03Å; V1060-T1074 VanDerWaalsContact CG1-OG1 3.23Å; V1060-T1074 WeakPolarHBondContact CG1-OG1 3.46Å; S1070-T1074 WeakPolarHBondContact O-CB 3.43Å; S1070-T1074 PolarHBondContact O-N 3.12Å; S1070-T1074 PolarHBondContact O-OG1 2.97Å; A1071-T1074 WeakPolarHBondContact O-CB 3.29Å; A1071-T1074 PolarHBondContact O-N 2.95Å; I1072-T1074 VanDerWaalsContact C-N 3.28Å; I1072-T1074 PolarHBondContact O-N 3.26Å; T1074-L1077 PolarHBondContact O-N 3.25Å; T1074-L1078 HydrophobicContact CG2-CD1 3.97Å; T1074-L1078 VanDerWaalsContact O-CG 3.24Å; T1074-L1078 WeakPolarHBondContact O-CG 3.5Å; T1074-L1078 PolarHBondContact O-N 2.92Å; T1074-C1105 PolarHBondContact OG1-SG 3.04Å; T1074-A1108 HydrophobicContact CG2-CB 3.75Å; T1074-L1109 HydrophobicContact CG2-CD2 4.49Å; T1074-L1109 HydrophobicContact CG2-CG 4.29Å
1075	K	94.4	Very high	91	Very high	137 Å²	137	48.4 Å²	48.4	60%	0.596	24%	0.24	S	C	*	.	H	α-helix	trans	-63.5	-40.1	176.3	-71.2	172	-177.5	178.8	0	111.9	A1071 I1072 I1073 L1078 K1079 A1108	A1071-K1075 WeakPolarHBondContact O-CG 3.25Å; A1071-K1075 PolarHBondContact O-N 2.71Å; I1072-K1075 PolarHBondContact O-N 2.84Å; I1072-K1075 VanDerWaalsContact O-N 3.13Å; I1073-K1075 PolarHBondContact O-N 2.81Å; K1075-L1078 PolarHBondContact O-N 2.78Å; K1075-K1079 WeakPolarHBondContact O-CB 3.22Å; K1075-K1079 PolarHBondContact O-N 2.79Å; K1075-A1108 HydrophobicContact CG-CB 4.11Å
1076	C	93.3	Very high	91.5	Very high	11 Å²	11	46.3 Å²	46.3	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-44.8	177.8	-172.8	0	0	0	0	112	I1072 I1073 L1078 K1079 H1080	I1072-C1076 PolarHBondContact O-N 3.04Å; I1073-C1076 PolarHBondContact O-N 2.96Å; C1076-L1078 PolarHBondContact O-N 2.79Å; C1076-K1079 WeakPolarHBondContact O-CB 3.26Å; C1076-K1079 PolarHBondContact O-N 3.07Å; C1076-H1080 PolarHBondContact O-N 3.42Å; C1076-H1080 PolarHBondContact O-ND1 3.18Å
1077	L	94.4	Very high	91.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-46.4	173.8	-74.4	168.1	0	0	0	111.7	L984 V988 L1003 P1010 P1056 L1057 V1060 I1073 T1074 K1079 H1080 A1082	L984-L1077 HydrophobicContact CD2-CD2 4.3Å; V988-L1077 HydrophobicContact CG1-CD1 4.29Å; L1003-L1077 HydrophobicContact CD1-CD2 4.04Å; L1003-L1077 HydrophobicContact CD2-CD2 4.39Å; P1010-L1077 HydrophobicContact CB-CD2 3.78Å; P1056-L1077 HydrophobicContact CB-CD1 4.42Å; P1056-L1077 HydrophobicContact CB-CD2 4.28Å; L1057-L1077 HydrophobicContact CB-CD1 4.35Å; L1057-L1077 HydrophobicContact CD1-CB 4.42Å; L1057-L1077 HydrophobicContact CD1-CD1 4.19Å; V1060-L1077 HydrophobicContact CG2-CD1 3.86Å; I1073-L1077 HydrophobicContact CG2-CD1 4.03Å; I1073-L1077 HydrophobicContact CG2-CG 4.39Å; I1073-L1077 WeakPolarHBondContact O-CB 3.46Å; I1073-L1077 WeakPolarHBondContact O-CG 3.27Å; I1073-L1077 PolarHBondContact O-N 2.85Å; T1074-L1077 PolarHBondContact O-N 3.25Å; L1077-K1079 PolarHBondContact O-N 3.21Å; L1077-H1080 CarbonylContact O-C 3.54Å; L1077-H1080 PolarHBondContact O-N 2.74Å; L1077-H1080 VanDerWaalsContact O-N 3.1Å; L1077-A1082 VanDerWaalsContact C-CB 3.47Å; L1077-A1082 HydrophobicContact CB-CB 3.86Å; L1077-A1082 WeakPolarHBondContact O-CB 3.25Å; L1077-A1082 PolarHBondContact O-N 2.97Å
1078	L	93.8	Very high	91.4	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.052	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-39.9	178.9	-68.6	168.6	0	0	0	112.2	L1057 T1074 K1075 C1076 H1080 N1081 P1084 L1109 H1112	L1057-L1078 HydrophobicContact CD2-CD2 4.21Å; T1074-L1078 HydrophobicContact CG2-CD1 3.97Å; T1074-L1078 VanDerWaalsContact O-CG 3.24Å; T1074-L1078 WeakPolarHBondContact O-CG 3.5Å; T1074-L1078 PolarHBondContact O-N 2.92Å; K1075-L1078 PolarHBondContact O-N 2.78Å; C1076-L1078 PolarHBondContact O-N 2.79Å; L1078-H1080 PolarHBondContact O-N 3.25Å; L1078-N1081 PolarHBondContact O-N 2.97Å; L1078-N1081 VanDerWaalsContact O-N 3.16Å; L1078-P1084 HydrophobicContact CD2-CB 4.38Å; L1078-P1084 HydrophobicContact CD2-CG 4.42Å; L1078-L1109 HydrophobicContact CD1-CD2 4.16Å; L1078-L1109 HydrophobicContact CD2-CD2 4.32Å; L1078-H1112 HydrophobicContact CD1-CB 4.12Å
1079	K	92.5	Very high	90.6	Very high	143 Å²	143	37 Å²	37	62%	0.622	19%	0.185	S	C	*	.	H	α-helix	trans	-56	-33.6	172.1	-180	-163.7	169.7	-157.6	0	111.9	E1004 K1075 C1076 L1077	E1004-K1079 IonicContact OE1-NZ 2.65Å; E1004-K1079 PolarHBondContact OE1-NZ 2.87Å; K1075-K1079 WeakPolarHBondContact O-CB 3.22Å; K1075-K1079 PolarHBondContact O-N 2.79Å; C1076-K1079 WeakPolarHBondContact O-CB 3.26Å; C1076-K1079 PolarHBondContact O-N 3.07Å; L1077-K1079 PolarHBondContact O-N 3.21Å
1080	H	92.8	Very high	90	Very high	43 Å²	43	35.9 Å²	35.9	20%	0.199	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	27.9	179.7	-66	96.5	0	0	0	113.8	L1003 E1004 P1010 C1076 L1077 L1078 A1082	L1003-H1080 HydrophobicContact CB-CB 4.47Å; L1003-H1080 HydrophobicContact CD1-CB 4.29Å; L1003-H1080 HydrophobicContact CD2-CB 4.15Å; E1004-H1080 WeakPolarHBondContact CG-NE2 3.33Å; E1004-H1080 IonicContact OE1-CE1 3.23Å; E1004-H1080 IonicContact OE1-NE2 3.16Å; P1010-H1080 WeakPolarHBondContact CG-O 3.36Å; C1076-H1080 PolarHBondContact O-N 3.42Å; C1076-H1080 PolarHBondContact O-ND1 3.18Å; L1077-H1080 CarbonylContact O-C 3.54Å; L1077-H1080 PolarHBondContact O-N 2.74Å; L1077-H1080 VanDerWaalsContact O-N 3.1Å; L1078-H1080 PolarHBondContact O-N 3.25Å; H1080-A1082 PolarHBondContact O-N 3.14Å
1081	N	91.3	Very high	89.8	Confident	134 Å²	134	36.3 Å²	36.3	72%	0.717	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.5	29	177.7	-55.4	-48.5	0	0	0	115.7	N1011 L1078 N1083	N1011-N1081 PolarHBondContact ND2-O 3.43Å; L1078-N1081 PolarHBondContact O-N 2.97Å; L1078-N1081 VanDerWaalsContact O-N 3.16Å; N1081-N1083 PolarHBondContact O-N 2.99Å
1082	A	92.9	Very high	89.7	Confident	4 Å²	4	35.9 Å²	35.9	3%	0.033	18%	0.177	C	C	.	.			trans	-61.8	127.7	164.9	0	0	0	0	0	110.8	P1010 L1057 L1077 H1080 P1084	P1010-A1082 HydrophobicContact CB-CB 3.92Å; P1010-A1082 HydrophobicContact CG-CB 4.24Å; L1057-A1082 HydrophobicContact CD2-CB 4.19Å; L1077-A1082 VanDerWaalsContact C-CB 3.47Å; L1077-A1082 HydrophobicContact CB-CB 3.86Å; L1077-A1082 WeakPolarHBondContact O-CB 3.25Å; L1077-A1082 PolarHBondContact O-N 2.97Å; H1080-A1082 PolarHBondContact O-N 3.14Å; A1082-P1084 VanDerWaalsContact O-CD 3.29Å; A1082-P1084 WeakPolarHBondContact O-CD 3.36Å
1083	N	91.9	Very high	89.6	Confident	62 Å²	62	32.3 Å²	32.3	33%	0.332	16%	0.159	S	C	.	.			trans	-87.5	110.3	-179.8	-178	-1.9	0	0	0	110.3	N1011 N1081 N1085 L1086	N1011-N1083 WeakPolarHBondContact OD1-CB 3.12Å; N1011-N1083 PolarHBondContact OD1-N 2.93Å; N1081-N1083 PolarHBondContact O-N 2.99Å; N1083-N1085 PolarHBondContact O-N 3.36Å; N1083-N1085 WeakPolarHBondContact OD1-CB 3.28Å; N1083-N1085 PolarHBondContact OD1-N 3.23Å; N1083-N1085 PolarHBondContact OD1-ND2 3.44Å; N1083-L1086 HydrophobicContact CB-CD1 4.09Å; N1083-L1086 HydrophobicContact CB-CG 3.99Å
1084	P	92.7	Very high	89.6	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.013	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.7	-179.4	31.2	-36.9	0	0	0	113.8	L1057 L1078 A1082 L1109 T1115	L1057-P1084 HydrophobicContact CD2-CB 4.16Å; L1078-P1084 HydrophobicContact CD2-CB 4.38Å; L1078-P1084 HydrophobicContact CD2-CG 4.42Å; A1082-P1084 VanDerWaalsContact O-CD 3.29Å; A1082-P1084 WeakPolarHBondContact O-CD 3.36Å; P1084-L1109 HydrophobicContact CB-CD2 3.81Å; P1084-T1115 HydrophobicContact CB-CG2 4.39Å; P1084-T1115 HydrophobicContact CG-CG2 4.49Å
1085	N	91.7	Very high	89.4	Confident	40 Å²	40	32.4 Å²	32.4	21%	0.214	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-0.7	-173.7	-46.7	-49.7	0	0	0	113.6	N1083 N1114 N1116 Q1119	N1083-N1085 PolarHBondContact O-N 3.36Å; N1083-N1085 WeakPolarHBondContact OD1-CB 3.28Å; N1083-N1085 PolarHBondContact OD1-N 3.23Å; N1083-N1085 PolarHBondContact OD1-ND2 3.44Å; N1085-N1114 PolarHBondContact ND2-O 3.12Å; N1085-N1116 WeakPolarHBondContact OD1-CB 3.47Å; N1085-N1116 PolarHBondContact OD1-N 2.64Å; N1085-Q1119 PolarHBondContact O-NE2 3.47Å
1086	L	89.9	Confident	89.1	Confident	34 Å²	34	26.1 Å²	26.1	18%	0.178	13%	0.133	C	C	.	.			trans	-61.8	143.5	167.8	-67.8	172.8	0	0	0	108.9	N1011 T1055 H1058 N1083	N1011-L1086 HydrophobicContact CB-CD1 3.94Å; T1055-L1086 HydrophobicContact CG2-CB 4.4Å; T1055-L1086 HydrophobicContact CG2-CD1 3.93Å; H1058-L1086 PolarHBondContact CE1-O 3.05Å; H1058-L1086 PolarHBondContact NE2-O 3.44Å; N1083-L1086 HydrophobicContact CB-CD1 4.09Å; N1083-L1086 HydrophobicContact CB-CG 3.99Å
1087	L	86.3	Confident	88.9	Confident	39 Å²	39	25.6 Å²	25.6	20%	0.204	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	115.7	-178.2	-67	-179.1	0	0	0	110	E1052 H1091 L1121	E1052-L1087 WeakPolarHBondContact CB-O 3.49Å; L1087-H1091 CarbonylContact C-O 3.48Å; L1087-H1091 WeakPolarHBondContact CA-O 3.48Å; L1087-L1121 HydrophobicContact CD2-CD2 4.1Å
1088	C	79	Confident	88.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	117.2	164.2	177.7	0	0	0	0	109.8	E1052 R1054 G1090 H1091	E1052-C1088 WeakPolarHBondContact O-CA 3.35Å; R1054-C1088 VanDerWaalsContact CA-SG 3.53Å; R1054-C1088 WeakPolarHBondContact CG-SG 3.37Å; R1054-C1088 PolarHBondContact N-SG 3.39Å; R1054-C1088 VanDerWaalsContact N-SG 3.37Å; C1088-G1090 PolarHBondContact O-N 3.08Å; C1088-G1090 VanDerWaalsContact O-N 3.12Å; C1088-H1091 PolarHBondContact N-O 3.26Å; C1088-H1091 WeakPolarHBondContact O-CB 3.39Å; C1088-H1091 PolarHBondContact O-N 2.94Å
1089	N	72.5	Confident	88.3	Confident	6 Å²	6	25.7 Å²	25.7	3%	0.032	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	45.2	-179.5	-66.7	-59.3	0	0	0	113	D1017 F1020 E1052 H1091	D1017-N1089 PolarHBondContact O-ND2 3.2Å; F1020-N1089 HydrophobicContact CB-CB 3.19Å; F1020-N1089 HydrophobicContact CD1-CB 4.09Å; F1020-N1089 HydrophobicContact CD2-CB 4.29Å; F1020-N1089 WeakPolarHBondContact CD2-ND2 3.46Å; F1020-N1089 HydrophobicContact CG-CB 3.64Å; E1052-N1089 PolarHBondContact O-N 3.2Å; E1052-N1089 VanDerWaalsContact O-N 3.16Å; N1089-H1091 VanDerWaalsContact C-N 3.32Å; N1089-H1091 PolarHBondContact O-N 3.36Å
1090	G	77.3	Confident	87.9	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-7.2	-178.2	0	0	0	0	0	116.9	C1088 L1121 G1122	C1088-G1090 PolarHBondContact O-N 3.08Å; C1088-G1090 VanDerWaalsContact O-N 3.12Å; G1090-L1121 CarbonylContact O-C 3.48Å; G1090-L1121 WeakPolarHBondContact O-CA 3.08Å; G1090-L1121 WeakPolarHBondContact O-CB 3.4Å; G1090-G1122 PolarHBondContact O-N 2.76Å
1091	H	84.8	Confident	87.5	Confident	9 Å²	9	18 Å²	18	4%	0.042	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	133.5	175.7	-83.2	-87.7	0	0	0	111.8	F1020 H1058 L1087 C1088 N1089 S1095 V1096 L1125	F1020-H1091 AromaticContact CD1-CD2 3.71Å; F1020-H1091 HydrophobicContact CE1-CB 4.39Å; H1058-H1091 PolarHBondContact NE2-O 3.41Å; H1058-H1091 VanDerWaalsContact NE2-O 3.08Å; L1087-H1091 CarbonylContact C-O 3.48Å; L1087-H1091 WeakPolarHBondContact CA-O 3.48Å; C1088-H1091 PolarHBondContact N-O 3.26Å; C1088-H1091 WeakPolarHBondContact O-CB 3.39Å; C1088-H1091 PolarHBondContact O-N 2.94Å; N1089-H1091 VanDerWaalsContact C-N 3.32Å; N1089-H1091 PolarHBondContact O-N 3.36Å; H1091-S1095 WeakPolarHBondContact CA-OG 3.37Å; H1091-S1095 WeakPolarHBondContact CB-OG 3.44Å; H1091-S1095 PolarHBondContact ND1-OG 3.04Å; H1091-V1096 HydrophobicContact CB-CG2 3.93Å; H1091-L1125 VanDerWaalsContact CD2-CD1 3.46Å; H1091-L1125 WeakPolarHBondContact CD2-CD1 3.47Å; H1091-L1125 VanDerWaalsContact NE2-CD1 3.32Å; H1091-L1125 WeakPolarHBondContact NE2-CD1 3.48Å
1092	S	90.5	Very high	87.3	Confident	3 Å²	3	11.6 Å²	11.6	2%	0.021	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	161.5	164.5	68.3	0	0	0	0	111.5	L1094 S1095 V1096	S1092-L1094 VanDerWaalsContact C-N 3.27Å; S1092-L1094 PolarHBondContact O-N 2.85Å; S1092-S1095 PolarHBondContact N-OG 3.2Å; S1092-S1095 WeakPolarHBondContact O-CA 3.35Å; S1092-S1095 WeakPolarHBondContact O-CB 3.48Å; S1092-S1095 PolarHBondContact O-N 3.36Å; S1092-S1095 PolarHBondContact O-OG 2.79Å; S1092-S1095 PolarHBondContact OG-N 3.5Å; S1092-V1096 PolarHBondContact O-N 3.49Å
1093	A	92.2	Very high	87.2	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-54.4	-41.7	179.3	0	0	0	0	0	112.9	L1057 H1058 S1095 V1096 A1097 L1109	L1057-A1093 HydrophobicContact CD2-CB 3.98Å; L1057-A1093 HydrophobicContact CG-CB 3.86Å; H1058-A1093 PolarHBondContact NE2-N 3.27Å; A1093-S1095 VanDerWaalsContact C-N 3.35Å; A1093-S1095 PolarHBondContact O-N 2.67Å; A1093-V1096 PolarHBondContact O-N 3.13Å; A1093-A1097 PolarHBondContact O-N 3.41Å; A1093-L1109 HydrophobicContact CB-CD1 4.35Å
1094	L	93.3	Very high	87.2	Confident	3 Å²	3	12.4 Å²	12.4	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-61.2	-41.9	174.7	178.6	61.5	0	0	0	111.9	S1092 V1096 A1097 I1098 I1106 L1109 I1110 T1115 I1117 A1128 L1153	S1092-L1094 VanDerWaalsContact C-N 3.27Å; S1092-L1094 PolarHBondContact O-N 2.85Å; L1094-V1096 VanDerWaalsContact C-N 3.31Å; L1094-V1096 PolarHBondContact O-N 3.08Å; L1094-A1097 PolarHBondContact O-N 3.25Å; L1094-I1098 HydrophobicContact CD1-CD1 4.13Å; L1094-I1098 HydrophobicContact CD1-CG1 4.41Å; L1094-I1098 HydrophobicContact CG-CD1 4.01Å; L1094-I1098 VanDerWaalsContact O-CG1 3.26Å; L1094-I1098 WeakPolarHBondContact O-CG1 3.35Å; L1094-I1098 PolarHBondContact O-N 3.17Å; L1094-I1106 HydrophobicContact CD1-CG2 4.22Å; L1094-L1109 HydrophobicContact CB-CD1 4.3Å; L1094-L1109 HydrophobicContact CD1-CB 4.12Å; L1094-L1109 HydrophobicContact CD1-CD1 4.49Å; L1094-I1110 HydrophobicContact CD1-CD1 4.46Å; L1094-I1110 HydrophobicContact CD1-CG1 3.93Å; L1094-T1115 HydrophobicContact CD2-CG2 4.09Å; L1094-I1117 HydrophobicContact CD2-CG1 4.35Å; L1094-A1128 HydrophobicContact CD2-CB 3.99Å; L1094-A1128 HydrophobicContact CG-CB 4.24Å; L1094-L1153 HydrophobicContact CD2-CD2 4.32Å
1095	S	90.1	Very high	87.2	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.2	-33.4	177.5	81.7	0	0	0	0	112.6	H1091 S1092 A1093 A1099	H1091-S1095 WeakPolarHBondContact CA-OG 3.37Å; H1091-S1095 WeakPolarHBondContact CB-OG 3.44Å; H1091-S1095 PolarHBondContact ND1-OG 3.04Å; S1092-S1095 PolarHBondContact N-OG 3.2Å; S1092-S1095 WeakPolarHBondContact O-CA 3.35Å; S1092-S1095 WeakPolarHBondContact O-CB 3.48Å; S1092-S1095 PolarHBondContact O-N 3.36Å; S1092-S1095 PolarHBondContact O-OG 2.79Å; S1092-S1095 PolarHBondContact OG-N 3.5Å; A1093-S1095 VanDerWaalsContact C-N 3.35Å; A1093-S1095 PolarHBondContact O-N 2.67Å; S1095-A1099 VanDerWaalsContact O-CB 3.28Å; S1095-A1099 WeakPolarHBondContact O-CB 3.47Å; S1095-A1099 PolarHBondContact O-N 2.82Å
1096	V	87.6	Confident	87.3	Confident	6 Å²	6	10.5 Å²	10.5	4%	0.036	6%	0.063	C	C	.	.	H	α-helix	trans	-67.6	-48	174.3	178	0	0	0	0	110.6	C1061 H1091 S1092 A1093 L1094 I1098 A1099 T1100	C1061-V1096 HydrophobicContact CB-CB 4.21Å; C1061-V1096 HydrophobicContact CB-CG1 4.09Å; H1091-V1096 HydrophobicContact CB-CG2 3.93Å; S1092-V1096 PolarHBondContact O-N 3.49Å; A1093-V1096 PolarHBondContact O-N 3.13Å; L1094-V1096 VanDerWaalsContact C-N 3.31Å; L1094-V1096 PolarHBondContact O-N 3.08Å; V1096-I1098 VanDerWaalsContact C-N 3.31Å; V1096-I1098 PolarHBondContact O-N 3.44Å; V1096-A1099 CarbonylContact O-C 3.57Å; V1096-A1099 WeakPolarHBondContact O-CA 3.33Å; V1096-A1099 WeakPolarHBondContact O-CB 3.49Å; V1096-A1099 PolarHBondContact O-N 3.43Å; V1096-T1100 HydrophobicContact CG1-CG2 4.24Å; V1096-T1100 WeakPolarHBondContact O-CG2 3.27Å; V1096-T1100 PolarHBondContact O-N 2.78Å; V1096-T1100 PolarHBondContact O-OG1 2.76Å
1097	A	90.4	Very high	87.4	Confident	0 Å²	0	12 Å²	12	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-38.8	178.5	0	0	0	0	0	112.5	C1061 A1093 L1094 T1100 G1101 N1102 C1105 I1106 L1109	C1061-A1097 HydrophobicContact CB-CB 3.99Å; A1093-A1097 PolarHBondContact O-N 3.41Å; L1094-A1097 PolarHBondContact O-N 3.25Å; A1097-T1100 PolarHBondContact O-OG1 3.05Å; A1097-G1101 PolarHBondContact O-N 3.04Å; A1097-G1101 VanDerWaalsContact O-N 3.12Å; A1097-N1102 PolarHBondContact O-N 2.81Å; A1097-C1105 HydrophobicContact CB-CB 4.24Å; A1097-I1106 HydrophobicContact CB-CG1 3.63Å; A1097-L1109 HydrophobicContact CB-CD1 4.4Å
1098	I	89	Confident	87.8	Confident	1 Å²	1	10.7 Å²	10.7	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-62.4	-44.9	171.7	-66.8	166.8	0	0	0	110.7	L1094 V1096 I1106 A1128 I1131 A1132 R1141 L1149 L1153	L1094-I1098 HydrophobicContact CD1-CD1 4.13Å; L1094-I1098 HydrophobicContact CD1-CG1 4.41Å; L1094-I1098 HydrophobicContact CG-CD1 4.01Å; L1094-I1098 VanDerWaalsContact O-CG1 3.26Å; L1094-I1098 WeakPolarHBondContact O-CG1 3.35Å; L1094-I1098 PolarHBondContact O-N 3.17Å; V1096-I1098 VanDerWaalsContact C-N 3.31Å; V1096-I1098 PolarHBondContact O-N 3.44Å; I1098-I1106 HydrophobicContact CB-CD1 4.4Å; I1098-I1106 HydrophobicContact CG1-CD1 3.79Å; I1098-I1106 HydrophobicContact CG1-CG1 4.16Å; I1098-A1128 HydrophobicContact CD1-CB 3.9Å; I1098-I1131 HydrophobicContact CB-CG2 4.24Å; I1098-I1131 HydrophobicContact CG2-CB 4.39Å; I1098-I1131 HydrophobicContact CG2-CG2 3.75Å; I1098-A1132 HydrophobicContact CG2-CB 3.94Å; I1098-R1141 PolarHBondContact O-NH1 2.98Å; I1098-L1149 HydrophobicContact CG1-CD2 4.37Å; I1098-L1149 HydrophobicContact CG2-CD2 4.23Å; I1098-L1153 HydrophobicContact CD1-CD1 4.03Å; I1098-L1153 HydrophobicContact CD1-CD2 4.36Å
1099	A	85.9	Confident	88.5	Confident	11 Å²	11	10.7 Å²	10.7	9%	0.091	7%	0.067	C	C	.	.	H	α-helix	trans	-68.7	-28.8	-179.7	0	0	0	0	0	114.4	S1095 V1096 I1131 F1137 R1140	S1095-A1099 VanDerWaalsContact O-CB 3.28Å; S1095-A1099 WeakPolarHBondContact O-CB 3.47Å; S1095-A1099 PolarHBondContact O-N 2.82Å; V1096-A1099 CarbonylContact O-C 3.57Å; V1096-A1099 WeakPolarHBondContact O-CA 3.33Å; V1096-A1099 WeakPolarHBondContact O-CB 3.49Å; V1096-A1099 PolarHBondContact O-N 3.43Å; A1099-I1131 HydrophobicContact CB-CG2 4.25Å; A1099-F1137 HydrophobicContact CB-CD1 4.17Å; A1099-F1137 HydrophobicContact CB-CE1 3.54Å; A1099-F1137 HydrophobicContact CB-CE2 4.08Å; A1099-F1137 HydrophobicContact CB-CZ 3.49Å; A1099-F1137 VanDerWaalsContact CB-CZ 3.49Å; A1099-F1137 WeakPolarHBondContact O-CD1 3.34Å; A1099-F1137 VanDerWaalsContact O-CE1 3.31Å; A1099-F1137 WeakPolarHBondContact O-CE1 3.26Å; A1099-R1140 WeakPolarHBondContact O-CD 3.45Å; A1099-R1140 PolarHBondContact O-NE 3.22Å
1100	T	83.3	Confident	89.5	Confident	7 Å²	7	10.7 Å²	10.7	4%	0.043	7%	0.067	C	C	.	.	H	α-helix	trans	-88.1	-24.9	179	55.3	0	0	0	0	114.2	T683 C1061 V1096 A1097 R1140	T683-T1100 HydrophobicContact CG2-CG2 3.71Å; C1061-T1100 PolarHBondContact O-OG1 2.88Å; V1096-T1100 HydrophobicContact CG1-CG2 4.24Å; V1096-T1100 WeakPolarHBondContact O-CG2 3.27Å; V1096-T1100 PolarHBondContact O-N 2.78Å; V1096-T1100 PolarHBondContact O-OG1 2.76Å; A1097-T1100 PolarHBondContact O-OG1 3.05Å; T1100-R1140 VanDerWaalsContact C-CD 3.45Å; T1100-R1140 WeakPolarHBondContact O-CD 3.5Å; T1100-R1140 PolarHBondContact O-NE 3.31Å; T1100-R1140 PolarHBondContact O-NH1 3.47Å
1101	G	83.9	Confident	90.1	Very high	16 Å²	16	15.6 Å²	15.6	17%	0.165	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	7.2	-174.1	0	0	0	0	0	114	A1097 D1103 R1141	A1097-G1101 PolarHBondContact O-N 3.04Å; A1097-G1101 VanDerWaalsContact O-N 3.12Å; G1101-D1103 VanDerWaalsContact C-N 3.27Å; G1101-D1103 PolarHBondContact O-N 2.92Å; G1101-R1141 VanDerWaalsContact CA-NH2 3.28Å
1102	N	87.4	Confident	90.5	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	10%	0.103	C	C	.	.			trans	-78.6	75.3	-176.7	-167.2	-27.1	0	0	0	111.1	R1063 L1067 A1097 C1105 I1106	R1063-N1102 PolarHBondContact O-ND2 3.17Å; L1067-N1102 HydrophobicContact CD2-CB 4.34Å; A1097-N1102 PolarHBondContact O-N 2.81Å; N1102-C1105 HydrophobicContact CB-CB 4.28Å; N1102-C1105 VanDerWaalsContact CG-SG 3.55Å; N1102-C1105 PolarHBondContact ND2-SG 3.17Å; N1102-C1105 VanDerWaalsContact ND2-SG 3.42Å; N1102-C1105 PolarHBondContact O-N 3.11Å; N1102-C1105 WeakPolarHBondContact OD1-CB 3.37Å; N1102-C1105 PolarHBondContact OD1-N 2.93Å; N1102-C1105 VanDerWaalsContact OD1-N 3.17Å; N1102-C1105 PolarHBondContact OD1-SG 3.03Å; N1102-C1105 VanDerWaalsContact OD1-SG 3.36Å; N1102-I1106 WeakPolarHBondContact O-CG1 3.32Å; N1102-I1106 PolarHBondContact O-N 3.24Å; N1102-I1106 VanDerWaalsContact O-N 3.14Å
1103	D	90.7	Very high	90.4	Very high	44 Å²	44	26.5 Å²	26.5	24%	0.235	14%	0.143	C	C	.	.	H	α-helix	trans	-54.4	-42.3	-178.8	-66.4	-30.8	0	0	0	112.7	R57 G1101 C1105 I1106 D1107 R1141	R57-D1103 IonicContact CZ-OD2 2.73Å; R57-D1103 IonicContact NH1-OD2 2.89Å; R57-D1103 PolarHBondContact NH1-OD2 2.67Å; R57-D1103 VanDerWaalsContact NH1-OD2 3.14Å; R57-D1103 IonicContact NH2-OD2 3.73Å; G1101-D1103 VanDerWaalsContact C-N 3.27Å; G1101-D1103 PolarHBondContact O-N 2.92Å; D1103-C1105 PolarHBondContact O-N 2.65Å; D1103-I1106 WeakPolarHBondContact O-CB 3.47Å; D1103-I1106 PolarHBondContact O-N 3.41Å; D1103-I1106 VanDerWaalsContact O-N 3.17Å; D1103-D1107 PolarHBondContact O-N 3.12Å; D1103-R1141 IonicContact OD1-CZ 2.72Å; D1103-R1141 IonicContact OD1-NE 3.76Å; D1103-R1141 PolarHBondContact OD1-NE 3.01Å; D1103-R1141 IonicContact OD1-NH2 2.81Å; D1103-R1141 PolarHBondContact OD1-NH2 3.01Å; D1103-R1141 IonicContact OD2-NE 3.49Å
1104	P	92	Very high	90.2	Very high	39 Å²	39	31.6 Å²	31.6	25%	0.253	17%	0.171	S	C	.	.	H	α-helix	trans	-60.4	-38.1	174.6	-28.6	38.7	0	0	0	115.3	L1067 A1071 D1107 A1108	L1067-P1104 HydrophobicContact CB-CG 4.14Å; A1071-P1104 HydrophobicContact CB-CB 3.66Å; P1104-D1107 PolarHBondContact O-N 3.32Å; P1104-A1108 PolarHBondContact O-N 3.35Å
1105	C	92.6	Very high	90.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-70.6	-34.5	174.3	-73.8	0	0	0	0	112.3	T1074 A1097 N1102 D1103 D1107 A1108 L1109	T1074-C1105 PolarHBondContact OG1-SG 3.04Å; A1097-C1105 HydrophobicContact CB-CB 4.24Å; N1102-C1105 HydrophobicContact CB-CB 4.28Å; N1102-C1105 VanDerWaalsContact CG-SG 3.55Å; N1102-C1105 PolarHBondContact ND2-SG 3.17Å; N1102-C1105 VanDerWaalsContact ND2-SG 3.42Å; N1102-C1105 PolarHBondContact O-N 3.11Å; N1102-C1105 WeakPolarHBondContact OD1-CB 3.37Å; N1102-C1105 PolarHBondContact OD1-N 2.93Å; N1102-C1105 VanDerWaalsContact OD1-N 3.17Å; N1102-C1105 PolarHBondContact OD1-SG 3.03Å; N1102-C1105 VanDerWaalsContact OD1-SG 3.36Å; D1103-C1105 PolarHBondContact O-N 2.65Å; C1105-D1107 VanDerWaalsContact C-N 3.31Å; C1105-D1107 PolarHBondContact O-N 3.03Å; C1105-A1108 PolarHBondContact O-N 3.15Å; C1105-L1109 WeakPolarHBondContact O-CB 3.43Å; C1105-L1109 WeakPolarHBondContact O-CG 3.38Å; C1105-L1109 PolarHBondContact O-N 3.44Å
