A0A3Q0KR84_SCHMA Loading...

Voltage-dependent L-type calcium channel subunit alpha AlphaSync

Voltage-sensitive calcium channels (VSCC) mediate the entry of calcium ions into excitable cells and are also involved in a variety of calcium-dependent processes, including muscle contraction, hormone or neurotransmitter release, gene expression, cell motility, cell division and cell death.

AlphaFold DB , UniProt , Accession A0A3Q0KR84, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,563 aa.

						>A0A3Q0KR84_SCHMA|A0A3Q0KR84
MNIGQNLQPDGFQPESLRSDPLTREHNNQSRESNSDYIFKNIHQYEQEEKVVNNINGPLYADSTALTSVMSDRQSHAPNQNLLSDTGLHTRTSVTNTTGVTGLSGIAGIAAAAANQQGKPLNLAALTLAAQSVAAKKRAGARAQAANTRPERTLFCLTLRNSLRKVCIKIGEWKPFEYLILLTIMANCCALGAITPYPDGDSNTLNHILEKIENVFIVIFTVECVLKIIAFGFVMHPGAYLRNAWNILDFTIVILGLLQPLIQQMVEQSGVDVKALRAFRVLRPLRLVSGLPSLQVVLNSIMRAMVPLLHIALLVIFVIIIYAIVGLELFSGKLHATCYDFITGEIEDNPSPCSLNQRGALCTGATICYDFKLDMSYAAVAERKQLAEAILAGNITPPLPQPERWVGPNYGITNFDNFGLSMLTVFQCITMEGWTQVLYWVNDSQGMLYPWIYFISMIIIGSFFVMNLVLGVLSGEFSKEREKAKKRGKYQKAREQMQFEEDVQGYLDWISAAEDISDDEETTNKEDEKEKKFHWCAACRTTSSSATDDFEEEEEDPSEHGLDDGGGGHRSQSSSQQHQYFFCIPLKGRRSRRWNRRCRRSCRRLVKSQTFYWIVIVLVFLNTGVLTSEHYGQPLWLDDFQDMANIVFVVLFSIEMLIKMYSLGIRCYFDFMFNRFDFFVVICSIIEVVLIQTKVMPPLGVSVLRCARLLRVFKVTRYWSSLRNLVGSLLASLKSIVSLLVLLFLFIVIFALLGMQLFGGRFNFPREEKPRSNFDSFYQSLITVFQILTSEDWNEAMYNGIRSYSNSRVGIMVCLYYVILFICGNYILLNVFLAIAVDNLADTGQIEEKKEETDNGDKSNNNENEVTRSEDIIEGERDKDNRIYQSIDDRKTSTTTTTIINTESKLTEVHHEFNDVTQLLDQLNLDPIIEEGDADRRLFDREDKRRTDDMDDDGDDLKEDQSRDSHDDNDNDDDRSVDENDKMKDTTSSRRHSEISSTKKIKPIPNASSFFIFNPTNPFRVACHEVCNHSYFNNIVLVCILVSSAMLAAEDPLDASSARNQILNYFDYFFTSVFTVEITLKIITYGLVLHKGAFCRSANNMLDFMVVLTSIISYPIDIDTISVVKILRVSRVLRPLRAINRAKGLKHVVQCVVVAVKSIGKIMMVTFLLEFMFAVIGVQLFAGKFHSCTDSSRLVPSQCHGQYITYELGDISRPVVLARVWLNNPLNFDNVPNAMLTLFAVSTFEGWPGLLYRSIDSYAEDYGSVYNNRPIVVIFYVAYIIVIAFFMINIFVGFVIVTFQQEGEQEYRNCELDKNQRKCIEFALKARPVKRYIPKENFQYRIWWFITSQPFEYCIFIFILINTISLAMKVEGQPNAYADALDYLNMIFTGVFTVEFVLKLTAFGFKNYFSDPWNVFDFIIVVGSFVDINMSHLAANSKFISINFFRLFRVMRLVKLLNRGEGIRTLLWTFVKSFQALPYVALLIIMLFFIYAVIGMQMFGKIALINPDSSINRNNNFQTFPQSLLVLFRSATGEAWQEIMLSCVNDHTVKCDRFSDTEMKAIRSFLDEQQHVILTNTSSTQHILVKQNGNISTESSTPFLTSIDDLTEYNQPSVSLYSHERDNHSIWDVLNNGLIDNNHNSLFAYSHPSNLLAVENPTIEKDWSSSFPSVENIHPPDDVIYSPDFVTRYRQSREINDQNATVPSISTQLSLSSSLKPVHIQPMHSSVEELDERTISLKKLDELGYNGPRATCGSNFAYPYFISFYMVCSFLIINLFVAVIMDNFDYLTRDWSILGPHHLDEFIRLWSEYDPEAKGRIKHLDVVTLLRKISPPLGFGKLCPHRTACVTLVRMNMPLNSDGTVMFNATLFALVRTNLKIKTEELRAVIKKIWKRTSNKLLDQLVPPAGGNNDVTVGKFYATFLIQEWFRRWKQKKAEEQKALLHGQGKRHSIMPFKSFGRPTTGPLETQNTSMNILLPPSEETSKRGSSGSLGDGDTHHSLLDSVKNVIHRVGSSRRHSEVSQCNEREKILHSYKPSLESADKKLSMISNDHLQSNQTTKLNTSKVLIPDHLNPTAQRIMLPTISQGSHEDEDIDNGGIGGLNKLMDGNIMNIEKFNTSNGKYHSINPSKRIENGFTVNGLPQKQYPLKTTDWNTTIYTDRNNPKNRPLSTLTHGSNSALCKSTDFSDVPYTHDPVLPISSLYKSNKYNKSKSINLINELQNEGNDLTNLITVRDNMNERDSRSDDIEEEEEEEEEEDLFTTIRSETPSPAPSIAAAILRPNYYPNLVENKSIKHRNTINPLDFTVYTSIPRNLIINKLMNKYGNTSGYSNGTVNKDLEELLNLPKTMWTACLPDVQPVNGNSHSTRGLKNYKRQLPQIPSEVNKIDARDTSNLCQISTSMGIKGRYSLLSDVLKMNTTKSGLMRAPQTNEKSQINDGISVVPYQPPSIDPHGPAPNPPVYCSSFTEPIMWSPRHDIEATGMNRELSQIYLKQPTTPRQNWLNQLVINDLNESDLIMNYKSIEEDWTHLDLPLQHLAPSSSSPPPPPAPKPILLNINEDLSKFNY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	27.8	Very low	29.9	Very low	217 Å²	217	147.7 Å²	147.7	100%	1.069	83%	0.832	S	S	*	*				0	146.7	0	-100.9	176.6	166.5	0	0	107.8
2	N	33.2	Very low	29.6	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	83%	0.828	S	S	*	*			trans	57.6	93.8	-157.9	-58.1	-1.7	0	0	0	110
3	I	27.8	Very low	29.3	Very low	168 Å²	168	151 Å²	151	86%	0.862	82%	0.821	S	S	*	*			cis	63.1	106.7	41.5	-47.1	175.7	0	0	0	111.1
4	G	33.9	Very low	29.5	Very low	71 Å²	71	147.8 Å²	147.8	73%	0.732	81%	0.812	S	S	*	*			trans	177.2	42.5	-175.1	0	0	0	0	0	117.4
5	Q	32.5	Very low	29.3	Very low	179 Å²	179	149.6 Å²	149.6	84%	0.836	81%	0.812	S	S	*	*			trans	54.9	109.8	158.3	-66	170.9	-16.7	0	0	118.2
6	N	29.4	Very low	29.1	Very low	154 Å²	154	146.7 Å²	146.7	82%	0.824	81%	0.806	S	S	*	*				59.6	103.2	88.3	-70.2	5.1	0	0	0	115.2
7	L	31.2	Very low	29	Very low	178 Å²	178	147.4 Å²	147.4	93%	0.932	81%	0.808	S	S	*	*				-167.2	129.5	123.1	-104.6	159.4	0	0	0	112.8
8	Q	27.5	Very low	29.1	Very low	177 Å²	177	151 Å²	151	83%	0.827	81%	0.807	S	S	*	*			trans	-94.4	176.9	166.3	-108.9	174.8	-65.1	0	0	108.9
9	P	32.3	Very low	29.1	Very low	89 Å²	89	147.7 Å²	147.7	58%	0.578	80%	0.797	S	S	*	*			cis	-134.8	-166.3	-14.2	40.3	-21.7	0	0	0	113.2
10	D	25.6	Very low	29	Very low	158 Å²	158	147.4 Å²	147.4	85%	0.845	80%	0.795	S	S	*	*			trans	47	134.2	149.3	-50	-29.6	0	0	0	122.2
11	G	28.2	Very low	29.2	Very low	79 Å²	79	145.1 Å²	145.1	81%	0.814	79%	0.788	S	S	*	*			trans	158.1	58.1	163.6	0	0	0	0	0	120.5
12	F	25.8	Very low	29.4	Very low	180 Å²	180	141.9 Å²	141.9	79%	0.789	77%	0.774	S	S	*	*			trans	7.8	118	152	-123.1	-109.3	0	0	0	121.8
13	Q	26.2	Very low	29.1	Very low	158 Å²	158	140 Å²	140	74%	0.738	77%	0.769	S	S	*	*			trans	56.2	179.7	140.7	-64.3	-166.3	-34.2	0	0	119.6
14	P	31.6	Very low	29.2	Very low	106 Å²	106	142.2 Å²	142.2	69%	0.688	77%	0.766	S	S	*	*				-130.3	-175.4	-70.6	41.4	-26.4	0	0	0	114
15	E	26.1	Very low	28.7	Very low	175 Å²	175	145.7 Å²	145.7	82%	0.818	76%	0.764	S	S	*	*			trans	60.1	125.6	158	-75	-148.7	111.9	0	0	123
16	S	26.5	Very low	28.3	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	76%	0.759	S	S	*	*			trans	73	117.2	136.3	79.5	0	0	0	0	120.3
17	L	27.4	Very low	28.1	Very low	158 Å²	158	143.5 Å²	143.5	83%	0.827	75%	0.752	S	S	*	*			trans	-166.7	133.5	137.5	-115.7	163.4	0	0	0	112.6
18	R	31	Very low	27.8	Very low	213 Å²	213	140.1 Å²	140.1	80%	0.804	74%	0.735	S	S	*	*			trans	68.4	103.7	159.2	-168	171.6	-70.3	149.8	0.4	117.7
19	S	28.4	Very low	27.6	Very low	88 Å²	88	138.6 Å²	138.6	62%	0.615	73%	0.728	S	S	*	*			cis	95.4	146.6	24.4	86.2	0	0	0	0	117.2
20	D	28.1	Very low	27.1	Very low	141 Å²	141	139.1 Å²	139.1	75%	0.754	73%	0.733	S	S	*	*			trans	80.6	155	160.2	-56.6	-54.8	0	0	0	119.7
21	P	33.6	Very low	27	Very low	100 Å²	100	140.3 Å²	140.3	65%	0.649	73%	0.726	S	S	*	*			cis	-145.4	-166.6	-39	39.2	-20.4	0	0	0	114.4
22	L	30.9	Very low	26.8	Very low	149 Å²	149	143.4 Å²	143.4	78%	0.78	72%	0.719	S	S	*	*			trans	72.5	148.9	159.1	-62.5	165.2	0	0	0	117.8
23	T	26.8	Very low	26.7	Very low	116 Å²	116	139.2 Å²	139.2	71%	0.712	71%	0.713	S	S	*	*			cis	165.1	164.7	-30.3	34.8	0	0	0	0	106.3
24	R	29.6	Very low	26.5	Very low	215 Å²	215	138.8 Å²	138.8	81%	0.811	72%	0.715	S	S	*	*			trans	82.2	119.2	177.9	-68.3	-160	135.4	145.3	-0.2	115.3
25	E	23.4	Very low	26.2	Very low	144 Å²	144	138.3 Å²	138.3	67%	0.673	71%	0.714	S	S	*	*				86.9	105.4	55.9	-77.6	-172.7	131	0	0	112.5
26	H	25.5	Very low	26.1	Very low	159 Å²	159	135.2 Å²	135.2	74%	0.736	70%	0.703	S	S	*	*				44.7	131	119	-90.8	-71.6	0	0	0	120.2
27	N	24.2	Very low	26	Very low	127 Å²	127	139.7 Å²	139.7	68%	0.679	71%	0.706	S	S	*	*			trans	75.5	147.5	144.2	-57.8	-10.5	0	0	0	115.2
28	N	24.7	Very low	26	Very low	107 Å²	107	138.3 Å²	138.3	57%	0.572	70%	0.698	S	S	*	*			cis	-152.8	156.3	9.9	-134.9	-7.1	0	0	0	114.4
29	Q	23.4	Very low	25.8	Very low	146 Å²	146	135.1 Å²	135.1	68%	0.682	69%	0.69	S	S	*	*			trans	44.2	80.6	139.5	-74.9	157.8	3.4	0	0	119.2
30	S	22.3	Very low	25.7	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	69%	0.691	S	S	*	*				55.8	-168	93.6	78.5	0	0	0	0	119.3
31	R	23.6	Very low	25.6	Very low	184 Å²	184	136.5 Å²	136.5	69%	0.694	68%	0.684	S	S	*	*			trans	73.2	122.1	162.6	-76.2	174.9	88.8	131	20.3	117.5
32	E	23.2	Very low	25.3	Very low	144 Å²	144	137.3 Å²	137.3	67%	0.673	68%	0.681	S	S	*	*			trans	75.5	131.5	131.3	-69.4	161	172.3	0	0	116.4
33	S	23.5	Very low	25.1	Very low	92 Å²	92	137.1 Å²	137.1	64%	0.643	68%	0.676	S	S	*	*			cis	-159.8	175.5	3.7	33.2	0	0	0	0	112.5
34	N	23.3	Very low	25	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	67%	0.669	S	S	*	*				0.4	163.9	129.1	-36.8	-27.6	0	0	0	116.9
35	S	24.7	Very low	24.7	Very low	96 Å²	96	135.4 Å²	135.4	67%	0.671	66%	0.663	S	S	*	*			trans	88.4	126.2	151.7	-171.1	0	0	0	0	116
36	D	24.5	Very low	24.8	Very low	110 Å²	110	135.2 Å²	135.2	59%	0.588	66%	0.662	S	S	*	*			cis	-154.7	133.7	-13.9	-104.2	-29.8	0	0	0	112.7
37	Y	24.9	Very low	24.8	Very low	198 Å²	198	134.1 Å²	134.1	78%	0.776	66%	0.657	S	S	*	*			trans	58	-166.7	137.1	-74.9	-149.5	0	0	0	117.1
38	I	26.8	Very low	24.7	Very low	128 Å²	128	135.6 Å²	135.6	66%	0.656	66%	0.66	S	S	*	*			trans	65.8	102.7	135.8	-81.1	155.1	0	0	0	115.4
39	F	25.6	Very low	24.8	Very low	146 Å²	146	137.4 Å²	137.4	64%	0.64	67%	0.665	S	S	*	*			cis	-166	-178.6	1.4	-136.4	-173.6	0	0	0	112.2
40	K	26.3	Very low	25	Very low	144 Å²	144	137.6 Å²	137.6	63%	0.626	66%	0.664	S	S	*	*				6	138.1	125.8	-69.9	-176	-164.5	172	0	115.4
41	N	27.5	Very low	25.1	Very low	115 Å²	115	139.7 Å²	139.7	62%	0.615	67%	0.672	S	S	*	*			cis	-167.4	162.5	41.5	-127.3	6.6	0	0	0	112.1
42	I	26.2	Very low	25.3	Very low	116 Å²	116	136.1 Å²	136.1	60%	0.595	67%	0.671	S	S	*	*				4.3	118.4	122.2	-30.7	163.9	0	0	0	112.3
43	H	27.6	Very low	25.5	Very low	146 Å²	146	135.3 Å²	135.3	68%	0.676	67%	0.671	S	S	*	*				-145.3	146.4	58.4	-82	-90.4	0	0	0	109.4
44	Q	24.4	Very low	25.8	Very low	120 Å²	120	134.5 Å²	134.5	56%	0.561	66%	0.659	S	S	*	*				70.4	124.6	54.7	-153.7	-170.2	5.3	0	0	112
45	Y	24	Very low	26.2	Very low	174 Å²	174	132.6 Å²	132.6	68%	0.682	65%	0.648	S	S	*	*			trans	75.5	133.8	163	-70.2	-47	0	0	0	121.6
46	E	24.2	Very low	26.5	Very low	141 Å²	141	131.9 Å²	131.9	66%	0.659	64%	0.637	S	S	*	*			trans	74.3	155.1	131.3	-69.9	166.2	160.1	0	0	119.2
47	Q	25.3	Very low	26.7	Very low	135 Å²	135	127.5 Å²	127.5	63%	0.631	62%	0.617	S	S	*	*			cis	-139.2	157.1	1.2	-139.4	131.3	27.7	0	0	113.3
48	E	23.1	Very low	27.1	Very low	159 Å²	159	122.4 Å²	122.4	74%	0.743	61%	0.608	S	S	*	*			trans	-19.3	163.5	145.3	-46.4	165.2	152.9	0	0	116.7
49	E	27.2	Very low	27	Very low	145 Å²	145	122.5 Å²	122.5	68%	0.678	61%	0.61	S	S	*	*				-160.1	149.1	107.6	-112.8	-163	137.1	0	0	114.8
50	K	27.4	Very low	27.1	Very low	149 Å²	149	125.1 Å²	125.1	65%	0.648	62%	0.617	S	S	*	*			trans	66.6	80.7	152.5	-68.7	160.3	177.6	140.5	0	118.6	V52	K50-V52 HydrophobicContact CG-CG2 4.4Å
51	V	25	Very low	27.2	Very low	144 Å²	144	122 Å²	122	87%	0.873	62%	0.618	S	S	*	*				-81.9	117.7	123.9	170.3	0	0	0	0	108.4
52	V	27	Very low	27	Very low	109 Å²	109	123 Å²	123	66%	0.661	62%	0.623	S	S	*	*			trans	-120.8	100.7	158.1	175.4	0	0	0	0	107.2	K50	K50-V52 HydrophobicContact CG-CG2 4.4Å
53	N	28	Very low	27	Very low	127 Å²	127	121.9 Å²	121.9	68%	0.679	63%	0.626	S	S	*	*			trans	58.2	127.7	158.4	-53.2	-30.5	0	0	0	120.4
54	N	29.5	Very low	27	Very low	74 Å²	74	121.3 Å²	121.3	40%	0.396	63%	0.632	S	S	.	*			trans	21.8	158.4	136.9	-59.8	-45.2	0	0	0	122.9	S1970	N54-S1970 WeakPolarHBondContact ND2-CB 3.49Å
55	I	31.5	Very low	27.2	Very low	108 Å²	108	119.7 Å²	119.7	55%	0.554	64%	0.64	S	S	*	*			trans	84.4	138.5	159.4	-58.7	143.9	0	0	0	114.6	I1973 L1974	I55-I1973 PolarHBondContact N-O 2.83Å; I55-L1974 WeakPolarHBondContact O-CB 3.46Å; I55-L1974 WeakPolarHBondContact O-CD1 3.49Å
56	N	30.2	Very low	27.3	Very low	82 Å²	82	118.3 Å²	118.3	44%	0.439	64%	0.644	S	S	.	*			cis	-156.5	136.3	-33.1	-113	-84.4	0	0	0	106.5	N1972	N56-N1972 PolarHBondContact ND2-O 3.29Å; N56-N1972 VanDerWaalsContact OD1-CB 3.22Å; N56-N1972 WeakPolarHBondContact OD1-CB 3.24Å; N56-N1972 PolarHBondContact OD1-O 2.76Å
57	G	28.9	Very low	27.5	Very low	17 Å²	17	117.9 Å²	117.9	18%	0.175	65%	0.651	C	S	.	*			trans	114	-177.7	164.6	0	0	0	0	0	118.1	L1975	G57-L1975 PolarHBondContact O-N 3.15Å
58	P	32.5	Very low	27.7	Very low	91 Å²	91	115.9 Å²	115.9	59%	0.591	65%	0.652	S	S	*	*			trans	-145.1	-157.9	-161.4	39.7	-16	0	0	0	115.7	L1975	P58-L1975 HydrophobicContact CB-CD1 4.46Å
59	L	26.6	Very low	28	Very low	131 Å²	131	114.2 Å²	114.2	69%	0.686	65%	0.652	S	S	*	*			trans	91.4	109.2	147.7	-113.8	87.2	0	0	0	121.1
60	Y	26.5	Very low	28.1	Very low	201 Å²	201	115.2 Å²	115.2	79%	0.788	66%	0.658	S	S	*	*				73.8	166.5	115.2	-99.7	-120.3	0	0	0	124.1
61	A	27.8	Very low	28.3	Very low	78 Å²	78	112.8 Å²	112.8	65%	0.645	66%	0.661	S	S	*	*			trans	86.7	98.1	147.5	0	0	0	0	0	119.4
62	D	25.1	Very low	28.5	Very low	137 Å²	137	111.1 Å²	111.1	73%	0.733	65%	0.647	S	S	*	*				80.1	106.1	118.5	-84.9	-65.8	0	0	0	122.7
63	S	25	Very low	28.7	Very low	92 Å²	92	115.3 Å²	115.3	64%	0.643	65%	0.651	S	S	*	*				75.8	168	112.2	-71.9	0	0	0	0	121.2
64	T	27.8	Very low	28.8	Very low	133 Å²	133	115.1 Å²	115.1	82%	0.816	65%	0.646	S	S	*	*			trans	76.9	118.5	171.8	73.5	0	0	0	0	117.5
65	A	28.5	Very low	29	Very low	87 Å²	87	115.3 Å²	115.3	72%	0.719	65%	0.653	S	S	*	*				72.8	150.5	122.3	0	0	0	0	0	120.3
66	L	26.7	Very low	29	Very low	145 Å²	145	116.7 Å²	116.7	76%	0.759	66%	0.657	S	S	*	*			cis	-165.1	154.2	-18.2	-114.7	173.3	0	0	0	108.5
67	T	28.1	Very low	29.3	Very low	132 Å²	132	116.6 Å²	116.6	81%	0.81	67%	0.667	S	S	*	*			trans	61.5	169.3	163.3	69.2	0	0	0	0	116.1
68	S	28.8	Very low	29.6	Very low	93 Å²	93	119.1 Å²	119.1	65%	0.65	68%	0.681	S	S	*	*			cis	-153.5	148.9	10.2	68.4	0	0	0	0	112
69	V	30.1	Very low	29.5	Very low	124 Å²	124	120.4 Å²	120.4	75%	0.752	68%	0.683	S	S	*	*			trans	64.8	139.8	137.4	170.9	0	0	0	0	117.7
70	M	29.9	Very low	29.6	Very low	165 Å²	165	121 Å²	121	81%	0.813	68%	0.682	S	S	*	*			cis	-139.7	142.4	3.7	-124.1	139.9	-172.3	0	0	105.5
71	S	30.7	Very low	29.8	Very low	99 Å²	99	118.2 Å²	118.2	69%	0.692	68%	0.681	S	S	*	*				72.7	147.8	59.2	-164	0	0	0	0	115.5
72	D	30.2	Very low	30.1	Very low	109 Å²	109	121.6 Å²	121.6	58%	0.583	69%	0.687	S	S	*	*			trans	87.3	131.6	172.6	-66.5	37	0	0	0	116.3
73	R	31.4	Very low	30.2	Very low	196 Å²	196	122.1 Å²	122.1	74%	0.74	69%	0.689	S	S	*	*			cis	-165.5	159.5	-3.5	-115.6	-179.6	163.9	128	-10.5	108.9
74	Q	30.1	Very low	30.4	Very low	123 Å²	123	122.7 Å²	122.7	58%	0.575	69%	0.693	S	S	*	*			cis	-164.4	131.4	-30.4	-111.9	-172.8	-56.3	0	0	104.7
75	S	32.1	Very low	30.2	Very low	79 Å²	79	123 Å²	123	55%	0.552	69%	0.69	S	S	*	*				62.9	158.8	87.9	85.4	0	0	0	0	114.8
76	H	32.3	Very low	30.1	Very low	136 Å²	136	124.9 Å²	124.9	63%	0.63	69%	0.693	S	S	*	*			cis	-127.3	161.1	8.2	-71.2	-79.3	0	0	0	109.9
77	A	36.5	Very low	30.2	Very low	80 Å²	80	121.5 Å²	121.5	66%	0.661	69%	0.692	S	S	*	*			cis	68.2	174.5	33.4	0	0	0	0	0	112
78	P	35.4	Very low	30.3	Very low	70 Å²	70	122.9 Å²	122.9	46%	0.455	69%	0.694	S	S	.	*			cis	-138.9	-152	3.5	32.4	-6.7	0	0	0	113.3
79	N	29.6	Very low	30.2	Very low	119 Å²	119	126.9 Å²	126.9	64%	0.636	70%	0.702	S	S	*	*			trans	85.9	136.5	150.7	-68.4	-0.3	0	0	0	119.6
80	Q	28.4	Very low	30.8	Very low	143 Å²	143	127.5 Å²	127.5	67%	0.668	71%	0.707	S	S	*	*			cis	-173	178.4	-17	-127.8	163.7	-6.8	0	0	109.5
81	N	30.5	Very low	31.2	Very low	142 Å²	142	129 Å²	129	76%	0.759	70%	0.703	S	S	*	*			trans	70.7	158	163.2	-54.3	-21.7	0	0	0	115.9
82	L	34.4	Very low	31.3	Very low	149 Å²	149	129.7 Å²	129.7	78%	0.78	70%	0.703	S	S	*	*			cis	179	121.9	-23.7	-174.6	78.9	0	0	0	102.6
83	L	27.9	Very low	31.4	Very low	148 Å²	148	127.7 Å²	127.7	78%	0.775	70%	0.698	S	S	*	*			cis	88.2	73.1	40.6	-152.8	163	0	0	0	114.5
84	S	29.9	Very low	31.2	Very low	105 Å²	105	122.5 Å²	122.5	73%	0.734	69%	0.688	S	S	*	*			trans	-176.6	138.8	156.7	51.7	0	0	0	0	106.5
85	D	23.2	Very low	31.1	Very low	138 Å²	138	120 Å²	120	74%	0.738	68%	0.681	S	S	*	*	S	Bend	cis	-93.4	161.2	6	-56.6	-55.7	0	0	0	113.9
86	T	25.2	Very low	30.8	Very low	128 Å²	128	120.9 Å²	120.9	79%	0.785	68%	0.679	S	S	*	*			cis	-149.6	157.5	-32.2	30	0	0	0	0	106.8
87	G	29.1	Very low	30.6	Very low	73 Å²	73	119.5 Å²	119.5	75%	0.753	68%	0.681	S	S	*	*	S	Bend	trans	97.1	112.4	178.3	0	0	0	0	0	113.1
88	L	31.6	Very low	30.5	Very low	161 Å²	161	122 Å²	122	84%	0.843	69%	0.688	S	S	*	*			cis	-136.4	121.9	6.5	-174.3	67.2	0	0	0	111
89	H	25.3	Very low	30.6	Very low	177 Å²	177	122 Å²	122	82%	0.819	70%	0.7	S	S	*	*			trans	-70.2	142.6	164.7	-96	-128.8	0	0	0	110.3
90	T	42.7	Very low	30.7	Very low	138 Å²	138	122.5 Å²	122.5	85%	0.847	71%	0.707	S	S	*	*			trans	-155.6	87.2	145.5	-7.1	0	0	0	0	110.7
91	R	38.8	Very low	31.2	Very low	197 Å²	197	122.3 Å²	122.3	74%	0.743	72%	0.716	S	S	*	*			trans	-131.1	160.2	148.2	-145.5	178.4	-177.9	-173.3	-1.4	108.6
92	T	33.1	Very low	31.6	Very low	112 Å²	112	119 Å²	119	69%	0.687	72%	0.716	S	S	*	*			trans	-65.9	140.9	-166.1	45.4	0	0	0	0	113.7
93	S	31.5	Very low	31.6	Very low	68 Å²	68	119.7 Å²	119.7	48%	0.476	72%	0.719	S	S	.	*			trans	53.9	132.6	130.9	70.1	0	0	0	0	122.2	D556	S93-D556 VanDerWaalsContact CB-CG 3.48Å; S93-D556 WeakPolarHBondContact CB-OD1 3.47Å; S93-D556 WeakPolarHBondContact CB-OD2 3.24Å; S93-D556 PolarHBondContact OG-OD1 2.82Å; S93-D556 PolarHBondContact OG-OD2 3.12Å
94	V	28.6	Very low	31.6	Very low	87 Å²	87	117.1 Å²	117.1	53%	0.527	71%	0.714	S	S	.	*				-163.1	145.8	124.7	138.7	0	0	0	0	106.6	D556	V94-D556 WeakPolarHBondContact CG2-OD1 3.2Å
95	T	27.2	Very low	31.9	Very low	70 Å²	70	115.9 Å²	115.9	43%	0.429	72%	0.718	S	S	.	*			trans	-68	131.9	167.8	43	0	0	0	0	109.4
96	N	26.7	Very low	32	Very low	97 Å²	97	115.7 Å²	115.7	52%	0.519	72%	0.715	S	S	.	*				-141.5	114.5	80	-88.9	-43.8	0	0	0	114.6	T98 D564	N96-T98 PolarHBondContact O-N 3.16Å; N96-D564 PolarHBondContact ND2-OD2 3.48Å
97	T	27.6	Very low	32.1	Very low	108 Å²	108	113.9 Å²	113.9	66%	0.663	71%	0.713	S	S	*	*			trans	-26.4	106	140.2	43.7	0	0	0	0	114.7
98	T	33.9	Very low	32.3	Very low	133 Å²	133	113.9 Å²	113.9	82%	0.816	71%	0.714	S	S	*	*			trans	174.7	149.4	147.3	23.5	0	0	0	0	109.7	N96	N96-T98 PolarHBondContact O-N 3.16Å
99	G	36.5	Very low	32	Very low	69 Å²	69	110.1 Å²	110.1	71%	0.711	69%	0.694	S	S	*	*			cis	-93.8	146.1	-44.1	0	0	0	0	0	108.6
100	V	32.1	Very low	32.2	Very low	129 Å²	129	107.2 Å²	107.2	78%	0.782	70%	0.7	S	S	*	*			cis	63.3	55.1	37	-161.9	0	0	0	0	112.9
101	T	40.5	Very low	31.9	Very low	139 Å²	139	105.4 Å²	105.4	85%	0.853	70%	0.699	S	S	*	*			trans	-163.3	121.2	146.1	41	0	0	0	0	109
102	G	37.2	Very low	31.3	Very low	73 Å²	73	98.7 Å²	98.7	75%	0.753	69%	0.686	S	S	*	*			cis	127.5	56	-2.8	0	0	0	0	0	114.2
103	L	34.8	Very low	31.1	Very low	163 Å²	163	97.9 Å²	97.9	85%	0.853	69%	0.691	S	S	*	*			trans	-150.8	151.7	168.2	-82	108.6	0	0	0	109.8
104	S	29	Very low	31.2	Very low	95 Å²	95	97.2 Å²	97.2	66%	0.664	69%	0.689	S	S	*	*			cis	-171.8	105.1	-26	51.4	0	0	0	0	108.9
105	G	35.1	Very low	31.1	Very low	79 Å²	79	98 Å²	98	81%	0.814	69%	0.69	S	S	*	*			trans	71.8	-179.9	-173.7	0	0	0	0	0	113.4
106	I	25.3	Very low	31.2	Very low	133 Å²	133	102.4 Å²	102.4	68%	0.682	71%	0.706	S	S	*	*			cis	-129.7	147	3.5	-48.7	174.1	0	0	0	109.2	I109	I106-I109 HydrophobicContact CB-CD1 4.1Å; I106-I109 HydrophobicContact CD1-CD1 4.16Å; I106-I109 HydrophobicContact CG2-CD1 3.81Å
107	A	27.9	Very low	31.3	Very low	90 Å²	90	102.6 Å²	102.6	74%	0.744	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	142.9	172.7	0	0	0	0	0	112.5	I109	A107-I109 PolarHBondContact O-N 2.95Å
108	G	32.9	Very low	31.5	Very low	74 Å²	74	98.4 Å²	98.4	76%	0.763	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.7	12	158.8	0	0	0	0	0	118.2
109	I	26.2	Very low	31.4	Very low	82 Å²	82	94.1 Å²	94.1	42%	0.421	65%	0.652	S	S	.	*	G	3₁₀ helix	trans	-102.2	9.2	-168.1	-81.2	176.7	0	0	0	115.3	I106 A107 A111 A112	I106-I109 HydrophobicContact CB-CD1 4.1Å; I106-I109 HydrophobicContact CD1-CD1 4.16Å; I106-I109 HydrophobicContact CG2-CD1 3.81Å; A107-I109 PolarHBondContact O-N 2.95Å; I109-A111 PolarHBondContact O-N 3.19Å; I109-A111 VanDerWaalsContact O-N 3.12Å; I109-A112 HydrophobicContact CG1-CB 4.37Å; I109-A112 HydrophobicContact CG2-CB 4.17Å; I109-A112 CarbonylContact O-C 3.45Å; I109-A112 WeakPolarHBondContact O-CA 3.26Å; I109-A112 PolarHBondContact O-N 2.96Å
110	A	28.1	Very low	31.4	Very low	116 Å²	116	93.7 Å²	93.7	96%	0.959	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-63.7	-12.3	164	0	0	0	0	0	113.3	A112	A110-A112 VanDerWaalsContact C-N 3.33Å
111	A	37	Very low	31.8	Very low	99 Å²	99	94.2 Å²	94.2	82%	0.818	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-86.9	8.4	166.8	0	0	0	0	0	113.8	I109	I109-A111 PolarHBondContact O-N 3.19Å; I109-A111 VanDerWaalsContact O-N 3.12Å
112	A	27	Very low	32.1	Very low	57 Å²	57	91 Å²	91	47%	0.471	61%	0.612	S	S	.	*			trans	-156	54	-166.6	0	0	0	0	0	115.8	I109 A110	I109-A112 HydrophobicContact CG1-CB 4.37Å; I109-A112 HydrophobicContact CG2-CB 4.17Å; I109-A112 CarbonylContact O-C 3.45Å; I109-A112 WeakPolarHBondContact O-CA 3.26Å; I109-A112 PolarHBondContact O-N 2.96Å; A110-A112 VanDerWaalsContact C-N 3.33Å
113	A	27.2	Very low	32.6	Very low	95 Å²	95	91.2 Å²	91.2	79%	0.785	60%	0.595	S	S	*	*			trans	-154.6	88	163.5	0	0	0	0	0	110
114	A	33.4	Very low	32.9	Very low	54 Å²	54	84.4 Å²	84.4	45%	0.446	56%	0.563	S	S	.	*			cis	70.8	102.4	23.7	0	0	0	0	0	114.8	L2029	A114-L2029 HydrophobicContact CB-CD2 4.14Å
115	N	27.9	Very low	33.8	Very low	103 Å²	103	82.8 Å²	82.8	55%	0.551	56%	0.555	S	S	*	*			trans	88.4	94.4	169.1	-64.3	-47.9	0	0	0	120.5	Q117 H2030	N115-Q117 PolarHBondContact OD1-NE2 2.83Å; N115-H2030 VanDerWaalsContact CA-CE1 3.47Å; N115-H2030 WeakPolarHBondContact CA-CE1 3.2Å; N115-H2030 WeakPolarHBondContact CA-NE2 3.36Å; N115-H2030 PolarHBondContact N-CE1 3.14Å; N115-H2030 VanDerWaalsContact N-CE1 3.35Å; N115-H2030 PolarHBondContact N-NE2 3.29Å
116	Q	29.3	Very low	34.5	Very low	163 Å²	163	84.6 Å²	84.6	76%	0.762	55%	0.545	S	S	*	.				174.2	153.7	118.7	-90.7	164.3	63	0	0	112.3	S2031	Q116-S2031 PolarHBondContact O-OG 2.73Å
117	Q	28.6	Very low	35.6	Very low	101 Å²	101	79.7 Å²	79.7	47%	0.472	52%	0.521	S	S	.	.				-170.8	108.4	-88.9	-88.9	-179.2	5.8	0	0	114.3	N115 Y2032 K2033	N115-Q117 PolarHBondContact OD1-NE2 2.83Å; Q117-Y2032 VanDerWaalsContact C-CD1 3.42Å; Q117-Y2032 CarbonylContact C-O 3.6Å; Q117-Y2032 WeakPolarHBondContact CA-O 3.03Å; Q117-Y2032 HydrophobicContact CB-CD1 4.05Å; Q117-Y2032 HydrophobicContact CB-CE1 4.45Å; Q117-Y2032 HydrophobicContact CG-CD1 4.41Å; Q117-Y2032 PolarHBondContact N-O 3.12Å; Q117-K2033 VanDerWaalsContact C-CD 3.5Å; Q117-K2033 WeakPolarHBondContact O-CD 3.42Å; Q117-K2033 WeakPolarHBondContact O-CE 3.49Å; Q117-K2033 PolarHBondContact O-NZ 2.59Å
118	G	31.2	Very low	36.7	Very low	19 Å²	19	80.8 Å²	80.8	20%	0.196	51%	0.514	C	S	.	.			trans	-167	-68	177.4	0	0	0	0	0	124.2	Y2032	G118-Y2032 PolarHBondContact N-O 2.98Å; G118-Y2032 WeakPolarHBondContact O-CD2 3.47Å; G118-Y2032 WeakPolarHBondContact O-CE2 3.22Å; G118-Y2032 PolarHBondContact O-OH 3.48Å
119	K	33.1	Very low	37.4	Very low	43 Å²	43	79.7 Å²	79.7	19%	0.187	50%	0.498	C	S	.	.			trans	-142.5	156.8	179.1	-45.8	-174.5	-173.2	177.2	0	115.2	L925 D926 Y2032 K2033 P2034	K119-L925 HydrophobicContact CB-CD1 4.24Å; K119-L925 HydrophobicContact CD-CB 4.22Å; K119-L925 HydrophobicContact CD-CD1 4.42Å; K119-L925 PolarHBondContact NZ-O 3.24Å; K119-D926 IonicContact NZ-OD1 3.28Å; K119-D926 PolarHBondContact NZ-OD1 3.29Å; K119-D926 IonicContact NZ-OD2 2.62Å; K119-D926 PolarHBondContact NZ-OD2 2.84Å; K119-Y2032 VanDerWaalsContact N-CD2 3.26Å; K119-Y2032 CarbonylContact O-C 2.89Å; K119-Y2032 WeakPolarHBondContact O-CA 3.35Å; K119-Y2032 PolarHBondContact O-N 3.47Å; K119-K2033 CarbonylContact C-O 3.18Å; K119-K2033 WeakPolarHBondContact CA-O 3.21Å; K119-K2033 WeakPolarHBondContact CB-O 3.28Å; K119-K2033 PolarHBondContact N-O 3.34Å; K119-K2033 PolarHBondContact O-N 3.36Å; K119-K2033 VanDerWaalsContact O-N 3.13Å; K119-K2033 VanDerWaalsContact O-O 3.07Å; K119-P2034 HydrophobicContact CD-CB 3.87Å; K119-P2034 HydrophobicContact CG-CB 3.97Å
120	P	35.3	Very low	38.5	Very low	61 Å²	61	76.8 Å²	76.8	40%	0.396	49%	0.486	S	S	.	.			trans	-92.3	166.2	-167.1	36.8	-36.5	0	0	0	117.1	N924 L925	P120-N924 PolarHBondContact O-ND2 2.91Å; P120-L925 WeakPolarHBondContact O-CD1 3.35Å
121	L	40.5	Very low	39.5	Very low	139 Å²	139	74.7 Å²	74.7	73%	0.728	46%	0.457	S	S	*	.			trans	-90.9	148.9	-178	-157.6	77.1	0	0	0	113.3	L123	L121-L123 PolarHBondContact O-N 3.35Å
122	N	46.5	Very low	40	Very low	73 Å²	73	73.2 Å²	73.2	39%	0.39	44%	0.44	S	S	.	.			trans	-89.1	83.8	-170.9	-147.7	-20	0	0	0	112.6	A124 A125	N122-A124 PolarHBondContact O-N 3.49Å; N122-A124 VanDerWaalsContact O-N 3.14Å; N122-A125 PolarHBondContact O-N 2.95Å; N122-A125 VanDerWaalsContact O-N 3.09Å
123	L	47.4	Very low	40.9	Very low	77 Å²	77	74.1 Å²	74.1	40%	0.403	44%	0.44	S	S	.	.	H	α-helix	trans	-55.3	-34.7	-173.5	-174.7	61.2	0	0	0	113.3	L121 A125 L126 T127	L121-L123 PolarHBondContact O-N 3.35Å; L123-A125 VanDerWaalsContact C-N 3.28Å; L123-A125 PolarHBondContact O-N 3.2Å; L123-L126 PolarHBondContact O-N 3.48Å; L123-L126 VanDerWaalsContact O-N 3.17Å; L123-T127 HydrophobicContact CD1-CG2 4.25Å; L123-T127 HydrophobicContact CG-CG2 4.15Å; L123-T127 PolarHBondContact O-N 3.32Å; L123-T127 PolarHBondContact O-OG1 3.24Å
124	A	42	Very low	41.8	Very low	20 Å²	20	70 Å²	70	17%	0.165	41%	0.405	C	S	.	.	H	α-helix	trans	-62.2	-29	179.7	0	0	0	0	0	114.2	N122 T127 L128	N122-A124 PolarHBondContact O-N 3.49Å; N122-A124 VanDerWaalsContact O-N 3.14Å; A124-T127 WeakPolarHBondContact CA-OG1 3.46Å; A124-T127 PolarHBondContact O-OG1 2.83Å; A124-L128 VanDerWaalsContact O-CB 3.31Å; A124-L128 WeakPolarHBondContact O-CB 3.2Å; A124-L128 WeakPolarHBondContact O-CG 3.39Å; A124-L128 PolarHBondContact O-N 3.32Å