1106	I	93.7	Very high	90.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-42.4	173	-65.5	169.6	0	0	0	110.4	L1094 A1097 I1098 N1102 D1103 A1108 L1109 I1110 L1149	L1094-I1106 HydrophobicContact CD1-CG2 4.22Å; A1097-I1106 HydrophobicContact CB-CG1 3.63Å; I1098-I1106 HydrophobicContact CB-CD1 4.4Å; I1098-I1106 HydrophobicContact CG1-CD1 3.79Å; I1098-I1106 HydrophobicContact CG1-CG1 4.16Å; N1102-I1106 WeakPolarHBondContact O-CG1 3.32Å; N1102-I1106 PolarHBondContact O-N 3.24Å; N1102-I1106 VanDerWaalsContact O-N 3.14Å; D1103-I1106 WeakPolarHBondContact O-CB 3.47Å; D1103-I1106 PolarHBondContact O-N 3.41Å; D1103-I1106 VanDerWaalsContact O-N 3.17Å; I1106-A1108 VanDerWaalsContact C-N 3.34Å; I1106-A1108 PolarHBondContact O-N 2.96Å; I1106-L1109 PolarHBondContact O-N 2.82Å; I1106-I1110 HydrophobicContact CG2-CD1 3.41Å; I1106-I1110 VanDerWaalsContact CG2-CD1 3.41Å; I1106-I1110 HydrophobicContact CG2-CG1 3.99Å; I1106-I1110 WeakPolarHBondContact O-CB 3.42Å; I1106-I1110 WeakPolarHBondContact O-CG1 3.5Å; I1106-I1110 PolarHBondContact O-N 3.32Å; I1106-L1149 HydrophobicContact CD1-CD1 4.36Å; I1106-L1149 HydrophobicContact CD1-CD2 4.37Å; I1106-L1149 HydrophobicContact CG2-CD1 3.78Å
1107	D	93	Very high	90.3	Very high	65 Å²	65	36.2 Å²	36.2	35%	0.348	20%	0.195	S	C	.	.	H	α-helix	trans	-64.2	-38.4	178.9	-67.8	-7.2	0	0	0	112.3	D1103 P1104 C1105 N1111 R1152	D1103-D1107 PolarHBondContact O-N 3.12Å; P1104-D1107 PolarHBondContact O-N 3.32Å; C1105-D1107 VanDerWaalsContact C-N 3.31Å; C1105-D1107 PolarHBondContact O-N 3.03Å; D1107-N1111 WeakPolarHBondContact O-CB 3.27Å; D1107-N1111 PolarHBondContact O-ND2 3.44Å; D1107-R1152 IonicContact OD1-CZ 3.23Å; D1107-R1152 IonicContact OD1-NH1 2.73Å; D1107-R1152 PolarHBondContact OD1-NH1 3.37Å; D1107-R1152 IonicContact OD1-NH2 3.45Å; D1107-R1152 PolarHBondContact OD1-NH2 3.13Å
1108	A	93.5	Very high	90.1	Very high	12 Å²	12	37.8 Å²	37.8	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-43.6	172.4	0	0	0	0	0	112.1	T1074 K1075 P1104 C1105 I1106 H1112	T1074-A1108 HydrophobicContact CG2-CB 3.75Å; K1075-A1108 HydrophobicContact CG-CB 4.11Å; P1104-A1108 PolarHBondContact O-N 3.35Å; C1105-A1108 PolarHBondContact O-N 3.15Å; I1106-A1108 VanDerWaalsContact C-N 3.34Å; I1106-A1108 PolarHBondContact O-N 2.96Å; A1108-H1112 PolarHBondContact O-N 3.2Å
1109	L	94.2	Very high	90	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-72.7	-45	-176.5	-73.3	168.1	0	0	0	113.4	L1057 T1074 L1078 P1084 A1093 L1094 A1097 C1105 I1106 N1111 H1112 T1115	L1057-L1109 HydrophobicContact CD2-CD2 4.43Å; T1074-L1109 HydrophobicContact CG2-CD2 4.49Å; T1074-L1109 HydrophobicContact CG2-CG 4.29Å; L1078-L1109 HydrophobicContact CD1-CD2 4.16Å; L1078-L1109 HydrophobicContact CD2-CD2 4.32Å; P1084-L1109 HydrophobicContact CB-CD2 3.81Å; A1093-L1109 HydrophobicContact CB-CD1 4.35Å; L1094-L1109 HydrophobicContact CB-CD1 4.3Å; L1094-L1109 HydrophobicContact CD1-CB 4.12Å; L1094-L1109 HydrophobicContact CD1-CD1 4.49Å; A1097-L1109 HydrophobicContact CB-CD1 4.4Å; C1105-L1109 WeakPolarHBondContact O-CB 3.43Å; C1105-L1109 WeakPolarHBondContact O-CG 3.38Å; C1105-L1109 PolarHBondContact O-N 3.44Å; I1106-L1109 PolarHBondContact O-N 2.82Å; L1109-N1111 PolarHBondContact O-N 3.34Å; L1109-H1112 PolarHBondContact O-N 3.09Å; L1109-T1115 WeakPolarHBondContact O-CB 3.25Å; L1109-T1115 PolarHBondContact O-OG1 3.31Å
1110	I	92.9	Very high	89.9	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-25.8	-178.8	-70	-179.8	0	0	0	112.1	L1094 I1106 I1117 L1149 L1153 K1156	L1094-I1110 HydrophobicContact CD1-CD1 4.46Å; L1094-I1110 HydrophobicContact CD1-CG1 3.93Å; I1106-I1110 HydrophobicContact CG2-CD1 3.41Å; I1106-I1110 VanDerWaalsContact CG2-CD1 3.41Å; I1106-I1110 HydrophobicContact CG2-CG1 3.99Å; I1106-I1110 WeakPolarHBondContact O-CB 3.42Å; I1106-I1110 WeakPolarHBondContact O-CG1 3.5Å; I1106-I1110 PolarHBondContact O-N 3.32Å; I1110-I1117 HydrophobicContact CG2-CD1 4.44Å; I1110-L1149 HydrophobicContact CD1-CD1 4.43Å; I1110-L1153 HydrophobicContact CD1-CD2 3.71Å; I1110-L1153 HydrophobicContact CD1-CG 4.3Å; I1110-L1153 HydrophobicContact CG1-CD2 4.33Å; I1110-K1156 HydrophobicContact CG2-CD 4.41Å; I1110-K1156 HydrophobicContact CG2-CG 3.95Å
1111	N	91.2	Very high	90	Very high	102 Å²	102	43.2 Å²	43.2	55%	0.545	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-9.9	178.3	-70.7	-40.2	0	0	0	113.7	D1107 L1109	D1107-N1111 WeakPolarHBondContact O-CB 3.27Å; D1107-N1111 PolarHBondContact O-ND2 3.44Å; L1109-N1111 PolarHBondContact O-N 3.34Å
1112	H	92.2	Very high	89.6	Confident	54 Å²	54	43 Å²	43	25%	0.25	23%	0.233	C	C	.	.	S	Bend	trans	-81.5	131.5	178.6	-172.4	-103.4	0	0	0	111.7	L1078 A1108 L1109 N1114 T1115	L1078-H1112 HydrophobicContact CD1-CB 4.12Å; A1108-H1112 PolarHBondContact O-N 3.2Å; L1109-H1112 PolarHBondContact O-N 3.09Å; H1112-N1114 VanDerWaalsContact C-N 3.3Å; H1112-N1114 PolarHBondContact O-N 2.85Å; H1112-T1115 PolarHBondContact O-N 3.42Å; H1112-T1115 PolarHBondContact O-OG1 3.33Å
1113	Q	88.1	Confident	88.7	Confident	187 Å²	187	45.6 Å²	45.6	87%	0.874	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.4	-170.3	-66.1	-180	-2.3	0	0	113.6	T1115	Q1113-T1115 PolarHBondContact O-N 3.36Å
1114	N	88.4	Confident	87.8	Confident	108 Å²	108	44.6 Å²	44.6	58%	0.578	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	2.8	-175.1	-61.1	-12.1	0	0	0	114	N1085 H1112 N1116	N1085-N1114 PolarHBondContact ND2-O 3.12Å; H1112-N1114 VanDerWaalsContact C-N 3.3Å; H1112-N1114 PolarHBondContact O-N 2.85Å; N1114-N1116 PolarHBondContact O-N 2.84Å
1115	T	91.4	Very high	87	Confident	15 Å²	15	44.2 Å²	44.2	9%	0.092	24%	0.243	C	C	.	.			trans	-80.5	114.5	-179	-55	0	0	0	0	111.7	P1084 L1094 L1109 H1112 Q1113 I1117	P1084-T1115 HydrophobicContact CB-CG2 4.39Å; P1084-T1115 HydrophobicContact CG-CG2 4.49Å; L1094-T1115 HydrophobicContact CD2-CG2 4.09Å; L1109-T1115 WeakPolarHBondContact O-CB 3.25Å; L1109-T1115 PolarHBondContact O-OG1 3.31Å; H1112-T1115 PolarHBondContact O-N 3.42Å; H1112-T1115 PolarHBondContact O-OG1 3.33Å; Q1113-T1115 PolarHBondContact O-N 3.36Å; T1115-I1117 PolarHBondContact O-N 3.49Å
1116	N	90.5	Very high	86.5	Confident	73 Å²	73	44.4 Å²	44.4	39%	0.39	25%	0.245	S	C	.	.			trans	-81.6	100.6	175.4	-174.9	-7.7	0	0	0	111.3	N1085 N1114 N1118 Q1119	N1085-N1116 WeakPolarHBondContact OD1-CB 3.47Å; N1085-N1116 PolarHBondContact OD1-N 2.64Å; N1114-N1116 PolarHBondContact O-N 2.84Å; N1116-N1118 VanDerWaalsContact C-N 3.3Å; N1116-N1118 PolarHBondContact O-N 3.49Å; N1116-N1118 PolarHBondContact OD1-N 2.72Å; N1116-Q1119 HydrophobicContact CB-CB 4.13Å; N1116-Q1119 WeakPolarHBondContact O-CB 3.34Å; N1116-Q1119 PolarHBondContact O-N 3.24Å; N1116-Q1119 PolarHBondContact OD1-N 3.02Å; N1116-Q1119 VanDerWaalsContact OD1-N 3.12Å
1117	I	91.3	Very high	86.2	Confident	17 Å²	17	44.8 Å²	44.8	9%	0.087	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-30.5	-179.6	-63.5	170.4	0	0	0	112.3	L1094 I1110 T1115 Q1119 L1153 K1156	L1094-I1117 HydrophobicContact CD2-CG1 4.35Å; I1110-I1117 HydrophobicContact CG2-CD1 4.44Å; T1115-I1117 PolarHBondContact O-N 3.49Å; I1117-Q1119 VanDerWaalsContact C-N 3.33Å; I1117-L1153 HydrophobicContact CG2-CB 4.49Å; I1117-L1153 HydrophobicContact CG2-CD2 3.9Å; I1117-K1156 HydrophobicContact CD1-CB 3.32Å; I1117-K1156 HydrophobicContact CD1-CG 4.3Å
1118	N	87	Confident	86	Confident	33 Å²	33	41.8 Å²	41.8	18%	0.176	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	8.8	-178.3	-59.5	-37.3	0	0	0	112.7	N1116 G1157 E1160 S1161	N1116-N1118 VanDerWaalsContact C-N 3.3Å; N1116-N1118 PolarHBondContact O-N 3.49Å; N1116-N1118 PolarHBondContact OD1-N 2.72Å; N1118-G1157 PolarHBondContact ND2-O 2.88Å; N1118-E1160 HydrophobicContact CB-CB 4.43Å; N1118-E1160 WeakPolarHBondContact ND2-CB 3.48Å; N1118-E1160 PolarHBondContact ND2-OE2 2.85Å; N1118-S1161 VanDerWaalsContact OD1-CA 3.28Å; N1118-S1161 WeakPolarHBondContact OD1-CA 3.36Å; N1118-S1161 PolarHBondContact OD1-N 3.32Å; N1118-S1161 PolarHBondContact OD1-OG 3.27Å
1119	Q	86.9	Confident	85.9	Confident	26 Å²	26	41.4 Å²	41.4	12%	0.121	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-56.1	127.6	-175.6	-174.8	176.8	10.1	0	0	111.6	N1085 N1116 I1117 L1121	N1085-Q1119 PolarHBondContact O-NE2 3.47Å; N1116-Q1119 HydrophobicContact CB-CB 4.13Å; N1116-Q1119 WeakPolarHBondContact O-CB 3.34Å; N1116-Q1119 PolarHBondContact O-N 3.24Å; N1116-Q1119 PolarHBondContact OD1-N 3.02Å; N1116-Q1119 VanDerWaalsContact OD1-N 3.12Å; I1117-Q1119 VanDerWaalsContact C-N 3.33Å; Q1119-L1121 PolarHBondContact O-N 3.11Å
1120	P	84.3	Confident	85.7	Confident	92 Å²	92	41.4 Å²	41.4	60%	0.597	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-68.7	122.5	171.1	28.3	-33	0	0	0	109.7	G1126	P1120-G1126 WeakPolarHBondContact CA-O 3.3Å
1121	L	84	Confident	85.4	Confident	16 Å²	16	41.3 Å²	41.3	8%	0.084	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-83.3	152.7	176.8	-61.7	179	0	0	0	110.7	L1087 G1090 Q1119 L1125 G1126 I1131	L1087-L1121 HydrophobicContact CD2-CD2 4.1Å; G1090-L1121 CarbonylContact O-C 3.48Å; G1090-L1121 WeakPolarHBondContact O-CA 3.08Å; G1090-L1121 WeakPolarHBondContact O-CB 3.4Å; Q1119-L1121 PolarHBondContact O-N 3.11Å; L1121-L1125 HydrophobicContact CB-CB 3.68Å; L1121-L1125 HydrophobicContact CB-CD1 4.46Å; L1121-L1125 HydrophobicContact CD1-CB 4.1Å; L1121-G1126 PolarHBondContact N-O 3.31Å; L1121-I1131 HydrophobicContact CD1-CD1 4.33Å; L1121-I1131 HydrophobicContact CD1-CG1 3.66Å
1122	G	75.5	Confident	85.4	Confident	12 Å²	12	36.7 Å²	36.7	12%	0.124	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-64.2	170.5	176.7	0	0	0	0	0	113.4	G1090 G1124 L1125	G1090-G1122 PolarHBondContact O-N 2.76Å; G1122-G1124 PolarHBondContact O-N 3.48Å; G1122-L1125 VanDerWaalsContact O-CB 3.32Å; G1122-L1125 WeakPolarHBondContact O-CB 3.47Å; G1122-L1125 WeakPolarHBondContact O-CD1 3.45Å; G1122-L1125 VanDerWaalsContact O-CG 3.3Å; G1122-L1125 WeakPolarHBondContact O-CG 3.34Å; G1122-L1125 PolarHBondContact O-N 2.86Å
1123	D	69.7	Low	85.4	Confident	54 Å²	54	34.1 Å²	34.1	29%	0.289	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	47.3	27.9	170.4	-66.8	-13.9	0	0	0	118.5	L1125 K1169	D1123-L1125 VanDerWaalsContact C-N 3.32Å; D1123-K1169 IonicContact OD1-NZ 3.97Å; D1123-K1169 PolarHBondContact OD1-NZ 3.01Å
1124	G	71.1	Confident	85.3	Confident	23 Å²	23	25.4 Å²	25.4	24%	0.237	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	76.9	19.6	176.9	0	0	0	0	0	113.4	G1122 G1126 F1180	G1122-G1124 PolarHBondContact O-N 3.48Å; G1124-G1126 PolarHBondContact O-N 3.49Å; G1124-F1180 WeakPolarHBondContact O-CE2 3.44Å
1125	L	75.2	Confident	85.1	Confident	31 Å²	31	21.5 Å²	21.5	16%	0.162	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.1	173	-66.7	167.5	0	0	0	112.9	H1091 L1121 G1122 D1123 S1127 C1130 I1131	H1091-L1125 VanDerWaalsContact CD2-CD1 3.46Å; H1091-L1125 WeakPolarHBondContact CD2-CD1 3.47Å; H1091-L1125 VanDerWaalsContact NE2-CD1 3.32Å; H1091-L1125 WeakPolarHBondContact NE2-CD1 3.48Å; L1121-L1125 HydrophobicContact CB-CB 3.68Å; L1121-L1125 HydrophobicContact CB-CD1 4.46Å; L1121-L1125 HydrophobicContact CD1-CB 4.1Å; G1122-L1125 VanDerWaalsContact O-CB 3.32Å; G1122-L1125 WeakPolarHBondContact O-CB 3.47Å; G1122-L1125 WeakPolarHBondContact O-CD1 3.45Å; G1122-L1125 VanDerWaalsContact O-CG 3.3Å; G1122-L1125 WeakPolarHBondContact O-CG 3.34Å; G1122-L1125 PolarHBondContact O-N 2.86Å; D1123-L1125 VanDerWaalsContact C-N 3.32Å; L1125-S1127 PolarHBondContact O-N 3.45Å; L1125-C1130 WeakPolarHBondContact O-CB 3.34Å; L1125-I1131 HydrophobicContact CB-CD1 4.17Å; L1125-I1131 HydrophobicContact CD2-CD1 4.1Å
1126	G	81.5	Confident	84.5	Confident	4 Å²	4	24.8 Å²	24.8	4%	0.041	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	86.1	-107	176.5	0	0	0	0	0	112	P1120 L1121 G1124	P1120-G1126 WeakPolarHBondContact CA-O 3.3Å; L1121-G1126 PolarHBondContact N-O 3.31Å; G1124-G1126 PolarHBondContact O-N 3.49Å
1127	S	88.4	Confident	83.8	Confident	9 Å²	9	22.8 Å²	22.8	6%	0.063	14%	0.137	C	C	.	.			trans	-139.8	175.6	177.6	68.2	0	0	0	0	110.7	L1125 L1129 C1130 I1131	L1125-S1127 PolarHBondContact O-N 3.45Å; S1127-L1129 PolarHBondContact O-N 2.86Å; S1127-L1129 PolarHBondContact OG-N 3.48Å; S1127-C1130 PolarHBondContact N-SG 3.22Å; S1127-C1130 WeakPolarHBondContact O-CA 3.46Å; S1127-C1130 VanDerWaalsContact O-CB 3.3Å; S1127-C1130 WeakPolarHBondContact O-CB 3.32Å; S1127-C1130 PolarHBondContact O-N 2.83Å; S1127-I1131 PolarHBondContact O-N 3.34Å; S1127-I1131 VanDerWaalsContact O-N 3.13Å
1128	A	89.6	Confident	83.2	Confident	3 Å²	3	23 Å²	23	3%	0.025	14%	0.138	C	C	.	.	H	α-helix	trans	-53.2	-36.9	173	0	0	0	0	0	112.6	L1094 I1098 I1131 A1132	L1094-A1128 HydrophobicContact CD2-CB 3.99Å; L1094-A1128 HydrophobicContact CG-CB 4.24Å; I1098-A1128 HydrophobicContact CD1-CB 3.9Å; A1128-I1131 PolarHBondContact O-N 3.07Å; A1128-A1132 PolarHBondContact O-N 3.42Å
1129	L	91.4	Very high	82.6	Confident	4 Å²	4	28 Å²	28	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-67.5	-35.3	175.7	-175.1	59	0	0	0	112.6	S1127 A1132 C1133 I1150 L1153 I1154 V1177 L1217	S1127-L1129 PolarHBondContact O-N 2.86Å; S1127-L1129 PolarHBondContact OG-N 3.48Å; L1129-A1132 PolarHBondContact O-N 3.14Å; L1129-C1133 WeakPolarHBondContact O-CB 3.48Å; L1129-C1133 PolarHBondContact O-N 3.26Å; L1129-C1133 PolarHBondContact O-SG 3.24Å; L1129-I1150 HydrophobicContact CD1-CB 4.45Å; L1129-I1150 HydrophobicContact CD1-CG1 4.31Å; L1129-I1150 HydrophobicContact CD1-CG2 4.09Å; L1129-L1153 HydrophobicContact CD1-CB 4.24Å; L1129-L1153 HydrophobicContact CD1-CD1 4.3Å; L1129-I1154 HydrophobicContact CD1-CD1 4.22Å; L1129-I1154 HydrophobicContact CD1-CG1 4.11Å; L1129-I1154 HydrophobicContact CD2-CD1 4.06Å; L1129-I1154 HydrophobicContact CD2-CG1 3.65Å; L1129-V1177 HydrophobicContact CD2-CG1 4.18Å; L1129-V1177 HydrophobicContact CD2-CG2 4.16Å; L1129-V1177 HydrophobicContact CG-CG1 4.01Å; L1129-V1177 HydrophobicContact CG-CG2 4.5Å; L1129-L1217 HydrophobicContact CD2-CD2 4.49Å
1130	C	89.2	Confident	81.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.6	-41.4	173.4	-63.4	0	0	0	0	112.3	L1125 S1127 C1133 S1134 F1165 F1180	L1125-C1130 WeakPolarHBondContact O-CB 3.34Å; S1127-C1130 PolarHBondContact N-SG 3.22Å; S1127-C1130 WeakPolarHBondContact O-CA 3.46Å; S1127-C1130 VanDerWaalsContact O-CB 3.3Å; S1127-C1130 WeakPolarHBondContact O-CB 3.32Å; S1127-C1130 PolarHBondContact O-N 2.83Å; C1130-C1133 CarbonylContact O-C 3.56Å; C1130-C1133 PolarHBondContact O-N 3.22Å; C1130-S1134 PolarHBondContact O-N 3.18Å; C1130-F1165 WeakPolarHBondContact SG-CZ 3.47Å; C1130-F1180 HydrophobicContact CB-CD1 3.61Å; C1130-F1180 HydrophobicContact CB-CE1 3.64Å; C1130-F1180 HydrophobicContact CB-CG 4.16Å; C1130-F1180 HydrophobicContact CB-CZ 4.18Å
1131	I	87.5	Confident	81.8	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-63	-47.9	174.7	-62.3	-53.3	0	0	0	110.5	I1098 A1099 L1121 L1125 S1127 A1128 C1133 S1134 F1137	I1098-I1131 HydrophobicContact CB-CG2 4.24Å; I1098-I1131 HydrophobicContact CG2-CB 4.39Å; I1098-I1131 HydrophobicContact CG2-CG2 3.75Å; A1099-I1131 HydrophobicContact CB-CG2 4.25Å; L1121-I1131 HydrophobicContact CD1-CD1 4.33Å; L1121-I1131 HydrophobicContact CD1-CG1 3.66Å; L1125-I1131 HydrophobicContact CB-CD1 4.17Å; L1125-I1131 HydrophobicContact CD2-CD1 4.1Å; S1127-I1131 PolarHBondContact O-N 3.34Å; S1127-I1131 VanDerWaalsContact O-N 3.13Å; A1128-I1131 PolarHBondContact O-N 3.07Å; I1131-C1133 PolarHBondContact O-N 2.8Å; I1131-S1134 PolarHBondContact O-N 2.72Å; I1131-S1134 VanDerWaalsContact O-N 3.11Å; I1131-F1137 HydrophobicContact CG2-CD2 3.94Å; I1131-F1137 HydrophobicContact CG2-CE2 3.71Å
1132	A	90.7	Very high	81.8	Confident	5 Å²	5	28.5 Å²	28.5	4%	0.041	15%	0.153	C	C	.	.	H	α-helix	trans	-56.9	-37.3	176.5	0	0	0	0	0	112.3	I1098 A1128 L1129 R1146 L1149 I1150 L1153	I1098-A1132 HydrophobicContact CG2-CB 3.94Å; A1128-A1132 PolarHBondContact O-N 3.42Å; L1129-A1132 PolarHBondContact O-N 3.14Å; A1132-R1146 PolarHBondContact O-NE 3.33Å; A1132-R1146 PolarHBondContact O-NH2 2.92Å; A1132-L1149 HydrophobicContact CB-CD2 4.34Å; A1132-I1150 HydrophobicContact CB-CG1 4.2Å; A1132-L1153 HydrophobicContact CB-CD1 3.89Å
1133	C	91.1	Very high	82.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-87.9	-6.2	179.6	-57.8	0	0	0	0	114.9	L1129 C1130 I1131 R1146 I1150 T1181 Y1185 I1213	L1129-C1133 WeakPolarHBondContact O-CB 3.48Å; L1129-C1133 PolarHBondContact O-N 3.26Å; L1129-C1133 PolarHBondContact O-SG 3.24Å; C1130-C1133 CarbonylContact O-C 3.56Å; C1130-C1133 PolarHBondContact O-N 3.22Å; I1131-C1133 PolarHBondContact O-N 2.8Å; C1133-R1146 PolarHBondContact O-NH2 3.06Å; C1133-I1150 VanDerWaalsContact SG-CD1 3.54Å; C1133-T1181 HydrophobicContact CB-CG2 3.16Å; C1133-Y1185 VanDerWaalsContact O-CE1 3.26Å; C1133-Y1185 WeakPolarHBondContact O-CE1 3.36Å; C1133-Y1185 PolarHBondContact O-OH 3.08Å; C1133-I1213 HydrophobicContact CB-CG2 4.33Å
1134	S	87.2	Confident	83.3	Confident	4 Å²	4	33.3 Å²	33.3	3%	0.028	17%	0.171	C	C	.	.	S	Bend	trans	-68.6	143.6	-179.2	178.1	0	0	0	0	113.2	C1130 I1131 L1136 F1137 R1146 D1184	C1130-S1134 PolarHBondContact O-N 3.18Å; I1131-S1134 PolarHBondContact O-N 2.72Å; I1131-S1134 VanDerWaalsContact O-N 3.11Å; S1134-L1136 PolarHBondContact O-N 3.49Å; S1134-L1136 VanDerWaalsContact O-N 3.17Å; S1134-L1136 PolarHBondContact OG-N 3.01Å; S1134-L1136 VanDerWaalsContact OG-N 3.17Å; S1134-F1137 PolarHBondContact O-N 3.24Å; S1134-R1146 PolarHBondContact O-NH2 2.93Å; S1134-D1184 PolarHBondContact OG-OD2 3.03Å
1135	S	84.9	Confident	84.1	Confident	27 Å²	27	34.4 Å²	34.4	19%	0.189	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-61.2	-16.8	171.1	61.5	0	0	0	0	113.7	F1137 D1184	S1135-F1137 VanDerWaalsContact C-N 3.29Å; S1135-F1137 PolarHBondContact O-N 3.09Å; S1135-D1184 WeakPolarHBondContact CB-OD2 3.3Å; S1135-D1184 PolarHBondContact N-OD2 2.95Å; S1135-D1184 PolarHBondContact OG-OD2 3.34Å
1136	L	77.5	Confident	84.9	Confident	84 Å²	84	33.4 Å²	33.4	44%	0.44	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-69.4	-20.5	-179.5	-67	175.6	0	0	0	114.5	R693 S1134	R693-L1136 PolarHBondContact NH1-O 3.39Å; S1134-L1136 PolarHBondContact O-N 3.49Å; S1134-L1136 VanDerWaalsContact O-N 3.17Å; S1134-L1136 PolarHBondContact OG-N 3.01Å; S1134-L1136 VanDerWaalsContact OG-N 3.17Å
1137	F	75.8	Confident	85.3	Confident	31 Å²	31	34.6 Å²	34.6	14%	0.136	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-122.7	9.1	-176.7	-51.3	-68.6	0	0	0	113	A1099 I1131 S1134 S1135 F1139 R1140	A1099-F1137 HydrophobicContact CB-CD1 4.17Å; A1099-F1137 HydrophobicContact CB-CE1 3.54Å; A1099-F1137 HydrophobicContact CB-CE2 4.08Å; A1099-F1137 HydrophobicContact CB-CZ 3.49Å; A1099-F1137 VanDerWaalsContact CB-CZ 3.49Å; A1099-F1137 WeakPolarHBondContact O-CD1 3.34Å; A1099-F1137 VanDerWaalsContact O-CE1 3.31Å; A1099-F1137 WeakPolarHBondContact O-CE1 3.26Å; I1131-F1137 HydrophobicContact CG2-CD2 3.94Å; I1131-F1137 HydrophobicContact CG2-CE2 3.71Å; S1134-F1137 PolarHBondContact O-N 3.24Å; S1135-F1137 VanDerWaalsContact C-N 3.29Å; S1135-F1137 PolarHBondContact O-N 3.09Å; F1137-F1139 PolarHBondContact O-N 2.9Å; F1137-F1139 VanDerWaalsContact O-N 3.14Å; F1137-R1140 PolarHBondContact O-N 3.31Å
1138	E	78.1	Confident	85.5	Confident	22 Å²	22	38.1 Å²	38.1	10%	0.103	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.5	-176.6	-179.5	160.6	-116.4	0	0	114.1	R1146 R1210	E1138-R1146 IonicContact OE1-NH1 3.8Å; E1138-R1210 WeakPolarHBondContact OE1-CG 3.38Å; E1138-R1210 IonicContact OE1-CZ 2.71Å; E1138-R1210 IonicContact OE1-NE 3.71Å; E1138-R1210 PolarHBondContact OE1-NE 2.71Å; E1138-R1210 IonicContact OE1-NH2 3.98Å; E1138-R1210 IonicContact OE2-CZ 2.66Å; E1138-R1210 VanDerWaalsContact OE2-CZ 3.26Å; E1138-R1210 IonicContact OE2-NE 2.74Å; E1138-R1210 PolarHBondContact OE2-NE 3.21Å; E1138-R1210 VanDerWaalsContact OE2-NE 3.08Å; E1138-R1210 IonicContact OE2-NH2 3.44Å; E1138-R1210 PolarHBondContact OE2-NH2 2.96Å
1139	F	75	Confident	85.6	Confident	138 Å²	138	38.4 Å²	38.4	61%	0.605	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-1	179.9	-55.5	-71.8	0	0	0	114.5	F1137	F1137-F1139 PolarHBondContact O-N 2.9Å; F1137-F1139 VanDerWaalsContact O-N 3.14Å
1140	R	72.9	Confident	85.7	Confident	78 Å²	78	38.2 Å²	38.2	29%	0.294	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-20.2	175.4	-75.4	-152.8	-170.6	-103.8	4.2	113.3	E1064 A1099 T1100 F1137	E1064-R1140 IonicContact OE1-CZ 2.78Å; E1064-R1140 IonicContact OE1-NH1 3.32Å; E1064-R1140 PolarHBondContact OE1-NH1 3.33Å; E1064-R1140 IonicContact OE1-NH2 3.8Å; E1064-R1140 PolarHBondContact OE1-NH2 3.37Å; A1099-R1140 WeakPolarHBondContact O-CD 3.45Å; A1099-R1140 PolarHBondContact O-NE 3.22Å; T1100-R1140 VanDerWaalsContact C-CD 3.45Å; T1100-R1140 WeakPolarHBondContact O-CD 3.5Å; T1100-R1140 PolarHBondContact O-NE 3.31Å; T1100-R1140 PolarHBondContact O-NH1 3.47Å; F1137-R1140 PolarHBondContact O-N 3.31Å
1141	R	82.4	Confident	85.9	Confident	13 Å²	13	41.8 Å²	41.8	5%	0.049	21%	0.206	C	C	.	.	S	Bend	trans	-141.1	140.4	-178.8	-64.2	-178.6	-179.7	84.6	-2.4	109.5	I1098 G1101 D1103 R1146	I1098-R1141 PolarHBondContact O-NH1 2.98Å; G1101-R1141 VanDerWaalsContact CA-NH2 3.28Å; D1103-R1141 IonicContact OD1-CZ 2.72Å; D1103-R1141 IonicContact OD1-NE 3.76Å; D1103-R1141 PolarHBondContact OD1-NE 3.01Å; D1103-R1141 IonicContact OD1-NH2 2.81Å; D1103-R1141 PolarHBondContact OD1-NH2 3.01Å; D1103-R1141 IonicContact OD2-NE 3.49Å; R1141-R1146 HydrophobicContact CB-CB 4.19Å
1142	P	83.8	Confident	86.1	Confident	52 Å²	52	45.1 Å²	45.1	34%	0.338	22%	0.218	S	C	.	.			trans	-63.1	160.9	168.6	32	-36.6	0	0	0	109.8	E1144 S1145 R1146	P1142-E1144 PolarHBondContact O-N 3.1Å; P1142-S1145 WeakPolarHBondContact CG-OG 3.39Å; P1142-S1145 PolarHBondContact O-N 3.28Å; P1142-R1146 VanDerWaalsContact O-CB 3.29Å; P1142-R1146 WeakPolarHBondContact O-CB 3.34Å; P1142-R1146 PolarHBondContact O-N 2.77Å
1143	I	86.5	Confident	86.2	Confident	41 Å²	41	44.9 Å²	44.9	21%	0.21	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-32.4	-170	-174	60.1	0	0	0	112.2	R1146 L1147 I1213	I1143-R1146 PolarHBondContact O-N 3.16Å; I1143-L1147 HydrophobicContact CD1-CD1 4.35Å; I1143-L1147 HydrophobicContact CD1-CG 4.22Å; I1143-L1147 HydrophobicContact CG1-CD1 4Å; I1143-L1147 HydrophobicContact CG1-CG 4.34Å; I1143-L1147 WeakPolarHBondContact O-CB 3.46Å; I1143-L1147 VanDerWaalsContact O-CG 3.29Å; I1143-L1147 WeakPolarHBondContact O-CG 3.43Å; I1143-L1147 PolarHBondContact O-N 2.86Å; I1143-I1213 HydrophobicContact CD1-CD1 3.71Å; I1143-I1213 HydrophobicContact CD1-CG1 3.93Å
1144	E	89.1	Confident	86.2	Confident	127 Å²	127	45 Å²	45	59%	0.593	22%	0.216	S	C	*	.	H	α-helix	trans	-64.1	-57.3	177.5	-61.1	69.4	-152	0	0	110.9	P1142 R1146 L1147 E1148	P1142-E1144 PolarHBondContact O-N 3.1Å; E1144-R1146 PolarHBondContact O-N 2.91Å; E1144-L1147 PolarHBondContact O-N 3.22Å; E1144-E1148 PolarHBondContact O-N 3.07Å
1145	S	89.2	Confident	86.3	Confident	46 Å²	46	50.3 Å²	50.3	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-61.3	-32.7	177.2	-51.5	0	0	0	0	112	R57 P1142 E1148 L1149	R57-S1145 PolarHBondContact NH2-OG 3.46Å; P1142-S1145 WeakPolarHBondContact CG-OG 3.39Å; P1142-S1145 PolarHBondContact O-N 3.28Å; S1145-E1148 PolarHBondContact O-N 3.25Å; S1145-L1149 PolarHBondContact O-N 3.18Å
1146	R	91.3	Very high	86.4	Confident	9 Å²	9	54.8 Å²	54.8	3%	0.034	26%	0.261	C	S	.	.	H	α-helix	trans	-72.1	-42.3	178.1	-172.4	-179.8	-178.6	-163.7	3.6	112.3	A1132 C1133 S1134 E1138 R1141 P1142 I1143 E1144 E1148 L1149 I1150	A1132-R1146 PolarHBondContact O-NE 3.33Å; A1132-R1146 PolarHBondContact O-NH2 2.92Å; C1133-R1146 PolarHBondContact O-NH2 3.06Å; S1134-R1146 PolarHBondContact O-NH2 2.93Å; E1138-R1146 IonicContact OE1-NH1 3.8Å; R1141-R1146 HydrophobicContact CB-CB 4.19Å; P1142-R1146 VanDerWaalsContact O-CB 3.29Å; P1142-R1146 WeakPolarHBondContact O-CB 3.34Å; P1142-R1146 PolarHBondContact O-N 2.77Å; I1143-R1146 PolarHBondContact O-N 3.16Å; E1144-R1146 PolarHBondContact O-N 2.91Å; R1146-E1148 VanDerWaalsContact C-N 3.3Å; R1146-L1149 PolarHBondContact O-N 3.34Å; R1146-I1150 HydrophobicContact CG-CD1 4.3Å; R1146-I1150 WeakPolarHBondContact O-CD1 3.24Å; R1146-I1150 VanDerWaalsContact O-CG1 3.3Å; R1146-I1150 WeakPolarHBondContact O-CG1 3.36Å; R1146-I1150 PolarHBondContact O-N 3.06Å
1147	L	90.8	Very high	86.7	Confident	29 Å²	29	51.2 Å²	51.2	15%	0.152	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-38.1	171.9	-78.1	169	0	0	0	110.7	I1143 E1144 I1150 K1151 Q1212 I1213	I1143-L1147 HydrophobicContact CD1-CD1 4.35Å; I1143-L1147 HydrophobicContact CD1-CG 4.22Å; I1143-L1147 HydrophobicContact CG1-CD1 4Å; I1143-L1147 HydrophobicContact CG1-CG 4.34Å; I1143-L1147 WeakPolarHBondContact O-CB 3.46Å; I1143-L1147 VanDerWaalsContact O-CG 3.29Å; I1143-L1147 WeakPolarHBondContact O-CG 3.43Å; I1143-L1147 PolarHBondContact O-N 2.86Å; E1144-L1147 PolarHBondContact O-N 3.22Å; L1147-I1150 WeakPolarHBondContact O-CB 3.36Å; L1147-I1150 PolarHBondContact O-N 3.26Å; L1147-K1151 WeakPolarHBondContact O-CG 3.22Å; L1147-K1151 PolarHBondContact O-N 3.19Å; L1147-Q1212 HydrophobicContact CD1-CB 4.45Å; L1147-I1213 HydrophobicContact CD2-CG1 3.75Å; L1147-I1213 HydrophobicContact CG-CG1 4.4Å
1148	E	91.7	Very high	87	Confident	84 Å²	84	50.9 Å²	50.9	39%	0.393	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-43.4	176.4	-163.4	52.9	-128.7	0	0	112.3	E1144 S1145 R1146 I1150 K1151 R1152	E1144-E1148 PolarHBondContact O-N 3.07Å; S1145-E1148 PolarHBondContact O-N 3.25Å; R1146-E1148 VanDerWaalsContact C-N 3.3Å; E1148-I1150 VanDerWaalsContact C-N 3.31Å; E1148-I1150 PolarHBondContact O-N 3.45Å; E1148-K1151 PolarHBondContact O-N 2.69Å; E1148-K1151 VanDerWaalsContact OE2-CD 3.31Å; E1148-K1151 WeakPolarHBondContact OE2-CD 3.34Å; E1148-K1151 WeakPolarHBondContact OE2-CE 3.46Å; E1148-K1151 IonicContact OE2-NZ 3.33Å; E1148-K1151 PolarHBondContact OE2-NZ 3.33Å; E1148-R1152 WeakPolarHBondContact O-CB 3.4Å; E1148-R1152 VanDerWaalsContact O-CG 3.29Å; E1148-R1152 WeakPolarHBondContact O-CG 3.23Å; E1148-R1152 PolarHBondContact O-N 3.45Å
1149	L	92.4	Very high	87	Confident	9 Å²	9	52.6 Å²	52.6	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-57.6	-43.4	170.6	176.6	60.2	0	0	0	112.1	I1098 I1106 I1110 A1132 S1145 R1146 R1152 L1153	I1098-L1149 HydrophobicContact CG1-CD2 4.37Å; I1098-L1149 HydrophobicContact CG2-CD2 4.23Å; I1106-L1149 HydrophobicContact CD1-CD1 4.36Å; I1106-L1149 HydrophobicContact CD1-CD2 4.37Å; I1106-L1149 HydrophobicContact CG2-CD1 3.78Å; I1110-L1149 HydrophobicContact CD1-CD1 4.43Å; A1132-L1149 HydrophobicContact CB-CD2 4.34Å; S1145-L1149 PolarHBondContact O-N 3.18Å; R1146-L1149 PolarHBondContact O-N 3.34Å; L1149-R1152 PolarHBondContact O-N 2.68Å; L1149-L1153 HydrophobicContact CD1-CD1 4.16Å; L1149-L1153 HydrophobicContact CD1-CG 4.26Å; L1149-L1153 HydrophobicContact CG-CD1 4.14Å; L1149-L1153 WeakPolarHBondContact O-CG 3.48Å; L1149-L1153 PolarHBondContact O-N 2.7Å
1150	I	92.7	Very high	87.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-43.9	177.6	-73.3	164	0	0	0	111.5	L1129 A1132 C1133 R1146 L1147 E1148 I1154 I1213 Y1216 L1217	L1129-I1150 HydrophobicContact CD1-CB 4.45Å; L1129-I1150 HydrophobicContact CD1-CG1 4.31Å; L1129-I1150 HydrophobicContact CD1-CG2 4.09Å; A1132-I1150 HydrophobicContact CB-CG1 4.2Å; C1133-I1150 VanDerWaalsContact SG-CD1 3.54Å; R1146-I1150 HydrophobicContact CG-CD1 4.3Å; R1146-I1150 WeakPolarHBondContact O-CD1 3.24Å; R1146-I1150 VanDerWaalsContact O-CG1 3.3Å; R1146-I1150 WeakPolarHBondContact O-CG1 3.36Å; R1146-I1150 PolarHBondContact O-N 3.06Å; L1147-I1150 WeakPolarHBondContact O-CB 3.36Å; L1147-I1150 PolarHBondContact O-N 3.26Å; E1148-I1150 VanDerWaalsContact C-N 3.31Å; E1148-I1150 PolarHBondContact O-N 3.45Å; I1150-I1154 HydrophobicContact CG2-CD1 3.82Å; I1150-I1154 WeakPolarHBondContact O-CG1 3.35Å; I1150-I1154 PolarHBondContact O-N 2.75Å; I1150-I1154 VanDerWaalsContact O-N 3.09Å; I1150-I1213 HydrophobicContact CD1-CD1 4.14Å; I1150-I1213 HydrophobicContact CD1-CG1 4.04Å; I1150-I1213 HydrophobicContact CD1-CG2 4.05Å; I1150-Y1216 HydrophobicContact CG2-CD1 4.02Å; I1150-Y1216 HydrophobicContact CG2-CE1 4.03Å; I1150-L1217 HydrophobicContact CG2-CD2 4.25Å
1151	K	92.9	Very high	87.5	Confident	74 Å²	74	48.2 Å²	48.2	32%	0.322	24%	0.244	S	C	.	.	H	α-helix	trans	-58.2	-50.1	173.6	-68.3	171.1	-163.2	166.8	0	110.8	L1147 E1148 L1153 I1154 N1155 Y1216	L1147-K1151 WeakPolarHBondContact O-CG 3.22Å; L1147-K1151 PolarHBondContact O-N 3.19Å; E1148-K1151 PolarHBondContact O-N 2.69Å; E1148-K1151 VanDerWaalsContact OE2-CD 3.31Å; E1148-K1151 WeakPolarHBondContact OE2-CD 3.34Å; E1148-K1151 WeakPolarHBondContact OE2-CE 3.46Å; E1148-K1151 IonicContact OE2-NZ 3.33Å; E1148-K1151 PolarHBondContact OE2-NZ 3.33Å; K1151-L1153 PolarHBondContact O-N 3.36Å; K1151-I1154 PolarHBondContact O-N 3.3Å; K1151-N1155 WeakPolarHBondContact O-CB 3.27Å; K1151-N1155 PolarHBondContact O-N 2.92Å; K1151-N1155 PolarHBondContact O-OD1 2.96Å; K1151-Y1216 HydrophobicContact CG-CE1 4.16Å; K1151-Y1216 HydrophobicContact CG-CE2 4.27Å; K1151-Y1216 WeakPolarHBondContact CG-OH 3.49Å
1152	R	92.2	Very high	87.3	Confident	75 Å²	75	48.3 Å²	48.3	28%	0.283	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-42.4	-178.1	-72	174.9	59.7	-156.9	-8.4	112.6	D1107 E1148 L1149 K1156	D1107-R1152 IonicContact OD1-CZ 3.23Å; D1107-R1152 IonicContact OD1-NH1 2.73Å; D1107-R1152 PolarHBondContact OD1-NH1 3.37Å; D1107-R1152 IonicContact OD1-NH2 3.45Å; D1107-R1152 PolarHBondContact OD1-NH2 3.13Å; E1148-R1152 WeakPolarHBondContact O-CB 3.4Å; E1148-R1152 VanDerWaalsContact O-CG 3.29Å; E1148-R1152 WeakPolarHBondContact O-CG 3.23Å; E1148-R1152 PolarHBondContact O-N 3.45Å; L1149-R1152 PolarHBondContact O-N 2.68Å; R1152-K1156 PolarHBondContact O-N 3.34Å
1153	L	92	Very high	86.6	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-46.8	174.9	-71.6	168.3	0	0	0	111.6	L1094 I1098 I1110 I1117 L1129 A1132 L1149 K1151 K1156 G1157	L1094-L1153 HydrophobicContact CD2-CD2 4.32Å; I1098-L1153 HydrophobicContact CD1-CD1 4.03Å; I1098-L1153 HydrophobicContact CD1-CD2 4.36Å; I1110-L1153 HydrophobicContact CD1-CD2 3.71Å; I1110-L1153 HydrophobicContact CD1-CG 4.3Å; I1110-L1153 HydrophobicContact CG1-CD2 4.33Å; I1117-L1153 HydrophobicContact CG2-CB 4.49Å; I1117-L1153 HydrophobicContact CG2-CD2 3.9Å; L1129-L1153 HydrophobicContact CD1-CB 4.24Å; L1129-L1153 HydrophobicContact CD1-CD1 4.3Å; A1132-L1153 HydrophobicContact CB-CD1 3.89Å; L1149-L1153 HydrophobicContact CD1-CD1 4.16Å; L1149-L1153 HydrophobicContact CD1-CG 4.26Å; L1149-L1153 HydrophobicContact CG-CD1 4.14Å; L1149-L1153 WeakPolarHBondContact O-CG 3.48Å; L1149-L1153 PolarHBondContact O-N 2.7Å; K1151-L1153 PolarHBondContact O-N 3.36Å; L1153-K1156 PolarHBondContact O-N 2.9Å; L1153-G1157 PolarHBondContact O-N 3.09Å
1154	I	91	Very high	85.4	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-67.8	-40.3	-179.9	-70.2	163.8	0	0	0	111.9	L1129 I1150 K1151 K1156 G1157 G1158 F1162 Y1216 L1217 F1224	L1129-I1154 HydrophobicContact CD1-CD1 4.22Å; L1129-I1154 HydrophobicContact CD1-CG1 4.11Å; L1129-I1154 HydrophobicContact CD2-CD1 4.06Å; L1129-I1154 HydrophobicContact CD2-CG1 3.65Å; I1150-I1154 HydrophobicContact CG2-CD1 3.82Å; I1150-I1154 WeakPolarHBondContact O-CG1 3.35Å; I1150-I1154 PolarHBondContact O-N 2.75Å; I1150-I1154 VanDerWaalsContact O-N 3.09Å; K1151-I1154 PolarHBondContact O-N 3.3Å; I1154-K1156 PolarHBondContact O-N 3.39Å; I1154-G1157 PolarHBondContact O-N 3.49Å; I1154-G1158 WeakPolarHBondContact O-CA 3.45Å; I1154-G1158 PolarHBondContact O-N 2.99Å; I1154-F1162 HydrophobicContact CD1-CE2 4.27Å; I1154-F1162 HydrophobicContact CD1-CZ 4.06Å; I1154-F1162 HydrophobicContact CG1-CE2 4.25Å; I1154-F1162 HydrophobicContact CG2-CE2 4.13Å; I1154-Y1216 HydrophobicContact CD1-CE1 3.97Å; I1154-L1217 HydrophobicContact CD1-CD2 3.7Å; I1154-F1224 HydrophobicContact CG2-CE2 3.83Å; I1154-F1224 HydrophobicContact CG2-CZ 4.08Å
1155	N	89.5	Confident	84.3	Confident	116 Å²	116	48.8 Å²	48.8	62%	0.62	24%	0.244	S	C	*	.	H	α-helix	trans	-64.4	-30.6	179.7	-70.2	-4.8	0	0	0	112.5	K1151	K1151-N1155 WeakPolarHBondContact O-CB 3.27Å; K1151-N1155 PolarHBondContact O-N 2.92Å; K1151-N1155 PolarHBondContact O-OD1 2.96Å
1156	K	88.4	Confident	82.8	Confident	121 Å²	121	48.9 Å²	48.9	53%	0.526	24%	0.242	S	C	.	.	H	α-helix	trans	-91.7	-33.5	178.1	-75.7	-89	-168.2	161.9	0	113.4	I1110 I1117 R1152 L1153 I1154	I1110-K1156 HydrophobicContact CG2-CD 4.41Å; I1110-K1156 HydrophobicContact CG2-CG 3.95Å; I1117-K1156 HydrophobicContact CD1-CB 3.32Å; I1117-K1156 HydrophobicContact CD1-CG 4.3Å; R1152-K1156 PolarHBondContact O-N 3.34Å; L1153-K1156 PolarHBondContact O-N 2.9Å; I1154-K1156 PolarHBondContact O-N 3.39Å
1157	G	82.2	Confident	81.4	Confident	9 Å²	9	49.2 Å²	49.2	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-86.8	-16.1	178.7	0	0	0	0	0	114.8	N1118 L1153 I1154 S1161	N1118-G1157 PolarHBondContact ND2-O 2.88Å; L1153-G1157 PolarHBondContact O-N 3.09Å; I1154-G1157 PolarHBondContact O-N 3.49Å; G1157-S1161 WeakPolarHBondContact CA-OG 3.37Å
1158	G	83.3	Confident	79.8	Confident	24 Å²	24	50.5 Å²	50.5	25%	0.247	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	63.7	-148.2	174.1	0	0	0	0	0	114.4	I1154 E1160 S1161	I1154-G1158 WeakPolarHBondContact O-CA 3.45Å; I1154-G1158 PolarHBondContact O-N 2.99Å; G1158-E1160 VanDerWaalsContact C-N 3.27Å; G1158-E1160 PolarHBondContact O-N 2.89Å; G1158-S1161 WeakPolarHBondContact O-CB 3.44Å; G1158-S1161 PolarHBondContact O-N 3.22Å; G1158-S1161 PolarHBondContact O-OG 2.89Å
1159	I	77.2	Confident	78.1	Confident	59 Å²	59	52 Å²	52	30%	0.303	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-62.8	-36	-176.9	-61.1	161.8	0	0	0	111.2	S1161 F1162 F1224 I1228	I1159-S1161 PolarHBondContact O-N 3.49Å; I1159-F1162 PolarHBondContact O-N 3.42Å; I1159-F1224 HydrophobicContact CB-CD1 4.42Å; I1159-F1224 HydrophobicContact CB-CG 4.45Å; I1159-F1224 HydrophobicContact CD1-CD1 4.33Å; I1159-F1224 HydrophobicContact CG1-CB 4.04Å; I1159-F1224 HydrophobicContact CG1-CD1 3.36Å; I1159-F1224 HydrophobicContact CG1-CE1 3.88Å; I1159-F1224 HydrophobicContact CG1-CG 3.76Å; I1159-F1224 HydrophobicContact CG2-CB 4.49Å; I1159-I1228 HydrophobicContact CD1-CD1 3.86Å; I1159-I1228 HydrophobicContact CD1-CG1 4.16Å; I1159-I1228 HydrophobicContact CG2-CD1 3.88Å
1160	E	78.4	Confident	75.8	Confident	119 Å²	119	56.2 Å²	56.2	56%	0.556	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24.5	180	-71.9	-179.1	176.4	0	0	113.4	N1118 G1158 F1162 Q1163	N1118-E1160 HydrophobicContact CB-CB 4.43Å; N1118-E1160 WeakPolarHBondContact ND2-CB 3.48Å; N1118-E1160 PolarHBondContact ND2-OE2 2.85Å; G1158-E1160 VanDerWaalsContact C-N 3.27Å; G1158-E1160 PolarHBondContact O-N 2.89Å; E1160-F1162 PolarHBondContact O-N 3.1Å; E1160-Q1163 WeakPolarHBondContact O-CB 3.42Å; E1160-Q1163 PolarHBondContact O-N 3.14Å
1161	S	80	Confident	74.1	Confident	5 Å²	5	63.5 Å²	63.5	4%	0.035	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-59.1	-16	172.9	-62.3	0	0	0	0	113.7	N1118 G1157 G1158 I1159 V1177	N1118-S1161 VanDerWaalsContact OD1-CA 3.28Å; N1118-S1161 WeakPolarHBondContact OD1-CA 3.36Å; N1118-S1161 PolarHBondContact OD1-N 3.32Å; N1118-S1161 PolarHBondContact OD1-OG 3.27Å; G1157-S1161 WeakPolarHBondContact CA-OG 3.37Å; G1158-S1161 WeakPolarHBondContact O-CB 3.44Å; G1158-S1161 PolarHBondContact O-N 3.22Å; G1158-S1161 PolarHBondContact O-OG 2.89Å; I1159-S1161 PolarHBondContact O-N 3.49Å; S1161-V1177 WeakPolarHBondContact O-CG2 3.4Å
1162	F	78.5	Confident	72.6	Confident	14 Å²	14	62.1 Å²	62.1	6%	0.061	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-105.1	8.1	176	-69.1	-91.1	0	0	0	114.2	I1154 I1159 E1160 I1178 L1217 R1220 L1221 F1224	I1154-F1162 HydrophobicContact CD1-CE2 4.27Å; I1154-F1162 HydrophobicContact CD1-CZ 4.06Å; I1154-F1162 HydrophobicContact CG1-CE2 4.25Å; I1154-F1162 HydrophobicContact CG2-CE2 4.13Å; I1159-F1162 PolarHBondContact O-N 3.42Å; E1160-F1162 PolarHBondContact O-N 3.1Å; F1162-I1178 HydrophobicContact CD1-CD1 4.47Å; F1162-I1178 HydrophobicContact CE1-CD1 4.18Å; F1162-I1178 HydrophobicContact CE1-CG1 4.33Å; F1162-L1217 HydrophobicContact CE1-CB 4.28Å; F1162-L1217 HydrophobicContact CE1-CD2 4.22Å; F1162-L1217 WeakPolarHBondContact CE1-O 3.37Å; F1162-L1217 HydrophobicContact CZ-CD2 4.08Å; F1162-R1220 HydrophobicContact CE2-CB 4.18Å; F1162-R1220 HydrophobicContact CZ-CB 3.9Å; F1162-L1221 HydrophobicContact CB-CD1 3.9Å; F1162-L1221 HydrophobicContact CD1-CB 3.93Å; F1162-L1221 HydrophobicContact CD1-CD1 4Å; F1162-L1221 HydrophobicContact CD1-CD2 4.49Å; F1162-L1221 HydrophobicContact CD1-CG 4.36Å; F1162-L1221 HydrophobicContact CE1-CB 3.97Å; F1162-L1221 HydrophobicContact CG-CD1 4.03Å; F1162-F1224 AromaticContact CD2-CD2 3.89Å; F1162-F1224 HydrophobicContact CD2-CD2 3.89Å; F1162-F1224 HydrophobicContact CD2-CE2 4.01Å; F1162-F1224 AromaticContact CE2-CD2 3.94Å; F1162-F1224 HydrophobicContact CE2-CD2 3.94Å; F1162-F1224 AromaticContact CE2-CE2 3.78Å; F1162-F1224 HydrophobicContact CE2-CE2 3.78Å
1163	Q	68.9	Low	71.4	Confident	108 Å²	108	60.9 Å²	60.9	51%	0.505	32%	0.324	S	S	.	.			trans	-56.7	150.4	177.6	-172.5	170.2	-0.5	0	0	111.7	E1160 F1165	E1160-Q1163 WeakPolarHBondContact O-CB 3.42Å; E1160-Q1163 PolarHBondContact O-N 3.14Å; Q1163-F1165 VanDerWaalsContact O-CD1 3.31Å; Q1163-F1165 WeakPolarHBondContact O-CD1 3.47Å
1164	L	62.1	Low	70.4	Confident	92 Å²	92	67.9 Å²	67.9	48%	0.482	35%	0.352	S	S	.	.			trans	-74.6	127.1	177.7	-63.6	171.6	0	0	0	110.5	G1175 N1176	L1164-G1175 WeakPolarHBondContact CA-O 3.5Å; L1164-N1176 HydrophobicContact CD2-CB 4.25Å
1165	F	65.3	Low	69.7	Low	31 Å²	31	67.9 Å²	67.9	14%	0.136	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	166.7	174.1	55.6	-90.4	0	0	0	110.8	C1130 Q1163 L1167 Y1174 G1175 V1177 F1180	C1130-F1165 WeakPolarHBondContact SG-CZ 3.47Å; Q1163-F1165 VanDerWaalsContact O-CD1 3.31Å; Q1163-F1165 WeakPolarHBondContact O-CD1 3.47Å; F1165-L1167 HydrophobicContact CD2-CD2 4.15Å; F1165-L1167 HydrophobicContact CE2-CD2 3.53Å; F1165-L1167 HydrophobicContact CZ-CD2 4.07Å; F1165-L1167 PolarHBondContact O-N 3.43Å; F1165-Y1174 WeakPolarHBondContact O-CA 3.44Å; F1165-G1175 PolarHBondContact N-O 3.06Å; F1165-G1175 PolarHBondContact O-N 2.99Å; F1165-V1177 HydrophobicContact CE1-CG2 3.79Å; F1165-V1177 HydrophobicContact CZ-CG2 4.25Å; F1165-F1180 HydrophobicContact CE2-CB 4.12Å; F1165-F1180 HydrophobicContact CE2-CD2 4.2Å; F1165-F1180 HydrophobicContact CE2-CG 4.39Å; F1165-F1180 HydrophobicContact CZ-CB 3.92Å; F1165-F1180 HydrophobicContact CZ-CG 4.47Å
1166	V	58.5	Low	69.3	Low	48 Å²	48	62.7 Å²	62.7	29%	0.291	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	109.5	-177.5	-179.4	0	0	0	0	110	K1169 Y1174	V1166-K1169 HydrophobicContact CG1-CG 4.25Å; V1166-Y1174 HydrophobicContact CG2-CD1 3.92Å; V1166-Y1174 HydrophobicContact CG2-CE1 3.47Å; V1166-Y1174 VanDerWaalsContact CG2-CE1 3.47Å
1167	L	61	Low	69.2	Low	16 Å²	16	56.9 Å²	56.9	8%	0.084	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-33.2	175.7	-62.5	-177.5	0	0	0	112.6	F1165 I1173 D1179 F1180 M1183 V1289	F1165-L1167 HydrophobicContact CD2-CD2 4.15Å; F1165-L1167 HydrophobicContact CE2-CD2 3.53Å; F1165-L1167 HydrophobicContact CZ-CD2 4.07Å; F1165-L1167 PolarHBondContact O-N 3.43Å; L1167-I1173 HydrophobicContact CB-CG2 4.38Å; L1167-I1173 HydrophobicContact CD1-CG2 4.28Å; L1167-I1173 PolarHBondContact N-O 3.49Å; L1167-D1179 HydrophobicContact CD1-CB 3.76Å; L1167-F1180 HydrophobicContact CD2-CB 3.59Å; L1167-F1180 HydrophobicContact CD2-CD2 4.02Å; L1167-F1180 HydrophobicContact CD2-CG 4.32Å; L1167-M1183 HydrophobicContact CD1-SD 4.05Å; L1167-V1289 HydrophobicContact CD1-CG1 4.49Å; L1167-V1289 HydrophobicContact CD1-CG2 4.23Å
1168	L	58.6	Low	69.6	Low	55 Å²	55	56.5 Å²	56.5	29%	0.288	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	99.9	-176.2	-89.7	161.9	0	0	0	109.3	S1170 K1171 G1172 I1173 M1183	L1168-S1170 PolarHBondContact O-N 2.82Å; L1168-K1171 HydrophobicContact CB-CB 4.37Å; L1168-K1171 PolarHBondContact O-N 3.33Å; L1168-K1171 VanDerWaalsContact O-N 3.09Å; L1168-G1172 PolarHBondContact O-N 3.45Å; L1168-G1172 VanDerWaalsContact O-N 3.12Å; L1168-I1173 HydrophobicContact CB-CB 4.35Å; L1168-I1173 HydrophobicContact CD1-CD1 4.03Å; L1168-I1173 PolarHBondContact O-N 3.23Å; L1168-M1183 HydrophobicContact CD1-CE 3.68Å
1169	K	55.4	Low	69.8	Low	116 Å²	116	55.5 Å²	55.5	50%	0.504	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-49.5	-47	175	-72	-177.8	177	178.1	0	110.9	D1123 V1166 K1171 G1172	D1123-K1169 IonicContact OD1-NZ 3.97Å; D1123-K1169 PolarHBondContact OD1-NZ 3.01Å; V1166-K1169 HydrophobicContact CG1-CG 4.25Å; K1169-K1171 PolarHBondContact O-N 3Å; K1169-G1172 PolarHBondContact O-N 3.4Å
1170	S	44.5	Very low	70.2	Confident	97 Å²	97	53.8 Å²	53.8	68%	0.678	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-65.6	-7.7	-177.6	65.3	0	0	0	0	116.4	L1168	L1168-S1170 PolarHBondContact O-N 2.82Å
1171	K	57.1	Low	70.7	Confident	153 Å²	153	48.1 Å²	48.1	67%	0.665	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-131.2	3.5	179.5	-64.6	-168.6	177.4	-173.4	0	113.9	L1168 K1169 I1173	L1168-K1171 HydrophobicContact CB-CB 4.37Å; L1168-K1171 PolarHBondContact O-N 3.33Å; L1168-K1171 VanDerWaalsContact O-N 3.09Å; K1169-K1171 PolarHBondContact O-N 3Å; K1171-I1173 HydrophobicContact CB-CD1 3.66Å; K1171-I1173 HydrophobicContact CB-CG1 3.71Å; K1171-I1173 HydrophobicContact CD-CD1 4.01Å; K1171-I1173 HydrophobicContact CG-CD1 4.46Å; K1171-I1173 PolarHBondContact O-N 3.1Å; K1171-I1173 VanDerWaalsContact O-N 3.16Å
1172	G	61.2	Low	71.2	Confident	46 Å²	46	52.3 Å²	52.3	47%	0.474	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	27.3	-176	0	0	0	0	0	114	L1168 K1169 Y1174	L1168-G1172 PolarHBondContact O-N 3.45Å; L1168-G1172 VanDerWaalsContact O-N 3.12Å; K1169-G1172 PolarHBondContact O-N 3.4Å; G1172-Y1174 WeakPolarHBondContact O-CD2 3.37Å; G1172-Y1174 WeakPolarHBondContact O-CE2 3.36Å; G1172-Y1174 PolarHBondContact O-N 2.99Å
1173	I	67	Low	71.6	Confident	49 Å²	49	54.8 Å²	54.8	25%	0.251	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	113.1	-174.6	-64.1	172.6	0	0	0	109.2	L1167 L1168 K1171 V1289	L1167-I1173 HydrophobicContact CB-CG2 4.38Å; L1167-I1173 HydrophobicContact CD1-CG2 4.28Å; L1167-I1173 PolarHBondContact N-O 3.49Å; L1168-I1173 HydrophobicContact CB-CB 4.35Å; L1168-I1173 HydrophobicContact CD1-CD1 4.03Å; L1168-I1173 PolarHBondContact O-N 3.23Å; K1171-I1173 HydrophobicContact CB-CD1 3.66Å; K1171-I1173 HydrophobicContact CB-CG1 3.71Å; K1171-I1173 HydrophobicContact CD-CD1 4.01Å; K1171-I1173 HydrophobicContact CG-CD1 4.46Å; K1171-I1173 PolarHBondContact O-N 3.1Å; K1171-I1173 VanDerWaalsContact O-N 3.16Å; I1173-V1289 HydrophobicContact CG2-CG1 3.48Å; I1173-V1289 VanDerWaalsContact CG2-CG1 3.48Å; I1173-V1289 HydrophobicContact CG2-CG2 4.36Å
1174	Y	70.7	Confident	72.4	Confident	147 Å²	147	49.9 Å²	49.9	58%	0.576	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.1	171	-63.8	-94.8	0	0	0	110.3	F1165 V1166 G1172 V1289	F1165-Y1174 WeakPolarHBondContact O-CA 3.44Å; V1166-Y1174 HydrophobicContact CG2-CD1 3.92Å; V1166-Y1174 HydrophobicContact CG2-CE1 3.47Å; V1166-Y1174 VanDerWaalsContact CG2-CE1 3.47Å; G1172-Y1174 WeakPolarHBondContact O-CD2 3.37Å; G1172-Y1174 WeakPolarHBondContact O-CE2 3.36Å; G1172-Y1174 PolarHBondContact O-N 2.99Å; Y1174-V1289 WeakPolarHBondContact O-CG2 3.26Å
1175	G	74.9	Confident	73.8	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	173.1	175.1	0	0	0	0	0	111.8	L1164 F1165 V1289	L1164-G1175 WeakPolarHBondContact CA-O 3.5Å; F1165-G1175 PolarHBondContact N-O 3.06Å; F1165-G1175 PolarHBondContact O-N 2.99Å; G1175-V1289 VanDerWaalsContact CA-CG2 3.44Å
1176	N	83	Confident	74.8	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.037	24%	0.242	C	C	.	.			trans	-91.5	179.3	178.7	65.5	19.6	0	0	0	111.3	L1164 I1178 D1179 F1180 G1286	L1164-N1176 HydrophobicContact CD2-CB 4.25Å; N1176-I1178 PolarHBondContact O-N 3.2Å; N1176-I1178 WeakPolarHBondContact OD1-CA 3.36Å; N1176-I1178 VanDerWaalsContact OD1-CB 3.31Å; N1176-I1178 WeakPolarHBondContact OD1-CB 3.41Å; N1176-I1178 PolarHBondContact OD1-N 3.01Å; N1176-D1179 PolarHBondContact O-N 3.34Å; N1176-D1179 VanDerWaalsContact O-N 3.13Å; N1176-D1179 PolarHBondContact OD1-N 3.21Å; N1176-D1179 PolarHBondContact OD1-OD2 3.21Å; N1176-F1180 PolarHBondContact O-N 3.37Å; N1176-G1286 PolarHBondContact ND2-O 3Å
1177	V	86.3	Confident	76.1	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.3	-32.8	174.9	-179.9	0	0	0	0	112.4	L1129 S1161 F1165 F1180 T1181 L1217	L1129-V1177 HydrophobicContact CD2-CG1 4.18Å; L1129-V1177 HydrophobicContact CD2-CG2 4.16Å; L1129-V1177 HydrophobicContact CG-CG1 4.01Å; L1129-V1177 HydrophobicContact CG-CG2 4.5Å; S1161-V1177 WeakPolarHBondContact O-CG2 3.4Å; F1165-V1177 HydrophobicContact CE1-CG2 3.79Å; F1165-V1177 HydrophobicContact CZ-CG2 4.25Å; V1177-F1180 PolarHBondContact O-N 3.13Å; V1177-T1181 HydrophobicContact CG1-CG2 4.18Å; V1177-T1181 WeakPolarHBondContact O-CB 3.29Å; V1177-T1181 VanDerWaalsContact O-CG2 3.22Å; V1177-T1181 WeakPolarHBondContact O-CG2 3.33Å; V1177-T1181 PolarHBondContact O-N 3.24Å; V1177-T1181 PolarHBondContact O-OG1 3.33Å; V1177-L1217 HydrophobicContact CG1-CD1 4.18Å