125	A	49	Very low	42.3	Very low	61 Å²	61	69.6 Å²	69.6	50%	0.504	40%	0.403	S	S	.	.	H	α-helix	trans	-76.6	-37.2	176.5	0	0	0	0	0	111.1	N122 L123 L128 A129	N122-A125 PolarHBondContact O-N 2.95Å; N122-A125 VanDerWaalsContact O-N 3.09Å; L123-A125 VanDerWaalsContact C-N 3.28Å; L123-A125 PolarHBondContact O-N 3.2Å; A125-L128 PolarHBondContact O-N 3.4Å; A125-A129 WeakPolarHBondContact O-CB 3.34Å; A125-A129 PolarHBondContact O-N 3.47Å
126	L	47.7	Very low	43	Very low	117 Å²	117	72.7 Å²	72.7	61%	0.613	41%	0.411	S	S	*	.	H	α-helix	trans	-71.6	-42.8	173.2	-153.8	76.1	0	0	0	110.7	L123 L128 A129 A130	L123-L126 PolarHBondContact O-N 3.48Å; L123-L126 VanDerWaalsContact O-N 3.17Å; L126-L128 PolarHBondContact O-N 3.18Å; L126-A129 PolarHBondContact O-N 3.11Å; L126-A130 WeakPolarHBondContact O-CA 3.44Å; L126-A130 WeakPolarHBondContact O-CB 3.45Å; L126-A130 PolarHBondContact O-N 2.74Å
127	T	48.8	Very low	43.6	Very low	29 Å²	29	70.4 Å²	70.4	18%	0.178	40%	0.399	C	S	.	.	H	α-helix	trans	-67.8	-14.9	173.1	60.3	0	0	0	0	113.3	L123 A124 Q131 N2284	L123-T127 HydrophobicContact CD1-CG2 4.25Å; L123-T127 HydrophobicContact CG-CG2 4.15Å; L123-T127 PolarHBondContact O-N 3.32Å; L123-T127 PolarHBondContact O-OG1 3.24Å; A124-T127 WeakPolarHBondContact CA-OG1 3.46Å; A124-T127 PolarHBondContact O-OG1 2.83Å; T127-Q131 WeakPolarHBondContact O-CA 3.23Å; T127-Q131 WeakPolarHBondContact O-CB 3.13Å; T127-Q131 VanDerWaalsContact O-CD 3.23Å; T127-Q131 WeakPolarHBondContact O-CG 3.28Å; T127-Q131 PolarHBondContact O-N 3.35Å; T127-N2284 PolarHBondContact OG1-O 3.24Å
128	L	50.6	Low	44.1	Very low	113 Å²	113	70.7 Å²	70.7	59%	0.592	40%	0.395	S	S	*	.	H	α-helix	trans	-87.4	-40.1	168.5	-82.4	169.2	0	0	0	113.5	A124 A125 L126 A130 Q131 S132	A124-L128 VanDerWaalsContact O-CB 3.31Å; A124-L128 WeakPolarHBondContact O-CB 3.2Å; A124-L128 WeakPolarHBondContact O-CG 3.39Å; A124-L128 PolarHBondContact O-N 3.32Å; A125-L128 PolarHBondContact O-N 3.4Å; L126-L128 PolarHBondContact O-N 3.18Å; L128-A130 VanDerWaalsContact C-N 3.31Å; L128-Q131 CarbonylContact O-C 3.59Å; L128-Q131 WeakPolarHBondContact O-CA 3.28Å; L128-Q131 PolarHBondContact O-N 2.71Å; L128-Q131 VanDerWaalsContact O-N 3.16Å; L128-S132 PolarHBondContact O-N 2.79Å
129	A	49.5	Very low	44.4	Very low	51 Å²	51	71.4 Å²	71.4	42%	0.421	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-42.9	170.9	0	0	0	0	0	110.7	A125 L126 Q131 S132 V133	A125-A129 WeakPolarHBondContact O-CB 3.34Å; A125-A129 PolarHBondContact O-N 3.47Å; L126-A129 PolarHBondContact O-N 3.11Å; A129-Q131 VanDerWaalsContact C-N 3.34Å; A129-S132 CarbonylContact O-C 2.95Å; A129-S132 WeakPolarHBondContact O-CA 3.16Å; A129-S132 WeakPolarHBondContact O-CB 3.11Å; A129-S132 PolarHBondContact O-N 2.72Å; A129-S132 PolarHBondContact O-OG 3.38Å; A129-V133 PolarHBondContact O-N 3.45Å
130	A	49.3	Very low	44.7	Very low	21 Å²	21	70.7 Å²	70.7	17%	0.174	40%	0.404	C	S	.	.	H	α-helix	trans	-79.6	-12.8	173.2	0	0	0	0	0	112.1	L126 L128 S132 A134 D2244	L126-A130 WeakPolarHBondContact O-CA 3.44Å; L126-A130 WeakPolarHBondContact O-CB 3.45Å; L126-A130 PolarHBondContact O-N 2.74Å; L128-A130 VanDerWaalsContact C-N 3.31Å; A130-S132 VanDerWaalsContact C-N 3.35Å; A130-A134 VanDerWaalsContact O-CA 3.32Å; A130-A134 WeakPolarHBondContact O-CA 3.44Å; A130-A134 VanDerWaalsContact O-CB 3.23Å; A130-A134 WeakPolarHBondContact O-CB 3.42Å; A130-A134 PolarHBondContact O-N 3.1Å; A130-D2244 WeakPolarHBondContact CB-OD1 3.34Å; A130-D2244 VanDerWaalsContact O-OD2 3.13Å
131	Q	48.1	Very low	44.9	Very low	73 Å²	73	69.6 Å²	69.6	34%	0.341	40%	0.401	S	S	.	.	H	α-helix	trans	-82	-8	156.1	-79	164.6	26.8	0	0	114	T127 L128 A129 A134 A135 P2283	T127-Q131 WeakPolarHBondContact O-CA 3.23Å; T127-Q131 WeakPolarHBondContact O-CB 3.13Å; T127-Q131 VanDerWaalsContact O-CD 3.23Å; T127-Q131 WeakPolarHBondContact O-CG 3.28Å; T127-Q131 PolarHBondContact O-N 3.35Å; L128-Q131 CarbonylContact O-C 3.59Å; L128-Q131 WeakPolarHBondContact O-CA 3.28Å; L128-Q131 PolarHBondContact O-N 2.71Å; L128-Q131 VanDerWaalsContact O-N 3.16Å; A129-Q131 VanDerWaalsContact C-N 3.34Å; Q131-A134 VanDerWaalsContact CA-CB 3.43Å; Q131-A134 HydrophobicContact CB-CB 4.26Å; Q131-A134 HydrophobicContact CG-CB 4.3Å; Q131-A134 WeakPolarHBondContact O-CB 3.42Å; Q131-A135 WeakPolarHBondContact O-CB 3.43Å; Q131-A135 PolarHBondContact O-N 2.83Å; Q131-P2283 PolarHBondContact NE2-O 2.74Å
132	S	47	Very low	44.7	Very low	68 Å²	68	66.7 Å²	66.7	48%	0.476	38%	0.38	S	S	.	.	H	α-helix	trans	-95.7	-27.2	168.9	87.1	0	0	0	0	112.8	L128 A129 A130 A135 K136	L128-S132 PolarHBondContact O-N 2.79Å; A129-S132 CarbonylContact O-C 2.95Å; A129-S132 WeakPolarHBondContact O-CA 3.16Å; A129-S132 WeakPolarHBondContact O-CB 3.11Å; A129-S132 PolarHBondContact O-N 2.72Å; A129-S132 PolarHBondContact O-OG 3.38Å; A130-S132 VanDerWaalsContact C-N 3.35Å; S132-A135 CarbonylContact O-C 3.56Å; S132-A135 PolarHBondContact O-N 3.45Å; S132-K136 PolarHBondContact O-N 2.66Å
133	V	47	Very low	44.5	Very low	75 Å²	75	65.6 Å²	65.6	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-81.7	-21.9	161.9	-179.8	0	0	0	0	110.7	A129	A129-V133 PolarHBondContact O-N 3.45Å
134	A	46.7	Very low	44.2	Very low	8 Å²	8	68.5 Å²	68.5	7%	0.066	39%	0.392	C	S	.	.	H	α-helix	trans	-55.3	-68.8	156.3	0	0	0	0	0	105.7	A130 Q131 K136 K137 I2245 E2246	A130-A134 VanDerWaalsContact O-CA 3.32Å; A130-A134 WeakPolarHBondContact O-CA 3.44Å; A130-A134 VanDerWaalsContact O-CB 3.23Å; A130-A134 WeakPolarHBondContact O-CB 3.42Å; A130-A134 PolarHBondContact O-N 3.1Å; Q131-A134 VanDerWaalsContact CA-CB 3.43Å; Q131-A134 HydrophobicContact CB-CB 4.26Å; Q131-A134 HydrophobicContact CG-CB 4.3Å; Q131-A134 WeakPolarHBondContact O-CB 3.42Å; A134-K136 PolarHBondContact O-N 2.62Å; A134-K137 PolarHBondContact O-N 2.83Å; A134-I2245 CarbonylContact O-C 3.18Å; A134-I2245 VanDerWaalsContact O-C 3.24Å; A134-I2245 VanDerWaalsContact O-CA 3.29Å; A134-I2245 WeakPolarHBondContact O-CA 3.4Å; A134-E2246 VanDerWaalsContact O-CA 3.3Å; A134-E2246 WeakPolarHBondContact O-CA 3.4Å; A134-E2246 WeakPolarHBondContact O-CB 3.24Å; A134-E2246 PolarHBondContact O-N 3.48Å
135	A	43.1	Very low	44.1	Very low	47 Å²	47	69.5 Å²	69.5	39%	0.388	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	32.7	-178.3	0	0	0	0	0	115.1	Q131 S132 E2246	Q131-A135 WeakPolarHBondContact O-CB 3.43Å; Q131-A135 PolarHBondContact O-N 2.83Å; S132-A135 CarbonylContact O-C 3.56Å; S132-A135 PolarHBondContact O-N 3.45Å; A135-E2246 HydrophobicContact CB-CB 4.49Å; A135-E2246 HydrophobicContact CB-CG 4.29Å
136	K	42.3	Very low	44	Very low	168 Å²	168	69.3 Å²	69.3	73%	0.73	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.2	12.9	163.7	-91.8	-176.2	174.1	-179.2	0	116.1	S132 A134 E2246	S132-K136 PolarHBondContact O-N 2.66Å; A134-K136 PolarHBondContact O-N 2.62Å; K136-E2246 WeakPolarHBondContact CA-OE2 3.45Å; K136-E2246 PolarHBondContact N-OE2 2.87Å
137	K	41.3	Very low	44	Very low	114 Å²	114	67.4 Å²	67.4	50%	0.496	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	-27.1	-174.7	-83.5	170.7	65.9	-172.5	0	120.5	A134 A139 G140 A141 I2245 E2246	A134-K137 PolarHBondContact O-N 2.83Å; K137-A139 VanDerWaalsContact C-N 3.34Å; K137-G140 VanDerWaalsContact O-CA 3.31Å; K137-G140 WeakPolarHBondContact O-CA 3.14Å; K137-G140 PolarHBondContact O-N 3.32Å; K137-A141 PolarHBondContact O-N 2.88Å; K137-I2245 HydrophobicContact CB-CB 4.24Å; K137-I2245 HydrophobicContact CB-CD1 4.48Å; K137-I2245 HydrophobicContact CB-CG1 3.71Å; K137-I2245 HydrophobicContact CB-CG2 3.76Å; K137-I2245 HydrophobicContact CD-CG1 4.28Å; K137-E2246 PolarHBondContact N-OE2 3.43Å
138	R	39	Very low	44.1	Very low	107 Å²	107	71 Å²	71	40%	0.404	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-79.6	-18.1	174.3	-106.2	173.2	-163	132.2	-12	110	G140 A141 R142 I2245 E2246 E2247 E2248	R138-G140 PolarHBondContact O-N 3.15Å; R138-A141 VanDerWaalsContact C-N 3.28Å; R138-A141 HydrophobicContact CB-CB 4.18Å; R138-A141 HydrophobicContact CG-CB 4.2Å; R138-A141 CarbonylContact O-C 3.52Å; R138-A141 VanDerWaalsContact O-CA 3.24Å; R138-A141 WeakPolarHBondContact O-CA 3.23Å; R138-A141 VanDerWaalsContact O-CB 3.26Å; R138-A141 WeakPolarHBondContact O-CB 2.83Å; R138-A141 PolarHBondContact O-N 3.09Å; R138-R142 PolarHBondContact O-N 3.38Å; R138-I2245 VanDerWaalsContact CA-CG2 3.48Å; R138-I2245 HydrophobicContact CB-CG2 3.6Å; R138-I2245 WeakPolarHBondContact CD-O 3.5Å; R138-I2245 HydrophobicContact CG-CB 4.38Å; R138-I2245 HydrophobicContact CG-CG2 3.53Å; R138-I2245 PolarHBondContact NH1-O 3.36Å; R138-E2246 CarbonylContact C-O 3.47Å; R138-E2246 WeakPolarHBondContact CA-O 3.16Å; R138-E2246 HydrophobicContact CB-CB 4.31Å; R138-E2246 WeakPolarHBondContact CB-O 3.45Å; R138-E2247 WeakPolarHBondContact CB-O 3.18Å; R138-E2247 WeakPolarHBondContact CD-O 3.38Å; R138-E2248 WeakPolarHBondContact O-CB 3.38Å
139	A	38	Very low	44.6	Very low	35 Å²	35	70.1 Å²	70.1	29%	0.289	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-73.3	-9.9	161.5	0	0	0	0	0	112.5	K137 A143 E2246 E2248	K137-A139 VanDerWaalsContact C-N 3.34Å; A139-A143 WeakPolarHBondContact O-CB 3.37Å; A139-E2246 VanDerWaalsContact CB-CD 3.41Å; A139-E2246 HydrophobicContact CB-CG 3.94Å; A139-E2246 VanDerWaalsContact CB-OE2 3.26Å; A139-E2246 WeakPolarHBondContact CB-OE2 3.14Å; A139-E2246 PolarHBondContact N-O 2.96Å; A139-E2248 WeakPolarHBondContact CA-OE2 2.86Å; A139-E2248 HydrophobicContact CB-CG 4.01Å
140	G	40.7	Very low	45.3	Very low	27 Å²	27	68.5 Å²	68.5	28%	0.278	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-82.4	-17.1	156.3	0	0	0	0	0	113.1	K137 R138 Q144	K137-G140 VanDerWaalsContact O-CA 3.31Å; K137-G140 WeakPolarHBondContact O-CA 3.14Å; K137-G140 PolarHBondContact O-N 3.32Å; R138-G140 PolarHBondContact O-N 3.15Å; G140-Q144 WeakPolarHBondContact O-CB 3.01Å; G140-Q144 WeakPolarHBondContact O-CG 3.43Å; G140-Q144 PolarHBondContact O-N 2.96Å; G140-Q144 VanDerWaalsContact O-N 3.16Å; G140-Q144 PolarHBondContact O-NE2 2.99Å
141	A	38.1	Very low	46.1	Very low	39 Å²	39	74.5 Å²	74.5	32%	0.322	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-29.9	-167.5	0	0	0	0	0	115.7	K137 R138 Q144 A145	K137-A141 PolarHBondContact O-N 2.88Å; R138-A141 VanDerWaalsContact C-N 3.28Å; R138-A141 HydrophobicContact CB-CB 4.18Å; R138-A141 HydrophobicContact CG-CB 4.2Å; R138-A141 CarbonylContact O-C 3.52Å; R138-A141 VanDerWaalsContact O-CA 3.24Å; R138-A141 WeakPolarHBondContact O-CA 3.23Å; R138-A141 VanDerWaalsContact O-CB 3.26Å; R138-A141 WeakPolarHBondContact O-CB 2.83Å; R138-A141 PolarHBondContact O-N 3.09Å; A141-Q144 CarbonylContact O-C 3.32Å; A141-Q144 WeakPolarHBondContact O-CB 3.3Å; A141-Q144 PolarHBondContact O-N 2.87Å; A141-A145 WeakPolarHBondContact O-CB 3.14Å; A141-A145 PolarHBondContact O-N 3.18Å
142	R	36.7	Very low	46.9	Very low	78 Å²	78	78.5 Å²	78.5	29%	0.294	42%	0.422	S	S	.	.	H	α-helix	trans	-87.1	-29	159.1	160.1	-90.7	-165.4	155.2	21.5	112.3	R138 Q144 A145 A146 E2248 E2249	R138-R142 PolarHBondContact O-N 3.38Å; R142-Q144 CarbonylContact O-C 3.34Å; R142-Q144 PolarHBondContact O-N 3.13Å; R142-A145 HydrophobicContact CB-CB 4.19Å; R142-A145 PolarHBondContact O-N 3.48Å; R142-A146 HydrophobicContact CG-CB 4.1Å; R142-A146 WeakPolarHBondContact O-CB 3.4Å; R142-A146 PolarHBondContact O-N 2.75Å; R142-E2248 WeakPolarHBondContact CA-OE2 3.5Å; R142-E2248 HydrophobicContact CB-CB 4.17Å; R142-E2248 WeakPolarHBondContact CB-OE2 3.28Å; R142-E2248 VanDerWaalsContact CD-OE1 3.31Å; R142-E2248 WeakPolarHBondContact CD-OE1 3.01Å; R142-E2248 VanDerWaalsContact CD-OE2 3.29Å; R142-E2248 WeakPolarHBondContact CD-OE2 2.99Å; R142-E2248 IonicContact CZ-OE1 3.5Å; R142-E2248 PolarHBondContact N-OE2 3.04Å; R142-E2248 IonicContact NE-OE1 2.75Å; R142-E2248 IonicContact NH1-OE1 3.13Å; R142-E2248 PolarHBondContact NH1-OE1 2.69Å; R142-E2249 HydrophobicContact CB-CB 3.7Å; R142-E2249 HydrophobicContact CG-CB 3.49Å; R142-E2249 VanDerWaalsContact CG-CB 3.49Å; R142-E2249 HydrophobicContact CG-CG 4.34Å; R142-E2249 VanDerWaalsContact CZ-CD 3.41Å; R142-E2249 IonicContact CZ-OE1 2.9Å; R142-E2249 IonicContact CZ-OE2 3.77Å; R142-E2249 VanDerWaalsContact NE-CD 3.3Å; R142-E2249 IonicContact NE-OE1 3.81Å; R142-E2249 PolarHBondContact NE-OE1 3.37Å; R142-E2249 IonicContact NE-OE2 2.82Å; R142-E2249 PolarHBondContact NE-OE2 3.48Å; R142-E2249 IonicContact NH1-OE1 3.63Å; R142-E2249 IonicContact NH2-OE1 2.64Å; R142-E2249 PolarHBondContact NH2-OE1 3.18Å; R142-E2249 IonicContact NH2-OE2 3.92Å; R142-E2249 PolarHBondContact NH2-OE2 3.1Å