1178	I	89.1	Confident	77.3	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-71.2	-38.4	-178.9	-54.1	178.1	0	0	0	110.5	F1162 N1176 T1181 Y1182 L1214 L1217 A1218 L1221 C1285 R1287	F1162-I1178 HydrophobicContact CD1-CD1 4.47Å; F1162-I1178 HydrophobicContact CE1-CD1 4.18Å; F1162-I1178 HydrophobicContact CE1-CG1 4.33Å; N1176-I1178 PolarHBondContact O-N 3.2Å; N1176-I1178 WeakPolarHBondContact OD1-CA 3.36Å; N1176-I1178 VanDerWaalsContact OD1-CB 3.31Å; N1176-I1178 WeakPolarHBondContact OD1-CB 3.41Å; N1176-I1178 PolarHBondContact OD1-N 3.01Å; I1178-T1181 WeakPolarHBondContact CA-OG1 3.38Å; I1178-T1181 PolarHBondContact O-OG1 3.25Å; I1178-T1181 VanDerWaalsContact O-OG1 3.09Å; I1178-Y1182 WeakPolarHBondContact O-CB 3.42Å; I1178-Y1182 PolarHBondContact O-N 2.97Å; I1178-L1214 HydrophobicContact CG2-CD2 4.2Å; I1178-L1217 HydrophobicContact CD1-CB 4.05Å; I1178-L1217 HydrophobicContact CG1-CB 3.82Å; I1178-L1217 HydrophobicContact CG1-CD1 4.49Å; I1178-A1218 HydrophobicContact CD1-CB 4.3Å; I1178-L1221 HydrophobicContact CD1-CB 4.1Å; I1178-L1221 HydrophobicContact CD1-CD2 3.68Å; I1178-C1285 WeakPolarHBondContact CG2-O 3.11Å; I1178-R1287 HydrophobicContact CG2-CG 4.26Å
1179	D	87.1	Confident	78.6	Confident	2 Å²	2	53 Å²	53	1%	0.011	27%	0.267	C	S	.	.	H	α-helix	trans	-71.7	-38	173.4	-72.3	-53.1	0	0	0	112.3	L1167 N1176 M1183 R1287 S1288 V1289	L1167-D1179 HydrophobicContact CD1-CB 3.76Å; N1176-D1179 PolarHBondContact O-N 3.34Å; N1176-D1179 VanDerWaalsContact O-N 3.13Å; N1176-D1179 PolarHBondContact OD1-N 3.21Å; N1176-D1179 PolarHBondContact OD1-OD2 3.21Å; D1179-M1183 VanDerWaalsContact O-CB 3.25Å; D1179-M1183 WeakPolarHBondContact O-CB 3.22Å; D1179-M1183 VanDerWaalsContact O-CG 3.27Å; D1179-M1183 WeakPolarHBondContact O-CG 3.26Å; D1179-M1183 PolarHBondContact O-N 3.32Å; D1179-R1287 WeakPolarHBondContact OD1-CA 3.46Å; D1179-R1287 VanDerWaalsContact OD1-CB 3.25Å; D1179-R1287 WeakPolarHBondContact OD1-CB 3.37Å; D1179-R1287 WeakPolarHBondContact OD1-CG 3.27Å; D1179-R1287 IonicContact OD1-NE 2.71Å; D1179-R1287 PolarHBondContact OD1-NE 3.19Å; D1179-S1288 PolarHBondContact OD2-N 3.4Å; D1179-S1288 PolarHBondContact OD2-OG 3.26Å; D1179-S1288 VanDerWaalsContact OD2-OG 3.04Å; D1179-V1289 HydrophobicContact CB-CB 4.03Å; D1179-V1289 HydrophobicContact CB-CG2 4.22Å; D1179-V1289 PolarHBondContact OD1-N 3.27Å; D1179-V1289 PolarHBondContact OD2-N 2.95Å
1180	F	87.1	Confident	80.1	Confident	24 Å²	24	52.7 Å²	52.7	11%	0.105	26%	0.263	C	S	.	.	H	α-helix	trans	-57.8	-51.5	171.5	-179.5	-91.6	0	0	0	111.7	G1124 C1130 F1165 L1167 N1176 V1177 M1183 D1184	G1124-F1180 WeakPolarHBondContact O-CE2 3.44Å; C1130-F1180 HydrophobicContact CB-CD1 3.61Å; C1130-F1180 HydrophobicContact CB-CE1 3.64Å; C1130-F1180 HydrophobicContact CB-CG 4.16Å; C1130-F1180 HydrophobicContact CB-CZ 4.18Å; F1165-F1180 HydrophobicContact CE2-CB 4.12Å; F1165-F1180 HydrophobicContact CE2-CD2 4.2Å; F1165-F1180 HydrophobicContact CE2-CG 4.39Å; F1165-F1180 HydrophobicContact CZ-CB 3.92Å; F1165-F1180 HydrophobicContact CZ-CG 4.47Å; L1167-F1180 HydrophobicContact CD2-CB 3.59Å; L1167-F1180 HydrophobicContact CD2-CD2 4.02Å; L1167-F1180 HydrophobicContact CD2-CG 4.32Å; N1176-F1180 PolarHBondContact O-N 3.37Å; V1177-F1180 PolarHBondContact O-N 3.13Å; F1180-M1183 PolarHBondContact O-N 3.36Å; F1180-D1184 PolarHBondContact O-N 3.29Å
1181	T	89.2	Confident	82.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.8	-40.7	-176.2	49.4	0	0	0	0	112	C1133 V1177 I1178 D1184 Y1185 L1214 L1217	C1133-T1181 HydrophobicContact CB-CG2 3.16Å; V1177-T1181 HydrophobicContact CG1-CG2 4.18Å; V1177-T1181 WeakPolarHBondContact O-CB 3.29Å; V1177-T1181 VanDerWaalsContact O-CG2 3.22Å; V1177-T1181 WeakPolarHBondContact O-CG2 3.33Å; V1177-T1181 PolarHBondContact O-N 3.24Å; V1177-T1181 PolarHBondContact O-OG1 3.33Å; I1178-T1181 WeakPolarHBondContact CA-OG1 3.38Å; I1178-T1181 PolarHBondContact O-OG1 3.25Å; I1178-T1181 VanDerWaalsContact O-OG1 3.09Å; T1181-D1184 PolarHBondContact O-N 3.18Å; T1181-Y1185 WeakPolarHBondContact O-CB 3.39Å; T1181-Y1185 VanDerWaalsContact O-CG 3.25Å; T1181-Y1185 PolarHBondContact O-N 2.98Å; T1181-L1214 WeakPolarHBondContact OG1-CD2 3.39Å; T1181-L1217 HydrophobicContact CG2-CD1 4.41Å
1182	Y	89.4	Confident	83.4	Confident	92 Å²	92	43.3 Å²	43.3	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-59.9	-46	171.2	-175.3	-87.4	0	0	0	111.5	I1178 Y1185 T1186 L1214 R1287	I1178-Y1182 WeakPolarHBondContact O-CB 3.42Å; I1178-Y1182 PolarHBondContact O-N 2.97Å; Y1182-Y1185 PolarHBondContact O-N 3.34Å; Y1182-T1186 HydrophobicContact CD1-CG2 3.9Å; Y1182-T1186 HydrophobicContact CE1-CG2 3.52Å; Y1182-T1186 WeakPolarHBondContact O-CG2 3.32Å; Y1182-T1186 PolarHBondContact O-N 3.17Å; Y1182-T1186 PolarHBondContact O-OG1 3.26Å; Y1182-L1214 HydrophobicContact CD2-CD1 4.46Å; Y1182-R1287 VanDerWaalsContact CE1-CZ 3.49Å; Y1182-R1287 VanDerWaalsContact CZ-NH1 3.31Å
1183	M	86.4	Confident	84.6	Confident	66 Å²	66	49.1 Å²	49.1	33%	0.325	23%	0.229	S	C	.	.	H	α-helix	trans	-60.3	-46	176	-81.1	-170.2	70.6	0	0	111.8	L1167 L1168 D1179 F1180 T1186 K1187	L1167-M1183 HydrophobicContact CD1-SD 4.05Å; L1168-M1183 HydrophobicContact CD1-CE 3.68Å; D1179-M1183 VanDerWaalsContact O-CB 3.25Å; D1179-M1183 WeakPolarHBondContact O-CB 3.22Å; D1179-M1183 VanDerWaalsContact O-CG 3.27Å; D1179-M1183 WeakPolarHBondContact O-CG 3.26Å; D1179-M1183 PolarHBondContact O-N 3.32Å; F1180-M1183 PolarHBondContact O-N 3.36Å; M1183-T1186 PolarHBondContact O-N 3.47Å; M1183-T1186 PolarHBondContact O-OG1 3.26Å; M1183-K1187 PolarHBondContact O-N 3.15Å
1184	D	86.6	Confident	85.5	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.027	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-47	178.5	-161.9	54.9	0	0	0	112	S1134 S1135 F1180 T1181 T1186 K1187	S1134-D1184 PolarHBondContact OG-OD2 3.03Å; S1135-D1184 WeakPolarHBondContact CB-OD2 3.3Å; S1135-D1184 PolarHBondContact N-OD2 2.95Å; S1135-D1184 PolarHBondContact OG-OD2 3.34Å; F1180-D1184 PolarHBondContact O-N 3.29Å; T1181-D1184 PolarHBondContact O-N 3.18Å; D1184-T1186 VanDerWaalsContact C-N 3.29Å; D1184-T1186 PolarHBondContact O-N 3.23Å; D1184-K1187 VanDerWaalsContact O-CB 3.28Å; D1184-K1187 WeakPolarHBondContact O-CB 3.48Å; D1184-K1187 PolarHBondContact O-N 3.39Å; D1184-K1187 VanDerWaalsContact O-N 3.1Å; D1184-K1187 WeakPolarHBondContact OD1-CD 3.38Å; D1184-K1187 WeakPolarHBondContact OD1-CE 3.38Å; D1184-K1187 IonicContact OD1-NZ 3.36Å; D1184-K1187 PolarHBondContact OD1-NZ 3.09Å
1185	Y	90.6	Very high	86.3	Confident	12 Å²	12	46.1 Å²	46.1	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-30	177.9	-64.4	-9.7	0	0	0	112.9	C1133 T1181 Y1182 K1187 D1188 R1210 L1214	C1133-Y1185 VanDerWaalsContact O-CE1 3.26Å; C1133-Y1185 WeakPolarHBondContact O-CE1 3.36Å; C1133-Y1185 PolarHBondContact O-OH 3.08Å; T1181-Y1185 WeakPolarHBondContact O-CB 3.39Å; T1181-Y1185 VanDerWaalsContact O-CG 3.25Å; T1181-Y1185 PolarHBondContact O-N 2.98Å; Y1182-Y1185 PolarHBondContact O-N 3.34Å; Y1185-K1187 VanDerWaalsContact C-N 3.29Å; Y1185-K1187 PolarHBondContact O-N 3.43Å; Y1185-D1188 WeakPolarHBondContact O-CB 3.19Å; Y1185-D1188 PolarHBondContact O-N 3.48Å; Y1185-R1210 HydrophobicContact CD1-CG 4.26Å; Y1185-R1210 HydrophobicContact CD2-CB 3.71Å; Y1185-R1210 HydrophobicContact CD2-CG 3.9Å; Y1185-R1210 HydrophobicContact CE1-CG 4.05Å; Y1185-R1210 HydrophobicContact CE2-CB 3.5Å; Y1185-R1210 HydrophobicContact CE2-CG 3.65Å; Y1185-R1210 HydrophobicContact CG-CB 4.44Å; Y1185-R1210 HydrophobicContact CG-CG 4.21Å; Y1185-L1214 HydrophobicContact CD2-CD1 3.95Å; Y1185-L1214 HydrophobicContact CD2-CG 4.24Å; Y1185-L1214 HydrophobicContact CE2-CD1 4.3Å; Y1185-L1214 HydrophobicContact CE2-CG 4.11Å
1186	T	87.1	Confident	86.9	Confident	56 Å²	56	50 Å²	50	34%	0.344	25%	0.245	S	C	.	.	H	α-helix	trans	-73.6	-14.8	174.8	64.3	0	0	0	0	114.4	Y1182 M1183 D1184 D1188 S1192	Y1182-T1186 HydrophobicContact CD1-CG2 3.9Å; Y1182-T1186 HydrophobicContact CE1-CG2 3.52Å; Y1182-T1186 WeakPolarHBondContact O-CG2 3.32Å; Y1182-T1186 PolarHBondContact O-N 3.17Å; Y1182-T1186 PolarHBondContact O-OG1 3.26Å; M1183-T1186 PolarHBondContact O-N 3.47Å; M1183-T1186 PolarHBondContact O-OG1 3.26Å; D1184-T1186 VanDerWaalsContact C-N 3.29Å; D1184-T1186 PolarHBondContact O-N 3.23Å; T1186-D1188 PolarHBondContact O-N 2.71Å; T1186-S1192 PolarHBondContact O-OG 2.64Å
1187	K	85.1	Confident	87.2	Confident	140 Å²	140	58 Å²	58	61%	0.609	28%	0.282	S	S	*	.	H	α-helix	trans	-64.5	-30.5	169.5	-59.2	170.1	-170	163.8	0	111.1	M1183 D1184 Y1185 T1189	M1183-K1187 PolarHBondContact O-N 3.15Å; D1184-K1187 VanDerWaalsContact O-CB 3.28Å; D1184-K1187 WeakPolarHBondContact O-CB 3.48Å; D1184-K1187 PolarHBondContact O-N 3.39Å; D1184-K1187 VanDerWaalsContact O-N 3.1Å; D1184-K1187 WeakPolarHBondContact OD1-CD 3.38Å; D1184-K1187 WeakPolarHBondContact OD1-CE 3.38Å; D1184-K1187 IonicContact OD1-NZ 3.36Å; D1184-K1187 PolarHBondContact OD1-NZ 3.09Å; Y1185-K1187 VanDerWaalsContact C-N 3.29Å; Y1185-K1187 PolarHBondContact O-N 3.43Å; K1187-T1189 VanDerWaalsContact C-N 3.35Å; K1187-T1189 PolarHBondContact O-N 3.39Å
1188	D	86	Confident	87.3	Confident	18 Å²	18	60.8 Å²	60.8	10%	0.096	31%	0.305	C	S	.	.			trans	-79.5	81.2	174.2	-166.6	-23.6	0	0	0	110.1	R697 Y1185 T1186 R1190 I1191 S1192 R1210	R697-D1188 IonicContact CZ-OD2 3.19Å; R697-D1188 VanDerWaalsContact CZ-OD2 3.27Å; R697-D1188 IonicContact NH1-OD1 3.68Å; R697-D1188 IonicContact NH1-OD2 2.64Å; R697-D1188 PolarHBondContact NH1-OD2 3.45Å; R697-D1188 IonicContact NH2-OD1 3.6Å; R697-D1188 IonicContact NH2-OD2 3.74Å; R697-D1188 PolarHBondContact NH2-OD2 2.88Å; Y1185-D1188 WeakPolarHBondContact O-CB 3.19Å; Y1185-D1188 PolarHBondContact O-N 3.48Å; T1186-D1188 PolarHBondContact O-N 2.71Å; D1188-R1190 PolarHBondContact O-N 3.01Å; D1188-R1190 PolarHBondContact OD1-N 3.07Å; D1188-I1191 PolarHBondContact O-N 3.2Å; D1188-I1191 PolarHBondContact OD1-N 2.84Å; D1188-S1192 WeakPolarHBondContact O-CB 3.24Å; D1188-S1192 PolarHBondContact O-N 2.99Å; D1188-S1192 PolarHBondContact O-OG 3.25Å; D1188-R1210 IonicContact OD2-CZ 2.69Å; D1188-R1210 IonicContact OD2-NH1 2.67Å; D1188-R1210 PolarHBondContact OD2-NH1 3.36Å; D1188-R1210 VanDerWaalsContact OD2-NH1 3.16Å; D1188-R1210 IonicContact OD2-NH2 2.67Å; D1188-R1210 PolarHBondContact OD2-NH2 2.9Å; D1188-R1210 VanDerWaalsContact OD2-NH2 3.13Å
1189	T	86.6	Confident	87.2	Confident	81 Å²	81	61.1 Å²	61.1	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-26.5	-177.6	55.9	0	0	0	0	113.2	K1187 S1192 K1193	K1187-T1189 VanDerWaalsContact C-N 3.35Å; K1187-T1189 PolarHBondContact O-N 3.39Å; T1189-S1192 WeakPolarHBondContact CA-OG 3.46Å; T1189-K1193 HydrophobicContact CG2-CD 4.34Å; T1189-K1193 WeakPolarHBondContact O-CB 3.37Å; T1189-K1193 PolarHBondContact O-N 2.96Å; T1189-K1193 VanDerWaalsContact O-N 3.1Å
1190	R	87.2	Confident	87.2	Confident	110 Å²	110	62.9 Å²	62.9	42%	0.415	32%	0.316	S	S	.	.	H	α-helix	trans	-65.5	-44.4	178.7	175.9	61.7	-174.6	159.6	17.4	111.1	D1188 T1194 E1203	D1188-R1190 PolarHBondContact O-N 3.01Å; D1188-R1190 PolarHBondContact OD1-N 3.07Å; R1190-T1194 WeakPolarHBondContact O-CB 3.48Å; R1190-T1194 PolarHBondContact O-OG1 3.49Å; R1190-E1203 WeakPolarHBondContact CG-OE1 3.07Å; R1190-E1203 IonicContact CZ-OE1 3.89Å; R1190-E1203 IonicContact CZ-OE2 2.73Å; R1190-E1203 IonicContact NE-OE1 3.96Å; R1190-E1203 PolarHBondContact NE-OE1 3.26Å; R1190-E1203 IonicContact NE-OE2 3.32Å; R1190-E1203 IonicContact NH2-OE1 3.33Å; R1190-E1203 PolarHBondContact NH2-OE1 3.44Å; R1190-E1203 IonicContact NH2-OE2 3.06Å; R1190-E1203 PolarHBondContact NH2-OE2 3.35Å
1191	I	86	Confident	87.2	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-84.8	-41.1	178.8	-64	-178.9	0	0	0	111.3	D1188 T1206 Y1207	D1188-I1191 PolarHBondContact O-N 3.2Å; D1188-I1191 PolarHBondContact OD1-N 2.84Å; I1191-T1206 HydrophobicContact CD1-CG2 3.52Å; I1191-Y1207 HydrophobicContact CG2-CD2 3.86Å; I1191-Y1207 HydrophobicContact CG2-CG 4.44Å
1192	S	84.5	Confident	87	Confident	50 Å²	50	71.6 Å²	71.6	35%	0.35	36%	0.358	S	S	.	.	H	α-helix	trans	-79.8	-25.3	-171.6	61.3	0	0	0	0	115.7	T1186 D1188 T1189	T1186-S1192 PolarHBondContact O-OG 2.64Å; D1188-S1192 WeakPolarHBondContact O-CB 3.24Å; D1188-S1192 PolarHBondContact O-N 2.99Å; D1188-S1192 PolarHBondContact O-OG 3.25Å; T1189-S1192 WeakPolarHBondContact CA-OG 3.46Å
1193	K	85.7	Confident	87	Confident	168 Å²	168	68.1 Å²	68.1	73%	0.73	35%	0.345	S	S	*	.	S	Bend	trans	-109.8	-8.2	-177.8	-59.3	-172	178.9	-177.9	0	114.6	T1189	T1189-K1193 HydrophobicContact CG2-CD 4.34Å; T1189-K1193 WeakPolarHBondContact O-CB 3.37Å; T1189-K1193 PolarHBondContact O-N 2.96Å; T1189-K1193 VanDerWaalsContact O-N 3.1Å
1194	T	87	Confident	87.1	Confident	35 Å²	35	67.9 Å²	67.9	22%	0.215	34%	0.342	C	S	.	.	S	Bend	trans	-86.9	133.1	177.5	-55.9	0	0	0	0	109.7	R1190 Y1196 A1198 L1199	R1190-T1194 WeakPolarHBondContact O-CB 3.48Å; R1190-T1194 PolarHBondContact O-OG1 3.49Å; T1194-Y1196 PolarHBondContact O-N 2.94Å; T1194-A1198 HydrophobicContact CG2-CB 3.79Å; T1194-L1199 HydrophobicContact CG2-CD2 3.87Å
1195	P	88.2	Confident	87.2	Confident	97 Å²	97	73 Å²	73	63%	0.63	37%	0.366	S	S	*	.			trans	-57.1	138.1	173.4	-24.7	34.5	0	0	0	111.6	H1197 A1198	P1195-H1197 VanDerWaalsContact C-N 3.25Å; P1195-H1197 PolarHBondContact O-N 3.37Å; P1195-H1197 VanDerWaalsContact O-N 3.08Å; P1195-A1198 WeakPolarHBondContact O-CB 3.43Å; P1195-A1198 PolarHBondContact O-N 3.15Å
1196	Y	86.4	Confident	87.1	Confident	83 Å²	83	73.4 Å²	73.4	33%	0.325	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-50.5	-40.2	-172.3	-174.1	-101.8	0	0	0	114.4	T1194 A1198 L1199 K1204 Y1207 N1208	T1194-Y1196 PolarHBondContact O-N 2.94Å; Y1196-A1198 PolarHBondContact O-N 3.42Å; Y1196-L1199 HydrophobicContact CD2-CD1 4.18Å; Y1196-L1199 WeakPolarHBondContact O-CB 3.34Å; Y1196-L1199 PolarHBondContact O-N 3.14Å; Y1196-K1204 HydrophobicContact CE1-CD 4.5Å; Y1196-K1204 HydrophobicContact CE1-CG 4.44Å; Y1196-K1204 HydrophobicContact CE2-CB 4.27Å; Y1196-K1204 HydrophobicContact CE2-CG 4.11Å; Y1196-Y1207 AromaticContact CD2-CD1 3.61Å; Y1196-Y1207 HydrophobicContact CD2-CD1 3.61Å; Y1196-Y1207 AromaticContact CD2-CE1 3.79Å; Y1196-Y1207 HydrophobicContact CD2-CE1 3.79Å; Y1196-Y1207 HydrophobicContact CD2-CG 4.11Å; Y1196-Y1207 AromaticContact CE2-CD1 3.48Å; Y1196-Y1207 HydrophobicContact CE2-CD1 3.48Å; Y1196-Y1207 VanDerWaalsContact CE2-CD1 3.48Å; Y1196-Y1207 AromaticContact CE2-CE1 3.97Å; Y1196-Y1207 HydrophobicContact CE2-CE1 3.97Å; Y1196-Y1207 HydrophobicContact CE2-CG 4.15Å; Y1196-N1208 WeakPolarHBondContact CE2-OD1 3.28Å; Y1196-N1208 PolarHBondContact OH-ND2 2.73Å; Y1196-N1208 PolarHBondContact OH-OD1 2.91Å
1197	H	89.2	Confident	87.3	Confident	175 Å²	175	74.6 Å²	74.6	81%	0.81	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-68.3	-13.1	179	-52.6	-67.3	0	0	0	114.6	P1195	P1195-H1197 VanDerWaalsContact C-N 3.25Å; P1195-H1197 PolarHBondContact O-N 3.37Å; P1195-H1197 VanDerWaalsContact O-N 3.08Å
1198	A	88.3	Confident	87.6	Confident	58 Å²	58	71 Å²	71	48%	0.479	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-101.2	2.8	177.7	0	0	0	0	0	113.8	T1194 P1195 Y1196	T1194-A1198 HydrophobicContact CG2-CB 3.79Å; P1195-A1198 WeakPolarHBondContact O-CB 3.43Å; P1195-A1198 PolarHBondContact O-N 3.15Å; Y1196-A1198 PolarHBondContact O-N 3.42Å
1199	L	87.6	Confident	87.8	Confident	8 Å²	8	70.4 Å²	70.4	4%	0.042	36%	0.355	C	S	.	.	S	Bend	trans	-80	146.8	169.6	-61.4	-179.9	0	0	0	110.6	T1194 Y1196 E1203 K1204 Y1207	T1194-L1199 HydrophobicContact CG2-CD2 3.87Å; Y1196-L1199 HydrophobicContact CD2-CD1 4.18Å; Y1196-L1199 WeakPolarHBondContact O-CB 3.34Å; Y1196-L1199 PolarHBondContact O-N 3.14Å; L1199-E1203 WeakPolarHBondContact CA-OE2 3.39Å; L1199-E1203 HydrophobicContact CB-CB 3.82Å; L1199-E1203 HydrophobicContact CD2-CB 4.13Å; L1199-E1203 HydrophobicContact CG-CB 4.4Å; L1199-K1204 HydrophobicContact CB-CG 3.78Å; L1199-K1204 VanDerWaalsContact O-CE 3.27Å; L1199-K1204 WeakPolarHBondContact O-CE 3.41Å; L1199-Y1207 HydrophobicContact CD1-CD2 4.35Å; L1199-Y1207 HydrophobicContact CD1-CG 4.32Å
1200	N	88.1	Confident	88.1	Confident	38 Å²	38	67 Å²	67	20%	0.203	33%	0.333	C	S	.	.			trans	-74.7	173.9	166.6	72.5	53.1	0	0	0	111.5	M704 I1202 E1203 K1204	M704-N1200 HydrophobicContact CE-CB 4.48Å; M704-N1200 WeakPolarHBondContact CE-ND2 3.48Å; N1200-I1202 PolarHBondContact OD1-N 3.1Å; N1200-E1203 PolarHBondContact N-OE2 3.08Å; N1200-E1203 WeakPolarHBondContact ND2-CG 3.15Å; N1200-E1203 PolarHBondContact ND2-OE2 3.48Å; N1200-E1203 VanDerWaalsContact ND2-OE2 3.11Å; N1200-E1203 WeakPolarHBondContact O-CB 3.36Å; N1200-E1203 PolarHBondContact O-N 3.35Å; N1200-E1203 WeakPolarHBondContact OD1-CG 3.49Å; N1200-E1203 PolarHBondContact OD1-N 3.24Å; N1200-K1204 WeakPolarHBondContact O-CG 3.28Å; N1200-K1204 PolarHBondContact O-N 3.1Å
1201	E	87	Confident	88.3	Confident	147 Å²	147	65.3 Å²	65.3	69%	0.687	33%	0.33	S	S	*	.	H	α-helix	trans	-61.5	-51	-174.5	-73.9	160.8	172.1	0	0	112.5	E1203 K1204 E1205	E1201-E1203 VanDerWaalsContact C-N 3.27Å; E1201-E1203 PolarHBondContact O-N 3.48Å; E1201-K1204 CarbonylContact O-C 3.54Å; E1201-K1204 WeakPolarHBondContact O-CA 3.15Å; E1201-K1204 WeakPolarHBondContact O-CB 3.39Å; E1201-K1204 PolarHBondContact O-N 3.49Å; E1201-E1205 WeakPolarHBondContact O-CG 3.19Å; E1201-E1205 PolarHBondContact O-N 3.06Å
1202	I	85.1	Confident	88.6	Confident	61 Å²	61	69.7 Å²	69.7	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-57.6	-39.3	174.3	-56.9	166.7	0	0	0	111.6	N1200 E1205 T1206	N1200-I1202 PolarHBondContact OD1-N 3.1Å; I1202-E1205 WeakPolarHBondContact CA-OE2 3.17Å; I1202-T1206 WeakPolarHBondContact O-CB 3.48Å; I1202-T1206 PolarHBondContact O-N 2.68Å; I1202-T1206 PolarHBondContact O-OG1 2.9Å
1203	E	88.4	Confident	89	Confident	18 Å²	18	67.3 Å²	67.3	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-34.5	175.2	-75	173.6	157.6	0	0	112.6	R1190 L1199 N1200 E1201 Y1207	R1190-E1203 WeakPolarHBondContact CG-OE1 3.07Å; R1190-E1203 IonicContact CZ-OE1 3.89Å; R1190-E1203 IonicContact CZ-OE2 2.73Å; R1190-E1203 IonicContact NE-OE1 3.96Å; R1190-E1203 PolarHBondContact NE-OE1 3.26Å; R1190-E1203 IonicContact NE-OE2 3.32Å; R1190-E1203 IonicContact NH2-OE1 3.33Å; R1190-E1203 PolarHBondContact NH2-OE1 3.44Å; R1190-E1203 IonicContact NH2-OE2 3.06Å; R1190-E1203 PolarHBondContact NH2-OE2 3.35Å; L1199-E1203 WeakPolarHBondContact CA-OE2 3.39Å; L1199-E1203 HydrophobicContact CB-CB 3.82Å; L1199-E1203 HydrophobicContact CD2-CB 4.13Å; L1199-E1203 HydrophobicContact CG-CB 4.4Å; N1200-E1203 PolarHBondContact N-OE2 3.08Å; N1200-E1203 WeakPolarHBondContact ND2-CG 3.15Å; N1200-E1203 PolarHBondContact ND2-OE2 3.48Å; N1200-E1203 VanDerWaalsContact ND2-OE2 3.11Å; N1200-E1203 WeakPolarHBondContact O-CB 3.36Å; N1200-E1203 PolarHBondContact O-N 3.35Å; N1200-E1203 WeakPolarHBondContact OD1-CG 3.49Å; N1200-E1203 PolarHBondContact OD1-N 3.24Å; E1201-E1203 VanDerWaalsContact C-N 3.27Å; E1201-E1203 PolarHBondContact O-N 3.48Å; E1203-Y1207 WeakPolarHBondContact O-CB 3.47Å; E1203-Y1207 PolarHBondContact O-N 3.43Å
1204	K	89.1	Confident	89.3	Confident	61 Å²	61	60.4 Å²	60.4	27%	0.265	31%	0.305	S	S	.	.	H	α-helix	trans	-71.7	-42.3	174	-72.8	169.1	-178.9	165	0	111.4	Y1196 L1199 N1200 E1201 Y1207 N1208	Y1196-K1204 HydrophobicContact CE1-CD 4.5Å; Y1196-K1204 HydrophobicContact CE1-CG 4.44Å; Y1196-K1204 HydrophobicContact CE2-CB 4.27Å; Y1196-K1204 HydrophobicContact CE2-CG 4.11Å; L1199-K1204 HydrophobicContact CB-CG 3.78Å; L1199-K1204 VanDerWaalsContact O-CE 3.27Å; L1199-K1204 WeakPolarHBondContact O-CE 3.41Å; N1200-K1204 WeakPolarHBondContact O-CG 3.28Å; N1200-K1204 PolarHBondContact O-N 3.1Å; E1201-K1204 CarbonylContact O-C 3.54Å; E1201-K1204 WeakPolarHBondContact O-CA 3.15Å; E1201-K1204 WeakPolarHBondContact O-CB 3.39Å; E1201-K1204 PolarHBondContact O-N 3.49Å; K1204-Y1207 WeakPolarHBondContact O-CB 3.43Å; K1204-Y1207 PolarHBondContact O-N 3.27Å; K1204-N1208 VanDerWaalsContact O-CB 3.27Å; K1204-N1208 WeakPolarHBondContact O-CB 3.33Å; K1204-N1208 PolarHBondContact O-N 2.86Å; K1204-N1208 PolarHBondContact O-ND2 2.93Å; K1204-N1208 PolarHBondContact O-OD1 3.48Å
1205	E	87.6	Confident	89.5	Confident	114 Å²	114	61.4 Å²	61.4	53%	0.533	31%	0.311	S	S	.	.	H	α-helix	trans	-60.2	-48	174.2	-72.7	159	-176.1	0	0	110.5	E1201 I1202 Y1207 N1208 G1209	E1201-E1205 WeakPolarHBondContact O-CG 3.19Å; E1201-E1205 PolarHBondContact O-N 3.06Å; I1202-E1205 WeakPolarHBondContact CA-OE2 3.17Å; E1205-Y1207 VanDerWaalsContact C-N 3.35Å; E1205-Y1207 PolarHBondContact O-N 2.98Å; E1205-N1208 PolarHBondContact O-N 3.27Å; E1205-G1209 PolarHBondContact O-N 2.8Å
1206	T	89.1	Confident	89.8	Confident	19 Å²	19	58.8 Å²	58.8	12%	0.117	29%	0.289	C	S	.	.	H	α-helix	trans	-58	-45.8	173.8	-52.8	0	0	0	0	111.2	I1191 I1202 R1210	I1191-T1206 HydrophobicContact CD1-CG2 3.52Å; I1202-T1206 WeakPolarHBondContact O-CB 3.48Å; I1202-T1206 PolarHBondContact O-N 2.68Å; I1202-T1206 PolarHBondContact O-OG1 2.9Å; T1206-R1210 WeakPolarHBondContact O-CB 3.39Å; T1206-R1210 VanDerWaalsContact O-CG 3.25Å; T1206-R1210 WeakPolarHBondContact O-CG 3.49Å; T1206-R1210 PolarHBondContact O-N 3.34Å
1207	Y	90.3	Very high	90.1	Very high	82 Å²	82	54.8 Å²	54.8	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-61.2	-46	175.7	-180	-84.5	0	0	0	112.1	I1191 Y1196 L1199 E1203 K1204 E1205 R1210 M1211	I1191-Y1207 HydrophobicContact CG2-CD2 3.86Å; I1191-Y1207 HydrophobicContact CG2-CG 4.44Å; Y1196-Y1207 AromaticContact CD2-CD1 3.61Å; Y1196-Y1207 HydrophobicContact CD2-CD1 3.61Å; Y1196-Y1207 AromaticContact CD2-CE1 3.79Å; Y1196-Y1207 HydrophobicContact CD2-CE1 3.79Å; Y1196-Y1207 HydrophobicContact CD2-CG 4.11Å; Y1196-Y1207 AromaticContact CE2-CD1 3.48Å; Y1196-Y1207 HydrophobicContact CE2-CD1 3.48Å; Y1196-Y1207 VanDerWaalsContact CE2-CD1 3.48Å; Y1196-Y1207 AromaticContact CE2-CE1 3.97Å; Y1196-Y1207 HydrophobicContact CE2-CE1 3.97Å; Y1196-Y1207 HydrophobicContact CE2-CG 4.15Å; L1199-Y1207 HydrophobicContact CD1-CD2 4.35Å; L1199-Y1207 HydrophobicContact CD1-CG 4.32Å; E1203-Y1207 WeakPolarHBondContact O-CB 3.47Å; E1203-Y1207 PolarHBondContact O-N 3.43Å; K1204-Y1207 WeakPolarHBondContact O-CB 3.43Å; K1204-Y1207 PolarHBondContact O-N 3.27Å; E1205-Y1207 VanDerWaalsContact C-N 3.35Å; E1205-Y1207 PolarHBondContact O-N 2.98Å; Y1207-R1210 PolarHBondContact O-N 2.66Å; Y1207-M1211 HydrophobicContact CD1-CG 3.98Å; Y1207-M1211 HydrophobicContact CE1-CG 3.56Å; Y1207-M1211 HydrophobicContact CE2-CG 4.48Å; Y1207-M1211 WeakPolarHBondContact O-CB 3.25Å; Y1207-M1211 WeakPolarHBondContact O-CG 3.24Å; Y1207-M1211 PolarHBondContact O-N 3.13Å
1208	N	92.1	Very high	90.1	Very high	63 Å²	63	46.5 Å²	46.5	34%	0.337	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-47.8	-179.2	-69.4	-12.2	0	0	0	110.5	Y1196 K1204 E1205 M1211 Q1212	Y1196-N1208 WeakPolarHBondContact CE2-OD1 3.28Å; Y1196-N1208 PolarHBondContact OH-ND2 2.73Å; Y1196-N1208 PolarHBondContact OH-OD1 2.91Å; K1204-N1208 VanDerWaalsContact O-CB 3.27Å; K1204-N1208 WeakPolarHBondContact O-CB 3.33Å; K1204-N1208 PolarHBondContact O-N 2.86Å; K1204-N1208 PolarHBondContact O-ND2 2.93Å; K1204-N1208 PolarHBondContact O-OD1 3.48Å; E1205-N1208 PolarHBondContact O-N 3.27Å; N1208-M1211 CarbonylContact O-C 3.44Å; N1208-M1211 PolarHBondContact O-N 2.88Å; N1208-Q1212 WeakPolarHBondContact O-CG 3.49Å; N1208-Q1212 PolarHBondContact O-N 3.01Å
1209	G	90.5	Very high	90.2	Very high	7 Å²	7	46.3 Å²	46.3	7%	0.072	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-42.8	177.2	0	0	0	0	0	113.1	E1205 M1211 Q1212 I1213	E1205-G1209 PolarHBondContact O-N 2.8Å; G1209-M1211 VanDerWaalsContact C-N 3.31Å; G1209-M1211 PolarHBondContact O-N 3Å; G1209-Q1212 WeakPolarHBondContact O-CB 3.14Å; G1209-Q1212 PolarHBondContact O-N 3.43Å; G1209-I1213 PolarHBondContact O-N 2.88Å
1210	R	93	Very high	90.4	Very high	10 Å²	10	49.5 Å²	49.5	4%	0.038	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-40.2	172.1	-73.1	-179.9	-175.6	178.9	6.3	112.4	E1138 Y1185 D1188 T1206 Y1207 L1214	E1138-R1210 WeakPolarHBondContact OE1-CG 3.38Å; E1138-R1210 IonicContact OE1-CZ 2.71Å; E1138-R1210 IonicContact OE1-NE 3.71Å; E1138-R1210 PolarHBondContact OE1-NE 2.71Å; E1138-R1210 IonicContact OE1-NH2 3.98Å; E1138-R1210 IonicContact OE2-CZ 2.66Å; E1138-R1210 VanDerWaalsContact OE2-CZ 3.26Å; E1138-R1210 IonicContact OE2-NE 2.74Å; E1138-R1210 PolarHBondContact OE2-NE 3.21Å; E1138-R1210 VanDerWaalsContact OE2-NE 3.08Å; E1138-R1210 IonicContact OE2-NH2 3.44Å; E1138-R1210 PolarHBondContact OE2-NH2 2.96Å; Y1185-R1210 HydrophobicContact CD1-CG 4.26Å; Y1185-R1210 HydrophobicContact CD2-CB 3.71Å; Y1185-R1210 HydrophobicContact CD2-CG 3.9Å; Y1185-R1210 HydrophobicContact CE1-CG 4.05Å; Y1185-R1210 HydrophobicContact CE2-CB 3.5Å; Y1185-R1210 HydrophobicContact CE2-CG 3.65Å; Y1185-R1210 HydrophobicContact CG-CB 4.44Å; Y1185-R1210 HydrophobicContact CG-CG 4.21Å; D1188-R1210 IonicContact OD2-CZ 2.69Å; D1188-R1210 IonicContact OD2-NH1 2.67Å; D1188-R1210 PolarHBondContact OD2-NH1 3.36Å; D1188-R1210 VanDerWaalsContact OD2-NH1 3.16Å; D1188-R1210 IonicContact OD2-NH2 2.67Å; D1188-R1210 PolarHBondContact OD2-NH2 2.9Å; D1188-R1210 VanDerWaalsContact OD2-NH2 3.13Å; T1206-R1210 WeakPolarHBondContact O-CB 3.39Å; T1206-R1210 VanDerWaalsContact O-CG 3.25Å; T1206-R1210 WeakPolarHBondContact O-CG 3.49Å; T1206-R1210 PolarHBondContact O-N 3.34Å; Y1207-R1210 PolarHBondContact O-N 2.66Å; R1210-L1214 PolarHBondContact O-N 2.8Å
1211	M	90.7	Very high	90.3	Very high	74 Å²	74	48 Å²	48	37%	0.365	23%	0.23	S	C	.	.	H	α-helix	trans	-70.7	-33.9	176.4	-76.6	-54.7	-47.8	0	0	113.1	Y1207 N1208 G1209 L1214 T1215	Y1207-M1211 HydrophobicContact CD1-CG 3.98Å; Y1207-M1211 HydrophobicContact CE1-CG 3.56Å; Y1207-M1211 HydrophobicContact CE2-CG 4.48Å; Y1207-M1211 WeakPolarHBondContact O-CB 3.25Å; Y1207-M1211 WeakPolarHBondContact O-CG 3.24Å; Y1207-M1211 PolarHBondContact O-N 3.13Å; N1208-M1211 CarbonylContact O-C 3.44Å; N1208-M1211 PolarHBondContact O-N 2.88Å; G1209-M1211 VanDerWaalsContact C-N 3.31Å; G1209-M1211 PolarHBondContact O-N 3Å; M1211-L1214 HydrophobicContact SD-CD1 4.26Å; M1211-T1215 VanDerWaalsContact O-CB 3.29Å; M1211-T1215 WeakPolarHBondContact O-CB 3.4Å; M1211-T1215 PolarHBondContact O-N 3Å; M1211-T1215 PolarHBondContact O-OG1 3.2Å
1212	Q	92.6	Very high	90.2	Very high	95 Å²	95	41.5 Å²	41.5	44%	0.444	20%	0.199	S	C	.	.	H	α-helix	trans	-61.5	-48	171.9	-73.6	169.3	0.6	0	0	110.7	L1147 N1208 G1209 T1215 Y1216	L1147-Q1212 HydrophobicContact CD1-CB 4.45Å; N1208-Q1212 WeakPolarHBondContact O-CG 3.49Å; N1208-Q1212 PolarHBondContact O-N 3.01Å; G1209-Q1212 WeakPolarHBondContact O-CB 3.14Å; G1209-Q1212 PolarHBondContact O-N 3.43Å; Q1212-T1215 PolarHBondContact O-N 2.94Å; Q1212-Y1216 WeakPolarHBondContact O-CB 3.12Å; Q1212-Y1216 PolarHBondContact O-N 2.97Å
1213	I	93	Very high	90.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.3	-51.4	175.9	-68.4	167.4	0	0	0	111.1	C1133 I1143 L1147 I1150 G1209 T1215 Y1216 L1217	C1133-I1213 HydrophobicContact CB-CG2 4.33Å; I1143-I1213 HydrophobicContact CD1-CD1 3.71Å; I1143-I1213 HydrophobicContact CD1-CG1 3.93Å; L1147-I1213 HydrophobicContact CD2-CG1 3.75Å; L1147-I1213 HydrophobicContact CG-CG1 4.4Å; I1150-I1213 HydrophobicContact CD1-CD1 4.14Å; I1150-I1213 HydrophobicContact CD1-CG1 4.04Å; I1150-I1213 HydrophobicContact CD1-CG2 4.05Å; G1209-I1213 PolarHBondContact O-N 2.88Å; I1213-T1215 VanDerWaalsContact C-N 3.3Å; I1213-T1215 PolarHBondContact O-N 2.97Å; I1213-Y1216 PolarHBondContact O-N 3.19Å; I1213-L1217 HydrophobicContact CG2-CD1 3.96Å; I1213-L1217 HydrophobicContact CG2-CG 4.39Å; I1213-L1217 WeakPolarHBondContact O-CG 3.27Å; I1213-L1217 PolarHBondContact O-N 3.42Å
1214	L	92.4	Very high	89.9	Confident	23 Å²	23	43.7 Å²	43.7	12%	0.12	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-36.8	179.5	-76.3	173.3	0	0	0	113	I1178 T1181 Y1182 Y1185 R1210 M1211 A1218	I1178-L1214 HydrophobicContact CG2-CD2 4.2Å; T1181-L1214 WeakPolarHBondContact OG1-CD2 3.39Å; Y1182-L1214 HydrophobicContact CD2-CD1 4.46Å; Y1185-L1214 HydrophobicContact CD2-CD1 3.95Å; Y1185-L1214 HydrophobicContact CD2-CG 4.24Å; Y1185-L1214 HydrophobicContact CE2-CD1 4.3Å; Y1185-L1214 HydrophobicContact CE2-CG 4.11Å; R1210-L1214 PolarHBondContact O-N 2.8Å; M1211-L1214 HydrophobicContact SD-CD1 4.26Å; L1214-A1218 WeakPolarHBondContact O-CB 3.17Å; L1214-A1218 PolarHBondContact O-N 3.12Å; L1214-A1218 VanDerWaalsContact O-N 3.14Å
1215	T	92	Very high	89.4	Confident	57 Å²	57	41.1 Å²	41.1	35%	0.35	20%	0.197	S	C	.	.	H	α-helix	trans	-67.9	-49.1	177.7	-56.4	0	0	0	0	110.2	M1211 Q1212 I1213 L1217 A1218 D1219	M1211-T1215 VanDerWaalsContact O-CB 3.29Å; M1211-T1215 WeakPolarHBondContact O-CB 3.4Å; M1211-T1215 PolarHBondContact O-N 3Å; M1211-T1215 PolarHBondContact O-OG1 3.2Å; Q1212-T1215 PolarHBondContact O-N 2.94Å; I1213-T1215 VanDerWaalsContact C-N 3.3Å; I1213-T1215 PolarHBondContact O-N 2.97Å; T1215-L1217 PolarHBondContact O-N 3.48Å; T1215-A1218 PolarHBondContact O-N 3.44Å; T1215-A1218 VanDerWaalsContact O-N 3.1Å; T1215-D1219 PolarHBondContact O-N 3.13Å
1216	Y	93.8	Very high	88.8	Confident	41 Å²	41	42.3 Å²	42.3	16%	0.161	20%	0.197	C	C	.	.	H	α-helix	trans	-58.3	-45.6	178	179.9	-98.3	0	0	0	112.6	I1150 K1151 I1154 Q1212 I1213 A1218 D1219 R1220	I1150-Y1216 HydrophobicContact CG2-CD1 4.02Å; I1150-Y1216 HydrophobicContact CG2-CE1 4.03Å; K1151-Y1216 HydrophobicContact CG-CE1 4.16Å; K1151-Y1216 HydrophobicContact CG-CE2 4.27Å; K1151-Y1216 WeakPolarHBondContact CG-OH 3.49Å; I1154-Y1216 HydrophobicContact CD1-CE1 3.97Å; Q1212-Y1216 WeakPolarHBondContact O-CB 3.12Å; Q1212-Y1216 PolarHBondContact O-N 2.97Å; I1213-Y1216 PolarHBondContact O-N 3.19Å; Y1216-A1218 VanDerWaalsContact C-N 3.31Å; Y1216-A1218 PolarHBondContact O-N 2.94Å; Y1216-D1219 PolarHBondContact O-N 3.34Å; Y1216-R1220 HydrophobicContact CD1-CG 4.36Å; Y1216-R1220 HydrophobicContact CE1-CG 3.77Å; Y1216-R1220 HydrophobicContact CE2-CG 4.07Å; Y1216-R1220 WeakPolarHBondContact O-CG 3.44Å; Y1216-R1220 PolarHBondContact O-N 2.81Å; Y1216-R1220 WeakPolarHBondContact OH-CD 3.25Å; Y1216-R1220 PolarHBondContact OH-NE 3.39Å
1217	L	91.7	Very high	88.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-40.1	175.5	-68.7	173.8	0	0	0	111.9	L1129 I1150 I1154 F1162 V1177 I1178 T1181 I1213 T1215 L1221	L1129-L1217 HydrophobicContact CD2-CD2 4.49Å; I1150-L1217 HydrophobicContact CG2-CD2 4.25Å; I1154-L1217 HydrophobicContact CD1-CD2 3.7Å; F1162-L1217 HydrophobicContact CE1-CB 4.28Å; F1162-L1217 HydrophobicContact CE1-CD2 4.22Å; F1162-L1217 WeakPolarHBondContact CE1-O 3.37Å; F1162-L1217 HydrophobicContact CZ-CD2 4.08Å; V1177-L1217 HydrophobicContact CG1-CD1 4.18Å; I1178-L1217 HydrophobicContact CD1-CB 4.05Å; I1178-L1217 HydrophobicContact CG1-CB 3.82Å; I1178-L1217 HydrophobicContact CG1-CD1 4.49Å; T1181-L1217 HydrophobicContact CG2-CD1 4.41Å; I1213-L1217 HydrophobicContact CG2-CD1 3.96Å; I1213-L1217 HydrophobicContact CG2-CG 4.39Å; I1213-L1217 WeakPolarHBondContact O-CG 3.27Å; I1213-L1217 PolarHBondContact O-N 3.42Å; T1215-L1217 PolarHBondContact O-N 3.48Å; L1217-L1221 WeakPolarHBondContact O-CB 3.31Å; L1217-L1221 PolarHBondContact O-N 3.26Å
1218	A	90.4	Very high	87.2	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-70.1	-33.7	177.7	0	0	0	0	0	112.8	I1178 L1214 T1215 Y1216 R1222	I1178-A1218 HydrophobicContact CD1-CB 4.3Å; L1214-A1218 WeakPolarHBondContact O-CB 3.17Å; L1214-A1218 PolarHBondContact O-N 3.12Å; L1214-A1218 VanDerWaalsContact O-N 3.14Å; T1215-A1218 PolarHBondContact O-N 3.44Å; T1215-A1218 VanDerWaalsContact O-N 3.1Å; Y1216-A1218 VanDerWaalsContact C-N 3.31Å; Y1216-A1218 PolarHBondContact O-N 2.94Å; A1218-R1222 VanDerWaalsContact C-CZ 3.49Å; A1218-R1222 WeakPolarHBondContact O-CG 3.43Å; A1218-R1222 VanDerWaalsContact O-CZ 3.25Å; A1218-R1222 PolarHBondContact O-N 3.03Å; A1218-R1222 VanDerWaalsContact O-N 3.12Å; A1218-R1222 PolarHBondContact O-NE 3.21Å; A1218-R1222 PolarHBondContact O-NH1 3.45Å
1219	D	90.4	Very high	86	Confident	54 Å²	54	41.7 Å²	41.7	29%	0.289	20%	0.2	S	C	.	.	H	α-helix	trans	-65.1	-48.4	171.8	-77.8	-51.9	0	0	0	111.5	T1215 Y1216 L1221 R1222 E1223	T1215-D1219 PolarHBondContact O-N 3.13Å; Y1216-D1219 PolarHBondContact O-N 3.34Å; D1219-L1221 VanDerWaalsContact C-N 3.35Å; D1219-L1221 PolarHBondContact O-N 3.35Å; D1219-R1222 WeakPolarHBondContact O-CB 3.39Å; D1219-R1222 PolarHBondContact O-N 2.98Å; D1219-R1222 VanDerWaalsContact O-N 3.1Å; D1219-R1222 IonicContact OD1-CZ 3.82Å; D1219-R1222 IonicContact OD1-NE 2.85Å; D1219-R1222 PolarHBondContact OD1-NE 3.32Å; D1219-R1222 IonicContact OD1-NH2 3.02Å; D1219-R1222 PolarHBondContact OD1-NH2 3.33Å; D1219-R1222 IonicContact OD2-NH2 3.77Å; D1219-R1222 PolarHBondContact OD2-NH2 3.09Å; D1219-E1223 WeakPolarHBondContact O-CG 3.44Å; D1219-E1223 PolarHBondContact O-N 3.44Å
1220	R	90.7	Very high	84.9	Confident	75 Å²	75	48.3 Å²	48.3	28%	0.283	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-39.2	177.7	-65	-66.6	138.8	-176.6	-1.3	112.6	F1162 Y1216 R1222 E1223 F1224	F1162-R1220 HydrophobicContact CE2-CB 4.18Å; F1162-R1220 HydrophobicContact CZ-CB 3.9Å; Y1216-R1220 HydrophobicContact CD1-CG 4.36Å; Y1216-R1220 HydrophobicContact CE1-CG 3.77Å; Y1216-R1220 HydrophobicContact CE2-CG 4.07Å; Y1216-R1220 WeakPolarHBondContact O-CG 3.44Å; Y1216-R1220 PolarHBondContact O-N 2.81Å; Y1216-R1220 WeakPolarHBondContact OH-CD 3.25Å; Y1216-R1220 PolarHBondContact OH-NE 3.39Å; R1220-R1222 VanDerWaalsContact C-N 3.33Å; R1220-R1222 PolarHBondContact O-N 3.36Å; R1220-E1223 WeakPolarHBondContact CD-OE2 3.41Å; R1220-E1223 IonicContact CZ-OE1 3.13Å; R1220-E1223 VanDerWaalsContact CZ-OE1 3.26Å; R1220-E1223 IonicContact CZ-OE2 2.67Å; R1220-E1223 IonicContact NE-OE1 2.61Å; R1220-E1223 IonicContact NE-OE2 2.7Å; R1220-E1223 PolarHBondContact NE-OE2 3.15Å; R1220-E1223 IonicContact NH1-OE1 3.12Å; R1220-E1223 PolarHBondContact NH1-OE1 2.78Å; R1220-E1223 IonicContact NH1-OE2 3.15Å; R1220-E1223 PolarHBondContact NH1-OE2 3.34Å; R1220-E1223 IonicContact NH2-OE1 3.14Å; R1220-E1223 PolarHBondContact NH2-OE1 2.73Å; R1220-E1223 IonicContact NH2-OE2 3.69Å; R1220-E1223 PolarHBondContact O-N 3.46Å; R1220-F1224 HydrophobicContact CB-CE2 4.44Å; R1220-F1224 WeakPolarHBondContact O-CD2 3.29Å; R1220-F1224 WeakPolarHBondContact O-CG 3.36Å; R1220-F1224 PolarHBondContact O-N 2.93Å
1221	L	87.1	Confident	83.5	Confident	7 Å²	7	51.6 Å²	51.6	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-36.9	173.8	-178.7	59.8	0	0	0	112.6	F1162 I1178 L1217 D1219 A1225 Y1279 F1281	F1162-L1221 HydrophobicContact CB-CD1 3.9Å; F1162-L1221 HydrophobicContact CD1-CB 3.93Å; F1162-L1221 HydrophobicContact CD1-CD1 4Å; F1162-L1221 HydrophobicContact CD1-CD2 4.49Å; F1162-L1221 HydrophobicContact CD1-CG 4.36Å; F1162-L1221 HydrophobicContact CE1-CB 3.97Å; F1162-L1221 HydrophobicContact CG-CD1 4.03Å; I1178-L1221 HydrophobicContact CD1-CB 4.1Å; I1178-L1221 HydrophobicContact CD1-CD2 3.68Å; L1217-L1221 WeakPolarHBondContact O-CB 3.31Å; L1217-L1221 PolarHBondContact O-N 3.26Å; D1219-L1221 VanDerWaalsContact C-N 3.35Å; D1219-L1221 PolarHBondContact O-N 3.35Å; L1221-A1225 WeakPolarHBondContact O-CB 3.31Å; L1221-A1225 PolarHBondContact O-N 2.84Å; L1221-A1225 VanDerWaalsContact O-N 3.09Å; L1221-Y1279 HydrophobicContact CD1-CE1 4.44Å; L1221-F1281 HydrophobicContact CD2-CD1 4.33Å; L1221-F1281 HydrophobicContact CD2-CD2 3.74Å; L1221-F1281 HydrophobicContact CD2-CE1 4.48Å; L1221-F1281 HydrophobicContact CD2-CE2 3.92Å; L1221-F1281 HydrophobicContact CD2-CG 3.96Å; L1221-F1281 HydrophobicContact CD2-CZ 4.29Å; L1221-F1281 HydrophobicContact CG-CD2 4.27Å; L1221-F1281 HydrophobicContact CG-CE1 4.25Å; L1221-F1281 HydrophobicContact CG-CE2 3.94Å; L1221-F1281 HydrophobicContact CG-CZ 3.93Å
1222	R	85.3	Confident	81.9	Confident	10 Å²	10	51 Å²	51	4%	0.038	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-48.7	173.6	-79.4	-178.8	-80.6	-79.7	4.8	111.7	A1218 D1219 R1220 F1224 A1225 Y1226 Y1283 E1284	A1218-R1222 VanDerWaalsContact C-CZ 3.49Å; A1218-R1222 WeakPolarHBondContact O-CG 3.43Å; A1218-R1222 VanDerWaalsContact O-CZ 3.25Å; A1218-R1222 PolarHBondContact O-N 3.03Å; A1218-R1222 VanDerWaalsContact O-N 3.12Å; A1218-R1222 PolarHBondContact O-NE 3.21Å; A1218-R1222 PolarHBondContact O-NH1 3.45Å; D1219-R1222 WeakPolarHBondContact O-CB 3.39Å; D1219-R1222 PolarHBondContact O-N 2.98Å; D1219-R1222 VanDerWaalsContact O-N 3.1Å; D1219-R1222 IonicContact OD1-CZ 3.82Å; D1219-R1222 IonicContact OD1-NE 2.85Å; D1219-R1222 PolarHBondContact OD1-NE 3.32Å; D1219-R1222 IonicContact OD1-NH2 3.02Å; D1219-R1222 PolarHBondContact OD1-NH2 3.33Å; D1219-R1222 IonicContact OD2-NH2 3.77Å; D1219-R1222 PolarHBondContact OD2-NH2 3.09Å; R1220-R1222 VanDerWaalsContact C-N 3.33Å; R1220-R1222 PolarHBondContact O-N 3.36Å; R1222-F1224 VanDerWaalsContact C-N 3.34Å; R1222-F1224 PolarHBondContact O-N 2.89Å; R1222-A1225 PolarHBondContact O-N 2.7Å; R1222-Y1226 PolarHBondContact O-N 3.19Å; R1222-Y1283 VanDerWaalsContact CD-O 3.25Å; R1222-Y1283 WeakPolarHBondContact CD-O 3.11Å; R1222-Y1283 HydrophobicContact CG-CD2 4.21Å; R1222-Y1283 HydrophobicContact CG-CE1 4.45Å; R1222-Y1283 HydrophobicContact CG-CE2 3.94Å; R1222-Y1283 PolarHBondContact NH1-O 3.06Å; R1222-E1284 VanDerWaalsContact NH1-C 3.3Å; R1222-E1284 PolarHBondContact NH1-O 2.8Å
1223	E	83.9	Confident	79.9	Confident	85 Å²	85	49.8 Å²	49.8	40%	0.397	24%	0.243	S	C	.	.	H	α-helix	trans	-57.7	-46.4	179.2	-70.1	171.7	-175.1	0	0	111.4	D1219 R1220 Y1226 S1227	D1219-E1223 WeakPolarHBondContact O-CG 3.44Å; D1219-E1223 PolarHBondContact O-N 3.44Å; R1220-E1223 WeakPolarHBondContact CD-OE2 3.41Å; R1220-E1223 IonicContact CZ-OE1 3.13Å; R1220-E1223 VanDerWaalsContact CZ-OE1 3.26Å; R1220-E1223 IonicContact CZ-OE2 2.67Å; R1220-E1223 IonicContact NE-OE1 2.61Å; R1220-E1223 IonicContact NE-OE2 2.7Å; R1220-E1223 PolarHBondContact NE-OE2 3.15Å; R1220-E1223 IonicContact NH1-OE1 3.12Å; R1220-E1223 PolarHBondContact NH1-OE1 2.78Å; R1220-E1223 IonicContact NH1-OE2 3.15Å; R1220-E1223 PolarHBondContact NH1-OE2 3.34Å; R1220-E1223 IonicContact NH2-OE1 3.14Å; R1220-E1223 PolarHBondContact NH2-OE1 2.73Å; R1220-E1223 IonicContact NH2-OE2 3.69Å; R1220-E1223 PolarHBondContact O-N 3.46Å; E1223-Y1226 PolarHBondContact O-N 3.46Å; E1223-S1227 PolarHBondContact O-N 2.81Å
1224	F	83	Confident	77.6	Confident	40 Å²	40	52.9 Å²	52.9	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-43.3	177.8	-72.8	-46.3	0	0	0	113	I1154 I1159 F1162 R1220 R1222 Y1226 S1227 I1228	I1154-F1224 HydrophobicContact CG2-CE2 3.83Å; I1154-F1224 HydrophobicContact CG2-CZ 4.08Å; I1159-F1224 HydrophobicContact CB-CD1 4.42Å; I1159-F1224 HydrophobicContact CB-CG 4.45Å; I1159-F1224 HydrophobicContact CD1-CD1 4.33Å; I1159-F1224 HydrophobicContact CG1-CB 4.04Å; I1159-F1224 HydrophobicContact CG1-CD1 3.36Å; I1159-F1224 HydrophobicContact CG1-CE1 3.88Å; I1159-F1224 HydrophobicContact CG1-CG 3.76Å; I1159-F1224 HydrophobicContact CG2-CB 4.49Å; F1162-F1224 AromaticContact CD2-CD2 3.89Å; F1162-F1224 HydrophobicContact CD2-CD2 3.89Å; F1162-F1224 HydrophobicContact CD2-CE2 4.01Å; F1162-F1224 AromaticContact CE2-CD2 3.94Å; F1162-F1224 HydrophobicContact CE2-CD2 3.94Å; F1162-F1224 AromaticContact CE2-CE2 3.78Å; F1162-F1224 HydrophobicContact CE2-CE2 3.78Å; R1220-F1224 HydrophobicContact CB-CE2 4.44Å; R1220-F1224 WeakPolarHBondContact O-CD2 3.29Å; R1220-F1224 WeakPolarHBondContact O-CG 3.36Å; R1220-F1224 PolarHBondContact O-N 2.93Å; R1222-F1224 VanDerWaalsContact C-N 3.34Å; R1222-F1224 PolarHBondContact O-N 2.89Å; F1224-Y1226 VanDerWaalsContact C-N 3.33Å; F1224-Y1226 PolarHBondContact O-N 3.41Å; F1224-S1227 PolarHBondContact O-N 3.43Å; F1224-S1227 PolarHBondContact O-OG 3.37Å; F1224-I1228 PolarHBondContact O-N 3.33Å; F1224-I1228 VanDerWaalsContact O-N 3.15Å
1225	A	77.7	Confident	75.4	Confident	6 Å²	6	55.1 Å²	55.1	5%	0.05	27%	0.274	C	S	.	.	H	α-helix	trans	-60.1	-43.6	175.4	0	0	0	0	0	111.8	L1221 R1222 I1228 E1229 Y1279 F1281	L1221-A1225 WeakPolarHBondContact O-CB 3.31Å; L1221-A1225 PolarHBondContact O-N 2.84Å; L1221-A1225 VanDerWaalsContact O-N 3.09Å; R1222-A1225 PolarHBondContact O-N 2.7Å; A1225-I1228 PolarHBondContact O-N 3.08Å; A1225-E1229 PolarHBondContact O-N 2.74Å; A1225-E1229 VanDerWaalsContact O-N 3.08Å; A1225-Y1279 HydrophobicContact CB-CD1 4.19Å; A1225-Y1279 HydrophobicContact CB-CD2 4.18Å; A1225-Y1279 HydrophobicContact CB-CE1 4.06Å; A1225-Y1279 HydrophobicContact CB-CE2 4.06Å; A1225-Y1279 HydrophobicContact CB-CG 4.24Å; A1225-F1281 HydrophobicContact CB-CE1 4.04Å; A1225-F1281 HydrophobicContact CB-CZ 4.02Å
1226	Y	75.8	Confident	72.9	Confident	139 Å²	139	55.6 Å²	55.6	55%	0.545	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-40.5	176.4	-173.4	-101.3	0	0	0	112.6	R1222 E1223 F1224 I1228 E1229 Y1230	R1222-Y1226 PolarHBondContact O-N 3.19Å; E1223-Y1226 PolarHBondContact O-N 3.46Å; F1224-Y1226 VanDerWaalsContact C-N 3.33Å; F1224-Y1226 PolarHBondContact O-N 3.41Å; Y1226-I1228 VanDerWaalsContact C-N 3.3Å; Y1226-I1228 PolarHBondContact O-N 3.36Å; Y1226-E1229 PolarHBondContact O-N 3.44Å; Y1226-Y1230 PolarHBondContact O-N 3.44Å
1227	S	75.3	Confident	70.1	Confident	49 Å²	49	59.7 Å²	59.7	34%	0.343	30%	0.297	S	S	.	.	H	α-helix	trans	-61.9	-37.4	177.8	74.1	0	0	0	0	112.6	E1223 F1224 T1231	E1223-S1227 PolarHBondContact O-N 2.81Å; F1224-S1227 PolarHBondContact O-N 3.43Å; F1224-S1227 PolarHBondContact O-OG 3.37Å; S1227-T1231 WeakPolarHBondContact O-CG2 3.34Å; S1227-T1231 PolarHBondContact O-N 3.27Å
1228	I	70.9	Confident	67.5	Low	34 Å²	34	66.5 Å²	66.5	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-71.1	-46.7	176.9	-76.3	166.3	0	0	0	110.6	I1159 F1224 A1225 Y1226 Y1230 T1231 T1232 Y1279	I1159-I1228 HydrophobicContact CD1-CD1 3.86Å; I1159-I1228 HydrophobicContact CD1-CG1 4.16Å; I1159-I1228 HydrophobicContact CG2-CD1 3.88Å; F1224-I1228 PolarHBondContact O-N 3.33Å; F1224-I1228 VanDerWaalsContact O-N 3.15Å; A1225-I1228 PolarHBondContact O-N 3.08Å; Y1226-I1228 VanDerWaalsContact C-N 3.3Å; Y1226-I1228 PolarHBondContact O-N 3.36Å; I1228-Y1230 VanDerWaalsContact C-N 3.26Å; I1228-Y1230 PolarHBondContact O-N 2.89Å; I1228-T1231 PolarHBondContact O-N 2.71Å; I1228-T1231 PolarHBondContact O-OG1 3.4Å; I1228-T1232 PolarHBondContact O-N 3.45Å; I1228-T1232 PolarHBondContact O-OG1 3.04Å; I1228-Y1279 HydrophobicContact CB-CE2 4.43Å; I1228-Y1279 HydrophobicContact CD1-CE2 4.36Å; I1228-Y1279 WeakPolarHBondContact CD1-OH 3.18Å; I1228-Y1279 HydrophobicContact CG2-CE2 4.39Å
1229	E	66.6	Low	65.1	Low	69 Å²	69	70.6 Å²	70.6	32%	0.322	35%	0.35	S	S	.	.	H	α-helix	trans	-53.1	-44.9	176	-74	-175.3	-177	0	0	111.4	A1225 Y1226 T1231 T1232 D1233	A1225-E1229 PolarHBondContact O-N 2.74Å; A1225-E1229 VanDerWaalsContact O-N 3.08Å; Y1226-E1229 PolarHBondContact O-N 3.44Å; E1229-T1231 PolarHBondContact O-N 3.29Å; E1229-T1232 WeakPolarHBondContact CA-OG1 3.24Å; E1229-T1232 PolarHBondContact O-N 3.12Å; E1229-T1232 PolarHBondContact O-OG1 3.34Å; E1229-D1233 PolarHBondContact O-N 3.28Å
1230	Y	66	Low	62.5	Low	145 Å²	145	71.6 Å²	71.6	57%	0.569	36%	0.355	S	S	*	.	H	α-helix	trans	-62.2	-40.1	177.1	-172	-99.6	0	0	0	113.4	Y1226 I1228 N1234	Y1226-Y1230 PolarHBondContact O-N 3.44Å; I1228-Y1230 VanDerWaalsContact C-N 3.26Å; I1228-Y1230 PolarHBondContact O-N 2.89Å; Y1230-N1234 WeakPolarHBondContact CD1-ND2 3.48Å; Y1230-N1234 WeakPolarHBondContact CE1-ND2 3.47Å; Y1230-N1234 PolarHBondContact O-N 3.41Å; Y1230-N1234 PolarHBondContact O-ND2 3.45Å
1231	T	63.6	Low	59.8	Low	80 Å²	80	76.1 Å²	76.1	49%	0.491	38%	0.378	S	S	.	.	H	α-helix	trans	-70.1	-32.8	175.9	58.6	0	0	0	0	113.2	S1227 I1228 E1229 T1235	S1227-T1231 WeakPolarHBondContact O-CG2 3.34Å; S1227-T1231 PolarHBondContact O-N 3.27Å; I1228-T1231 PolarHBondContact O-N 2.71Å; I1228-T1231 PolarHBondContact O-OG1 3.4Å; E1229-T1231 PolarHBondContact O-N 3.29Å; T1231-T1235 PolarHBondContact O-N 3.02Å; T1231-T1235 PolarHBondContact O-OG1 3.3Å
1232	T	56.8	Low	57.4	Low	60 Å²	60	81.8 Å²	81.8	37%	0.368	41%	0.408	S	S	.	.	H	α-helix	trans	-72.1	-37.7	175.8	45	0	0	0	0	112.7	I1228 E1229 T1235 T1236	I1228-T1232 PolarHBondContact O-N 3.45Å; I1228-T1232 PolarHBondContact O-OG1 3.04Å; E1229-T1232 WeakPolarHBondContact CA-OG1 3.24Å; E1229-T1232 PolarHBondContact O-N 3.12Å; E1229-T1232 PolarHBondContact O-OG1 3.34Å; T1232-T1235 WeakPolarHBondContact CA-OG1 3.48Å; T1232-T1235 PolarHBondContact O-OG1 3.09Å; T1232-T1236 VanDerWaalsContact O-CB 3.29Å; T1232-T1236 WeakPolarHBondContact O-CB 3.29Å; T1232-T1236 PolarHBondContact O-N 3.5Å; T1232-T1236 PolarHBondContact O-OG1 3.27Å
1233	D	51.9	Low	55	Low	70 Å²	70	88.9 Å²	88.9	37%	0.374	44%	0.435	S	S	.	.	H	α-helix	trans	-66	-45.9	178.5	-77	-9	0	0	0	110.6	E1229 T1235 T1236 E1237 R1301	E1229-D1233 PolarHBondContact O-N 3.28Å; D1233-T1235 PolarHBondContact O-N 2.84Å; D1233-T1236 PolarHBondContact O-N 3.3Å; D1233-E1237 PolarHBondContact O-N 3.36Å; D1233-R1301 IonicContact OD2-NH1 3.96Å