143	A	41.4	Very low	48.1	Very low	49 Å²	49	75.3 Å²	75.3	41%	0.405	40%	0.399	S	S	.	.	H	α-helix	trans	-50.9	-16	156.1	0	0	0	0	0	112.5	A139 N147 E2248	A139-A143 WeakPolarHBondContact O-CB 3.37Å; A143-N147 PolarHBondContact O-ND2 3.01Å; A143-E2248 PolarHBondContact N-OE2 2.87Å
144	Q	41.8	Very low	49.2	Very low	139 Å²	139	75.7 Å²	75.7	65%	0.65	40%	0.398	S	S	*	.	H	α-helix	trans	-102.3	-37.2	164.1	-73.1	159.5	16.3	0	0	115.1	G140 A141 R142 N147 T148	G140-Q144 WeakPolarHBondContact O-CB 3.01Å; G140-Q144 WeakPolarHBondContact O-CG 3.43Å; G140-Q144 PolarHBondContact O-N 2.96Å; G140-Q144 VanDerWaalsContact O-N 3.16Å; G140-Q144 PolarHBondContact O-NE2 2.99Å; A141-Q144 CarbonylContact O-C 3.32Å; A141-Q144 WeakPolarHBondContact O-CB 3.3Å; A141-Q144 PolarHBondContact O-N 2.87Å; R142-Q144 CarbonylContact O-C 3.34Å; R142-Q144 PolarHBondContact O-N 3.13Å; Q144-N147 CarbonylContact O-C 2.82Å; Q144-N147 VanDerWaalsContact O-C 3.26Å; Q144-N147 VanDerWaalsContact O-CA 3.27Å; Q144-N147 WeakPolarHBondContact O-CA 3.07Å; Q144-N147 VanDerWaalsContact O-CB 3.27Å; Q144-N147 WeakPolarHBondContact O-CB 3.29Å; Q144-N147 PolarHBondContact O-N 3.22Å; Q144-T148 PolarHBondContact O-N 3.33Å
145	A	39.4	Very low	50.1	Low	41 Å²	41	83.2 Å²	83.2	34%	0.339	43%	0.43	S	S	.	.	H	α-helix	trans	-68	-45.3	179.9	0	0	0	0	0	113.2	A141 R142 N147 T148	A141-A145 WeakPolarHBondContact O-CB 3.14Å; A141-A145 PolarHBondContact O-N 3.18Å; R142-A145 HydrophobicContact CB-CB 4.19Å; R142-A145 PolarHBondContact O-N 3.48Å; A145-N147 PolarHBondContact O-N 2.89Å; A145-N147 VanDerWaalsContact O-N 3.08Å; A145-T148 WeakPolarHBondContact O-CB 3.2Å; A145-T148 WeakPolarHBondContact O-CG2 3.21Å; A145-T148 PolarHBondContact O-N 3.3Å; A145-T148 PolarHBondContact O-OG1 3.19Å
146	A	47.6	Very low	51.5	Low	56 Å²	56	85.2 Å²	85.2	46%	0.463	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-10.2	169.1	0	0	0	0	0	112.6	R142	R142-A146 HydrophobicContact CG-CB 4.1Å; R142-A146 WeakPolarHBondContact O-CB 3.4Å; R142-A146 PolarHBondContact O-N 2.75Å
147	N	48.2	Very low	52.9	Low	77 Å²	77	78.3 Å²	78.3	41%	0.412	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	19	174.6	-98.2	-48.5	0	0	0	113.5	A143 Q144 A145 R149	A143-N147 PolarHBondContact O-ND2 3.01Å; Q144-N147 CarbonylContact O-C 2.82Å; Q144-N147 VanDerWaalsContact O-C 3.26Å; Q144-N147 VanDerWaalsContact O-CA 3.27Å; Q144-N147 WeakPolarHBondContact O-CA 3.07Å; Q144-N147 VanDerWaalsContact O-CB 3.27Å; Q144-N147 WeakPolarHBondContact O-CB 3.29Å; Q144-N147 PolarHBondContact O-N 3.22Å; A145-N147 PolarHBondContact O-N 2.89Å; A145-N147 VanDerWaalsContact O-N 3.08Å; N147-R149 WeakPolarHBondContact O-CG 3.27Å; N147-R149 PolarHBondContact O-N 2.64Å
148	T	50.5	Low	54.5	Low	105 Å²	105	75.7 Å²	75.7	64%	0.644	41%	0.405	S	S	*	.			trans	-66.6	74.8	166.8	46.7	0	0	0	0	111	Q144 A145	Q144-T148 PolarHBondContact O-N 3.33Å; A145-T148 WeakPolarHBondContact O-CB 3.2Å; A145-T148 WeakPolarHBondContact O-CG2 3.21Å; A145-T148 PolarHBondContact O-N 3.3Å; A145-T148 PolarHBondContact O-OG1 3.19Å
149	R	61.5	Low	56.2	Low	95 Å²	95	74 Å²	74	36%	0.358	40%	0.403	S	S	.	.			trans	-58.4	126.6	-176	-53.3	-166.9	-162.5	88.8	-3.7	109.6	N147 L159 E172	N147-R149 WeakPolarHBondContact O-CG 3.27Å; N147-R149 PolarHBondContact O-N 2.64Å; R149-L159 HydrophobicContact CB-CD2 4.07Å; R149-E172 IonicContact CZ-OE1 3.5Å; R149-E172 IonicContact CZ-OE2 2.82Å; R149-E172 IonicContact NE-OE1 2.75Å; R149-E172 PolarHBondContact NE-OE1 3.45Å; R149-E172 IonicContact NH2-OE1 3.31Å; R149-E172 PolarHBondContact NH2-OE1 2.75Å; R149-E172 IonicContact NH2-OE2 3.23Å; R149-E172 PolarHBondContact NH2-OE2 3.23Å
150	P	63.7	Low	57.8	Low	17 Å²	17	83.6 Å²	83.6	11%	0.11	43%	0.432	C	S	.	.			trans	-63	142.5	-174	25.2	-35.5	0	0	0	111.3	R152 T153 R164 H236	P150-R152 PolarHBondContact O-N 2.96Å; P150-R152 VanDerWaalsContact O-N 3.11Å; P150-T153 HydrophobicContact CG-CG2 3.89Å; P150-R164 VanDerWaalsContact O-CZ 3.26Å; P150-R164 PolarHBondContact O-NH1 3.29Å; P150-R164 PolarHBondContact O-NH2 3.45Å; P150-H236 HydrophobicContact CB-CB 4.36Å; P150-H236 VanDerWaalsContact CB-CD2 3.44Å; P150-H236 WeakPolarHBondContact CB-CD2 3.01Å; P150-H236 WeakPolarHBondContact CB-NE2 3.18Å; P150-H236 HydrophobicContact CG-CB 4.25Å; P150-H236 VanDerWaalsContact CG-CD2 3.46Å; P150-H236 WeakPolarHBondContact CG-CD2 3.44Å
151	E	65.7	Low	59.7	Low	147 Å²	147	84.9 Å²	84.9	69%	0.687	43%	0.433	S	S	*	.	S	Bend	trans	-54.3	-37.2	-176.2	-71.9	-152.8	142.5	0	0	113	T158 L159 R164	E151-T158 CarbonylContact O-C 3.5Å; E151-T158 WeakPolarHBondContact O-CA 3.49Å; E151-L159 PolarHBondContact O-N 3.05Å; E151-R164 PolarHBondContact O-NH1 3.5Å
152	R	65.3	Low	61.8	Low	156 Å²	156	87.4 Å²	87.4	59%	0.589	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.5	-179.5	-51.7	-176	-170.3	-170.2	3.8	109.8	P150 L157 T158	P150-R152 PolarHBondContact O-N 2.96Å; P150-R152 VanDerWaalsContact O-N 3.11Å; R152-L157 WeakPolarHBondContact CA-O 3.4Å; R152-T158 HydrophobicContact CG-CG2 4.36Å
153	T	71.4	Confident	63.9	Low	1 Å²	1	88.1 Å²	88.1	1%	0.006	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	152.2	165	52	0	0	0	0	110.2	P150 F155 C156 L157 R164 I229 G232	P150-T153 HydrophobicContact CG-CG2 3.89Å; T153-F155 PolarHBondContact O-N 3.38Å; T153-C156 PolarHBondContact O-N 3.39Å; T153-L157 PolarHBondContact N-O 2.94Å; T153-L157 WeakPolarHBondContact O-CB 3.43Å; T153-L157 PolarHBondContact O-N 3.33Å; T153-R164 VanDerWaalsContact OG1-CD 3.3Å; T153-R164 WeakPolarHBondContact OG1-CD 3.17Å; T153-R164 PolarHBondContact OG1-NE 3.01Å; T153-I229 PolarHBondContact OG1-O 3.32Å; T153-G232 VanDerWaalsContact CG2-CA 3.44Å
154	L	70.7	Confident	65.9	Low	83 Å²	83	85.8 Å²	85.8	44%	0.435	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	33.5	-178	-57.9	173.4	0	0	0	113.4	C156 L157 I228 I229 F233	L154-C156 PolarHBondContact O-N 2.87Å; L154-C156 PolarHBondContact O-SG 2.9Å; L154-C156 VanDerWaalsContact O-SG 3.4Å; L154-L157 HydrophobicContact CD1-CD1 4.19Å; L154-I228 HydrophobicContact CD2-CG2 4.25Å; L154-I229 HydrophobicContact CD1-CG1 4.46Å; L154-F233 HydrophobicContact CD2-CB 4.23Å
155	F	66.5	Low	67.9	Low	166 Å²	166	86.1 Å²	86.1	73%	0.728	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	-26.1	-171.4	-59.1	-82.5	0	0	0	117.1	T153 M235	T153-F155 PolarHBondContact O-N 3.38Å; F155-M235 HydrophobicContact CE1-SD 4.06Å; F155-M235 HydrophobicContact CE2-SD 4.33Å; F155-M235 HydrophobicContact CZ-CE 3.82Å; F155-M235 HydrophobicContact CZ-SD 3.54Å; F155-M235 VanDerWaalsContact CZ-SD 3.54Å
156	C	73	Confident	70.2	Confident	89 Å²	89	88.1 Å²	88.1	60%	0.601	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-20.4	-171.3	63.6	0	0	0	0	115.6	T153 L154 T158	T153-C156 PolarHBondContact O-N 3.39Å; L154-C156 PolarHBondContact O-N 2.87Å; L154-C156 PolarHBondContact O-SG 2.9Å; L154-C156 VanDerWaalsContact O-SG 3.4Å; C156-T158 PolarHBondContact O-N 2.75Å
157	L	71.1	Confident	72	Confident	23 Å²	23	85.9 Å²	85.9	12%	0.12	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	87.9	-172.4	-58.2	-177.5	0	0	0	112.1	R152 T153 L154 N161 R164 I229	R152-L157 WeakPolarHBondContact CA-O 3.4Å; T153-L157 PolarHBondContact N-O 2.94Å; T153-L157 WeakPolarHBondContact O-CB 3.43Å; T153-L157 PolarHBondContact O-N 3.33Å; L154-L157 HydrophobicContact CD1-CD1 4.19Å; L157-N161 WeakPolarHBondContact CD2-ND2 3.09Å; L157-R164 HydrophobicContact CB-CB 4.44Å; L157-R164 WeakPolarHBondContact O-CD 3.26Å; L157-R164 PolarHBondContact O-NH1 3.32Å; L157-I229 HydrophobicContact CD1-CG1 4.38Å; L157-I229 HydrophobicContact CD1-CG2 3.91Å
158	T	75.5	Confident	73.7	Confident	59 Å²	59	83 Å²	83	36%	0.362	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	153.9	172.8	65	0	0	0	0	111.9	E151 R152 C156 R160 N161	E151-T158 CarbonylContact O-C 3.5Å; E151-T158 WeakPolarHBondContact O-CA 3.49Å; R152-T158 HydrophobicContact CG-CG2 4.36Å; C156-T158 PolarHBondContact O-N 2.75Å; T158-R160 PolarHBondContact O-N 2.92Å; T158-R160 VanDerWaalsContact O-N 3.07Å; T158-N161 VanDerWaalsContact O-CB 3.29Å; T158-N161 WeakPolarHBondContact O-CB 3.46Å; T158-N161 PolarHBondContact O-N 3.12Å; T158-N161 PolarHBondContact OG1-N 2.61Å
159	L	72.7	Confident	75.3	Confident	71 Å²	71	86 Å²	86	37%	0.372	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-20.9	171.5	-74.7	169.5	0	0	0	113.8	R149 E151 I168	R149-L159 HydrophobicContact CB-CD2 4.07Å; E151-L159 PolarHBondContact O-N 3.05Å; L159-I168 HydrophobicContact CD2-CD1 4.23Å
160	R	72.2	Confident	76.6	Confident	238 Å²	238	84.4 Å²	84.4	90%	0.898	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-13.6	175.7	-64.4	-173.3	-179.1	-168.6	0.7	113.7	T158 S162	T158-R160 PolarHBondContact O-N 2.92Å; T158-R160 VanDerWaalsContact O-N 3.07Å; R160-S162 PolarHBondContact O-N 3.07Å
161	N	79.9	Confident	77.3	Confident	54 Å²	54	84.2 Å²	84.2	29%	0.289	41%	0.413	S	S	.	.			trans	-67.8	126.3	-179.7	-170.9	-33.3	0	0	0	110.3	L157 T158 L163 R164 K165	L157-N161 WeakPolarHBondContact CD2-ND2 3.09Å; T158-N161 VanDerWaalsContact O-CB 3.29Å; T158-N161 WeakPolarHBondContact O-CB 3.46Å; T158-N161 PolarHBondContact O-N 3.12Å; T158-N161 PolarHBondContact OG1-N 2.61Å; N161-L163 VanDerWaalsContact C-N 3.28Å; N161-L163 PolarHBondContact O-N 3.22Å; N161-L163 PolarHBondContact OD1-N 3.4Å; N161-L163 VanDerWaalsContact OD1-N 3.14Å; N161-R164 HydrophobicContact CB-CB 4.44Å; N161-R164 PolarHBondContact O-N 2.73Å; N161-K165 PolarHBondContact O-N 3.36Å
162	S	83.3	Confident	78	Confident	91 Å²	91	81.1 Å²	81.1	64%	0.636	40%	0.398	S	S	*	.	H	α-helix	trans	-56.8	-40.5	-176.5	51.9	0	0	0	0	112.6	R160 K165 V166	R160-S162 PolarHBondContact O-N 3.07Å; S162-K165 PolarHBondContact O-N 2.72Å; S162-V166 WeakPolarHBondContact O-CG2 3.49Å; S162-V166 PolarHBondContact O-N 2.99Å
163	L	81.5	Confident	79	Confident	93 Å²	93	81.1 Å²	81.1	49%	0.487	40%	0.399	S	S	.	.	H	α-helix	trans	-60.5	-50.9	178.3	-167.7	161.7	0	0	0	110.4	N161 K165 V166 C167 I229	N161-L163 VanDerWaalsContact C-N 3.28Å; N161-L163 PolarHBondContact O-N 3.22Å; N161-L163 PolarHBondContact OD1-N 3.4Å; N161-L163 VanDerWaalsContact OD1-N 3.14Å; L163-K165 PolarHBondContact O-N 3.2Å; L163-V166 PolarHBondContact O-N 2.85Å; L163-C167 PolarHBondContact O-N 3.42Å; L163-C167 PolarHBondContact O-SG 3.12Å; L163-I229 HydrophobicContact CD2-CD1 4.14Å; L163-I229 HydrophobicContact CD2-CG2 3.82Å
164	R	83	Confident	79.5	Confident	0 Å²	0	87.9 Å²	87.9	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-63.6	-41.1	178.5	-174.3	175.9	176.7	-153.3	-9	112.1	P150 E151 T153 L157 N161 V166 C167 I168 I229 A230	P150-R164 VanDerWaalsContact O-CZ 3.26Å; P150-R164 PolarHBondContact O-NH1 3.29Å; P150-R164 PolarHBondContact O-NH2 3.45Å; E151-R164 PolarHBondContact O-NH1 3.5Å; T153-R164 VanDerWaalsContact OG1-CD 3.3Å; T153-R164 WeakPolarHBondContact OG1-CD 3.17Å; T153-R164 PolarHBondContact OG1-NE 3.01Å; L157-R164 HydrophobicContact CB-CB 4.44Å; L157-R164 WeakPolarHBondContact O-CD 3.26Å; L157-R164 PolarHBondContact O-NH1 3.32Å; N161-R164 HydrophobicContact CB-CB 4.44Å; N161-R164 PolarHBondContact O-N 2.73Å; R164-V166 VanDerWaalsContact C-N 3.3Å; R164-V166 PolarHBondContact O-N 3.49Å; R164-C167 PolarHBondContact O-N 2.93Å; R164-I168 HydrophobicContact CG-CD1 3.92Å; R164-I168 HydrophobicContact CG-CG1 4.4Å; R164-I168 VanDerWaalsContact O-CG1 3.32Å; R164-I168 WeakPolarHBondContact O-CG1 3.42Å; R164-I168 PolarHBondContact O-N 3.27Å; R164-I229 HydrophobicContact CB-CG2 4.4Å; R164-I229 HydrophobicContact CG-CG2 4.43Å; R164-A230 PolarHBondContact NE-O 2.7Å; R164-A230 PolarHBondContact NH2-O 2.95Å; R164-A230 VanDerWaalsContact NH2-O 3.16Å
165	K	83.1	Confident	80.3	Confident	147 Å²	147	86.8 Å²	86.8	64%	0.639	43%	0.426	S	S	*	.	H	α-helix	trans	-61.8	-36.9	176.6	-172.2	174.3	-178.7	177.4	0	112.2	N161 S162 L163 K169	N161-K165 PolarHBondContact O-N 3.36Å; S162-K165 PolarHBondContact O-N 2.72Å; L163-K165 PolarHBondContact O-N 3.2Å; K165-K169 WeakPolarHBondContact O-CB 3.35Å; K165-K169 PolarHBondContact O-N 3.29Å; K165-K169 VanDerWaalsContact O-N 3.11Å
166	V	87	Confident	81.2	Confident	83 Å²	83	80 Å²	80	50%	0.503	40%	0.396	S	S	.	.	H	α-helix	trans	-69.1	-46.4	173.2	169.2	0	0	0	0	111.2	S162 L163 R164 I168 K169 I170	S162-V166 WeakPolarHBondContact O-CG2 3.49Å; S162-V166 PolarHBondContact O-N 2.99Å; L163-V166 PolarHBondContact O-N 2.85Å; R164-V166 VanDerWaalsContact C-N 3.3Å; R164-V166 PolarHBondContact O-N 3.49Å; V166-I168 VanDerWaalsContact C-N 3.34Å; V166-I168 PolarHBondContact O-N 3.14Å; V166-K169 PolarHBondContact O-N 3.19Å; V166-K169 VanDerWaalsContact O-N 3.17Å; V166-I170 HydrophobicContact CG1-CD1 3.69Å; V166-I170 HydrophobicContact CG1-CG1 4.41Å; V166-I170 WeakPolarHBondContact O-CG1 3.39Å; V166-I170 PolarHBondContact O-N 3.48Å