1234	N	45	Very low	52.6	Low	66 Å²	66	89.6 Å²	89.6	35%	0.353	44%	0.441	S	S	.	.	H	α-helix	trans	-61.4	-40.4	177.5	-76	-64.7	0	0	0	114	Y1230 Q1238	Y1230-N1234 WeakPolarHBondContact CD1-ND2 3.48Å; Y1230-N1234 WeakPolarHBondContact CE1-ND2 3.47Å; Y1230-N1234 PolarHBondContact O-N 3.41Å; Y1230-N1234 PolarHBondContact O-ND2 3.45Å; N1234-Q1238 PolarHBondContact O-N 2.89Å
1235	T	45.6	Very low	50.3	Low	70 Å²	70	96.5 Å²	96.5	43%	0.429	47%	0.474	S	S	.	.	H	α-helix	trans	-72.5	-32.8	177	45.7	0	0	0	0	111.8	T1231 T1232 D1233 Q1238 I1239	T1231-T1235 PolarHBondContact O-N 3.02Å; T1231-T1235 PolarHBondContact O-OG1 3.3Å; T1232-T1235 WeakPolarHBondContact CA-OG1 3.48Å; T1232-T1235 PolarHBondContact O-OG1 3.09Å; D1233-T1235 PolarHBondContact O-N 2.84Å; T1235-Q1238 PolarHBondContact O-N 3.02Å; T1235-I1239 WeakPolarHBondContact O-CB 3.47Å; T1235-I1239 WeakPolarHBondContact O-CD1 3.46Å; T1235-I1239 VanDerWaalsContact O-CG1 3.24Å; T1235-I1239 WeakPolarHBondContact O-CG1 3.49Å; T1235-I1239 PolarHBondContact O-N 3.07Å
1236	T	39.2	Very low	48.3	Very low	67 Å²	67	103.2 Å²	103.2	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-70.8	-33.8	176.2	-52.6	0	0	0	0	111.9	T1232 D1233 N1240	T1232-T1236 VanDerWaalsContact O-CB 3.29Å; T1232-T1236 WeakPolarHBondContact O-CB 3.29Å; T1232-T1236 PolarHBondContact O-N 3.5Å; T1232-T1236 PolarHBondContact O-OG1 3.27Å; D1233-T1236 PolarHBondContact O-N 3.3Å; T1236-N1240 VanDerWaalsContact O-CB 3.27Å; T1236-N1240 WeakPolarHBondContact O-CB 3.42Å; T1236-N1240 PolarHBondContact O-N 2.73Å; T1236-N1240 PolarHBondContact O-ND2 2.85Å; T1236-N1240 VanDerWaalsContact O-ND2 3.09Å
1237	E	34.2	Very low	46.2	Very low	126 Å²	126	103.9 Å²	103.9	59%	0.589	51%	0.514	S	S	*	.	H	α-helix	trans	-65.2	-43.7	172	-72.5	-169.8	164.7	0	0	112.2	D1233 N1240 F1241	D1233-E1237 PolarHBondContact O-N 3.36Å; E1237-N1240 PolarHBondContact O-N 2.78Å; E1237-F1241 PolarHBondContact O-N 2.9Å
1238	Q	38.5	Very low	44.1	Very low	143 Å²	143	108.9 Å²	108.9	67%	0.668	54%	0.537	S	S	*	.	H	α-helix	trans	-62.7	-43.7	175.2	-70.3	-180	-9.1	0	0	112.4	N1234 T1235 N1240 F1241	N1234-Q1238 PolarHBondContact O-N 2.89Å; T1235-Q1238 PolarHBondContact O-N 3.02Å; Q1238-N1240 VanDerWaalsContact C-N 3.27Å; Q1238-N1240 PolarHBondContact O-N 3.17Å; Q1238-F1241 PolarHBondContact O-N 3.01Å
1239	I	38.7	Very low	42.3	Very low	88 Å²	88	116.1 Å²	116.1	45%	0.451	57%	0.567	S	S	.	*	H	α-helix	trans	-69.2	-23.8	178.4	-66.3	164.3	0	0	0	112.4	T1235 R1243	T1235-I1239 WeakPolarHBondContact O-CB 3.47Å; T1235-I1239 WeakPolarHBondContact O-CD1 3.46Å; T1235-I1239 VanDerWaalsContact O-CG1 3.24Å; T1235-I1239 WeakPolarHBondContact O-CG1 3.49Å; T1235-I1239 PolarHBondContact O-N 3.07Å; I1239-R1243 WeakPolarHBondContact O-CG 3.46Å; I1239-R1243 PolarHBondContact O-N 3.45Å
1240	N	36.4	Very low	40.5	Very low	74 Å²	74	119 Å²	119	40%	0.396	59%	0.59	S	S	.	*	H	α-helix	trans	-81.4	-17.7	177.7	-80.7	-30.5	0	0	0	114.1	T1236 E1237 Q1238 N1244	T1236-N1240 VanDerWaalsContact O-CB 3.27Å; T1236-N1240 WeakPolarHBondContact O-CB 3.42Å; T1236-N1240 PolarHBondContact O-N 2.73Å; T1236-N1240 PolarHBondContact O-ND2 2.85Å; T1236-N1240 VanDerWaalsContact O-ND2 3.09Å; E1237-N1240 PolarHBondContact O-N 2.78Å; Q1238-N1240 VanDerWaalsContact C-N 3.27Å; Q1238-N1240 PolarHBondContact O-N 3.17Å; N1240-N1244 PolarHBondContact O-ND2 3.02Å; N1240-N1244 VanDerWaalsContact O-ND2 3.08Å
1241	F	35.2	Very low	38.9	Very low	171 Å²	171	118.6 Å²	118.6	75%	0.75	60%	0.596	S	S	*	*	H	α-helix	trans	-69.7	-48.2	169	-92.7	-87.1	0	0	0	111.1	E1237 Q1238 R1243 N1244	E1237-F1241 PolarHBondContact O-N 2.9Å; Q1238-F1241 PolarHBondContact O-N 3.01Å; F1241-R1243 VanDerWaalsContact C-N 3.27Å; F1241-R1243 PolarHBondContact O-N 3.25Å; F1241-N1244 PolarHBondContact O-N 3.24Å
1242	D	35.9	Very low	37	Very low	125 Å²	125	119.2 Å²	119.2	67%	0.668	60%	0.604	S	S	*	*	H	α-helix	trans	-67.1	-23.4	179.2	-69.4	-14.9	0	0	0	113.8
1243	R	34	Very low	35.8	Very low	160 Å²	160	126.5 Å²	126.5	60%	0.604	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-8.7	-178.8	-81.8	-176.8	174.3	-175.1	1.4	115.5	I1239 F1241	I1239-R1243 WeakPolarHBondContact O-CG 3.46Å; I1239-R1243 PolarHBondContact O-N 3.45Å; F1241-R1243 VanDerWaalsContact C-N 3.27Å; F1241-R1243 PolarHBondContact O-N 3.25Å
1244	N	33.8	Very low	34.8	Very low	100 Å²	100	128.2 Å²	128.2	54%	0.535	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.3	-10.7	-179.8	-75.2	-40.8	0	0	0	113.9	N1240 F1241 K1247	N1240-N1244 PolarHBondContact O-ND2 3.02Å; N1240-N1244 VanDerWaalsContact O-ND2 3.08Å; F1241-N1244 PolarHBondContact O-N 3.24Å; N1244-K1247 PolarHBondContact OD1-NZ 2.81Å
1245	E	36.2	Very low	34	Very low	184 Å²	184	131.1 Å²	131.1	86%	0.86	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-5.8	173.1	-62.8	-166.6	146.9	0	0	113.9
1246	L	35.7	Very low	33.3	Very low	148 Å²	148	137.1 Å²	137.1	78%	0.775	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	15.3	-175.8	-81.4	154.3	0	0	0	114	D1248	L1246-D1248 PolarHBondContact O-N 2.88Å
1247	K	30.1	Very low	32.6	Very low	153 Å²	153	140.8 Å²	140.8	67%	0.665	70%	0.703	S	S	*	*			trans	-98.8	58.9	-179.8	-72.2	176.7	-177.4	161	0	112.8	N1244	N1244-K1247 PolarHBondContact OD1-NZ 2.81Å
1248	D	31.1	Very low	32.6	Very low	153 Å²	153	140 Å²	140	82%	0.818	72%	0.718	S	S	*	*			trans	-141.4	137.4	162.3	-106.7	-35.9	0	0	0	110.5	L1246	L1246-D1248 PolarHBondContact O-N 2.88Å
1249	K	34	Very low	32.1	Very low	186 Å²	186	139 Å²	139	81%	0.809	73%	0.727	S	S	*	*			trans	85.6	84.7	-176.4	-54.3	162.4	-175.3	171	0	116.5
1250	T	29.4	Very low	31.9	Very low	130 Å²	130	140.8 Å²	140.8	80%	0.798	75%	0.747	S	S	*	*				39.4	143.1	115.8	62	0	0	0	0	119.5
1251	I	30.8	Very low	31.6	Very low	136 Å²	136	147 Å²	147	70%	0.697	77%	0.771	S	S	*	*			cis	-149.6	150.3	44.5	-69.3	170.4	0	0	0	111.3	Y1253	I1251-Y1253 HydrophobicContact CG2-CE2 3.84Å
1252	S	25.6	Very low	31.2	Very low	94 Å²	94	144.9 Å²	144.9	66%	0.657	77%	0.774	S	S	*	*			trans	-100.3	152.7	177	56.9	0	0	0	0	114.4
1253	Y	29.9	Very low	30.8	Very low	213 Å²	213	144.3 Å²	144.3	84%	0.835	78%	0.78	S	S	*	*			trans	-142.9	145.2	148.6	-66.6	-69.7	0	0	0	112.5	I1251	I1251-Y1253 HydrophobicContact CG2-CE2 3.84Å
1254	P	31.1	Very low	30.4	Very low	105 Å²	105	148.4 Å²	148.4	68%	0.682	80%	0.795	S	S	*	*			trans	-137.8	-175.9	-158.7	37.3	-14.4	0	0	0	117.1
1255	V	29.1	Very low	30	Very low	127 Å²	127	150.6 Å²	150.6	77%	0.77	81%	0.806	S	S	*	*			trans	66.5	152	162.9	-113.7	0	0	0	0	116.3
1256	K	30	Very low	29.4	Very low	197 Å²	197	150.3 Å²	150.3	86%	0.857	81%	0.805	S	S	*	*			cis	-141.1	158.9	18.9	-65.8	-177.1	176.5	171.9	0	115.3
1257	T	26	Very low	28.9	Very low	144 Å²	144	148.9 Å²	148.9	88%	0.883	81%	0.807	S	S	*	*			trans	-89.2	146.5	174.2	48.7	0	0	0	0	113.8
1258	A	32.3	Very low	28.7	Very low	110 Å²	110	146.9 Å²	146.9	91%	0.909	81%	0.81	S	S	*	*			trans	-151.8	151.1	154.1	0	0	0	0	0	110.8
1259	S	29.5	Very low	28.3	Very low	120 Å²	120	146.1 Å²	146.1	84%	0.839	81%	0.811	S	S	*	*			trans	-111.7	136.2	-162.1	56.7	0	0	0	0	115.2
1260	S	34.7	Very low	27.9	Very low	127 Å²	127	147.5 Å²	147.5	89%	0.888	81%	0.813	S	S	*	*			trans	-161.9	160.8	144.9	50.3	0	0	0	0	111.2
1261	K	29.6	Very low	27.8	Very low	205 Å²	205	148.7 Å²	148.7	89%	0.891	81%	0.813	S	S	*	*			trans	-85	160.3	-164	-88	175.3	177.4	172.5	0	114.1
1262	P	27.4	Very low	27.7	Very low	126 Å²	126	152 Å²	152	82%	0.818	82%	0.822	S	S	*	*			trans	-97.4	143.1	-147.3	35.8	-36.1	0	0	0	116.3
1263	S	26.2	Very low	27.7	Very low	112 Å²	112	155.7 Å²	155.7	78%	0.783	83%	0.827	S	S	*	*			trans	-108.1	100.6	168.1	45	0	0	0	0	112	L1265	S1263-L1265 PolarHBondContact O-N 3.04Å
1264	R	25.2	Very low	27.5	Very low	246 Å²	246	153.1 Å²	153.1	93%	0.928	83%	0.828	S	S	*	*			trans	10.4	77.2	146.7	-165	-166.5	-138.5	171.6	5.6	118
1265	L	25.3	Very low	27.4	Very low	147 Å²	147	154.1 Å²	154.1	77%	0.77	84%	0.837	S	S	*	*			trans	-158.5	141.8	157.5	-99.6	133.3	0	0	0	111.4	S1263	S1263-L1265 PolarHBondContact O-N 3.04Å
1266	Q	25	Very low	27.3	Very low	177 Å²	177	152.4 Å²	152.4	83%	0.827	83%	0.83	S	S	*	*			trans	52	110.4	160.9	-64.6	170.2	2.5	0	0	119
1267	S	25.2	Very low	27.7	Very low	118 Å²	118	146.8 Å²	146.8	83%	0.825	81%	0.808	S	S	*	*			trans	-72.9	140.1	163.1	48.7	0	0	0	0	111.1
1268	P	24.6	Very low	28.6	Very low	112 Å²	112	144 Å²	144	73%	0.727	79%	0.794	S	S	*	*			trans	-82.1	143.3	-164.1	-8.9	26.5	0	0	0	114.4	Y1270	P1268-Y1270 HydrophobicContact CB-CD2 4.34Å; P1268-Y1270 PolarHBondContact O-N 2.83Å
1269	T	24.3	Very low	29.8	Very low	136 Å²	136	140.9 Å²	140.9	83%	0.834	76%	0.759	S	S	*	*			trans	-65	105.7	167.4	41.4	0	0	0	0	112.6
1270	Y	25.4	Very low	31.9	Very low	215 Å²	215	138.1 Å²	138.1	84%	0.843	74%	0.74	S	S	*	*			trans	-148	87.6	162.4	-79.6	-76.5	0	0	0	111.7	P1268	P1268-Y1270 HydrophobicContact CB-CD2 4.34Å; P1268-Y1270 PolarHBondContact O-N 2.83Å
1271	L	27.5	Very low	34.2	Very low	156 Å²	156	132.7 Å²	132.7	82%	0.817	70%	0.701	S	S	*	*			trans	-139.5	106.6	157	-87.4	177.3	0	0	0	109.4
1272	K	27.2	Very low	37.1	Very low	204 Å²	204	123 Å²	123	89%	0.887	66%	0.658	S	S	*	*			trans	-69.8	143.9	168.2	-83.8	-179.1	171.5	179.8	0	109.3	N1274	K1272-N1274 PolarHBondContact O-N 3.38Å
1273	K	26.8	Very low	40	Very low	173 Å²	173	118.5 Å²	118.5	75%	0.752	63%	0.625	S	S	*	*			trans	-54.4	119.8	168	-65.6	176.3	175.6	-179.7	0	109.4
1274	N	25.1	Very low	43	Very low	159 Å²	159	113.7 Å²	113.7	85%	0.85	59%	0.591	S	S	*	*			trans	-164.4	150.2	148.9	-99.5	-4.5	0	0	0	109.3	K1272 C1276	K1272-N1274 PolarHBondContact O-N 3.38Å; N1274-C1276 PolarHBondContact O-N 3.1Å; N1274-C1276 VanDerWaalsContact O-N 3.12Å
1275	S	28.6	Very low	46	Very low	125 Å²	125	103.9 Å²	103.9	87%	0.874	56%	0.559	S	S	*	*	S	Bend	trans	-73.8	92.4	-170	48.9	0	0	0	0	113.6
1276	C	27.7	Very low	48.9	Very low	92 Å²	92	96.9 Å²	96.9	62%	0.622	52%	0.522	S	S	*	.	S	Bend	trans	-158.4	149	152.3	-153	0	0	0	0	110.4	N1274 S1278	N1274-C1276 PolarHBondContact O-N 3.1Å; N1274-C1276 VanDerWaalsContact O-N 3.12Å; C1276-S1278 PolarHBondContact O-N 3.5Å
1277	I	38.6	Very low	51.9	Low	79 Å²	79	90.1 Å²	90.1	41%	0.405	49%	0.489	S	S	.	.			trans	-69.6	113.8	-176.4	-63.1	170.3	0	0	0	109.3	Y1279	I1277-Y1279 HydrophobicContact CB-CE1 4.46Å; I1277-Y1279 HydrophobicContact CG2-CD1 3.96Å; I1277-Y1279 HydrophobicContact CG2-CE1 3.88Å; I1277-Y1279 HydrophobicContact CG2-CG 4.43Å; I1277-Y1279 WeakPolarHBondContact O-CD2 3.47Å; I1277-Y1279 PolarHBondContact O-N 2.98Å; I1277-Y1279 VanDerWaalsContact O-N 3.09Å
1278	S	44.4	Very low	54.6	Low	84 Å²	84	85.9 Å²	85.9	59%	0.587	46%	0.459	S	S	*	.			trans	-76.8	98.5	173.1	55.7	0	0	0	0	110.2	C1276 S1280	C1276-S1278 PolarHBondContact O-N 3.5Å; S1278-S1280 PolarHBondContact O-N 3.06Å; S1278-S1280 PolarHBondContact O-OG 3.19Å
1279	Y	58.3	Low	57.3	Low	45 Å²	45	81.9 Å²	81.9	18%	0.176	43%	0.433	C	S	.	.			trans	-65.7	66	-172.9	-75.5	-63.6	0	0	0	115.2	L1221 A1225 I1228 I1277 F1281	L1221-Y1279 HydrophobicContact CD1-CE1 4.44Å; A1225-Y1279 HydrophobicContact CB-CD1 4.19Å; A1225-Y1279 HydrophobicContact CB-CD2 4.18Å; A1225-Y1279 HydrophobicContact CB-CE1 4.06Å; A1225-Y1279 HydrophobicContact CB-CE2 4.06Å; A1225-Y1279 HydrophobicContact CB-CG 4.24Å; I1228-Y1279 HydrophobicContact CB-CE2 4.43Å; I1228-Y1279 HydrophobicContact CD1-CE2 4.36Å; I1228-Y1279 WeakPolarHBondContact CD1-OH 3.18Å; I1228-Y1279 HydrophobicContact CG2-CE2 4.39Å; I1277-Y1279 HydrophobicContact CB-CE1 4.46Å; I1277-Y1279 HydrophobicContact CG2-CD1 3.96Å; I1277-Y1279 HydrophobicContact CG2-CE1 3.88Å; I1277-Y1279 HydrophobicContact CG2-CG 4.43Å; I1277-Y1279 WeakPolarHBondContact O-CD2 3.47Å; I1277-Y1279 PolarHBondContact O-N 2.98Å; I1277-Y1279 VanDerWaalsContact O-N 3.09Å; Y1279-F1281 VanDerWaalsContact C-N 3.33Å; Y1279-F1281 AromaticContact CD1-CD1 3.78Å; Y1279-F1281 HydrophobicContact CD1-CD1 3.78Å; Y1279-F1281 AromaticContact CD1-CE1 3.47Å; Y1279-F1281 HydrophobicContact CD1-CE1 3.47Å; Y1279-F1281 VanDerWaalsContact CD1-CE1 3.47Å; Y1279-F1281 HydrophobicContact CE1-CE1 4.32Å; Y1279-F1281 HydrophobicContact CG-CD1 4.29Å; Y1279-F1281 AromaticContact CG-CE1 3.9Å; Y1279-F1281 HydrophobicContact CG-CE1 3.9Å; Y1279-F1281 PolarHBondContact O-N 3.06Å; Y1279-F1281 VanDerWaalsContact O-N 3.15Å
1280	S	72.5	Confident	59.7	Low	62 Å²	62	78.8 Å²	78.8	43%	0.434	43%	0.428	S	S	.	.			trans	-86.6	68.9	172.1	49.7	0	0	0	0	110.8	S1278 S1288 L1293	S1278-S1280 PolarHBondContact O-N 3.06Å; S1278-S1280 PolarHBondContact O-OG 3.19Å; S1280-S1288 WeakPolarHBondContact O-CB 3.47Å; S1280-L1293 WeakPolarHBondContact O-CD1 3.48Å
1281	F	84.5	Confident	62.4	Low	14 Å²	14	70.4 Å²	70.4	6%	0.061	40%	0.399	C	S	.	.	S	Bend	trans	-130.7	158.1	175.5	73.3	-89.4	0	0	0	112	L1221 A1225 Y1279 Y1283 Y1303	L1221-F1281 HydrophobicContact CD2-CD1 4.33Å; L1221-F1281 HydrophobicContact CD2-CD2 3.74Å; L1221-F1281 HydrophobicContact CD2-CE1 4.48Å; L1221-F1281 HydrophobicContact CD2-CE2 3.92Å; L1221-F1281 HydrophobicContact CD2-CG 3.96Å; L1221-F1281 HydrophobicContact CD2-CZ 4.29Å; L1221-F1281 HydrophobicContact CG-CD2 4.27Å; L1221-F1281 HydrophobicContact CG-CE1 4.25Å; L1221-F1281 HydrophobicContact CG-CE2 3.94Å; L1221-F1281 HydrophobicContact CG-CZ 3.93Å; A1225-F1281 HydrophobicContact CB-CE1 4.04Å; A1225-F1281 HydrophobicContact CB-CZ 4.02Å; Y1279-F1281 VanDerWaalsContact C-N 3.33Å; Y1279-F1281 AromaticContact CD1-CD1 3.78Å; Y1279-F1281 HydrophobicContact CD1-CD1 3.78Å; Y1279-F1281 AromaticContact CD1-CE1 3.47Å; Y1279-F1281 HydrophobicContact CD1-CE1 3.47Å; Y1279-F1281 VanDerWaalsContact CD1-CE1 3.47Å; Y1279-F1281 HydrophobicContact CE1-CE1 4.32Å; Y1279-F1281 HydrophobicContact CG-CD1 4.29Å; Y1279-F1281 AromaticContact CG-CE1 3.9Å; Y1279-F1281 HydrophobicContact CG-CE1 3.9Å; Y1279-F1281 PolarHBondContact O-N 3.06Å; Y1279-F1281 VanDerWaalsContact O-N 3.15Å; F1281-Y1283 PolarHBondContact O-N 3.12Å; F1281-Y1303 WeakPolarHBondContact O-CB 3.47Å
1282	C	90	Very high	65.1	Low	0 Å²	0	73.4 Å²	73.4	0%	0	40%	0.4	C	S	.	.			trans	-73.3	115.8	175.1	-179.8	0	0	0	0	110.9	E1284 C1285 G1286 R1287 L1293 Y1303 C1305	C1282-E1284 PolarHBondContact O-N 2.99Å; C1282-C1285 PolarHBondContact O-N 3.17Å; C1282-C1285 VanDerWaalsContact SG-SG 3.67Å; C1282-G1286 WeakPolarHBondContact O-CA 3.43Å; C1282-G1286 PolarHBondContact O-N 2.98Å; C1282-R1287 PolarHBondContact N-O 3.27Å; C1282-L1293 HydrophobicContact CB-CD2 3.87Å; C1282-Y1303 WeakPolarHBondContact CA-O 3.35Å; C1282-C1305 HydrophobicContact CB-CB 3.82Å; C1282-C1305 PolarHBondContact SG-N 3.32Å; C1282-C1305 PolarHBondContact SG-SG 3.44Å
1283	Y	87.4	Confident	68	Low	32 Å²	32	65.9 Å²	65.9	13%	0.125	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-23.8	-176.8	-168.5	-97.3	0	0	0	114.9	R1222 F1281 V1302 Y1303 S1313 R1317 H1318 E1321	R1222-Y1283 VanDerWaalsContact CD-O 3.25Å; R1222-Y1283 WeakPolarHBondContact CD-O 3.11Å; R1222-Y1283 HydrophobicContact CG-CD2 4.21Å; R1222-Y1283 HydrophobicContact CG-CE1 4.45Å; R1222-Y1283 HydrophobicContact CG-CE2 3.94Å; R1222-Y1283 PolarHBondContact NH1-O 3.06Å; F1281-Y1283 PolarHBondContact O-N 3.12Å; Y1283-V1302 HydrophobicContact CD1-CG1 3.94Å; Y1283-V1302 HydrophobicContact CD2-CG1 3.65Å; Y1283-V1302 HydrophobicContact CD2-CG2 4.44Å; Y1283-V1302 HydrophobicContact CE2-CG1 4.49Å; Y1283-V1302 HydrophobicContact CG-CG1 3.35Å; Y1283-Y1303 WeakPolarHBondContact CB-O 3.25Å; Y1283-Y1303 PolarHBondContact N-O 3.3Å; Y1283-S1313 WeakPolarHBondContact CD1-OG 3.14Å; Y1283-R1317 HydrophobicContact CE1-CG 4.25Å; Y1283-H1318 HydrophobicContact CE1-CB 4.48Å; Y1283-E1321 WeakPolarHBondContact CE1-OE2 3.41Å; Y1283-E1321 VanDerWaalsContact OH-CD 3.29Å; Y1283-E1321 PolarHBondContact OH-OE1 3.08Å; Y1283-E1321 PolarHBondContact OH-OE2 3.12Å; Y1283-E1321 VanDerWaalsContact OH-OE2 3.06Å
1284	E	89	Confident	70.9	Confident	12 Å²	12	60.6 Å²	60.6	6%	0.056	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-44	175.4	-177.9	55.3	-159.2	0	0	113.6	R1222 C1282 C1309 K1312 S1313 R1317	R1222-E1284 VanDerWaalsContact NH1-C 3.3Å; R1222-E1284 PolarHBondContact NH1-O 2.8Å; C1282-E1284 PolarHBondContact O-N 2.99Å; E1284-C1309 HydrophobicContact CB-CB 3.74Å; E1284-C1309 HydrophobicContact CG-CB 4.15Å; E1284-K1312 HydrophobicContact CG-CB 4.36Å; E1284-K1312 HydrophobicContact CG-CD 4.35Å; E1284-K1312 WeakPolarHBondContact OE1-CD 3.3Å; E1284-K1312 VanDerWaalsContact OE1-CE 3.24Å; E1284-K1312 WeakPolarHBondContact OE1-CE 3.43Å; E1284-K1312 WeakPolarHBondContact OE1-CG 3.24Å; E1284-K1312 IonicContact OE1-NZ 3.29Å; E1284-K1312 PolarHBondContact OE1-NZ 2.72Å; E1284-S1313 WeakPolarHBondContact OE2-CA 3.4Å; E1284-S1313 WeakPolarHBondContact OE2-CB 3.44Å; E1284-R1317 IonicContact OE1-NH2 2.7Å; E1284-R1317 IonicContact OE2-CZ 3.14Å; E1284-R1317 VanDerWaalsContact OE2-CZ 3.26Å; E1284-R1317 IonicContact OE2-NH1 3.27Å; E1284-R1317 PolarHBondContact OE2-NH1 3.35Å; E1284-R1317 IonicContact OE2-NH2 2.73Å; E1284-R1317 PolarHBondContact OE2-NH2 3.36Å
1285	C	88.6	Confident	73.9	Confident	39 Å²	39	55.7 Å²	55.7	26%	0.264	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	7.9	-169.3	68.8	0	0	0	0	115	I1178 C1282 R1287	I1178-C1285 WeakPolarHBondContact CG2-O 3.11Å; C1282-C1285 PolarHBondContact O-N 3.17Å; C1282-C1285 VanDerWaalsContact SG-SG 3.67Å; C1285-R1287 PolarHBondContact O-N 3.25Å
1286	G	86.6	Confident	76.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.286	C	S	.	.			trans	72.4	-13.5	172.4	0	0	0	0	0	117	N1176 C1282	N1176-G1286 PolarHBondContact ND2-O 3Å; C1282-G1286 WeakPolarHBondContact O-CA 3.43Å; C1282-G1286 PolarHBondContact O-N 2.98Å
1287	R	87.1	Confident	79.3	Confident	36 Å²	36	49.3 Å²	49.3	14%	0.136	28%	0.284	C	S	.	.			trans	-69.5	131.1	-177.8	-67.6	-171	60.5	-155.5	-8.9	113.3	I1178 D1179 Y1182 C1282 C1285 V1289 G1290 V1291	I1178-R1287 HydrophobicContact CG2-CG 4.26Å; D1179-R1287 WeakPolarHBondContact OD1-CA 3.46Å; D1179-R1287 VanDerWaalsContact OD1-CB 3.25Å; D1179-R1287 WeakPolarHBondContact OD1-CB 3.37Å; D1179-R1287 WeakPolarHBondContact OD1-CG 3.27Å; D1179-R1287 IonicContact OD1-NE 2.71Å; D1179-R1287 PolarHBondContact OD1-NE 3.19Å; Y1182-R1287 VanDerWaalsContact CE1-CZ 3.49Å; Y1182-R1287 VanDerWaalsContact CZ-NH1 3.31Å; C1282-R1287 PolarHBondContact N-O 3.27Å; C1285-R1287 PolarHBondContact O-N 3.25Å; R1287-V1289 PolarHBondContact NH2-O 2.64Å; R1287-G1290 PolarHBondContact NH2-O 2.99Å; R1287-V1291 HydrophobicContact CB-CG1 4.48Å; R1287-V1291 HydrophobicContact CB-CG2 4.34Å
1288	S	83.7	Confident	81.2	Confident	28 Å²	28	51.4 Å²	51.4	20%	0.196	29%	0.286	C	S	.	.			trans	-106.5	-30.6	167.7	58.8	0	0	0	0	112.4	D1179 S1280	D1179-S1288 PolarHBondContact OD2-N 3.4Å; D1179-S1288 PolarHBondContact OD2-OG 3.26Å; D1179-S1288 VanDerWaalsContact OD2-OG 3.04Å; S1280-S1288 WeakPolarHBondContact O-CB 3.47Å
1289	V	80.2	Confident	82.9	Confident	28 Å²	28	48.1 Å²	48.1	17%	0.17	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	142.1	-174.5	-179.6	0	0	0	0	113	L1167 I1173 Y1174 G1175 D1179 R1287 V1291	L1167-V1289 HydrophobicContact CD1-CG1 4.49Å; L1167-V1289 HydrophobicContact CD1-CG2 4.23Å; I1173-V1289 HydrophobicContact CG2-CG1 3.48Å; I1173-V1289 VanDerWaalsContact CG2-CG1 3.48Å; I1173-V1289 HydrophobicContact CG2-CG2 4.36Å; Y1174-V1289 WeakPolarHBondContact O-CG2 3.26Å; G1175-V1289 VanDerWaalsContact CA-CG2 3.44Å; D1179-V1289 HydrophobicContact CB-CB 4.03Å; D1179-V1289 HydrophobicContact CB-CG2 4.22Å; D1179-V1289 PolarHBondContact OD1-N 3.27Å; D1179-V1289 PolarHBondContact OD2-N 2.95Å; R1287-V1289 PolarHBondContact NH2-O 2.64Å; V1289-V1291 VanDerWaalsContact C-N 3.25Å; V1289-V1291 PolarHBondContact O-N 3.15Å
1290	G	74.2	Confident	83.9	Confident	72 Å²	72	51.9 Å²	51.9	74%	0.742	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	28	171.3	0	0	0	0	0	113.6	R1287	R1287-G1290 PolarHBondContact NH2-O 2.99Å
1291	V	82.3	Confident	84.1	Confident	38 Å²	38	52.7 Å²	52.7	23%	0.23	28%	0.275	C	S	.	.	S	Bend	trans	-136.7	146.5	177.1	-75.4	0	0	0	0	110.5	R1287 V1289 L1293 C1305	R1287-V1291 HydrophobicContact CB-CG1 4.48Å; R1287-V1291 HydrophobicContact CB-CG2 4.34Å; V1289-V1291 VanDerWaalsContact C-N 3.25Å; V1289-V1291 PolarHBondContact O-N 3.15Å; V1291-L1293 HydrophobicContact CG2-CD2 3.96Å; V1291-L1293 HydrophobicContact CG2-CG 4.28Å; V1291-L1293 PolarHBondContact O-N 2.84Å; V1291-C1305 HydrophobicContact CB-CB 3.59Å; V1291-C1305 HydrophobicContact CG1-CB 3.67Å; V1291-C1305 HydrophobicContact CG2-CB 4.06Å
1292	R	85.3	Confident	84	Confident	220 Å²	220	52.8 Å²	52.8	83%	0.83	28%	0.277	S	S	*	.			trans	-89.4	100.6	171.6	-173.1	176.2	-177.1	177.4	1.4	109.4
1293	L	87.8	Confident	83.9	Confident	45 Å²	45	56.6 Å²	56.6	24%	0.236	29%	0.292	C	S	.	.			trans	-71	137.2	177	-64	179.9	0	0	0	111.5	S1280 C1282 V1291 Y1303 F1304 C1305	S1280-L1293 WeakPolarHBondContact O-CD1 3.48Å; C1282-L1293 HydrophobicContact CB-CD2 3.87Å; V1291-L1293 HydrophobicContact CG2-CD2 3.96Å; V1291-L1293 HydrophobicContact CG2-CG 4.28Å; V1291-L1293 PolarHBondContact O-N 2.84Å; L1293-Y1303 HydrophobicContact CB-CD1 4.08Å; L1293-F1304 CarbonylContact C-O 3.57Å; L1293-F1304 WeakPolarHBondContact CA-O 3.46Å; L1293-C1305 HydrophobicContact CD2-CB 4.23Å
1294	T	87.8	Confident	84.1	Confident	63 Å²	63	55 Å²	55	39%	0.387	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126	178.9	55.6	0	0	0	0	109.4	Y1303 F1304	T1294-Y1303 CarbonylContact O-C 3.45Å; T1294-Y1303 WeakPolarHBondContact O-CA 3.03Å; T1294-F1304 PolarHBondContact N-O 3.42Å; T1294-F1304 PolarHBondContact O-N 3.37Å; T1294-F1304 PolarHBondContact OG1-O 2.97Å
1295	V	87.4	Confident	84.1	Confident	55 Å²	55	55.7 Å²	55.7	33%	0.333	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	148.2	-176.7	174.2	0	0	0	0	111.4	S1297 H1300 V1302 Y1303	V1295-S1297 PolarHBondContact O-N 3.03Å; V1295-H1300 HydrophobicContact CG1-CB 4.02Å; V1295-H1300 VanDerWaalsContact CG1-O 3.28Å; V1295-H1300 WeakPolarHBondContact CG1-O 2.98Å; V1295-V1302 CarbonylContact C-O 3.31Å; V1295-Y1303 HydrophobicContact CG2-CD1 3.62Å; V1295-Y1303 HydrophobicContact CG2-CE1 3.35Å
1296	C	85.9	Confident	84.2	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	29%	0.293	C	S	.	.			trans	-64	120.4	170.3	-171.2	0	0	0	0	110.6	R1298 H1300 V1302 F1304 H1318	C1296-R1298 PolarHBondContact O-N 3.45Å; C1296-H1300 VanDerWaalsContact O-CA 3.28Å; C1296-H1300 WeakPolarHBondContact O-CA 3.22Å; C1296-H1300 PolarHBondContact O-N 3.3Å; C1296-V1302 HydrophobicContact CB-CB 4.35Å; C1296-V1302 WeakPolarHBondContact CB-O 3.45Å; C1296-V1302 PolarHBondContact N-O 3.47Å; C1296-F1304 HydrophobicContact CB-CE2 3.89Å; C1296-H1318 PolarHBondContact SG-NE2 3.08Å
1297	S	82.9	Confident	84.4	Confident	83 Å²	83	64.4 Å²	64.4	58%	0.58	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	23.8	-178.2	56.4	0	0	0	0	114.6	V1295 K1310	V1295-S1297 PolarHBondContact O-N 3.03Å; S1297-K1310 PolarHBondContact OG-NZ 3.28Å