167	C	86.2	Confident	81.5	Confident	8 Å²	8	81.3 Å²	81.3	5%	0.054	39%	0.393	C	S	.	.	H	α-helix	trans	-60.9	-39.8	177.6	-64.7	0	0	0	0	112.9	L163 R164 I170 G171 L226 I229	L163-C167 PolarHBondContact O-N 3.42Å; L163-C167 PolarHBondContact O-SG 3.12Å; R164-C167 PolarHBondContact O-N 2.93Å; C167-I170 PolarHBondContact O-N 2.95Å; C167-G171 PolarHBondContact O-N 2.92Å; C167-L226 HydrophobicContact CB-CD2 4.19Å; C167-L226 VanDerWaalsContact SG-CD2 3.56Å; C167-I229 HydrophobicContact CB-CB 4.31Å; C167-I229 HydrophobicContact CB-CG2 3.75Å
168	I	83.3	Confident	82.2	Confident	17 Å²	17	87.7 Å²	87.7	9%	0.087	42%	0.417	C	S	.	.	H	α-helix	trans	-61.5	-50.2	172.5	-68.7	166.3	0	0	0	110.2	L159 R164 V166 I170 G171 E172 A230	L159-I168 HydrophobicContact CD2-CD1 4.23Å; R164-I168 HydrophobicContact CG-CD1 3.92Å; R164-I168 HydrophobicContact CG-CG1 4.4Å; R164-I168 VanDerWaalsContact O-CG1 3.32Å; R164-I168 WeakPolarHBondContact O-CG1 3.42Å; R164-I168 PolarHBondContact O-N 3.27Å; V166-I168 VanDerWaalsContact C-N 3.34Å; V166-I168 PolarHBondContact O-N 3.14Å; I168-I170 PolarHBondContact O-N 3.07Å; I168-G171 PolarHBondContact O-N 3.02Å; I168-E172 HydrophobicContact CG2-CG 4.43Å; I168-E172 PolarHBondContact O-N 2.97Å; I168-A230 HydrophobicContact CG1-CB 3.7Å
169	K	85.5	Confident	82.8	Confident	169 Å²	169	89.2 Å²	89.2	74%	0.735	42%	0.422	S	S	*	.	H	α-helix	trans	-61.1	-30	-179.9	-173.9	175.9	178.6	-176.7	0	113.2	K165 V166	K165-K169 WeakPolarHBondContact O-CB 3.35Å; K165-K169 PolarHBondContact O-N 3.29Å; K165-K169 VanDerWaalsContact O-N 3.11Å; V166-K169 PolarHBondContact O-N 3.19Å; V166-K169 VanDerWaalsContact O-N 3.17Å
170	I	87.3	Confident	83.4	Confident	61 Å²	61	86 Å²	86	31%	0.313	41%	0.405	S	S	.	.	H	α-helix	trans	-79.1	-47.9	174.9	-66.6	168.1	0	0	0	110.9	V166 C167 I168 E172 W173 F176 L226	V166-I170 HydrophobicContact CG1-CD1 3.69Å; V166-I170 HydrophobicContact CG1-CG1 4.41Å; V166-I170 WeakPolarHBondContact O-CG1 3.39Å; V166-I170 PolarHBondContact O-N 3.48Å; C167-I170 PolarHBondContact O-N 2.95Å; I168-I170 PolarHBondContact O-N 3.07Å; I170-E172 VanDerWaalsContact C-N 3.31Å; I170-E172 PolarHBondContact O-N 3.11Å; I170-W173 VanDerWaalsContact O-CB 3.24Å; I170-W173 WeakPolarHBondContact O-CB 3.13Å; I170-W173 PolarHBondContact O-N 3.48Å; I170-F176 HydrophobicContact CG2-CD2 3.94Å; I170-F176 HydrophobicContact CG2-CE2 4.07Å; I170-F176 HydrophobicContact CG2-CG 4.34Å; I170-F176 WeakPolarHBondContact O-CB 3.43Å; I170-L226 HydrophobicContact CG2-CD1 4.17Å
171	G	78.6	Confident	83.7	Confident	13 Å²	13	77.3 Å²	77.3	13%	0.134	38%	0.377	C	S	.	.	H	α-helix	trans	-66.4	-28.5	-175.1	0	0	0	0	0	114.5	C167 I168	C167-G171 PolarHBondContact O-N 2.92Å; I168-G171 PolarHBondContact O-N 3.02Å
172	E	81.5	Confident	83.9	Confident	81 Å²	81	79.9 Å²	79.9	38%	0.379	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5.9	177.5	-62.8	174.9	176.4	0	0	113.1	R149 I168 I170	R149-E172 IonicContact CZ-OE1 3.5Å; R149-E172 IonicContact CZ-OE2 2.82Å; R149-E172 IonicContact NE-OE1 2.75Å; R149-E172 PolarHBondContact NE-OE1 3.45Å; R149-E172 IonicContact NH2-OE1 3.31Å; R149-E172 PolarHBondContact NH2-OE1 2.75Å; R149-E172 IonicContact NH2-OE2 3.23Å; R149-E172 PolarHBondContact NH2-OE2 3.23Å; I168-E172 HydrophobicContact CG2-CG 4.43Å; I168-E172 PolarHBondContact O-N 2.97Å; I170-E172 VanDerWaalsContact C-N 3.31Å; I170-E172 PolarHBondContact O-N 3.11Å
173	W	85.4	Confident	84.1	Confident	157 Å²	157	76.4 Å²	76.4	60%	0.595	37%	0.365	S	S	*	.			trans	-82.8	117.8	-178.3	-161.4	41.1	0	0	0	110.2	I170 P175 F176 E177	I170-W173 VanDerWaalsContact O-CB 3.24Å; I170-W173 WeakPolarHBondContact O-CB 3.13Å; I170-W173 PolarHBondContact O-N 3.48Å; W173-P175 VanDerWaalsContact C-CD 3.46Å; W173-P175 VanDerWaalsContact C-N 3.3Å; W173-P175 HydrophobicContact CD2-CB 3.99Å; W173-P175 HydrophobicContact CD2-CG 3.93Å; W173-P175 HydrophobicContact CE3-CB 3.95Å; W173-P175 HydrophobicContact CE3-CG 4.39Å; W173-P175 HydrophobicContact CG-CG 4.33Å; W173-P175 HydrophobicContact CH2-CB 4.19Å; W173-P175 HydrophobicContact CH2-CG 4.43Å; W173-P175 HydrophobicContact CZ2-CB 4.23Å; W173-P175 HydrophobicContact CZ2-CG 3.97Å; W173-P175 HydrophobicContact CZ3-CB 4.05Å; W173-P175 VanDerWaalsContact O-N 3.15Å; W173-F176 HydrophobicContact CB-CB 4.22Å; W173-F176 WeakPolarHBondContact O-CA 3.31Å; W173-F176 WeakPolarHBondContact O-CB 3.34Å; W173-F176 PolarHBondContact O-N 3.05Å; W173-E177 PolarHBondContact O-N 3.41Å
174	K	82.7	Confident	84.2	Confident	142 Å²	142	72 Å²	72	62%	0.617	34%	0.342	S	S	*	.	H	α-helix	trans	-51.7	-38.1	180	-64.8	-173.8	176.7	-174.7	0	114.6	F176 E177 Y178	K174-F176 VanDerWaalsContact C-N 3.26Å; K174-F176 PolarHBondContact O-N 2.83Å; K174-E177 PolarHBondContact O-N 2.77Å; K174-Y178 HydrophobicContact CB-CE2 4.34Å; K174-Y178 VanDerWaalsContact O-CD2 3.24Å; K174-Y178 WeakPolarHBondContact O-CD2 3.34Å; K174-Y178 PolarHBondContact O-N 3.29Å
175	P	86.6	Confident	84	Confident	60 Å²	60	76.9 Å²	76.9	39%	0.39	37%	0.366	S	S	.	.	H	α-helix	trans	-60.7	-28.1	171	-26.6	37	0	0	0	114.9	W173 L179	W173-P175 VanDerWaalsContact C-CD 3.46Å; W173-P175 VanDerWaalsContact C-N 3.3Å; W173-P175 HydrophobicContact CD2-CB 3.99Å; W173-P175 HydrophobicContact CD2-CG 3.93Å; W173-P175 HydrophobicContact CE3-CB 3.95Å; W173-P175 HydrophobicContact CE3-CG 4.39Å; W173-P175 HydrophobicContact CG-CG 4.33Å; W173-P175 HydrophobicContact CH2-CB 4.19Å; W173-P175 HydrophobicContact CH2-CG 4.43Å; W173-P175 HydrophobicContact CZ2-CB 4.23Å; W173-P175 HydrophobicContact CZ2-CG 3.97Å; W173-P175 HydrophobicContact CZ3-CB 4.05Å; W173-P175 VanDerWaalsContact O-N 3.15Å; P175-L179 WeakPolarHBondContact O-CB 3.31Å; P175-L179 PolarHBondContact O-N 3.06Å
176	F	86.1	Confident	84.2	Confident	24 Å²	24	71.8 Å²	71.8	11%	0.105	35%	0.351	C	S	.	.	H	α-helix	trans	-69.6	-41.4	173.3	-177.7	-106.7	0	0	0	111.3	I170 W173 K174 L179 I180 E223 L226	I170-F176 HydrophobicContact CG2-CD2 3.94Å; I170-F176 HydrophobicContact CG2-CE2 4.07Å; I170-F176 HydrophobicContact CG2-CG 4.34Å; I170-F176 WeakPolarHBondContact O-CB 3.43Å; W173-F176 HydrophobicContact CB-CB 4.22Å; W173-F176 WeakPolarHBondContact O-CA 3.31Å; W173-F176 WeakPolarHBondContact O-CB 3.34Å; W173-F176 PolarHBondContact O-N 3.05Å; K174-F176 VanDerWaalsContact C-N 3.26Å; K174-F176 PolarHBondContact O-N 2.83Å; F176-L179 PolarHBondContact O-N 3.31Å; F176-I180 HydrophobicContact CE1-CG1 4.38Å; F176-I180 HydrophobicContact CE2-CG1 4.42Å; F176-I180 HydrophobicContact CZ-CD1 4.49Å; F176-I180 HydrophobicContact CZ-CG1 4.3Å; F176-I180 WeakPolarHBondContact O-CG1 3.41Å; F176-I180 PolarHBondContact O-N 2.9Å; F176-E223 HydrophobicContact CE1-CG 3.86Å; F176-E223 HydrophobicContact CZ-CB 4.28Å; F176-E223 HydrophobicContact CZ-CG 3.56Å; F176-L226 HydrophobicContact CE2-CD1 4.13Å; F176-L226 HydrophobicContact CZ-CD1 4.05Å
177	E	79.8	Confident	84.1	Confident	117 Å²	117	67.9 Å²	67.9	55%	0.547	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-47.1	172.3	-60.5	-172	123.5	0	0	111.4	W173 K174 L179 I180 L181	W173-E177 PolarHBondContact O-N 3.41Å; K174-E177 PolarHBondContact O-N 2.77Å; E177-L179 PolarHBondContact O-N 2.73Å; E177-I180 PolarHBondContact O-N 2.98Å; E177-L181 WeakPolarHBondContact O-CB 3.29Å; E177-L181 PolarHBondContact O-N 2.76Å
178	Y	84.1	Confident	83.8	Confident	157 Å²	157	68.5 Å²	68.5	62%	0.616	33%	0.331	S	S	*	.	H	α-helix	trans	-64.5	-36.9	176.2	-63.9	-47.2	0	0	0	113.1	K174 L181 L182	K174-Y178 HydrophobicContact CB-CE2 4.34Å; K174-Y178 VanDerWaalsContact O-CD2 3.24Å; K174-Y178 WeakPolarHBondContact O-CD2 3.34Å; K174-Y178 PolarHBondContact O-N 3.29Å; Y178-L181 PolarHBondContact O-N 2.8Å; Y178-L182 VanDerWaalsContact O-CB 3.26Å; Y178-L182 WeakPolarHBondContact O-CB 3.21Å; Y178-L182 PolarHBondContact O-N 3.24Å
179	L	88	Confident	83.8	Confident	90 Å²	90	71.7 Å²	71.7	47%	0.471	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-43.9	175.8	-179.9	154.8	0	0	0	111.4	P175 F176 E177 L182 T183	P175-L179 WeakPolarHBondContact O-CB 3.31Å; P175-L179 PolarHBondContact O-N 3.06Å; F176-L179 PolarHBondContact O-N 3.31Å; E177-L179 PolarHBondContact O-N 2.73Å; L179-L182 PolarHBondContact O-N 3.02Å; L179-T183 WeakPolarHBondContact O-CB 3.39Å; L179-T183 PolarHBondContact O-N 3.17Å; L179-T183 PolarHBondContact O-OG1 3.37Å
180	I	85.9	Confident	83.9	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.015	33%	0.326	C	S	.	.	H	α-helix	trans	-68.2	-39.2	176.1	-64.4	-64.2	0	0	0	110.8	F176 E177 L182 T183 I184 I219 F220 E223	F176-I180 HydrophobicContact CE1-CG1 4.38Å; F176-I180 HydrophobicContact CE2-CG1 4.42Å; F176-I180 HydrophobicContact CZ-CD1 4.49Å; F176-I180 HydrophobicContact CZ-CG1 4.3Å; F176-I180 WeakPolarHBondContact O-CG1 3.41Å; F176-I180 PolarHBondContact O-N 2.9Å; E177-I180 PolarHBondContact O-N 2.98Å; I180-L182 PolarHBondContact O-N 3.4Å; I180-T183 CarbonylContact O-C 3.6Å; I180-T183 WeakPolarHBondContact O-CB 3.15Å; I180-T183 PolarHBondContact O-N 3.16Å; I180-T183 VanDerWaalsContact O-N 3.14Å; I180-I184 HydrophobicContact CG2-CD1 3.95Å; I180-I184 HydrophobicContact CG2-CG1 4.42Å; I180-I184 WeakPolarHBondContact O-CG1 3.18Å; I180-I184 PolarHBondContact O-N 2.8Å; I180-I219 HydrophobicContact CD1-CG2 4.17Å; I180-F220 HydrophobicContact CG2-CE1 4.28Å; I180-E223 HydrophobicContact CD1-CB 3.93Å; I180-E223 HydrophobicContact CD1-CG 3.68Å; I180-E223 HydrophobicContact CG1-CG 3.92Å; I180-E223 WeakPolarHBondContact CG2-OE2 3.46Å
181	L	78.4	Confident	83.7	Confident	57 Å²	57	61.8 Å²	61.8	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-61.7	-43.1	175.3	-155.8	70.8	0	0	0	111.9	E177 Y178 T183 I184 M185 L287	E177-L181 WeakPolarHBondContact O-CB 3.29Å; E177-L181 PolarHBondContact O-N 2.76Å; Y178-L181 PolarHBondContact O-N 2.8Å; L181-T183 VanDerWaalsContact C-N 3.33Å; L181-I184 PolarHBondContact O-N 3.3Å; L181-M185 PolarHBondContact O-N 3.09Å; L181-L287 HydrophobicContact CD1-CD2 3.66Å; L181-L287 HydrophobicContact CD1-CG 4.16Å; L181-L287 HydrophobicContact CD2-CD2 4.19Å; L181-L287 HydrophobicContact CG-CD2 3.87Å
182	L	85.2	Confident	83.9	Confident	108 Å²	108	62 Å²	62	57%	0.565	31%	0.314	S	S	*	.	H	α-helix	trans	-63.4	-38.1	173.1	-178.1	63.9	0	0	0	111.7	Y178 L179 I180 M185 A186	Y178-L182 VanDerWaalsContact O-CB 3.26Å; Y178-L182 WeakPolarHBondContact O-CB 3.21Å; Y178-L182 PolarHBondContact O-N 3.24Å; L179-L182 PolarHBondContact O-N 3.02Å; I180-L182 PolarHBondContact O-N 3.4Å; L182-M185 HydrophobicContact CD1-CE 4Å; L182-M185 PolarHBondContact O-N 3.29Å; L182-A186 VanDerWaalsContact O-CB 3.3Å; L182-A186 WeakPolarHBondContact O-CB 2.95Å; L182-A186 PolarHBondContact O-N 3.14Å
183	T	87.1	Confident	84.2	Confident	17 Å²	17	60.2 Å²	60.2	10%	0.104	31%	0.313	C	S	.	.	H	α-helix	trans	-67.6	-39.8	176	-55.6	0	0	0	0	111.6	L179 I180 L181 A186 N187 F216 I219 F220	L179-T183 WeakPolarHBondContact O-CB 3.39Å; L179-T183 PolarHBondContact O-N 3.17Å; L179-T183 PolarHBondContact O-OG1 3.37Å; I180-T183 CarbonylContact O-C 3.6Å; I180-T183 WeakPolarHBondContact O-CB 3.15Å; I180-T183 PolarHBondContact O-N 3.16Å; I180-T183 VanDerWaalsContact O-N 3.14Å; L181-T183 VanDerWaalsContact C-N 3.33Å; T183-A186 PolarHBondContact O-N 2.66Å; T183-N187 WeakPolarHBondContact O-CB 3.18Å; T183-N187 PolarHBondContact O-N 3.38Å; T183-F216 HydrophobicContact CG2-CD1 3.69Å; T183-F216 HydrophobicContact CG2-CE1 4.06Å; T183-I219 HydrophobicContact CG2-CB 4.46Å; T183-I219 HydrophobicContact CG2-CD1 4.16Å; T183-I219 HydrophobicContact CG2-CG2 4Å; T183-F220 HydrophobicContact CG2-CE1 4.18Å; T183-F220 HydrophobicContact CG2-CE2 4.43Å; T183-F220 HydrophobicContact CG2-CZ 3.84Å
184	I	83.7	Confident	84.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-46.8	173.3	-68.7	164.5	0	0	0	109.9	I180 L181 A186 N187 C188 F220 R283 R286	I180-I184 HydrophobicContact CG2-CD1 3.95Å; I180-I184 HydrophobicContact CG2-CG1 4.42Å; I180-I184 WeakPolarHBondContact O-CG1 3.18Å; I180-I184 PolarHBondContact O-N 2.8Å; L181-I184 PolarHBondContact O-N 3.3Å; I184-A186 PolarHBondContact O-N 2.96Å; I184-N187 WeakPolarHBondContact O-CB 3.48Å; I184-N187 PolarHBondContact O-N 3.03Å; I184-C188 PolarHBondContact O-N 3.16Å; I184-C188 PolarHBondContact O-SG 2.65Å; I184-F220 HydrophobicContact CD1-CE1 4.47Å; I184-F220 HydrophobicContact CG1-CE1 3.7Å; I184-F220 HydrophobicContact CG1-CZ 3.76Å; I184-R283 HydrophobicContact CG2-CB 4.23Å; I184-R286 HydrophobicContact CD1-CB 4.14Å; I184-R286 HydrophobicContact CD1-CG 4.13Å