1298	R	80.3	Confident	84.5	Confident	123 Å²	123	67.9 Å²	67.9	46%	0.464	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.2	-68.5	179.1	-76.6	-173.8	177.2	-166.4	1.7	110.8	C1296 H1300 C1322 Y1323	C1296-R1298 PolarHBondContact O-N 3.45Å; R1298-H1300 PolarHBondContact O-CD2 3.33Å; R1298-C1322 WeakPolarHBondContact CB-SG 3.47Å; R1298-Y1323 PolarHBondContact NH1-OH 3.3Å
1299	C	79.3	Confident	84.9	Confident	14 Å²	14	67.4 Å²	67.4	10%	0.095	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-19.2	178.5	66.2	0	0	0	0	113.8	R1301 T1325 L1328	C1299-R1301 PolarHBondContact O-N 2.9Å; C1299-T1325 HydrophobicContact CB-CG2 4.27Å; C1299-L1328 HydrophobicContact CB-CD1 4.23Å
1300	H	79.9	Confident	85.3	Confident	125 Å²	125	69.1 Å²	69.1	58%	0.579	36%	0.357	S	S	*	.	S	Bend	trans	57.2	-4.8	-173.8	-65.6	-89.5	0	0	0	117.5	V1295 C1296 R1298	V1295-H1300 HydrophobicContact CG1-CB 4.02Å; V1295-H1300 VanDerWaalsContact CG1-O 3.28Å; V1295-H1300 WeakPolarHBondContact CG1-O 2.98Å; C1296-H1300 VanDerWaalsContact O-CA 3.28Å; C1296-H1300 WeakPolarHBondContact O-CA 3.22Å; C1296-H1300 PolarHBondContact O-N 3.3Å; R1298-H1300 PolarHBondContact O-CD2 3.33Å
1301	R	75.2	Confident	86.1	Confident	78 Å²	78	71.3 Å²	71.3	29%	0.294	35%	0.351	S	S	.	.	S	Bend	trans	-77.7	-32	178	-61.5	179.1	-173.7	-151.6	-1.6	113.9	D1233 C1299 E1327	D1233-R1301 IonicContact OD2-NH1 3.96Å; C1299-R1301 PolarHBondContact O-N 2.9Å; R1301-E1327 IonicContact CZ-OE1 3.13Å; R1301-E1327 IonicContact CZ-OE2 2.67Å; R1301-E1327 IonicContact NH2-OE1 3.08Å; R1301-E1327 PolarHBondContact NH2-OE1 3.35Å; R1301-E1327 IonicContact NH2-OE2 3.26Å; R1301-E1327 PolarHBondContact NH2-OE2 3.04Å; R1301-E1327 VanDerWaalsContact NH2-OE2 3.12Å
1302	V	83	Confident	86.4	Confident	16 Å²	16	74.3 Å²	74.3	10%	0.097	36%	0.361	C	S	.	.			trans	-107.9	142.2	-166.2	-179.6	0	0	0	0	113.2	Y1283 V1295 C1296 F1304 H1318	Y1283-V1302 HydrophobicContact CD1-CG1 3.94Å; Y1283-V1302 HydrophobicContact CD2-CG1 3.65Å; Y1283-V1302 HydrophobicContact CD2-CG2 4.44Å; Y1283-V1302 HydrophobicContact CE2-CG1 4.49Å; Y1283-V1302 HydrophobicContact CG-CG1 3.35Å; V1295-V1302 CarbonylContact C-O 3.31Å; C1296-V1302 HydrophobicContact CB-CB 4.35Å; C1296-V1302 WeakPolarHBondContact CB-O 3.45Å; C1296-V1302 PolarHBondContact N-O 3.47Å; V1302-F1304 HydrophobicContact CG1-CE1 4.06Å; V1302-F1304 HydrophobicContact CG1-CE2 4.27Å; V1302-F1304 HydrophobicContact CG1-CZ 3.7Å; V1302-H1318 VanDerWaalsContact CG2-CE1 3.48Å; V1302-H1318 WeakPolarHBondContact CG2-CE1 3.22Å
1303	Y	89	Confident	86.5	Confident	80 Å²	80	63.9 Å²	63.9	31%	0.314	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.7	-176.6	-62.3	-99.7	0	0	0	114.4	F1281 C1282 Y1283 L1293 T1294 V1295	F1281-Y1303 WeakPolarHBondContact O-CB 3.47Å; C1282-Y1303 WeakPolarHBondContact CA-O 3.35Å; Y1283-Y1303 WeakPolarHBondContact CB-O 3.25Å; Y1283-Y1303 PolarHBondContact N-O 3.3Å; L1293-Y1303 HydrophobicContact CB-CD1 4.08Å; T1294-Y1303 CarbonylContact O-C 3.45Å; T1294-Y1303 WeakPolarHBondContact O-CA 3.03Å; V1295-Y1303 HydrophobicContact CG2-CD1 3.62Å; V1295-Y1303 HydrophobicContact CG2-CE1 3.35Å
1304	F	90.2	Very high	86.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	133.2	179	-52.9	-73.9	0	0	0	113.3	L1293 T1294 C1296 V1302 K1310 H1318	L1293-F1304 CarbonylContact C-O 3.57Å; L1293-F1304 WeakPolarHBondContact CA-O 3.46Å; T1294-F1304 PolarHBondContact N-O 3.42Å; T1294-F1304 PolarHBondContact O-N 3.37Å; T1294-F1304 PolarHBondContact OG1-O 2.97Å; C1296-F1304 HydrophobicContact CB-CE2 3.89Å; V1302-F1304 HydrophobicContact CG1-CE1 4.06Å; V1302-F1304 HydrophobicContact CG1-CE2 4.27Å; V1302-F1304 HydrophobicContact CG1-CZ 3.7Å; F1304-K1310 HydrophobicContact CB-CB 3.91Å; F1304-K1310 HydrophobicContact CD1-CB 4.1Å; F1304-K1310 HydrophobicContact CD2-CB 3.93Å; F1304-K1310 HydrophobicContact CD2-CD 3.96Å; F1304-K1310 HydrophobicContact CD2-CG 3.7Å; F1304-K1310 HydrophobicContact CE2-CB 4.5Å; F1304-K1310 HydrophobicContact CE2-CD 4.34Å; F1304-K1310 HydrophobicContact CE2-CG 3.92Å; F1304-K1310 HydrophobicContact CG-CB 3.69Å; F1304-K1310 HydrophobicContact CG-CG 4.01Å; F1304-K1310 HydrophobicContact CZ-CG 4.43Å; F1304-H1318 AromaticContact CZ-CD2 3.74Å
1305	C	90.3	Very high	86.5	Confident	26 Å²	26	66.5 Å²	66.5	18%	0.176	33%	0.332	C	S	.	.	S	Bend	trans	-76.4	-19.1	177.9	65.1	0	0	0	0	114.8	C1282 V1291 L1293 C1309	C1282-C1305 HydrophobicContact CB-CB 3.82Å; C1282-C1305 PolarHBondContact SG-N 3.32Å; C1282-C1305 PolarHBondContact SG-SG 3.44Å; V1291-C1305 HydrophobicContact CB-CB 3.59Å; V1291-C1305 HydrophobicContact CG1-CB 3.67Å; V1291-C1305 HydrophobicContact CG2-CB 4.06Å; L1293-C1305 HydrophobicContact CD2-CB 4.23Å; C1305-C1309 PolarHBondContact SG-SG 3.2Å
1306	S	90.7	Very high	86.3	Confident	42 Å²	42	70.1 Å²	70.1	29%	0.294	35%	0.347	S	S	.	.	S	Bend	trans	-157.9	160.2	-173.5	72	0	0	0	0	111.6	V1308 C1309 K1310	S1306-V1308 PolarHBondContact O-N 3.23Å; S1306-C1309 PolarHBondContact O-N 2.81Å; S1306-C1309 WeakPolarHBondContact OG-CB 3.37Å; S1306-C1309 PolarHBondContact OG-N 3.36Å; S1306-C1309 PolarHBondContact OG-SG 2.95Å; S1306-C1309 VanDerWaalsContact OG-SG 3.41Å; S1306-K1310 PolarHBondContact O-N 3.42Å
1307	K	89.3	Confident	86.3	Confident	180 Å²	180	72.6 Å²	72.6	78%	0.783	36%	0.356	S	S	*	.	H	α-helix	trans	-59.1	-36	171.8	-69.7	-175.1	179.3	-179.5	0	112	K1310 L1311	K1307-K1310 PolarHBondContact O-N 3.16Å; K1307-L1311 WeakPolarHBondContact O-CB 3.5Å; K1307-L1311 VanDerWaalsContact O-CG 3.3Å; K1307-L1311 WeakPolarHBondContact O-CG 3.29Å; K1307-L1311 PolarHBondContact O-N 3.25Å
1308	V	90.2	Very high	86.4	Confident	108 Å²	108	68.7 Å²	68.7	66%	0.655	33%	0.329	S	S	*	.	H	α-helix	trans	-64.5	-48.8	178.5	-178.7	0	0	0	0	110.6	S1306 K1310 L1311 K1312	S1306-V1308 PolarHBondContact O-N 3.23Å; V1308-K1310 PolarHBondContact O-N 2.98Å; V1308-L1311 PolarHBondContact O-N 3.33Å; V1308-K1312 WeakPolarHBondContact O-CB 3.39Å; V1308-K1312 PolarHBondContact O-N 2.76Å
1309	C	90.7	Very high	86.6	Confident	19 Å²	19	68.1 Å²	68.1	13%	0.128	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-40.6	176.1	-73.9	0	0	0	0	112.4	E1284 C1305 S1306 S1313	E1284-C1309 HydrophobicContact CB-CB 3.74Å; E1284-C1309 HydrophobicContact CG-CB 4.15Å; C1305-C1309 PolarHBondContact SG-SG 3.2Å; S1306-C1309 PolarHBondContact O-N 2.81Å; S1306-C1309 WeakPolarHBondContact OG-CB 3.37Å; S1306-C1309 PolarHBondContact OG-N 3.36Å; S1306-C1309 PolarHBondContact OG-SG 2.95Å; S1306-C1309 VanDerWaalsContact OG-SG 3.41Å; C1309-S1313 VanDerWaalsContact O-CB 3.26Å; C1309-S1313 WeakPolarHBondContact O-CB 3.18Å; C1309-S1313 PolarHBondContact O-N 3.32Å
1310	K	90	Very high	86.6	Confident	64 Å²	64	72.7 Å²	72.7	28%	0.278	35%	0.353	S	S	.	.	H	α-helix	trans	-60.5	-47.6	174.1	-175.6	171.3	-178.6	175.6	0	111.8	S1297 F1304 S1306 K1307 V1308 W1314	S1297-K1310 PolarHBondContact OG-NZ 3.28Å; F1304-K1310 HydrophobicContact CB-CB 3.91Å; F1304-K1310 HydrophobicContact CD1-CB 4.1Å; F1304-K1310 HydrophobicContact CD2-CB 3.93Å; F1304-K1310 HydrophobicContact CD2-CD 3.96Å; F1304-K1310 HydrophobicContact CD2-CG 3.7Å; F1304-K1310 HydrophobicContact CE2-CB 4.5Å; F1304-K1310 HydrophobicContact CE2-CD 4.34Å; F1304-K1310 HydrophobicContact CE2-CG 3.92Å; F1304-K1310 HydrophobicContact CG-CB 3.69Å; F1304-K1310 HydrophobicContact CG-CG 4.01Å; F1304-K1310 HydrophobicContact CZ-CG 4.43Å; S1306-K1310 PolarHBondContact O-N 3.42Å; K1307-K1310 PolarHBondContact O-N 3.16Å; V1308-K1310 PolarHBondContact O-N 2.98Å; K1310-W1314 WeakPolarHBondContact O-CB 3.22Å; K1310-W1314 PolarHBondContact O-N 3.09Å
1311	L	90.3	Very high	86.5	Confident	117 Å²	117	69.5 Å²	69.5	61%	0.613	34%	0.339	S	S	*	.	H	α-helix	trans	-64.8	-48.6	179.3	-74.2	169.2	0	0	0	111.9	K1307 V1308 W1314 T1315	K1307-L1311 WeakPolarHBondContact O-CB 3.5Å; K1307-L1311 VanDerWaalsContact O-CG 3.3Å; K1307-L1311 WeakPolarHBondContact O-CG 3.29Å; K1307-L1311 PolarHBondContact O-N 3.25Å; V1308-L1311 PolarHBondContact O-N 3.33Å; L1311-W1314 WeakPolarHBondContact O-CB 3.02Å; L1311-W1314 PolarHBondContact O-N 3.22Å; L1311-T1315 PolarHBondContact O-N 3Å; L1311-T1315 PolarHBondContact O-OG1 3.08Å; L1311-T1315 VanDerWaalsContact O-OG1 3.07Å
1312	K	89.3	Confident	86.6	Confident	102 Å²	102	65.9 Å²	65.9	44%	0.443	33%	0.325	S	S	.	.	H	α-helix	trans	-61	-48.2	-179.2	-172.8	175.1	175.1	-125.4	0	111.7	E1284 V1308 W1314 T1315 M1316	E1284-K1312 HydrophobicContact CG-CB 4.36Å; E1284-K1312 HydrophobicContact CG-CD 4.35Å; E1284-K1312 WeakPolarHBondContact OE1-CD 3.3Å; E1284-K1312 VanDerWaalsContact OE1-CE 3.24Å; E1284-K1312 WeakPolarHBondContact OE1-CE 3.43Å; E1284-K1312 WeakPolarHBondContact OE1-CG 3.24Å; E1284-K1312 IonicContact OE1-NZ 3.29Å; E1284-K1312 PolarHBondContact OE1-NZ 2.72Å; V1308-K1312 WeakPolarHBondContact O-CB 3.39Å; V1308-K1312 PolarHBondContact O-N 2.76Å; K1312-W1314 VanDerWaalsContact C-N 3.35Å; K1312-W1314 PolarHBondContact O-N 3.15Å; K1312-T1315 WeakPolarHBondContact CA-OG1 3.48Å; K1312-T1315 PolarHBondContact O-N 3.11Å; K1312-T1315 PolarHBondContact O-OG1 2.91Å; K1312-M1316 HydrophobicContact CG-CG 4.33Å; K1312-M1316 WeakPolarHBondContact O-CB 3.44Å; K1312-M1316 WeakPolarHBondContact O-CG 3.48Å; K1312-M1316 PolarHBondContact O-N 3.12Å
1313	S	87.2	Confident	85.8	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-42.6	175.3	168.6	0	0	0	0	112.2	Y1283 E1284 C1309 T1315 M1316 R1317 H1318	Y1283-S1313 WeakPolarHBondContact CD1-OG 3.14Å; E1284-S1313 WeakPolarHBondContact OE2-CA 3.4Å; E1284-S1313 WeakPolarHBondContact OE2-CB 3.44Å; C1309-S1313 VanDerWaalsContact O-CB 3.26Å; C1309-S1313 WeakPolarHBondContact O-CB 3.18Å; C1309-S1313 PolarHBondContact O-N 3.32Å; S1313-T1315 PolarHBondContact O-N 2.93Å; S1313-M1316 PolarHBondContact O-N 2.85Å; S1313-R1317 PolarHBondContact O-N 3.09Å; S1313-H1318 PolarHBondContact O-N 3.04Å; S1313-H1318 VanDerWaalsContact OG-CB 3.27Å; S1313-H1318 WeakPolarHBondContact OG-CB 3.45Å
1314	W	87.1	Confident	84.4	Confident	66 Å²	66	71.1 Å²	71.1	25%	0.25	35%	0.352	C	S	.	.	I	π-helix	trans	-58.8	-46.6	176	-173.6	-93.5	0	0	0	111.9	K1310 L1311 K1312 H1318 K1319 C1322	K1310-W1314 WeakPolarHBondContact O-CB 3.22Å; K1310-W1314 PolarHBondContact O-N 3.09Å; L1311-W1314 WeakPolarHBondContact O-CB 3.02Å; L1311-W1314 PolarHBondContact O-N 3.22Å; K1312-W1314 VanDerWaalsContact C-N 3.35Å; K1312-W1314 PolarHBondContact O-N 3.15Å; W1314-H1318 AromaticContact CE3-CD2 3.88Å; W1314-K1319 HydrophobicContact CD2-CB 4.29Å; W1314-K1319 HydrophobicContact CZ2-CB 4.28Å; W1314-K1319 HydrophobicContact CZ2-CG 4.19Å; W1314-K1319 WeakPolarHBondContact O-CB 3.48Å; W1314-K1319 PolarHBondContact O-N 3.26Å; W1314-C1322 HydrophobicContact CH2-CB 4.47Å; W1314-C1322 HydrophobicContact CZ3-CB 4.09Å
1315	T	87.8	Confident	82.8	Confident	97 Å²	97	71.7 Å²	71.7	60%	0.595	36%	0.355	S	S	*	.	I	π-helix	trans	-68.8	-31.8	179.5	47.1	0	0	0	0	114	L1311 K1312 S1313	L1311-T1315 PolarHBondContact O-N 3Å; L1311-T1315 PolarHBondContact O-OG1 3.08Å; L1311-T1315 VanDerWaalsContact O-OG1 3.07Å; K1312-T1315 WeakPolarHBondContact CA-OG1 3.48Å; K1312-T1315 PolarHBondContact O-N 3.11Å; K1312-T1315 PolarHBondContact O-OG1 2.91Å; S1313-T1315 PolarHBondContact O-N 2.93Å
1316	M	84.7	Confident	81.1	Confident	131 Å²	131	74 Å²	74	65%	0.645	37%	0.37	S	S	*	.	I	π-helix	trans	-89.4	-42.4	-172.1	-66.8	-73.4	102.2	0	0	113.6	K1312 S1313	K1312-M1316 HydrophobicContact CG-CG 4.33Å; K1312-M1316 WeakPolarHBondContact O-CB 3.44Å; K1312-M1316 WeakPolarHBondContact O-CG 3.48Å; K1312-M1316 PolarHBondContact O-N 3.12Å; S1313-M1316 PolarHBondContact O-N 2.85Å
1317	R	85.7	Confident	79.3	Confident	53 Å²	53	77.3 Å²	77.3	20%	0.2	38%	0.381	C	S	.	.	I	π-helix	trans	-150.9	-45.5	-168.8	58.6	-178.9	117.5	60.9	10.1	114.5	Y1283 E1284 S1313 K1319 N1320 E1321	Y1283-R1317 HydrophobicContact CE1-CG 4.25Å; E1284-R1317 IonicContact OE1-NH2 2.7Å; E1284-R1317 IonicContact OE2-CZ 3.14Å; E1284-R1317 VanDerWaalsContact OE2-CZ 3.26Å; E1284-R1317 IonicContact OE2-NH1 3.27Å; E1284-R1317 PolarHBondContact OE2-NH1 3.35Å; E1284-R1317 IonicContact OE2-NH2 2.73Å; E1284-R1317 PolarHBondContact OE2-NH2 3.36Å; S1313-R1317 PolarHBondContact O-N 3.09Å; R1317-K1319 VanDerWaalsContact C-N 3.25Å; R1317-K1319 PolarHBondContact O-N 3.09Å; R1317-K1319 VanDerWaalsContact O-N 3.1Å; R1317-N1320 PolarHBondContact O-N 3.26Å; R1317-E1321 VanDerWaalsContact CB-OE1 3.29Å; R1317-E1321 WeakPolarHBondContact CB-OE1 3.2Å; R1317-E1321 PolarHBondContact O-N 3.01Å
1318	H	85.1	Confident	77.6	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.009	36%	0.356	C	S	.	.	I	π-helix	trans	-66.8	-21.6	-171.1	-171.9	60.1	0	0	0	114.8	Y1283 C1296 V1302 F1304 S1313 W1314 N1320 E1321 C1322	Y1283-H1318 HydrophobicContact CE1-CB 4.48Å; C1296-H1318 PolarHBondContact SG-NE2 3.08Å; V1302-H1318 VanDerWaalsContact CG2-CE1 3.48Å; V1302-H1318 WeakPolarHBondContact CG2-CE1 3.22Å; F1304-H1318 AromaticContact CZ-CD2 3.74Å; S1313-H1318 PolarHBondContact O-N 3.04Å; S1313-H1318 VanDerWaalsContact OG-CB 3.27Å; S1313-H1318 WeakPolarHBondContact OG-CB 3.45Å; W1314-H1318 AromaticContact CE3-CD2 3.88Å; H1318-N1320 PolarHBondContact O-N 3.4Å; H1318-E1321 WeakPolarHBondContact CA-OE2 2.92Å; H1318-E1321 IonicContact CG-OE2 3.81Å; H1318-E1321 IonicContact ND1-OE2 2.78Å; H1318-E1321 PolarHBondContact ND1-OE2 3.27Å; H1318-C1322 WeakPolarHBondContact O-CB 3.23Å; H1318-C1322 PolarHBondContact O-N 3.41Å
1319	K	83.7	Confident	75.9	Confident	110 Å²	110	69.7 Å²	69.7	48%	0.478	34%	0.342	S	S	.	.	H	α-helix	trans	-55.2	-38.2	170.2	174.6	-175.9	174.4	-166.5	0	111.8	W1314 R1317 Y1323	W1314-K1319 HydrophobicContact CD2-CB 4.29Å; W1314-K1319 HydrophobicContact CZ2-CB 4.28Å; W1314-K1319 HydrophobicContact CZ2-CG 4.19Å; W1314-K1319 WeakPolarHBondContact O-CB 3.48Å; W1314-K1319 PolarHBondContact O-N 3.26Å; R1317-K1319 VanDerWaalsContact C-N 3.25Å; R1317-K1319 PolarHBondContact O-N 3.09Å; R1317-K1319 VanDerWaalsContact O-N 3.1Å; K1319-Y1323 HydrophobicContact CG-CE2 4.38Å; K1319-Y1323 WeakPolarHBondContact O-CD2 3.27Å; K1319-Y1323 WeakPolarHBondContact O-CE2 3.41Å
1320	N	79.5	Confident	74.1	Confident	110 Å²	110	72 Å²	72	59%	0.588	36%	0.356	S	S	*	.	H	α-helix	trans	-83.3	-49.2	-177.3	-63.4	-12.9	0	0	0	110.9	R1317 H1318 C1322 Y1323	R1317-N1320 PolarHBondContact O-N 3.26Å; H1318-N1320 PolarHBondContact O-N 3.4Å; N1320-C1322 VanDerWaalsContact C-N 3.29Å; N1320-C1322 PolarHBondContact O-N 3.17Å; N1320-Y1323 PolarHBondContact O-N 3.23Å; N1320-Y1323 VanDerWaalsContact O-N 3.12Å
1321	E	77.4	Confident	72.2	Confident	58 Å²	58	72.1 Å²	72.1	27%	0.271	36%	0.357	S	S	.	.	H	α-helix	trans	-55.6	-41	178	-59.9	154.1	-170.7	0	0	112.6	Y1283 R1317 H1318 Y1323 L1324	Y1283-E1321 WeakPolarHBondContact CE1-OE2 3.41Å; Y1283-E1321 VanDerWaalsContact OH-CD 3.29Å; Y1283-E1321 PolarHBondContact OH-OE1 3.08Å; Y1283-E1321 PolarHBondContact OH-OE2 3.12Å; Y1283-E1321 VanDerWaalsContact OH-OE2 3.06Å; R1317-E1321 VanDerWaalsContact CB-OE1 3.29Å; R1317-E1321 WeakPolarHBondContact CB-OE1 3.2Å; R1317-E1321 PolarHBondContact O-N 3.01Å; H1318-E1321 WeakPolarHBondContact CA-OE2 2.92Å; H1318-E1321 IonicContact CG-OE2 3.81Å; H1318-E1321 IonicContact ND1-OE2 2.78Å; H1318-E1321 PolarHBondContact ND1-OE2 3.27Å; E1321-Y1323 PolarHBondContact O-N 2.98Å; E1321-Y1323 VanDerWaalsContact O-N 3.09Å; E1321-L1324 PolarHBondContact O-N 3.2Å
1322	C	77.3	Confident	70.2	Confident	2 Å²	2	74 Å²	74	1%	0.014	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.5	-178.6	-174.7	0	0	0	0	113.6	R1298 W1314 H1318 N1320 L1328	R1298-C1322 WeakPolarHBondContact CB-SG 3.47Å; W1314-C1322 HydrophobicContact CH2-CB 4.47Å; W1314-C1322 HydrophobicContact CZ3-CB 4.09Å; H1318-C1322 WeakPolarHBondContact O-CB 3.23Å; H1318-C1322 PolarHBondContact O-N 3.41Å; N1320-C1322 VanDerWaalsContact C-N 3.29Å; N1320-C1322 PolarHBondContact O-N 3.17Å; C1322-L1328 VanDerWaalsContact O-CD1 3.23Å; C1322-L1328 WeakPolarHBondContact O-CD1 3.44Å
1323	Y	66	Low	68.4	Low	92 Å²	92	74 Å²	74	36%	0.361	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-11.3	176	-69.2	-67.8	0	0	0	114	R1298 K1319 N1320 E1321 Q1329	R1298-Y1323 PolarHBondContact NH1-OH 3.3Å; K1319-Y1323 HydrophobicContact CG-CE2 4.38Å; K1319-Y1323 WeakPolarHBondContact O-CD2 3.27Å; K1319-Y1323 WeakPolarHBondContact O-CE2 3.41Å; N1320-Y1323 PolarHBondContact O-N 3.23Å; N1320-Y1323 VanDerWaalsContact O-N 3.12Å; E1321-Y1323 PolarHBondContact O-N 2.98Å; E1321-Y1323 VanDerWaalsContact O-N 3.09Å; Y1323-Q1329 PolarHBondContact O-OE1 3.27Å
1324	L	59.5	Low	66.7	Low	115 Å²	115	83.2 Å²	83.2	60%	0.602	40%	0.396	S	S	*	.			trans	-88.4	4.5	-172.7	-69.2	173	0	0	0	114.2	E1321	E1321-L1324 PolarHBondContact O-N 3.2Å
1325	T	57.9	Low	64.7	Low	11 Å²	11	88.7 Å²	88.7	7%	0.067	42%	0.416	C	S	.	.	S	Bend	trans	-79.2	136	177.3	82.2	0	0	0	0	110	C1299 E1327 L1328 Q1329	C1299-T1325 HydrophobicContact CB-CG2 4.27Å; T1325-E1327 VanDerWaalsContact CB-OE2 3.22Å; T1325-E1327 WeakPolarHBondContact CB-OE2 3.48Å; T1325-E1327 PolarHBondContact O-N 3.44Å; T1325-E1327 VanDerWaalsContact O-N 3.08Å; T1325-E1327 PolarHBondContact OG1-OE2 2.78Å; T1325-L1328 PolarHBondContact O-N 2.87Å; T1325-Q1329 PolarHBondContact O-N 2.83Å
1326	P	54.8	Low	62.3	Low	76 Å²	76	87 Å²	87	49%	0.494	41%	0.409	S	S	.	.	H	α-helix	trans	-54.7	-32.7	-176.3	-28.8	35.5	0	0	0	114.1	L1328 T1330	P1326-L1328 VanDerWaalsContact C-N 3.35Å; P1326-L1328 PolarHBondContact O-N 3.32Å; P1326-T1330 WeakPolarHBondContact O-CG2 3.48Å; P1326-T1330 PolarHBondContact O-N 3.05Å; P1326-T1330 VanDerWaalsContact O-N 3.15Å; P1326-T1330 PolarHBondContact O-OG1 2.91Å
1327	E	52.6	Low	59.7	Low	111 Å²	111	86.9 Å²	86.9	52%	0.519	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-30.8	177.8	-41.7	94.5	167.3	0	0	112.6	R1301 T1325 T1330 E1331	R1301-E1327 IonicContact CZ-OE1 3.13Å; R1301-E1327 IonicContact CZ-OE2 2.67Å; R1301-E1327 IonicContact NH2-OE1 3.08Å; R1301-E1327 PolarHBondContact NH2-OE1 3.35Å; R1301-E1327 IonicContact NH2-OE2 3.26Å; R1301-E1327 PolarHBondContact NH2-OE2 3.04Å; R1301-E1327 VanDerWaalsContact NH2-OE2 3.12Å; T1325-E1327 VanDerWaalsContact CB-OE2 3.22Å; T1325-E1327 WeakPolarHBondContact CB-OE2 3.48Å; T1325-E1327 PolarHBondContact O-N 3.44Å; T1325-E1327 VanDerWaalsContact O-N 3.08Å; T1325-E1327 PolarHBondContact OG1-OE2 2.78Å; E1327-T1330 PolarHBondContact O-OG1 2.85Å; E1327-E1331 VanDerWaalsContact O-CB 3.31Å; E1327-E1331 WeakPolarHBondContact O-CB 3.28Å; E1327-E1331 PolarHBondContact O-N 3.44Å
1328	L	52.1	Low	57.3	Low	51 Å²	51	90.3 Å²	90.3	27%	0.267	44%	0.444	S	S	.	.	H	α-helix	trans	-90.9	-26.1	177.9	-70.9	176.3	0	0	0	112.9	C1299 C1322 T1325 P1326 R1332	C1299-L1328 HydrophobicContact CB-CD1 4.23Å; C1322-L1328 VanDerWaalsContact O-CD1 3.23Å; C1322-L1328 WeakPolarHBondContact O-CD1 3.44Å; T1325-L1328 PolarHBondContact O-N 2.87Å; P1326-L1328 VanDerWaalsContact C-N 3.35Å; P1326-L1328 PolarHBondContact O-N 3.32Å; L1328-R1332 VanDerWaalsContact O-CB 3.3Å; L1328-R1332 WeakPolarHBondContact O-CB 3.46Å; L1328-R1332 PolarHBondContact O-N 2.91Å
1329	Q	54.5	Low	54.7	Low	76 Å²	76	99.6 Å²	99.6	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-54.5	169.8	-146.9	93.5	10.9	0	0	109.6	Y1323 T1325 E1331 R1332 D1333	Y1323-Q1329 PolarHBondContact O-OE1 3.27Å; T1325-Q1329 PolarHBondContact O-N 2.83Å; Q1329-E1331 VanDerWaalsContact C-N 3.33Å; Q1329-E1331 PolarHBondContact O-N 2.98Å; Q1329-R1332 WeakPolarHBondContact O-CA 3.28Å; Q1329-R1332 WeakPolarHBondContact O-CB 3.3Å; Q1329-R1332 PolarHBondContact O-N 2.86Å; Q1329-D1333 VanDerWaalsContact O-CG 3.28Å; Q1329-D1333 PolarHBondContact O-N 3.23Å
1330	T	53.3	Low	52.1	Low	69 Å²	69	100.2 Å²	100.2	42%	0.423	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-35.4	178.3	50.3	0	0	0	0	113.2	P1326 E1327 R1332 R1334	P1326-T1330 WeakPolarHBondContact O-CG2 3.48Å; P1326-T1330 PolarHBondContact O-N 3.05Å; P1326-T1330 VanDerWaalsContact O-N 3.15Å; P1326-T1330 PolarHBondContact O-OG1 2.91Å; E1327-T1330 PolarHBondContact O-OG1 2.85Å; T1330-R1332 VanDerWaalsContact C-N 3.32Å; T1330-R1334 WeakPolarHBondContact O-CB 3.38Å; T1330-R1334 WeakPolarHBondContact O-CD 3.48Å; T1330-R1334 VanDerWaalsContact O-CG 3.24Å; T1330-R1334 WeakPolarHBondContact O-CG 3.48Å; T1330-R1334 PolarHBondContact O-N 3.37Å; T1330-R1334 VanDerWaalsContact O-N 3.13Å
1331	E	50.9	Low	49.6	Very low	66 Å²	66	102.3 Å²	102.3	31%	0.308	51%	0.508	S	S	.	.	H	α-helix	trans	-68.9	-28.7	173.8	-164.5	67	-165.1	0	0	112.7	E1327 Q1329 R1334 R1335	E1327-E1331 VanDerWaalsContact O-CB 3.31Å; E1327-E1331 WeakPolarHBondContact O-CB 3.28Å; E1327-E1331 PolarHBondContact O-N 3.44Å; Q1329-E1331 VanDerWaalsContact C-N 3.33Å; Q1329-E1331 PolarHBondContact O-N 2.98Å; E1331-R1334 IonicContact OE2-NH1 3.48Å; E1331-R1334 PolarHBondContact OE2-NH1 3.5Å; E1331-R1335 VanDerWaalsContact O-CD 3.31Å; E1331-R1335 WeakPolarHBondContact O-CD 3.47Å; E1331-R1335 WeakPolarHBondContact O-CG 3.1Å; E1331-R1335 IonicContact OE1-CZ 3.39Å; E1331-R1335 IonicContact OE1-NE 3.56Å; E1331-R1335 PolarHBondContact OE1-NE 2.93Å; E1331-R1335 IonicContact OE1-NH2 2.68Å; E1331-R1335 PolarHBondContact OE1-NH2 3.02Å
1332	R	48.3	Very low	47.4	Very low	156 Å²	156	104.7 Å²	104.7	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-76.8	-43.7	174.4	-179.4	-179.4	173.6	-178.1	-5.1	111.5	L1328 Q1329 T1330 R1334 R1335 S1336	L1328-R1332 VanDerWaalsContact O-CB 3.3Å; L1328-R1332 WeakPolarHBondContact O-CB 3.46Å; L1328-R1332 PolarHBondContact O-N 2.91Å; Q1329-R1332 WeakPolarHBondContact O-CA 3.28Å; Q1329-R1332 WeakPolarHBondContact O-CB 3.3Å; Q1329-R1332 PolarHBondContact O-N 2.86Å; T1330-R1332 VanDerWaalsContact C-N 3.32Å; R1332-R1334 VanDerWaalsContact C-N 3.25Å; R1332-R1334 PolarHBondContact O-N 3.23Å; R1332-R1335 CarbonylContact O-C 3.51Å; R1332-R1335 WeakPolarHBondContact O-CA 3.46Å; R1332-R1335 PolarHBondContact O-N 3.14Å; R1332-S1336 PolarHBondContact O-N 3.47Å; R1332-S1336 VanDerWaalsContact O-N 3.08Å; R1332-S1336 PolarHBondContact O-OG 3.08Å
1333	D	51.2	Low	45	Very low	102 Å²	102	113.3 Å²	113.3	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-62.5	-35	178.2	-61.9	-26.8	0	0	0	111.4	Q1329 R1335 S1336	Q1329-D1333 VanDerWaalsContact O-CG 3.28Å; Q1329-D1333 PolarHBondContact O-N 3.23Å; D1333-R1335 PolarHBondContact O-N 3.02Å; D1333-S1336 PolarHBondContact O-OG 2.88Å