185	M	79.2	Confident	84.3	Confident	103 Å²	103	49 Å²	49	51%	0.507	27%	0.273	S	S	.	.	H	α-helix	trans	-61.8	-43.9	177.1	-167.3	177.4	77.2	0	0	111.8	L181 L182 N187 C188 C189	L181-M185 PolarHBondContact O-N 3.09Å; L182-M185 HydrophobicContact CD1-CE 4Å; L182-M185 PolarHBondContact O-N 3.29Å; M185-N187 VanDerWaalsContact C-N 3.31Å; M185-N187 PolarHBondContact O-N 2.72Å; M185-C188 WeakPolarHBondContact O-CB 3.24Å; M185-C188 PolarHBondContact O-N 3.33Å; M185-C188 VanDerWaalsContact O-N 3.14Å; M185-C189 PolarHBondContact O-N 2.86Å; M185-C189 PolarHBondContact O-SG 2.74Å
186	A	86.8	Confident	84.1	Confident	40 Å²	40	47.4 Å²	47.4	33%	0.331	26%	0.263	S	S	.	.	H	α-helix	trans	-62	-37.6	174.8	0	0	0	0	0	112.3	L182 T183 I184 C189 A190 F216	L182-A186 VanDerWaalsContact O-CB 3.3Å; L182-A186 WeakPolarHBondContact O-CB 2.95Å; L182-A186 PolarHBondContact O-N 3.14Å; T183-A186 PolarHBondContact O-N 2.66Å; I184-A186 PolarHBondContact O-N 2.96Å; A186-C189 PolarHBondContact O-N 3.28Å; A186-A190 WeakPolarHBondContact O-CB 3.46Å; A186-A190 PolarHBondContact O-N 2.8Å; A186-F216 HydrophobicContact CB-CE1 4.09Å; A186-F216 HydrophobicContact CB-CZ 3.94Å
187	N	84.4	Confident	84	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-67.1	-36.7	172.8	179.9	98.3	0	0	0	112.3	T183 I184 M185 A190 L191 F216 R283	T183-N187 WeakPolarHBondContact O-CB 3.18Å; T183-N187 PolarHBondContact O-N 3.38Å; I184-N187 WeakPolarHBondContact O-CB 3.48Å; I184-N187 PolarHBondContact O-N 3.03Å; M185-N187 VanDerWaalsContact C-N 3.31Å; M185-N187 PolarHBondContact O-N 2.72Å; N187-A190 PolarHBondContact O-N 2.77Å; N187-L191 WeakPolarHBondContact ND2-CD1 3Å; N187-L191 WeakPolarHBondContact O-CG 3.46Å; N187-L191 PolarHBondContact O-N 3.3Å; N187-F216 HydrophobicContact CB-CD1 4.42Å; N187-F216 HydrophobicContact CB-CD2 3.83Å; N187-F216 HydrophobicContact CB-CE1 4.48Å; N187-F216 HydrophobicContact CB-CE2 3.91Å; N187-F216 HydrophobicContact CB-CG 4.11Å; N187-F216 HydrophobicContact CB-CZ 4.25Å; N187-F216 VanDerWaalsContact OD1-CD2 3.29Å; N187-F216 WeakPolarHBondContact OD1-CD2 3.44Å; N187-R283 PolarHBondContact OD1-NH1 3.41Å
188	C	80.5	Confident	84	Confident	20 Å²	20	47.5 Å²	47.5	14%	0.135	27%	0.265	C	S	.	.	H	α-helix	trans	-65.3	-43.5	172.2	-64.1	0	0	0	0	111.8	I184 M185 A190 L191 G192 P284	I184-C188 PolarHBondContact O-N 3.16Å; I184-C188 PolarHBondContact O-SG 2.65Å; M185-C188 WeakPolarHBondContact O-CB 3.24Å; M185-C188 PolarHBondContact O-N 3.33Å; M185-C188 VanDerWaalsContact O-N 3.14Å; C188-A190 VanDerWaalsContact C-N 3.31Å; C188-A190 PolarHBondContact O-N 2.81Å; C188-L191 PolarHBondContact O-N 2.74Å; C188-G192 PolarHBondContact O-N 3.17Å; C188-P284 VanDerWaalsContact SG-CD 3.58Å
189	C	84.2	Confident	83.5	Confident	85 Å²	85	48.4 Å²	48.4	57%	0.574	28%	0.28	S	S	*	.	H	α-helix	trans	-62.9	-37.9	174.3	-64.9	0	0	0	0	111.9	M185 A186 A193	M185-C189 PolarHBondContact O-N 2.86Å; M185-C189 PolarHBondContact O-SG 2.74Å; A186-C189 PolarHBondContact O-N 3.28Å; C189-A193 VanDerWaalsContact O-CB 3.32Å; C189-A193 WeakPolarHBondContact O-CB 3.41Å; C189-A193 PolarHBondContact O-N 3.11Å
190	A	86.1	Confident	82.7	Confident	16 Å²	16	46.2 Å²	46.2	13%	0.132	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-49.8	173.6	0	0	0	0	0	111.5	A186 N187 C188 G192 A193 I194 L209 F216	A186-A190 WeakPolarHBondContact O-CB 3.46Å; A186-A190 PolarHBondContact O-N 2.8Å; N187-A190 PolarHBondContact O-N 2.77Å; C188-A190 VanDerWaalsContact C-N 3.31Å; C188-A190 PolarHBondContact O-N 2.81Å; A190-G192 VanDerWaalsContact C-N 3.33Å; A190-G192 PolarHBondContact O-N 3Å; A190-A193 PolarHBondContact O-N 3.03Å; A190-I194 PolarHBondContact O-N 2.76Å; A190-L209 HydrophobicContact CB-CD2 3.98Å; A190-F216 HydrophobicContact CB-CE2 3.78Å
191	L	83	Confident	82.6	Confident	6 Å²	6	51.2 Å²	51.2	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-41.9	176.8	-72.7	172.6	0	0	0	112	N187 C188 A193 I194 V281 L752 M755	N187-L191 WeakPolarHBondContact ND2-CD1 3Å; N187-L191 WeakPolarHBondContact O-CG 3.46Å; N187-L191 PolarHBondContact O-N 3.3Å; C188-L191 PolarHBondContact O-N 2.74Å; L191-A193 PolarHBondContact O-N 3.41Å; L191-I194 HydrophobicContact CD2-CD1 4.21Å; L191-I194 PolarHBondContact O-N 3.4Å; L191-V281 HydrophobicContact CD1-CG2 4.38Å; L191-L752 HydrophobicContact CB-CD1 4.48Å; L191-L752 HydrophobicContact CB-CD2 4.24Å; L191-M755 WeakPolarHBondContact O-CE 3.31Å
192	G	84.3	Confident	82.7	Confident	17 Å²	17	50.2 Å²	50.2	18%	0.175	30%	0.304	C	S	.	.	H	α-helix	trans	-72.1	-10.8	175.7	0	0	0	0	0	115.1	C188 A190 F777	C188-G192 PolarHBondContact O-N 3.17Å; A190-G192 VanDerWaalsContact C-N 3.33Å; A190-G192 PolarHBondContact O-N 3Å; G192-F777 WeakPolarHBondContact O-CB 3.31Å
193	A	87.3	Confident	82.9	Confident	43 Å²	43	47 Å²	47	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-95	-13.2	172.9	0	0	0	0	0	113	C189 A190 L191 T195 L205 L209	C189-A193 VanDerWaalsContact O-CB 3.32Å; C189-A193 WeakPolarHBondContact O-CB 3.41Å; C189-A193 PolarHBondContact O-N 3.11Å; A190-A193 PolarHBondContact O-N 3.03Å; L191-A193 PolarHBondContact O-N 3.41Å; A193-T195 PolarHBondContact O-N 3.43Å; A193-L205 VanDerWaalsContact O-CD2 3.24Å; A193-L205 WeakPolarHBondContact O-CD2 2.99Å; A193-L209 HydrophobicContact CB-CD1 3.8Å
194	I	84.1	Confident	83	Confident	20 Å²	20	51.7 Å²	51.7	10%	0.103	32%	0.316	C	S	.	.			trans	-69.8	118.4	172.2	-62.1	175.3	0	0	0	108.4	A190 L191 P196 L209 M755	A190-I194 PolarHBondContact O-N 2.76Å; L191-I194 HydrophobicContact CD2-CD1 4.21Å; L191-I194 PolarHBondContact O-N 3.4Å; I194-P196 WeakPolarHBondContact O-CD 3.38Å; I194-L209 HydrophobicContact CB-CD1 4.44Å; I194-L209 HydrophobicContact CG1-CB 4.08Å; I194-L209 HydrophobicContact CG1-CD1 3.64Å; I194-M755 WeakPolarHBondContact O-CE 3.48Å
195	T	85.7	Confident	83.3	Confident	43 Å²	43	55.6 Å²	55.6	26%	0.264	34%	0.337	S	S	.	.			trans	-94.2	109.3	170.7	53	0	0	0	0	108.9	A193 Y197 N203 N206	A193-T195 PolarHBondContact O-N 3.43Å; T195-Y197 WeakPolarHBondContact O-CD2 3.33Å; T195-Y197 WeakPolarHBondContact O-CE2 2.98Å; T195-Y197 VanDerWaalsContact OG1-CE2 3.23Å; T195-Y197 WeakPolarHBondContact OG1-CE2 3.23Å; T195-N203 PolarHBondContact OG1-ND2 3.45Å; T195-N206 PolarHBondContact N-OD1 3.37Å; T195-N206 PolarHBondContact O-ND2 2.91Å
196	P	83.1	Confident	83.6	Confident	27 Å²	27	51.3 Å²	51.3	18%	0.175	32%	0.316	C	S	.	.			trans	-69.5	131	175.4	28.9	-34.9	0	0	0	110.9	I194 M755	I194-P196 WeakPolarHBondContact O-CD 3.38Å; P196-M755 HydrophobicContact CG-CG 3.73Å
197	Y	82.3	Confident	83.6	Confident	91 Å²	91	53.7 Å²	53.7	36%	0.357	32%	0.32	S	S	.	.			trans	-109.6	155.2	174.9	-66.8	-85.5	0	0	0	110.6	T195 N203	T195-Y197 WeakPolarHBondContact O-CD2 3.33Å; T195-Y197 WeakPolarHBondContact O-CE2 2.98Å; T195-Y197 VanDerWaalsContact OG1-CE2 3.23Å; T195-Y197 WeakPolarHBondContact OG1-CE2 3.23Å; Y197-N203 HydrophobicContact CE2-CB 3.96Å; Y197-N203 WeakPolarHBondContact CE2-ND2 3.32Å; Y197-N203 PolarHBondContact OH-ND2 2.96Å
198	P	80.4	Confident	83.8	Confident	52 Å²	52	58.3 Å²	58.3	34%	0.338	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-58.5	160.2	172.5	25.1	-35.2	0	0	0	112.7	G200 D201	P198-G200 PolarHBondContact O-N 3.26Å; P198-D201 PolarHBondContact O-N 2.94Å; P198-D201 VanDerWaalsContact O-N 3.1Å
199	D	74.9	Confident	84.1	Confident	176 Å²	176	58.4 Å²	58.4	94%	0.941	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	52.7	13.5	165.6	-54.6	-38.4	0	0	0	117.9
200	G	71.3	Confident	84	Confident	44 Å²	44	57.3 Å²	57.3	45%	0.454	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	95	8.5	177.3	0	0	0	0	0	115.4	P198	P198-G200 PolarHBondContact O-N 3.26Å
201	D	82.2	Confident	84	Confident	108 Å²	108	63.5 Å²	63.5	58%	0.578	35%	0.353	S	S	*	.			trans	-64.8	158.6	173.4	-174.7	31.9	0	0	0	112.5	P198	P198-D201 PolarHBondContact O-N 2.94Å; P198-D201 VanDerWaalsContact O-N 3.1Å
202	S	82.1	Confident	84.2	Confident	36 Å²	36	66.3 Å²	66.3	25%	0.252	37%	0.367	S	S	.	.			trans	-159.2	134.4	177.8	64.7	0	0	0	0	113.2	H207	S202-H207 PolarHBondContact OG-CE1 3.42Å; S202-H207 PolarHBondContact OG-NE2 2.89Å
203	N	88	Confident	84.1	Confident	42 Å²	42	66.1 Å²	66.1	23%	0.225	36%	0.362	C	S	.	.			trans	-75.6	168.7	172.6	68.7	30.3	0	0	0	112.7	T195 Y197 L205 N206 H207	T195-N203 PolarHBondContact OG1-ND2 3.45Å; Y197-N203 HydrophobicContact CE2-CB 3.96Å; Y197-N203 WeakPolarHBondContact CE2-ND2 3.32Å; Y197-N203 PolarHBondContact OH-ND2 2.96Å; N203-L205 PolarHBondContact O-N 3.29Å; N203-L205 WeakPolarHBondContact OD1-CA 3.36Å; N203-L205 WeakPolarHBondContact OD1-CB 3.35Å; N203-L205 PolarHBondContact OD1-N 2.79Å; N203-L205 VanDerWaalsContact OD1-N 3.12Å; N203-N206 PolarHBondContact O-N 2.62Å; N203-N206 PolarHBondContact OD1-N 2.87Å; N203-H207 PolarHBondContact O-N 3.23Å
204	T	90.1	Very high	83.9	Confident	115 Å²	115	68.2 Å²	68.2	71%	0.706	37%	0.367	S	S	*	.	H	α-helix	trans	-61.3	-27.6	179.1	52.1	0	0	0	0	113.6	I208	T204-I208 WeakPolarHBondContact O-CD1 3.31Å; T204-I208 VanDerWaalsContact O-CG1 3.32Å; T204-I208 WeakPolarHBondContact O-CG1 3.35Å; T204-I208 PolarHBondContact O-N 3.25Å
205	L	89.3	Confident	84.2	Confident	83 Å²	83	71.2 Å²	71.2	44%	0.435	39%	0.386	S	S	.	.	H	α-helix	trans	-70.3	-43.2	176.9	172.5	150.1	0	0	0	111.2	A193 N203 H207 I208 L209	A193-L205 VanDerWaalsContact O-CD2 3.24Å; A193-L205 WeakPolarHBondContact O-CD2 2.99Å; N203-L205 PolarHBondContact O-N 3.29Å; N203-L205 WeakPolarHBondContact OD1-CA 3.36Å; N203-L205 WeakPolarHBondContact OD1-CB 3.35Å; N203-L205 PolarHBondContact OD1-N 2.79Å; N203-L205 VanDerWaalsContact OD1-N 3.12Å; L205-H207 PolarHBondContact O-N 3.05Å; L205-I208 WeakPolarHBondContact O-CB 2.97Å; L205-I208 PolarHBondContact O-N 3.49Å; L205-I208 VanDerWaalsContact O-N 3.07Å; L205-L209 HydrophobicContact CD2-CD1 3.5Å; L205-L209 VanDerWaalsContact CD2-CD1 3.5Å; L205-L209 HydrophobicContact CD2-CG 4.29Å; L205-L209 HydrophobicContact CG-CD1 4.27Å; L205-L209 WeakPolarHBondContact O-CG 3.34Å; L205-L209 PolarHBondContact O-N 3.48Å
206	N	86	Confident	84.3	Confident	12 Å²	12	70.2 Å²	70.2	6%	0.064	38%	0.378	C	S	.	.	H	α-helix	trans	-58.7	-46.4	173.5	-73.8	-5.9	0	0	0	111	T195 N203 I208 L209 E210	T195-N206 PolarHBondContact N-OD1 3.37Å; T195-N206 PolarHBondContact O-ND2 2.91Å; N203-N206 PolarHBondContact O-N 2.62Å; N203-N206 PolarHBondContact OD1-N 2.87Å; N206-I208 PolarHBondContact O-N 2.97Å; N206-L209 PolarHBondContact O-N 2.87Å; N206-L209 VanDerWaalsContact O-N 3.09Å; N206-E210 PolarHBondContact O-N 3.16Å
207	H	85.7	Confident	84.4	Confident	91 Å²	91	69.3 Å²	69.3	42%	0.421	37%	0.372	S	S	.	.	H	α-helix	trans	-61.6	-26.5	175	-73.3	-33.8	0	0	0	114.2	S202 N203 L205 K211	S202-H207 PolarHBondContact OG-CE1 3.42Å; S202-H207 PolarHBondContact OG-NE2 2.89Å; N203-H207 PolarHBondContact O-N 3.23Å; L205-H207 PolarHBondContact O-N 3.05Å; H207-K211 WeakPolarHBondContact O-CD 3.41Å; H207-K211 WeakPolarHBondContact O-CG 3.06Å
208	I	90	Very high	84.7	Confident	98 Å²	98	69.3 Å²	69.3	50%	0.503	38%	0.381	S	S	.	.	H	α-helix	trans	-78.2	-42.6	172.5	-70.8	164.6	0	0	0	110	T204 L205 N206 K211 I212	T204-I208 WeakPolarHBondContact O-CD1 3.31Å; T204-I208 VanDerWaalsContact O-CG1 3.32Å; T204-I208 WeakPolarHBondContact O-CG1 3.35Å; T204-I208 PolarHBondContact O-N 3.25Å; L205-I208 WeakPolarHBondContact O-CB 2.97Å; L205-I208 PolarHBondContact O-N 3.49Å; L205-I208 VanDerWaalsContact O-N 3.07Å; N206-I208 PolarHBondContact O-N 2.97Å; I208-K211 WeakPolarHBondContact O-CB 3.4Å; I208-K211 PolarHBondContact O-N 2.88Å; I208-I212 HydrophobicContact CG2-CD1 3.76Å; I208-I212 HydrophobicContact CG2-CG1 4.45Å; I208-I212 WeakPolarHBondContact O-CG1 3.48Å; I208-I212 PolarHBondContact O-N 3.23Å
209	L	87.2	Confident	85.1	Confident	21 Å²	21	69.4 Å²	69.4	11%	0.11	38%	0.378	C	S	.	.	H	α-helix	trans	-64.1	-40.3	178.4	-68.7	175	0	0	0	112.5	A190 A193 I194 L205 N206 K211 I212 E213	A190-L209 HydrophobicContact CB-CD2 3.98Å; A193-L209 HydrophobicContact CB-CD1 3.8Å; I194-L209 HydrophobicContact CB-CD1 4.44Å; I194-L209 HydrophobicContact CG1-CB 4.08Å; I194-L209 HydrophobicContact CG1-CD1 3.64Å; L205-L209 HydrophobicContact CD2-CD1 3.5Å; L205-L209 VanDerWaalsContact CD2-CD1 3.5Å; L205-L209 HydrophobicContact CD2-CG 4.29Å; L205-L209 HydrophobicContact CG-CD1 4.27Å; L205-L209 WeakPolarHBondContact O-CG 3.34Å; L205-L209 PolarHBondContact O-N 3.48Å; N206-L209 PolarHBondContact O-N 2.87Å; N206-L209 VanDerWaalsContact O-N 3.09Å; L209-K211 VanDerWaalsContact C-N 3.29Å; L209-K211 PolarHBondContact O-N 3.39Å; L209-I212 HydrophobicContact CD2-CD1 4.49Å; L209-I212 CarbonylContact O-C 3.12Å; L209-I212 PolarHBondContact O-N 2.86Å; L209-E213 WeakPolarHBondContact O-CB 3.36Å; L209-E213 PolarHBondContact O-N 2.87Å
210	E	80.1	Confident	85.8	Confident	63 Å²	63	61.4 Å²	61.4	29%	0.294	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-34.3	173.7	-69.9	-172.5	134.4	0	0	112.5	N206 E213 N214 R277	N206-E210 PolarHBondContact O-N 3.16Å; E210-E213 PolarHBondContact O-N 3.26Å; E210-N214 PolarHBondContact O-N 2.84Å; E210-N214 PolarHBondContact O-ND2 2.79Å; E210-N214 VanDerWaalsContact O-ND2 3.16Å; E210-R277 IonicContact OE1-CZ 3.72Å; E210-R277 IonicContact OE1-NH1 2.8Å; E210-R277 PolarHBondContact OE1-NH1 2.87Å; E210-R277 IonicContact OE1-NH2 3.51Å; E210-R277 PolarHBondContact OE1-NH2 2.99Å
211	K	86.1	Confident	86.7	Confident	146 Å²	146	61 Å²	61	64%	0.635	32%	0.324	S	S	*	.	H	α-helix	trans	-70.1	-40	173.5	-71.1	169.9	-173.7	169.9	0	111.7	H207 I208 L209 E213 N214	H207-K211 WeakPolarHBondContact O-CD 3.41Å; H207-K211 WeakPolarHBondContact O-CG 3.06Å; I208-K211 WeakPolarHBondContact O-CB 3.4Å; I208-K211 PolarHBondContact O-N 2.88Å; L209-K211 VanDerWaalsContact C-N 3.29Å; L209-K211 PolarHBondContact O-N 3.39Å; K211-E213 VanDerWaalsContact C-N 3.3Å; K211-N214 PolarHBondContact O-N 3.2Å
212	I	89	Confident	87.1	Confident	65 Å²	65	59.7 Å²	59.7	33%	0.333	32%	0.319	S	S	.	.	H	α-helix	trans	-66	-34.3	173.7	-68.7	168.2	0	0	0	110.9	I208 L209 N214 V215 F216	I208-I212 HydrophobicContact CG2-CD1 3.76Å; I208-I212 HydrophobicContact CG2-CG1 4.45Å; I208-I212 WeakPolarHBondContact O-CG1 3.48Å; I208-I212 PolarHBondContact O-N 3.23Å; L209-I212 HydrophobicContact CD2-CD1 4.49Å; L209-I212 CarbonylContact O-C 3.12Å; L209-I212 PolarHBondContact O-N 2.86Å; I212-N214 VanDerWaalsContact C-N 3.3Å; I212-N214 PolarHBondContact O-N 2.68Å; I212-V215 WeakPolarHBondContact O-CA 3.45Å; I212-V215 VanDerWaalsContact O-CB 3.3Å; I212-V215 WeakPolarHBondContact O-CB 3.24Å; I212-V215 PolarHBondContact O-N 2.8Å; I212-F216 HydrophobicContact CG2-CD2 4.05Å; I212-F216 HydrophobicContact CG2-CE2 3.49Å; I212-F216 VanDerWaalsContact CG2-CE2 3.49Å; I212-F216 HydrophobicContact CG2-CZ 3.8Å; I212-F216 PolarHBondContact O-N 3.48Å
213	E	82.1	Confident	87.4	Confident	13 Å²	13	58.1 Å²	58.1	6%	0.061	31%	0.308	C	S	.	.	H	α-helix	trans	-63.1	-37.1	179.1	-153.4	-173.1	-172.4	0	0	112.1	L209 E210 K211 V215 F216 I217 R280	L209-E213 WeakPolarHBondContact O-CB 3.36Å; L209-E213 PolarHBondContact O-N 2.87Å; E210-E213 PolarHBondContact O-N 3.26Å; K211-E213 VanDerWaalsContact C-N 3.3Å; E213-V215 VanDerWaalsContact C-N 3.31Å; E213-V215 PolarHBondContact O-N 3.4Å; E213-F216 PolarHBondContact O-N 2.87Å; E213-I217 WeakPolarHBondContact O-CG1 3.26Å; E213-I217 PolarHBondContact O-N 2.68Å; E213-R280 WeakPolarHBondContact OE1-CD 3.37Å; E213-R280 IonicContact OE1-CZ 2.71Å; E213-R280 IonicContact OE1-NE 2.77Å; E213-R280 IonicContact OE1-NH1 2.89Å; E213-R280 PolarHBondContact OE1-NH1 3.01Å; E213-R280 IonicContact OE2-NH1 3.3Å; E213-R280 PolarHBondContact OE2-NH1 2.57Å
214	N	83.1	Confident	87.4	Confident	87 Å²	87	56.4 Å²	56.4	47%	0.465	30%	0.3	S	S	.	.	H	α-helix	trans	-62.2	-35.9	170.6	-70.4	-50.7	0	0	0	112.5	E210 K211 I212 I217 V218	E210-N214 PolarHBondContact O-N 2.84Å; E210-N214 PolarHBondContact O-ND2 2.79Å; E210-N214 VanDerWaalsContact O-ND2 3.16Å; K211-N214 PolarHBondContact O-N 3.2Å; I212-N214 VanDerWaalsContact C-N 3.3Å; I212-N214 PolarHBondContact O-N 2.68Å; N214-I217 PolarHBondContact O-N 3.06Å; N214-V218 WeakPolarHBondContact O-CG2 3.43Å; N214-V218 PolarHBondContact O-N 3.33Å; N214-V218 VanDerWaalsContact O-N 3.08Å
215	V	88.7	Confident	87.3	Confident	83 Å²	83	54.5 Å²	54.5	50%	0.503	29%	0.288	S	S	.	.	H	α-helix	trans	-65.5	-42.3	173.7	-175.6	0	0	0	0	110.7	I212 E213 I217 V218 I219	I212-V215 WeakPolarHBondContact O-CA 3.45Å; I212-V215 VanDerWaalsContact O-CB 3.3Å; I212-V215 WeakPolarHBondContact O-CB 3.24Å; I212-V215 PolarHBondContact O-N 2.8Å; E213-V215 VanDerWaalsContact C-N 3.31Å; E213-V215 PolarHBondContact O-N 3.4Å; V215-I217 PolarHBondContact O-N 2.84Å; V215-V218 PolarHBondContact O-N 3.29Å; V215-I219 HydrophobicContact CG1-CD1 4.13Å; V215-I219 WeakPolarHBondContact O-CG1 3.27Å; V215-I219 PolarHBondContact O-N 3.4Å
216	F	88.2	Confident	87.3	Confident	21 Å²	21	52 Å²	52	9%	0.092	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-42.1	174.1	-66.9	-45.1	0	0	0	112.3	T183 A186 N187 A190 I212 E213 V218 I219 F220	T183-F216 HydrophobicContact CG2-CD1 3.69Å; T183-F216 HydrophobicContact CG2-CE1 4.06Å; A186-F216 HydrophobicContact CB-CE1 4.09Å; A186-F216 HydrophobicContact CB-CZ 3.94Å; N187-F216 HydrophobicContact CB-CD1 4.42Å; N187-F216 HydrophobicContact CB-CD2 3.83Å; N187-F216 HydrophobicContact CB-CE1 4.48Å; N187-F216 HydrophobicContact CB-CE2 3.91Å; N187-F216 HydrophobicContact CB-CG 4.11Å; N187-F216 HydrophobicContact CB-CZ 4.25Å; N187-F216 VanDerWaalsContact OD1-CD2 3.29Å; N187-F216 WeakPolarHBondContact OD1-CD2 3.44Å; A190-F216 HydrophobicContact CB-CE2 3.78Å; I212-F216 HydrophobicContact CG2-CD2 4.05Å; I212-F216 HydrophobicContact CG2-CE2 3.49Å; I212-F216 VanDerWaalsContact CG2-CE2 3.49Å; I212-F216 HydrophobicContact CG2-CZ 3.8Å; I212-F216 PolarHBondContact O-N 3.48Å; E213-F216 PolarHBondContact O-N 2.87Å; F216-V218 VanDerWaalsContact C-N 3.32Å; F216-V218 PolarHBondContact O-N 2.98Å; F216-I219 HydrophobicContact CD1-CD1 4.49Å; F216-I219 PolarHBondContact O-N 3.01Å; F216-F220 HydrophobicContact CB-CD2 4.36Å; F216-F220 HydrophobicContact CB-CE2 4.04Å; F216-F220 WeakPolarHBondContact O-CD2 3.27Å; F216-F220 PolarHBondContact O-N 3.39Å
217	I	84.8	Confident	87.3	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-45	175.3	-66.5	164.2	0	0	0	110.8	E213 N214 V215 F220 T221 L257	E213-I217 WeakPolarHBondContact O-CG1 3.26Å; E213-I217 PolarHBondContact O-N 2.68Å; N214-I217 PolarHBondContact O-N 3.06Å; V215-I217 PolarHBondContact O-N 2.84Å; I217-F220 PolarHBondContact O-N 2.91Å; I217-T221 WeakPolarHBondContact O-CB 3.32Å; I217-T221 PolarHBondContact O-N 3.17Å; I217-T221 PolarHBondContact O-OG1 2.92Å; I217-L257 HydrophobicContact CG2-CD2 3.82Å; I217-L257 HydrophobicContact CG2-CG 4.18Å
218	V	88.9	Confident	87.4	Confident	92 Å²	92	49.1 Å²	49.1	56%	0.558	26%	0.261	S	S	*	.	H	α-helix	trans	-60.8	-45	176.5	171.4	0	0	0	0	111.5	N214 V215 F216 F220 T221 V222	N214-V218 WeakPolarHBondContact O-CG2 3.43Å; N214-V218 PolarHBondContact O-N 3.33Å; N214-V218 VanDerWaalsContact O-N 3.08Å; V215-V218 PolarHBondContact O-N 3.29Å; F216-V218 VanDerWaalsContact C-N 3.32Å; F216-V218 PolarHBondContact O-N 2.98Å; V218-F220 PolarHBondContact O-N 3.46Å; V218-T221 PolarHBondContact O-N 2.88Å; V218-V222 WeakPolarHBondContact O-CG2 3.43Å; V218-V222 PolarHBondContact O-N 3.39Å
219	I	90.4	Very high	87.2	Confident	54 Å²	54	45.8 Å²	45.8	28%	0.277	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-47.7	178.4	-65.1	163.1	0	0	0	111	I180 T183 V215 F216 T221 V222 E223	I180-I219 HydrophobicContact CD1-CG2 4.17Å; T183-I219 HydrophobicContact CG2-CB 4.46Å; T183-I219 HydrophobicContact CG2-CD1 4.16Å; T183-I219 HydrophobicContact CG2-CG2 4Å; V215-I219 HydrophobicContact CG1-CD1 4.13Å; V215-I219 WeakPolarHBondContact O-CG1 3.27Å; V215-I219 PolarHBondContact O-N 3.4Å; F216-I219 HydrophobicContact CD1-CD1 4.49Å; F216-I219 PolarHBondContact O-N 3.01Å; I219-T221 VanDerWaalsContact C-N 3.34Å; I219-T221 PolarHBondContact O-N 2.63Å; I219-V222 PolarHBondContact O-N 3.01Å; I219-E223 PolarHBondContact O-N 3.36Å
220	F	88.7	Confident	87	Confident	8 Å²	8	44.8 Å²	44.8	4%	0.035	24%	0.239	C	C	.	.	H	α-helix	trans	-68.7	-30.2	178.5	-63	-55.9	0	0	0	113	I180 T183 I184 F216 I217 V218 E223 C224 V253	I180-F220 HydrophobicContact CG2-CE1 4.28Å; T183-F220 HydrophobicContact CG2-CE1 4.18Å; T183-F220 HydrophobicContact CG2-CE2 4.43Å; T183-F220 HydrophobicContact CG2-CZ 3.84Å; I184-F220 HydrophobicContact CD1-CE1 4.47Å; I184-F220 HydrophobicContact CG1-CE1 3.7Å; I184-F220 HydrophobicContact CG1-CZ 3.76Å; F216-F220 HydrophobicContact CB-CD2 4.36Å; F216-F220 HydrophobicContact CB-CE2 4.04Å; F216-F220 WeakPolarHBondContact O-CD2 3.27Å; F216-F220 PolarHBondContact O-N 3.39Å; I217-F220 PolarHBondContact O-N 2.91Å; V218-F220 PolarHBondContact O-N 3.46Å; F220-E223 PolarHBondContact O-N 3.04Å; F220-C224 VanDerWaalsContact O-CB 3.23Å; F220-C224 WeakPolarHBondContact O-CB 3.29Å; F220-C224 PolarHBondContact O-N 2.94Å; F220-V253 HydrophobicContact CB-CG2 3.66Å
221	T	89.5	Confident	87.1	Confident	35 Å²	35	44.1 Å²	44.1	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-44	171.3	-60.2	0	0	0	0	111.5	I217 V218 I219 C224 V225 V253 L257	I217-T221 WeakPolarHBondContact O-CB 3.32Å; I217-T221 PolarHBondContact O-N 3.17Å; I217-T221 PolarHBondContact O-OG1 2.92Å; V218-T221 PolarHBondContact O-N 2.88Å; I219-T221 VanDerWaalsContact C-N 3.34Å; I219-T221 PolarHBondContact O-N 2.63Å; T221-C224 PolarHBondContact O-N 2.83Å; T221-V225 WeakPolarHBondContact O-CG2 3.34Å; T221-V225 PolarHBondContact O-N 2.86Å; T221-V253 WeakPolarHBondContact OG1-CG1 3.45Å; T221-L257 HydrophobicContact CG2-CD1 4.23Å
222	V	90.3	Very high	86.8	Confident	80 Å²	80	37.2 Å²	37.2	49%	0.485	21%	0.205	S	C	.	.	H	α-helix	trans	-62.4	-43.4	174.9	171.1	0	0	0	0	111	V218 I219 C224 V225 L226	V218-V222 WeakPolarHBondContact O-CG2 3.43Å; V218-V222 PolarHBondContact O-N 3.39Å; I219-V222 PolarHBondContact O-N 3.01Å; V222-C224 PolarHBondContact O-N 3.17Å; V222-V225 PolarHBondContact O-N 2.73Å; V222-L226 HydrophobicContact CG1-CD1 3.9Å; V222-L226 HydrophobicContact CG1-CG 4.31Å; V222-L226 WeakPolarHBondContact O-CB 3.28Å; V222-L226 VanDerWaalsContact O-CG 3.26Å; V222-L226 WeakPolarHBondContact O-CG 3.19Å; V222-L226 PolarHBondContact O-N 3.25Å
223	E	88.7	Confident	86.6	Confident	3 Å²	3	38.2 Å²	38.2	1%	0.014	21%	0.207	C	C	.	.	H	α-helix	trans	-58.7	-49	176.1	-164.6	-142.5	153.5	0	0	112.2	F176 I180 I219 F220 V225 L226 K227 R286	F176-E223 HydrophobicContact CE1-CG 3.86Å; F176-E223 HydrophobicContact CZ-CB 4.28Å; F176-E223 HydrophobicContact CZ-CG 3.56Å; I180-E223 HydrophobicContact CD1-CB 3.93Å; I180-E223 HydrophobicContact CD1-CG 3.68Å; I180-E223 HydrophobicContact CG1-CG 3.92Å; I180-E223 WeakPolarHBondContact CG2-OE2 3.46Å; I219-E223 PolarHBondContact O-N 3.36Å; F220-E223 PolarHBondContact O-N 3.04Å; E223-V225 PolarHBondContact O-N 3.24Å; E223-L226 PolarHBondContact O-N 2.87Å; E223-K227 PolarHBondContact O-N 3.23Å; E223-K227 WeakPolarHBondContact OE1-CE 3.3Å; E223-K227 IonicContact OE1-NZ 2.64Å; E223-K227 PolarHBondContact OE1-NZ 3.42Å; E223-R286 VanDerWaalsContact CD-NH1 3.31Å; E223-R286 IonicContact OE1-CZ 3.43Å; E223-R286 VanDerWaalsContact OE1-CZ 3.26Å; E223-R286 IonicContact OE1-NH1 3.16Å; E223-R286 PolarHBondContact OE1-NH1 2.98Å; E223-R286 IonicContact OE1-NH2 2.77Å; E223-R286 PolarHBondContact OE1-NH2 3.1Å; E223-R286 IonicContact OE2-CZ 3.38Å; E223-R286 IonicContact OE2-NH1 2.62Å; E223-R286 PolarHBondContact OE2-NH1 3.37Å; E223-R286 IonicContact OE2-NH2 3.19Å
224	C	87.7	Confident	86.6	Confident	7 Å²	7	41.1 Å²	41.1	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-57.7	-47.8	177.7	-178.6	0	0	0	0	111.5	F220 T221 V222 K227 I228 Y240	F220-C224 VanDerWaalsContact O-CB 3.23Å; F220-C224 WeakPolarHBondContact O-CB 3.29Å; F220-C224 PolarHBondContact O-N 2.94Å; T221-C224 PolarHBondContact O-N 2.83Å; V222-C224 PolarHBondContact O-N 3.17Å; C224-K227 PolarHBondContact O-N 3.46Å; C224-I228 WeakPolarHBondContact O-CB 3.35Å; C224-I228 VanDerWaalsContact O-CG1 3.28Å; C224-I228 WeakPolarHBondContact O-CG1 3.42Å; C224-I228 PolarHBondContact O-N 3.08Å; C224-Y240 PolarHBondContact SG-OH 2.86Å
225	V	88.9	Confident	86.2	Confident	75 Å²	75	43.2 Å²	43.2	46%	0.455	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-43.9	177.9	169.9	0	0	0	0	111.8	T221 V222 E223 K227 I228 I229	T221-V225 WeakPolarHBondContact O-CG2 3.34Å; T221-V225 PolarHBondContact O-N 2.86Å; V222-V225 PolarHBondContact O-N 2.73Å; E223-V225 PolarHBondContact O-N 3.24Å; V225-K227 PolarHBondContact O-N 3.31Å; V225-I228 PolarHBondContact O-N 3.46Å; V225-I229 HydrophobicContact CG1-CD1 3.77Å; V225-I229 WeakPolarHBondContact O-CB 3.46Å; V225-I229 VanDerWaalsContact O-CG1 3.31Å; V225-I229 WeakPolarHBondContact O-CG1 3.44Å; V225-I229 PolarHBondContact O-N 2.87Å