1334	R	50.8	Low	43.2	Very low	193 Å²	193	116.3 Å²	116.3	73%	0.728	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-19	169.7	-74.7	170.4	179.6	166	1.1	114.6	T1330 E1331 R1332	T1330-R1334 WeakPolarHBondContact O-CB 3.38Å; T1330-R1334 WeakPolarHBondContact O-CD 3.48Å; T1330-R1334 VanDerWaalsContact O-CG 3.24Å; T1330-R1334 WeakPolarHBondContact O-CG 3.48Å; T1330-R1334 PolarHBondContact O-N 3.37Å; T1330-R1334 VanDerWaalsContact O-N 3.13Å; E1331-R1334 IonicContact OE2-NH1 3.48Å; E1331-R1334 PolarHBondContact OE2-NH1 3.5Å; R1332-R1334 VanDerWaalsContact C-N 3.25Å; R1332-R1334 PolarHBondContact O-N 3.23Å
1335	R	46.9	Very low	41.6	Very low	181 Å²	181	115.9 Å²	115.9	68%	0.683	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-2.9	-173.8	-69	175.8	-170.1	-144.8	6.8	113.8	E1331 R1332 D1333 P1337	E1331-R1335 VanDerWaalsContact O-CD 3.31Å; E1331-R1335 WeakPolarHBondContact O-CD 3.47Å; E1331-R1335 WeakPolarHBondContact O-CG 3.1Å; E1331-R1335 IonicContact OE1-CZ 3.39Å; E1331-R1335 IonicContact OE1-NE 3.56Å; E1331-R1335 PolarHBondContact OE1-NE 2.93Å; E1331-R1335 IonicContact OE1-NH2 2.68Å; E1331-R1335 PolarHBondContact OE1-NH2 3.02Å; R1332-R1335 CarbonylContact O-C 3.51Å; R1332-R1335 WeakPolarHBondContact O-CA 3.46Å; R1332-R1335 PolarHBondContact O-N 3.14Å; D1333-R1335 PolarHBondContact O-N 3.02Å; R1335-P1337 WeakPolarHBondContact O-CD 3.48Å
1336	S	35.9	Very low	40	Very low	62 Å²	62	121.2 Å²	121.2	43%	0.434	62%	0.622	S	S	.	*			trans	-85.5	113.2	172	35.4	0	0	0	0	112.1	R1332 D1333 T1338	R1332-S1336 PolarHBondContact O-N 3.47Å; R1332-S1336 VanDerWaalsContact O-N 3.08Å; R1332-S1336 PolarHBondContact O-OG 3.08Å; D1333-S1336 PolarHBondContact O-OG 2.88Å; S1336-T1338 PolarHBondContact O-N 3.36Å; S1336-T1338 VanDerWaalsContact O-N 3.16Å
1337	P	31.4	Very low	38.6	Very low	129 Å²	129	124.7 Å²	124.7	84%	0.838	64%	0.637	S	S	*	*			trans	-87.3	80.2	179.1	35.3	-33.6	0	0	0	111.2	R1335	R1335-P1337 WeakPolarHBondContact O-CD 3.48Å
1338	T	34.4	Very low	37.3	Very low	124 Å²	124	127.9 Å²	127.9	76%	0.761	65%	0.649	S	S	*	*			trans	-124.5	88.6	178	24.7	0	0	0	0	113.1	S1336	S1336-T1338 PolarHBondContact O-N 3.36Å; S1336-T1338 VanDerWaalsContact O-N 3.16Å
1339	K	30	Very low	36.1	Very low	197 Å²	197	134.1 Å²	134.1	86%	0.857	68%	0.677	S	S	*	*			trans	12.3	130.2	138.9	-81.6	178.8	174.4	179.5	0	118.9
1340	V	29.4	Very low	34.9	Very low	124 Å²	124	139.6 Å²	139.6	75%	0.752	70%	0.702	S	S	*	*			trans	78.1	99	149.8	-176.4	0	0	0	0	116.9	P1342	V1340-P1342 HydrophobicContact CG1-CG 4.22Å
1341	L	28	Very low	33.6	Very low	154 Å²	154	143.7 Å²	143.7	81%	0.806	72%	0.721	S	S	*	*			trans	-77.2	144.3	144.6	-116.3	84.6	0	0	0	109.3
1342	P	30.7	Very low	32.9	Very low	108 Å²	108	150.1 Å²	150.1	70%	0.701	75%	0.751	S	S	*	*				-123.7	147.9	129.9	1.7	20.1	0	0	0	111.6	V1340	V1340-P1342 HydrophobicContact CG1-CG 4.22Å
1343	K	27.2	Very low	32.1	Very low	183 Å²	183	151.3 Å²	151.3	80%	0.796	76%	0.763	S	S	*	*			trans	-85.4	129.8	172.6	-63.3	172.2	176.3	177.3	0	110.2
1344	L	28.3	Very low	31.2	Very low	155 Å²	155	151.8 Å²	151.8	81%	0.812	77%	0.772	S	S	*	*			trans	-155.8	108	150.5	-84.4	116.8	0	0	0	106.3
1345	T	24.9	Very low	30	Very low	106 Å²	106	150.1 Å²	150.1	65%	0.65	78%	0.777	S	S	*	*				61.9	107.2	81.1	62.7	0	0	0	0	115.6
1346	T	23.5	Very low	28.9	Very low	122 Å²	122	147 Å²	147	75%	0.748	77%	0.773	S	S	*	*			trans	57.2	108.6	141.8	58.4	0	0	0	0	120.5
1347	N	27.1	Very low	28.5	Very low	149 Å²	149	152.2 Å²	152.2	80%	0.797	80%	0.796	S	S	*	*				177.7	123.4	125.9	-84.7	-26.2	0	0	0	107.3
1348	K	25.1	Very low	28.1	Very low	179 Å²	179	152 Å²	152	78%	0.778	78%	0.784	S	S	*	*				81.7	132.4	61.7	-87.9	-169.8	172.9	-178.4	0	113.9
1349	Q	26.2	Very low	27.7	Very low	182 Å²	182	155.1 Å²	155.1	85%	0.85	79%	0.79	S	S	*	*			trans	74.7	139	169.7	-64.5	155.1	-48.3	0	0	114.3
1350	E	29.5	Very low	27.5	Very low	191 Å²	191	156.3 Å²	156.3	89%	0.893	79%	0.789	S	S	*	*			cis	-130.2	157.9	20	-66.9	174.9	149	0	0	114.3
1351	N	26.8	Very low	27.2	Very low	154 Å²	154	157.3 Å²	157.3	82%	0.824	79%	0.789	S	S	*	*			trans	-116.2	138.3	175	-88.3	-32.2	0	0	0	109.3
1352	H	34.6	Very low	27	Very low	201 Å²	201	157.8 Å²	157.8	93%	0.931	79%	0.786	S	S	*	*			trans	-152	143.7	147.6	-92.8	-67.2	0	0	0	112.4
1353	Q	31.5	Very low	26.7	Very low	182 Å²	182	156.8 Å²	156.8	85%	0.85	78%	0.782	S	S	*	*			trans	-81.5	-171.9	178.5	-68.6	175.6	-32	0	0	110.9
1354	P	33.6	Very low	26.5	Very low	112 Å²	112	155.2 Å²	155.2	73%	0.727	78%	0.782	S	S	*	*			cis	-119.4	-165.8	-5.8	7.5	20.7	0	0	0	112.5
1355	L	25.7	Very low	26.4	Very low	157 Å²	157	156.2 Å²	156.2	82%	0.822	79%	0.787	S	S	*	*			cis	-146.2	163	6.1	-132.8	146.3	0	0	0	110.1
1356	L	23.9	Very low	26.3	Very low	116 Å²	116	156.5 Å²	156.5	61%	0.607	79%	0.785	S	S	*	*			trans	-94.4	149.9	166.3	-117.5	68	0	0	0	109.9	Q1358	L1356-Q1358 HydrophobicContact CD2-CG 3.8Å; L1356-Q1358 HydrophobicContact CG-CG 4.13Å
1357	N	26.6	Very low	26.5	Very low	171 Å²	171	162.4 Å²	162.4	91%	0.914	79%	0.794	S	S	*	*			trans	-142.8	112.6	130.6	-129	-8.9	0	0	0	110.6
1358	Q	23.7	Very low	26.4	Very low	125 Å²	125	160.8 Å²	160.8	58%	0.584	79%	0.785	S	S	*	*			trans	-92.5	130.8	178.2	-70.1	172.5	-16.7	0	0	109.3	L1356	L1356-Q1358 HydrophobicContact CD2-CG 3.8Å; L1356-Q1358 HydrophobicContact CG-CG 4.13Å
1359	Q	25.9	Very low	26.4	Very low	190 Å²	190	160.7 Å²	160.7	89%	0.888	79%	0.792	S	S	*	*			trans	-124.7	85.6	142.1	-76.5	-166.9	-13.4	0	0	108.9
1360	R	24.7	Very low	26.4	Very low	222 Å²	222	161.4 Å²	161.4	84%	0.838	79%	0.793	S	S	*	*			trans	-76.7	111.4	155.8	-79.9	-179.5	171.9	-179.6	-3	107.4
1361	I	24.3	Very low	26.1	Very low	145 Å²	145	158.3 Å²	158.3	74%	0.744	78%	0.782	S	S	*	*			trans	-132.8	101.9	156.2	-62.8	-173.9	0	0	0	109.2
1362	H	23.5	Very low	26.1	Very low	163 Å²	163	159.5 Å²	159.5	76%	0.755	78%	0.782	S	S	*	*			trans	51.8	106.5	143	-76.9	-82.3	0	0	0	121.4
1363	S	23.4	Very low	25.6	Very low	87 Å²	87	156.9 Å²	156.9	61%	0.608	78%	0.775	S	S	*	*				35.1	109.2	116.4	62.8	0	0	0	0	118.3
1364	N	24.3	Very low	25.2	Very low	151 Å²	151	153.3 Å²	153.3	81%	0.807	77%	0.766	S	S	*	*				-156.4	126.1	114.1	-97.6	-29.7	0	0	0	111.1	N1366	N1364-N1366 PolarHBondContact O-N 3.36Å
1365	L	24.6	Very low	24.9	Very low	175 Å²	175	154.3 Å²	154.3	92%	0.916	77%	0.773	S	S	*	*			trans	-65.7	110.6	154	-81.3	88.3	0	0	0	106.9
1366	N	24.5	Very low	24.8	Very low	113 Å²	113	153.1 Å²	153.1	60%	0.604	78%	0.777	S	S	*	*			trans	-152	89.4	165.1	-142.8	-5.2	0	0	0	112.3	N1364 N1368	N1364-N1366 PolarHBondContact O-N 3.36Å; N1366-N1368 WeakPolarHBondContact O-CB 3.46Å; N1366-N1368 PolarHBondContact O-N 3.37Å
1367	W	26.3	Very low	25.2	Very low	246 Å²	246	153.2 Å²	153.2	93%	0.932	78%	0.783	S	S	*	*	S	Bend	trans	45.3	14	135.8	-76.8	75.8	0	0	0	121.7
1368	N	25.1	Very low	25.3	Very low	115 Å²	115	151.7 Å²	151.7	62%	0.615	79%	0.785	S	S	*	*			trans	-111.8	10.3	-172	-77.1	-22.6	0	0	0	115.5	N1366 F1370	N1366-N1368 WeakPolarHBondContact O-CB 3.46Å; N1366-N1368 PolarHBondContact O-N 3.37Å; N1368-F1370 PolarHBondContact O-N 3.15Å
1369	L	25.6	Very low	25.8	Very low	176 Å²	176	150.1 Å²	150.1	92%	0.921	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	34.2	179.3	-148.4	80.7	0	0	0	113.9
1370	F	25.9	Very low	26	Very low	198 Å²	198	144.8 Å²	144.8	87%	0.868	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	3	-177.4	-134.1	-91	0	0	0	113	N1368	N1368-F1370 PolarHBondContact O-N 3.15Å
1371	N	24.2	Very low	26.3	Very low	126 Å²	126	142.2 Å²	142.2	67%	0.674	78%	0.781	S	S	*	*			trans	-128.9	23.7	-163.7	-88.8	-14.2	0	0	0	116.4
1372	H	25.6	Very low	26.4	Very low	178 Å²	178	143.6 Å²	143.6	82%	0.824	78%	0.782	S	S	*	*			trans	-103.9	20.2	-179.4	-96.3	-60.5	0	0	0	116.3	T1374	H1372-T1374 VanDerWaalsContact C-N 3.28Å; H1372-T1374 PolarHBondContact O-N 3.23Å; H1372-T1374 VanDerWaalsContact O-N 3.11Å
1373	L	25.5	Very low	26.8	Very low	147 Å²	147	141.5 Å²	141.5	77%	0.77	78%	0.775	S	S	*	*			trans	-82.2	71.3	166	-82.9	165.3	0	0	0	110.9	F1382	L1373-F1382 HydrophobicContact CB-CZ 4.4Å
1374	T	23.7	Very low	27	Very low	107 Å²	107	140 Å²	140	66%	0.656	77%	0.774	S	S	*	*			trans	-135	91.9	172.4	41.8	0	0	0	0	111.8	H1372	H1372-T1374 VanDerWaalsContact C-N 3.28Å; H1372-T1374 PolarHBondContact O-N 3.23Å; H1372-T1374 VanDerWaalsContact O-N 3.11Å
1375	C	26.7	Very low	27	Very low	132 Å²	132	140 Å²	140	89%	0.892	77%	0.773	S	S	*	*			trans	-136.6	125.8	152.6	-91.6	0	0	0	0	107.9
1376	C	24.2	Very low	27.2	Very low	133 Å²	133	137.9 Å²	137.9	90%	0.899	76%	0.76	S	S	*	*			trans	-81.5	136.7	-166.5	-55.7	0	0	0	0	112.4
1377	T	31.7	Very low	27.3	Very low	118 Å²	118	141.5 Å²	141.5	72%	0.724	77%	0.767	S	S	*	*			trans	-128.4	141	155.1	53.6	0	0	0	0	109	S1379	T1377-S1379 PolarHBondContact O-N 2.83Å
1378	S	29.3	Very low	27.4	Very low	138 Å²	138	135 Å²	135	97%	0.965	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	31	-162.6	52.7	0	0	0	0	116
1379	S	34	Very low	27.7	Very low	92 Å²	92	133 Å²	133	64%	0.643	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.1	-5	-173.1	58.5	0	0	0	0	116.4	T1377 E1381	T1377-S1379 PolarHBondContact O-N 2.83Å; S1379-E1381 PolarHBondContact O-N 3.12Å
1380	G	29	Very low	27.9	Very low	78 Å²	78	129.8 Å²	129.8	80%	0.804	73%	0.732	S	S	*	*			trans	74.1	7.6	161.9	0	0	0	0	0	118.9
1381	E	31.4	Very low	28.2	Very low	168 Å²	168	130.5 Å²	130.5	79%	0.785	73%	0.731	S	S	*	*			trans	-96.9	119.7	179.5	-65.5	-166.3	153	0	0	113.5	S1379	S1379-E1381 PolarHBondContact O-N 3.12Å
1382	F	25.4	Very low	28.6	Very low	174 Å²	174	129.2 Å²	129.2	76%	0.763	72%	0.724	S	S	*	*			trans	-103.6	108.6	174.9	-126.4	-87.7	0	0	0	109.8	L1373	L1373-F1382 HydrophobicContact CB-CZ 4.4Å
1383	I	32.2	Very low	29	Very low	119 Å²	119	129.7 Å²	129.7	61%	0.61	72%	0.72	S	S	*	*			trans	-97.9	102.7	176.9	-62	176.5	0	0	0	109.9
1384	G	27.3	Very low	29.6	Very low	56 Å²	56	129.1 Å²	129.1	58%	0.577	71%	0.713	S	S	*	*			trans	-74.2	141	169	0	0	0	0	0	112	I1386	G1384-I1386 PolarHBondContact O-N 3.5Å
1385	I	25.3	Very low	30.5	Very low	152 Å²	152	131.1 Å²	131.1	78%	0.779	71%	0.71	S	S	*	*			trans	-73.7	115.9	-178.2	-58.9	167.5	0	0	0	110.3	Y1387	I1385-Y1387 HydrophobicContact CG2-CD2 3.95Å; I1385-Y1387 HydrophobicContact CG2-CE2 3.94Å
1386	I	27.6	Very low	31.1	Very low	129 Å²	129	130.6 Å²	130.6	66%	0.662	70%	0.697	S	S	*	*			trans	-115	128.2	167.8	-60.7	-176.4	0	0	0	110.1	G1384	G1384-I1386 PolarHBondContact O-N 3.5Å
1387	Y	27.3	Very low	32	Very low	190 Å²	190	128.5 Å²	128.5	75%	0.745	68%	0.677	S	S	*	*			trans	-92.9	123.2	175.3	-90.6	-110.9	0	0	0	110.5	I1385	I1385-Y1387 HydrophobicContact CG2-CD2 3.95Å; I1385-Y1387 HydrophobicContact CG2-CE2 3.94Å
1388	H	27.6	Very low	32.8	Very low	109 Å²	109	128.2 Å²	128.2	51%	0.505	67%	0.671	S	S	.	*			trans	-76.6	161.1	166.2	-149.8	-140.8	0	0	0	110.4	E1047	E1047-H1388 IonicContact OE1-CE1 2.81Å; E1047-H1388 PolarHBondContact OE1-CE1 3.26Å; E1047-H1388 VanDerWaalsContact OE1-CE1 3.32Å; E1047-H1388 IonicContact OE1-ND1 3.93Å; E1047-H1388 PolarHBondContact OE1-ND1 3.41Å
1389	P	32.7	Very low	33.8	Very low	74 Å²	74	127.2 Å²	127.2	48%	0.481	65%	0.651	S	S	.	*	S	Bend		-129.2	150.1	-93	41.4	-26.5	0	0	0	113.9
1390	S	29.1	Very low	34.5	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	64%	0.642	S	S	*	*	S	Bend	trans	-163.3	-23.4	158.1	-73.3	0	0	0	0	113.7
1391	Y	32.5	Very low	35.2	Very low	212 Å²	212	127.7 Å²	127.7	83%	0.831	62%	0.619	S	S	*	*	S	Bend	trans	-139.7	1.7	-165.4	-84.2	-75.7	0	0	0	117.8
1392	N	32.6	Very low	36.2	Very low	99 Å²	99	126.6 Å²	126.6	53%	0.529	61%	0.611	S	S	.	*			trans	-114.4	-0.5	-169.7	-85.7	-16.8	0	0	0	117.1	Q1394 Y1395	N1392-Q1394 PolarHBondContact O-N 2.98Å; N1392-Q1394 VanDerWaalsContact O-N 3.11Å; N1392-Y1395 WeakPolarHBondContact O-CB 3.47Å; N1392-Y1395 PolarHBondContact O-N 3.35Å
1393	Y	33.5	Very low	37.4	Very low	189 Å²	189	124.6 Å²	124.6	74%	0.741	61%	0.607	S	S	*	*	H	α-helix	trans	-54.8	-31.4	170.6	-96.6	-82.6	0	0	0	112.1	Y1395 L1396 L1397	Y1393-Y1395 PolarHBondContact O-N 3.13Å; Y1393-L1396 PolarHBondContact O-N 3.12Å; Y1393-L1397 WeakPolarHBondContact O-CB 3.35Å; Y1393-L1397 PolarHBondContact O-N 3.49Å; Y1393-L1397 VanDerWaalsContact O-N 3.14Å
1394	Q	39.1	Very low	38.6	Very low	134 Å²	134	121.5 Å²	121.5	63%	0.626	59%	0.592	S	S	*	*	H	α-helix	trans	-63.7	-20.1	176.3	-155	139.2	24.4	0	0	114.2	N1392 N1398	N1392-Q1394 PolarHBondContact O-N 2.98Å; N1392-Q1394 VanDerWaalsContact O-N 3.11Å; Q1394-N1398 WeakPolarHBondContact O-CB 3.31Å; Q1394-N1398 PolarHBondContact O-N 3.06Å; Q1394-N1398 PolarHBondContact O-ND2 2.98Å; Q1394-N1398 PolarHBondContact O-OD1 2.75Å
1395	Y	41.1	Very low	40.1	Very low	149 Å²	149	128.4 Å²	128.4	58%	0.584	61%	0.609	S	S	*	*	H	α-helix	trans	-77.6	-45.8	178.6	-172.3	-101.6	0	0	0	112.2	N1392 Y1393 N1398 H1399	N1392-Y1395 WeakPolarHBondContact O-CB 3.47Å; N1392-Y1395 PolarHBondContact O-N 3.35Å; Y1393-Y1395 PolarHBondContact O-N 3.13Å; Y1395-N1398 PolarHBondContact O-N 3.2Å; Y1395-H1399 AromaticContact CD2-CD2 3.91Å; Y1395-H1399 AromaticContact CE1-CD2 3.9Å; Y1395-H1399 AromaticContact CE2-CD2 3.47Å; Y1395-H1399 VanDerWaalsContact CE2-CD2 3.47Å; Y1395-H1399 WeakPolarHBondContact CE2-CD2 3.44Å; Y1395-H1399 AromaticContact CE2-NE2 3.54Å; Y1395-H1399 AromaticContact CZ-CD2 3.46Å; Y1395-H1399 VanDerWaalsContact CZ-CD2 3.46Å; Y1395-H1399 AromaticContact CZ-NE2 3.66Å; Y1395-H1399 WeakPolarHBondContact O-CB 3.2Å; Y1395-H1399 PolarHBondContact O-N 3.28Å; Y1395-H1399 VanDerWaalsContact O-N 3.12Å
1396	L	40.4	Very low	41.9	Very low	121 Å²	121	127 Å²	127	63%	0.634	60%	0.603	S	S	*	*	H	α-helix	trans	-66.7	-43	174.8	-100	150.8	0	0	0	111.4	Y1393 H1399 Y1400	Y1393-L1396 PolarHBondContact O-N 3.12Å; L1396-H1399 PolarHBondContact O-N 3.29Å; L1396-Y1400 HydrophobicContact CD2-CD2 4.12Å; L1396-Y1400 PolarHBondContact O-N 2.68Å; L1396-Y1400 VanDerWaalsContact O-N 3.12Å
1397	L	43.4	Very low	42.9	Very low	89 Å²	89	123.3 Å²	123.3	47%	0.466	60%	0.597	S	S	.	*	H	α-helix	trans	-58.7	-50.5	172.7	-84.5	157	0	0	0	111.8	Y1393 H1399 M1401	Y1393-L1397 WeakPolarHBondContact O-CB 3.35Å; Y1393-L1397 PolarHBondContact O-N 3.49Å; Y1393-L1397 VanDerWaalsContact O-N 3.14Å; L1397-H1399 VanDerWaalsContact C-N 3.34Å; L1397-H1399 PolarHBondContact O-N 3.16Å; L1397-M1401 HydrophobicContact CD2-SD 3.79Å; L1397-M1401 WeakPolarHBondContact O-CB 3.31Å; L1397-M1401 PolarHBondContact O-N 3.34Å; L1397-M1401 VanDerWaalsContact O-N 3.13Å
1398	N	48.6	Very low	43.8	Very low	113 Å²	113	120.1 Å²	120.1	60%	0.604	59%	0.588	S	S	*	*	H	α-helix	trans	-70.1	-23	-177.1	-72.1	-7.3	0	0	0	114.7	Q1394 Y1395	Q1394-N1398 WeakPolarHBondContact O-CB 3.31Å; Q1394-N1398 PolarHBondContact O-N 3.06Å; Q1394-N1398 PolarHBondContact O-ND2 2.98Å; Q1394-N1398 PolarHBondContact O-OD1 2.75Å; Y1395-N1398 PolarHBondContact O-N 3.2Å
1399	H	49.3	Very low	44.7	Very low	116 Å²	116	119.8 Å²	119.8	54%	0.537	59%	0.589	S	S	.	*	H	α-helix	trans	-94.2	-33.9	-178.4	-92.7	-60.5	0	0	0	114.7	Y1395 L1396 L1397	Y1395-H1399 AromaticContact CD2-CD2 3.91Å; Y1395-H1399 AromaticContact CE1-CD2 3.9Å; Y1395-H1399 AromaticContact CE2-CD2 3.47Å; Y1395-H1399 VanDerWaalsContact CE2-CD2 3.47Å; Y1395-H1399 WeakPolarHBondContact CE2-CD2 3.44Å; Y1395-H1399 AromaticContact CE2-NE2 3.54Å; Y1395-H1399 AromaticContact CZ-CD2 3.46Å; Y1395-H1399 VanDerWaalsContact CZ-CD2 3.46Å; Y1395-H1399 AromaticContact CZ-NE2 3.66Å; Y1395-H1399 WeakPolarHBondContact O-CB 3.2Å; Y1395-H1399 PolarHBondContact O-N 3.28Å; Y1395-H1399 VanDerWaalsContact O-N 3.12Å; L1396-H1399 PolarHBondContact O-N 3.29Å; L1397-H1399 VanDerWaalsContact C-N 3.34Å; L1397-H1399 PolarHBondContact O-N 3.16Å
1400	Y	49.4	Very low	45.4	Very low	116 Å²	116	120.8 Å²	120.8	46%	0.455	59%	0.589	S	S	.	*	H	α-helix	trans	-114.9	-12.7	-172.7	-67.7	-84.5	0	0	0	114.8	L1396 I1411 G1412	L1396-Y1400 HydrophobicContact CD2-CD2 4.12Å; L1396-Y1400 PolarHBondContact O-N 2.68Å; L1396-Y1400 VanDerWaalsContact O-N 3.12Å; Y1400-I1411 WeakPolarHBondContact O-CA 3.48Å; Y1400-G1412 PolarHBondContact O-N 3.18Å
1401	M	43.5	Very low	46.4	Very low	65 Å²	65	120.5 Å²	120.5	32%	0.32	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	115.9	168.6	-74.2	-173.3	168.8	0	0	110.3	L1397 I1409 I1410 I1411	L1397-M1401 HydrophobicContact CD2-SD 3.79Å; L1397-M1401 WeakPolarHBondContact O-CB 3.31Å; L1397-M1401 PolarHBondContact O-N 3.34Å; L1397-M1401 VanDerWaalsContact O-N 3.13Å; M1401-I1409 HydrophobicContact CB-CG2 4.03Å; M1401-I1409 HydrophobicContact CE-CG2 4.31Å; M1401-I1409 HydrophobicContact CG-CG2 3.81Å; M1401-I1409 HydrophobicContact SD-CG2 3.92Å; M1401-I1410 WeakPolarHBondContact CA-O 3.48Å; M1401-I1411 HydrophobicContact CE-CD1 4.25Å; M1401-I1411 HydrophobicContact CE-CG1 4.31Å
1402	K	51.3	Low	47.1	Very low	145 Å²	145	112.2 Å²	112.2	63%	0.63	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.5	126.6	168	-78.1	-174.6	176.1	-179.1	0	109.7	I1410	K1402-I1410 HydrophobicContact CB-CB 4.43Å; K1402-I1410 PolarHBondContact N-O 2.87Å; K1402-I1410 WeakPolarHBondContact O-CB 3.24Å; K1402-I1410 PolarHBondContact O-N 3.13Å
1403	I	51.5	Low	47.5	Very low	132 Å²	132	113.9 Å²	113.9	68%	0.677	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79	125.8	166.9	-56.8	175.3	0	0	0	107	H1408	I1403-H1408 WeakPolarHBondContact CA-O 3.46Å
1404	N	56.8	Low	48	Very low	53 Å²	53	112.7 Å²	112.7	28%	0.283	57%	0.566	S	S	.	*			trans	-82.1	175.2	174.2	80.7	-5.3	0	0	0	111.6	N1406 G1407 H1408 I1410	N1404-N1406 PolarHBondContact O-N 3.48Å; N1404-N1406 WeakPolarHBondContact OD1-CA 3.45Å; N1404-N1406 WeakPolarHBondContact OD1-CB 3.49Å; N1404-N1406 PolarHBondContact OD1-N 3.37Å; N1404-G1407 PolarHBondContact O-N 2.76Å; N1404-G1407 PolarHBondContact OD1-N 2.92Å; N1404-H1408 PolarHBondContact N-O 2.98Å; N1404-H1408 WeakPolarHBondContact OD1-CB 3.45Å; N1404-H1408 PolarHBondContact OD1-N 3.43Å; N1404-I1410 HydrophobicContact CB-CD1 3.86Å; N1404-I1410 HydrophobicContact CB-CG1 4.29Å
1405	E	60.5	Low	48	Very low	202 Å²	202	116.2 Å²	116.2	94%	0.944	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-18.1	-179.2	-62.8	169.5	-135	0	0	113.7
1406	N	62	Low	47.9	Very low	123 Å²	123	110.8 Å²	110.8	66%	0.658	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	7.2	179.1	-59.4	-9.7	0	0	0	113.3	N1404 H1408	N1404-N1406 PolarHBondContact O-N 3.48Å; N1404-N1406 WeakPolarHBondContact OD1-CA 3.45Å; N1404-N1406 WeakPolarHBondContact OD1-CB 3.49Å; N1404-N1406 PolarHBondContact OD1-N 3.37Å; N1406-H1408 VanDerWaalsContact C-N 3.32Å; N1406-H1408 PolarHBondContact O-N 3.02Å
1407	G	49.3	Very low	47.4	Very low	51 Å²	51	115.1 Å²	115.1	53%	0.526	59%	0.586	S	S	.	*	S	Bend	trans	79.5	4.5	-178.1	0	0	0	0	0	115.4	N1404	N1404-G1407 PolarHBondContact O-N 2.76Å; N1404-G1407 PolarHBondContact OD1-N 2.92Å
1408	H	45.4	Very low	47	Very low	123 Å²	123	112.7 Å²	112.7	57%	0.569	58%	0.583	S	S	*	*			trans	-79.2	135.8	176.1	-56.6	154	0	0	0	111.4	I1403 N1404 N1406 I1410	I1403-H1408 WeakPolarHBondContact CA-O 3.46Å; N1404-H1408 PolarHBondContact N-O 2.98Å; N1404-H1408 WeakPolarHBondContact OD1-CB 3.45Å; N1404-H1408 PolarHBondContact OD1-N 3.43Å; N1406-H1408 VanDerWaalsContact C-N 3.32Å; N1406-H1408 PolarHBondContact O-N 3.02Å; H1408-I1410 PolarHBondContact O-N 3.44Å
1409	I	46.9	Very low	46.1	Very low	101 Å²	101	115.8 Å²	115.8	52%	0.518	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.2	108.7	175.1	-56.9	172.6	0	0	0	108.9	M1401 I1411	M1401-I1409 HydrophobicContact CB-CG2 4.03Å; M1401-I1409 HydrophobicContact CE-CG2 4.31Å; M1401-I1409 HydrophobicContact CG-CG2 3.81Å; M1401-I1409 HydrophobicContact SD-CG2 3.92Å; I1409-I1411 HydrophobicContact CG2-CG1 4.09Å
1410	I	47.8	Very low	45.5	Very low	95 Å²	95	119.3 Å²	119.3	49%	0.487	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.9	116.6	168.8	-56.6	176.7	0	0	0	108	M1401 K1402 N1404 H1408	M1401-I1410 WeakPolarHBondContact CA-O 3.48Å; K1402-I1410 HydrophobicContact CB-CB 4.43Å; K1402-I1410 PolarHBondContact N-O 2.87Å; K1402-I1410 WeakPolarHBondContact O-CB 3.24Å; K1402-I1410 PolarHBondContact O-N 3.13Å; N1404-I1410 HydrophobicContact CB-CD1 3.86Å; N1404-I1410 HydrophobicContact CB-CG1 4.29Å; H1408-I1410 PolarHBondContact O-N 3.44Å
1411	I	50.4	Low	44.7	Very low	103 Å²	103	118.6 Å²	118.6	53%	0.528	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.7	121.7	174.7	-56.7	175.2	0	0	0	108.5	Y1400 M1401 I1409	Y1400-I1411 WeakPolarHBondContact O-CA 3.48Å; M1401-I1411 HydrophobicContact CE-CD1 4.25Å; M1401-I1411 HydrophobicContact CE-CG1 4.31Å; I1409-I1411 HydrophobicContact CG2-CG1 4.09Å
1412	G	46.7	Very low	44	Very low	37 Å²	37	122.5 Å²	122.5	38%	0.381	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-75.4	136.6	175.8	0	0	0	0	0	112.4	Y1400	Y1400-G1412 PolarHBondContact O-N 3.18Å
1413	T	41.2	Very low	43	Very low	135 Å²	135	124.7 Å²	124.7	83%	0.828	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-76.5	129.2	179.5	45.4	0	0	0	0	112.4
1414	Y	43	Very low	42.6	Very low	163 Å²	163	124.4 Å²	124.4	64%	0.639	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-93.8	123.5	174.4	-176.6	-102.8	0	0	0	110.1
1415	K	40.7	Very low	41.9	Very low	208 Å²	208	128.1 Å²	128.1	90%	0.904	68%	0.678	S	S	*	*			trans	-101.4	76.4	176	-72.7	-171.6	176.2	-174.5	0	110.5
1416	G	37.6	Very low	40.8	Very low	35 Å²	35	124 Å²	124	36%	0.361	66%	0.663	S	S	.	*			trans	-136	139.6	172.7	0	0	0	0	0	110.8	G1418	G1416-G1418 PolarHBondContact O-N 2.98Å; G1416-G1418 VanDerWaalsContact O-N 3.13Å
1417	E	30.9	Very low	39.6	Very low	213 Å²	213	124.1 Å²	124.1	100%	0.995	66%	0.664	S	S	*	*	S	Bend	trans	-74	100.6	178.6	-66.1	-178	162.3	0	0	109.9
1418	G	34.6	Very low	39	Very low	38 Å²	38	128.6 Å²	128.6	39%	0.392	67%	0.672	S	S	.	*	S	Bend	trans	176.1	134.4	178	0	0	0	0	0	111.2	G1416 Y1420	G1416-G1418 PolarHBondContact O-N 2.98Å; G1416-G1418 VanDerWaalsContact O-N 3.13Å; G1418-Y1420 VanDerWaalsContact C-N 3.32Å; G1418-Y1420 WeakPolarHBondContact O-CD2 3.4Å; G1418-Y1420 PolarHBondContact O-N 3Å
1419	N	30.4	Very low	38.6	Very low	177 Å²	177	129 Å²	129	95%	0.947	68%	0.679	S	S	*	*			trans	-74.2	81.8	-178.5	-76.9	-21	0	0	0	111.4
1420	Y	36	Very low	38	Very low	190 Å²	190	131 Å²	131	75%	0.745	69%	0.691	S	S	*	*			trans	-103.7	102.7	172.6	-60.4	-74.8	0	0	0	110.6	G1418	G1418-Y1420 VanDerWaalsContact C-N 3.32Å; G1418-Y1420 WeakPolarHBondContact O-CD2 3.4Å; G1418-Y1420 PolarHBondContact O-N 3Å
1421	S	31.5	Very low	37.2	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	71%	0.706	S	S	*	*			trans	-83.7	123.3	165.7	39.3	0	0	0	0	110.2
1422	L	29.4	Very low	36.1	Very low	146 Å²	146	136.3 Å²	136.3	76%	0.764	72%	0.721	S	S	*	*			trans	-73.1	124.8	164.5	-115	83	0	0	0	108.6
1423	I	31.2	Very low	35.1	Very low	192 Å²	192	145.4 Å²	145.4	99%	0.985	75%	0.752	S	S	*	*			trans	-118.4	0	169	-52.6	174.6	0	0	0	109.4	K1042	K1042-I1423 PolarHBondContact NZ-O 3.22Å

Retrieved 1,423 of 1,423 residues in 1414.4 ms (Link to these results)

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