226	L	88.2	Confident	85.4	Confident	29 Å²	29	42.5 Å²	42.5	15%	0.152	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-45.3	176.5	-73.3	171.4	0	0	0	111.8	C167 I170 F176 V222 E223 I229 A230	C167-L226 HydrophobicContact CB-CD2 4.19Å; C167-L226 VanDerWaalsContact SG-CD2 3.56Å; I170-L226 HydrophobicContact CG2-CD1 4.17Å; F176-L226 HydrophobicContact CE2-CD1 4.13Å; F176-L226 HydrophobicContact CZ-CD1 4.05Å; V222-L226 HydrophobicContact CG1-CD1 3.9Å; V222-L226 HydrophobicContact CG1-CG 4.31Å; V222-L226 WeakPolarHBondContact O-CB 3.28Å; V222-L226 VanDerWaalsContact O-CG 3.26Å; V222-L226 WeakPolarHBondContact O-CG 3.19Å; V222-L226 PolarHBondContact O-N 3.25Å; E223-L226 PolarHBondContact O-N 2.87Å; L226-I229 PolarHBondContact O-N 3.25Å; L226-A230 WeakPolarHBondContact O-CB 3.49Å; L226-A230 PolarHBondContact O-N 3.45Å
227	K	87	Confident	84.5	Confident	23 Å²	23	46.1 Å²	46.1	10%	0.1	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-43.2	177.1	-76	-177	169.3	169.7	0	112.8	E223 C224 V225 I229 A230 F231 Y240 N246	E223-K227 PolarHBondContact O-N 3.23Å; E223-K227 WeakPolarHBondContact OE1-CE 3.3Å; E223-K227 IonicContact OE1-NZ 2.64Å; E223-K227 PolarHBondContact OE1-NZ 3.42Å; C224-K227 PolarHBondContact O-N 3.46Å; V225-K227 PolarHBondContact O-N 3.31Å; K227-I229 VanDerWaalsContact C-N 3.28Å; K227-I229 PolarHBondContact O-N 2.95Å; K227-A230 PolarHBondContact O-N 3Å; K227-F231 HydrophobicContact CB-CD2 4.04Å; K227-F231 HydrophobicContact CB-CE2 4.16Å; K227-F231 HydrophobicContact CD-CE2 4.47Å; K227-F231 HydrophobicContact CG-CD2 4.38Å; K227-F231 HydrophobicContact CG-CE2 3.99Å; K227-F231 WeakPolarHBondContact O-CB 3.42Å; K227-F231 WeakPolarHBondContact O-CD2 3.38Å; K227-F231 PolarHBondContact O-N 3.39Å; K227-Y240 HydrophobicContact CB-CD2 3.63Å; K227-Y240 HydrophobicContact CB-CE2 3.67Å; K227-Y240 HydrophobicContact CD-CD2 4.1Å; K227-Y240 HydrophobicContact CD-CE2 3.58Å; K227-Y240 HydrophobicContact CG-CE2 4.32Å; K227-N246 PolarHBondContact NZ-OD1 3.07Å
228	I	87.6	Confident	83.7	Confident	21 Å²	21	47.7 Å²	47.7	11%	0.108	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-37.3	177.2	-71.6	168.6	0	0	0	111.2	L154 C224 V225 G232 F233 Y240 F250	L154-I228 HydrophobicContact CD2-CG2 4.25Å; C224-I228 WeakPolarHBondContact O-CB 3.35Å; C224-I228 VanDerWaalsContact O-CG1 3.28Å; C224-I228 WeakPolarHBondContact O-CG1 3.42Å; C224-I228 PolarHBondContact O-N 3.08Å; V225-I228 PolarHBondContact O-N 3.46Å; I228-G232 CarbonylContact O-C 3.24Å; I228-G232 WeakPolarHBondContact O-CA 3.48Å; I228-G232 PolarHBondContact O-N 3.45Å; I228-F233 HydrophobicContact CD1-CD2 4.04Å; I228-F233 HydrophobicContact CD1-CE2 4.18Å; I228-F233 HydrophobicContact CG1-CD2 4.22Å; I228-F233 HydrophobicContact CG2-CB 4.28Å; I228-F233 HydrophobicContact CG2-CD2 4.1Å; I228-Y240 HydrophobicContact CD1-CD1 3.84Å; I228-Y240 HydrophobicContact CD1-CE1 3.95Å; I228-Y240 HydrophobicContact CG1-CD1 3.37Å; I228-Y240 HydrophobicContact CG1-CD2 4.39Å; I228-Y240 HydrophobicContact CG1-CE1 3.87Å; I228-Y240 HydrophobicContact CG1-CG 3.67Å; I228-F250 HydrophobicContact CD1-CD2 4.47Å; I228-F250 HydrophobicContact CD1-CE2 4.27Å
229	I	86.4	Confident	83	Confident	27 Å²	27	43.5 Å²	43.5	14%	0.138	24%	0.244	C	C	.	.	H	α-helix	trans	-67.7	-43.8	175.2	-72.3	166.4	0	0	0	111.5	T153 L154 L157 L163 R164 C167 V225 L226 K227	T153-I229 PolarHBondContact OG1-O 3.32Å; L154-I229 HydrophobicContact CD1-CG1 4.46Å; L157-I229 HydrophobicContact CD1-CG1 4.38Å; L157-I229 HydrophobicContact CD1-CG2 3.91Å; L163-I229 HydrophobicContact CD2-CD1 4.14Å; L163-I229 HydrophobicContact CD2-CG2 3.82Å; R164-I229 HydrophobicContact CB-CG2 4.4Å; R164-I229 HydrophobicContact CG-CG2 4.43Å; C167-I229 HydrophobicContact CB-CB 4.31Å; C167-I229 HydrophobicContact CB-CG2 3.75Å; V225-I229 HydrophobicContact CG1-CD1 3.77Å; V225-I229 WeakPolarHBondContact O-CB 3.46Å; V225-I229 VanDerWaalsContact O-CG1 3.31Å; V225-I229 WeakPolarHBondContact O-CG1 3.44Å; V225-I229 PolarHBondContact O-N 2.87Å; L226-I229 PolarHBondContact O-N 3.25Å; K227-I229 VanDerWaalsContact C-N 3.28Å; K227-I229 PolarHBondContact O-N 2.95Å
230	A	83.5	Confident	82.8	Confident	1 Å²	1	41 Å²	41	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-66	-56.8	-178.8	0	0	0	0	0	112.7	R164 I168 L226 K227	R164-A230 PolarHBondContact NE-O 2.7Å; R164-A230 PolarHBondContact NH2-O 2.95Å; R164-A230 VanDerWaalsContact NH2-O 3.16Å; I168-A230 HydrophobicContact CG1-CB 3.7Å; L226-A230 WeakPolarHBondContact O-CB 3.49Å; L226-A230 PolarHBondContact O-N 3.45Å; K227-A230 PolarHBondContact O-N 3Å
231	F	81.3	Confident	82.6	Confident	48 Å²	48	42.3 Å²	42.3	21%	0.211	24%	0.238	C	C	.	.	H	α-helix	trans	-91.1	-26.4	-171	-56.7	-49.8	0	0	0	113.9	K227	K227-F231 HydrophobicContact CB-CD2 4.04Å; K227-F231 HydrophobicContact CB-CE2 4.16Å; K227-F231 HydrophobicContact CD-CE2 4.47Å; K227-F231 HydrophobicContact CG-CD2 4.38Å; K227-F231 HydrophobicContact CG-CE2 3.99Å; K227-F231 WeakPolarHBondContact O-CB 3.42Å; K227-F231 WeakPolarHBondContact O-CD2 3.38Å; K227-F231 PolarHBondContact O-N 3.39Å
232	G	80.8	Confident	82.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.01	26%	0.257	C	S	.	.			trans	92.3	166.5	-170	0	0	0	0	0	112.5	T153 I228 Y240	T153-G232 VanDerWaalsContact CG2-CA 3.44Å; I228-G232 CarbonylContact O-C 3.24Å; I228-G232 WeakPolarHBondContact O-CA 3.48Å; I228-G232 PolarHBondContact O-N 3.45Å; G232-Y240 WeakPolarHBondContact O-CB 3.3Å; G232-Y240 PolarHBondContact O-N 3.23Å
233	F	83.7	Confident	81.5	Confident	87 Å²	87	48.2 Å²	48.2	38%	0.382	25%	0.254	S	S	.	.	S	Bend	trans	-84.5	-64.1	-167.7	-169.1	-129.9	0	0	0	113.7	L154 I228 L241 F250	L154-F233 HydrophobicContact CD2-CB 4.23Å; I228-F233 HydrophobicContact CD1-CD2 4.04Å; I228-F233 HydrophobicContact CD1-CE2 4.18Å; I228-F233 HydrophobicContact CG1-CD2 4.22Å; I228-F233 HydrophobicContact CG2-CB 4.28Å; I228-F233 HydrophobicContact CG2-CD2 4.1Å; F233-L241 HydrophobicContact CD2-CD1 3.98Å; F233-L241 HydrophobicContact CD2-CG 4.22Å; F233-L241 HydrophobicContact CE1-CD1 4.23Å; F233-L241 HydrophobicContact CE2-CD1 3.42Å; F233-L241 VanDerWaalsContact CE2-CD1 3.42Å; F233-L241 HydrophobicContact CE2-CG 4.02Å; F233-L241 HydrophobicContact CZ-CD1 3.56Å; F233-L241 WeakPolarHBondContact O-CB 3.47Å; F233-L241 PolarHBondContact O-N 2.97Å; F233-F250 AromaticContact CE2-CE2 3.88Å; F233-F250 HydrophobicContact CE2-CE2 3.88Å; F233-F250 AromaticContact CE2-CZ 3.73Å; F233-F250 HydrophobicContact CE2-CZ 3.73Å; F233-F250 HydrophobicContact CZ-CE2 4.44Å; F233-F250 AromaticContact CZ-CZ 3.85Å; F233-F250 HydrophobicContact CZ-CZ 3.85Å
234	V	83	Confident	80.9	Confident	73 Å²	73	51.4 Å²	51.4	44%	0.442	28%	0.28	S	S	.	.	S	Bend	trans	-134.3	-33.2	-173.2	174	0	0	0	0	114.4	H236 L241	V234-H236 VanDerWaalsContact C-N 3.33Å; V234-H236 PolarHBondContact O-N 3.02Å; V234-H236 VanDerWaalsContact O-N 3.15Å; V234-L241 HydrophobicContact CG2-CB 4.19Å; V234-L241 HydrophobicContact CG2-CD1 3.88Å; V234-L241 HydrophobicContact CG2-CG 4.46Å
235	M	73.9	Confident	80.4	Confident	131 Å²	131	54.6 Å²	54.6	65%	0.645	29%	0.291	S	S	*	.	S	Bend	trans	-78.3	1.7	-158.5	-71.7	-175.1	160	0	0	117.4	F155	F155-M235 HydrophobicContact CE1-SD 4.06Å; F155-M235 HydrophobicContact CE2-SD 4.33Å; F155-M235 HydrophobicContact CZ-CE 3.82Å; F155-M235 HydrophobicContact CZ-SD 3.54Å; F155-M235 VanDerWaalsContact CZ-SD 3.54Å
236	H	71.5	Confident	80	Confident	68 Å²	68	51.6 Å²	51.6	32%	0.315	27%	0.273	S	S	.	.	S	Bend	trans	-130.6	154.8	-174.8	-57.5	-67.6	0	0	0	110.7	P150 V234 G238 A239 R242	P150-H236 HydrophobicContact CB-CB 4.36Å; P150-H236 VanDerWaalsContact CB-CD2 3.44Å; P150-H236 WeakPolarHBondContact CB-CD2 3.01Å; P150-H236 WeakPolarHBondContact CB-NE2 3.18Å; P150-H236 HydrophobicContact CG-CB 4.25Å; P150-H236 VanDerWaalsContact CG-CD2 3.46Å; P150-H236 WeakPolarHBondContact CG-CD2 3.44Å; V234-H236 VanDerWaalsContact C-N 3.33Å; V234-H236 PolarHBondContact O-N 3.02Å; V234-H236 VanDerWaalsContact O-N 3.15Å; H236-G238 VanDerWaalsContact C-N 3.34Å; H236-G238 PolarHBondContact O-N 3.05Å; H236-A239 HydrophobicContact CB-CB 4.24Å; H236-A239 WeakPolarHBondContact O-CB 3.02Å; H236-A239 PolarHBondContact O-N 2.93Å; H236-R242 VanDerWaalsContact O-CD 3.3Å; H236-R242 WeakPolarHBondContact O-CD 3.16Å; H236-R242 PolarHBondContact O-NE 3.39Å
237	P	69.2	Low	79.8	Confident	98 Å²	98	53.8 Å²	53.8	64%	0.636	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-47.4	177.9	19.5	-31.1	0	0	0	112.2	A239 R242	P237-A239 VanDerWaalsContact C-N 3.25Å; P237-A239 PolarHBondContact O-N 2.91Å; P237-R242 WeakPolarHBondContact O-CD 3.29Å
238	G	68.8	Low	79.4	Confident	41 Å²	41	54.5 Å²	54.5	42%	0.423	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	18.7	173.2	0	0	0	0	0	115.9	H236	H236-G238 VanDerWaalsContact C-N 3.34Å; H236-G238 PolarHBondContact O-N 3.05Å
239	A	74.9	Confident	79	Confident	3 Å²	3	54 Å²	54	3%	0.025	29%	0.286	C	S	.	.			trans	-75.1	151.8	179.3	0	0	0	0	0	112.5	H236 P237 L241 R242	H236-A239 HydrophobicContact CB-CB 4.24Å; H236-A239 WeakPolarHBondContact O-CB 3.02Å; H236-A239 PolarHBondContact O-N 2.93Å; P237-A239 VanDerWaalsContact C-N 3.25Å; P237-A239 PolarHBondContact O-N 2.91Å; A239-L241 PolarHBondContact O-N 3.39Å; A239-R242 PolarHBondContact O-N 3.49Å
240	Y	85	Confident	79	Confident	2 Å²	2	55 Å²	55	1%	0.008	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-48.8	-52.6	-173.6	-179	-109.8	0	0	0	113	C224 K227 I228 G232 R242 N243 N246 F250	C224-Y240 PolarHBondContact SG-OH 2.86Å; K227-Y240 HydrophobicContact CB-CD2 3.63Å; K227-Y240 HydrophobicContact CB-CE2 3.67Å; K227-Y240 HydrophobicContact CD-CD2 4.1Å; K227-Y240 HydrophobicContact CD-CE2 3.58Å; K227-Y240 HydrophobicContact CG-CE2 4.32Å; I228-Y240 HydrophobicContact CD1-CD1 3.84Å; I228-Y240 HydrophobicContact CD1-CE1 3.95Å; I228-Y240 HydrophobicContact CG1-CD1 3.37Å; I228-Y240 HydrophobicContact CG1-CD2 4.39Å; I228-Y240 HydrophobicContact CG1-CE1 3.87Å; I228-Y240 HydrophobicContact CG1-CG 3.67Å; G232-Y240 WeakPolarHBondContact O-CB 3.3Å; G232-Y240 PolarHBondContact O-N 3.23Å; Y240-R242 VanDerWaalsContact C-N 3.3Å; Y240-R242 PolarHBondContact O-N 3.15Å; Y240-N243 PolarHBondContact O-N 3.25Å; Y240-N246 HydrophobicContact CD1-CB 4.39Å; Y240-N246 HydrophobicContact CD2-CB 3.68Å; Y240-N246 VanDerWaalsContact CD2-ND2 3.34Å; Y240-N246 WeakPolarHBondContact CD2-ND2 3.43Å; Y240-N246 HydrophobicContact CE1-CB 4.21Å; Y240-N246 HydrophobicContact CE2-CB 3.45Å; Y240-N246 VanDerWaalsContact CE2-CB 3.45Å; Y240-N246 WeakPolarHBondContact CE2-OD1 3.22Å; Y240-N246 HydrophobicContact CG-CB 4.15Å; Y240-N246 WeakPolarHBondContact O-CB 3.14Å; Y240-N246 PolarHBondContact O-ND2 3.36Å; Y240-N246 VanDerWaalsContact O-ND2 3.1Å; Y240-N246 PolarHBondContact OH-O 2.85Å; Y240-F250 HydrophobicContact CE1-CB 4Å; Y240-F250 AromaticContact CE1-CD2 4Å; Y240-F250 HydrophobicContact CE1-CD2 4Å; Y240-F250 HydrophobicContact CE1-CG 4.32Å
241	L	83.9	Confident	79	Confident	35 Å²	35	57.9 Å²	57.9	18%	0.183	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-80.1	4.9	-177	-64.3	-174.3	0	0	0	115.6	F233 V234 A239 I247 F250	F233-L241 HydrophobicContact CD2-CD1 3.98Å; F233-L241 HydrophobicContact CD2-CG 4.22Å; F233-L241 HydrophobicContact CE1-CD1 4.23Å; F233-L241 HydrophobicContact CE2-CD1 3.42Å; F233-L241 VanDerWaalsContact CE2-CD1 3.42Å; F233-L241 HydrophobicContact CE2-CG 4.02Å; F233-L241 HydrophobicContact CZ-CD1 3.56Å; F233-L241 WeakPolarHBondContact O-CB 3.47Å; F233-L241 PolarHBondContact O-N 2.97Å; V234-L241 HydrophobicContact CG2-CB 4.19Å; V234-L241 HydrophobicContact CG2-CD1 3.88Å; V234-L241 HydrophobicContact CG2-CG 4.46Å; A239-L241 PolarHBondContact O-N 3.39Å; L241-I247 VanDerWaalsContact O-CD1 3.3Å; L241-I247 WeakPolarHBondContact O-CD1 3.49Å; L241-I247 WeakPolarHBondContact O-CG1 3.24Å; L241-F250 HydrophobicContact CD1-CD1 4.31Å; L241-F250 HydrophobicContact CD1-CE1 3.98Å; L241-F250 HydrophobicContact CD1-CZ 4.27Å; L241-F250 HydrophobicContact CD2-CB 3.85Å; L241-F250 HydrophobicContact CD2-CD1 3.62Å; L241-F250 HydrophobicContact CD2-CD2 4.16Å; L241-F250 HydrophobicContact CD2-CE1 4.11Å; L241-F250 HydrophobicContact CD2-CG 3.64Å
242	R	80.5	Confident	79	Confident	163 Å²	163	55.9 Å²	55.9	62%	0.615	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-86.9	-21.3	168.4	-77.3	-163	179.3	-159.2	-0.9	113.3	H236 P237 A239 Y240	H236-R242 VanDerWaalsContact O-CD 3.3Å; H236-R242 WeakPolarHBondContact O-CD 3.16Å; H236-R242 PolarHBondContact O-NE 3.39Å; P237-R242 WeakPolarHBondContact O-CD 3.29Å; A239-R242 PolarHBondContact O-N 3.49Å; Y240-R242 VanDerWaalsContact C-N 3.3Å; Y240-R242 PolarHBondContact O-N 3.15Å
243	N	77.4	Confident	79.3	Confident	77 Å²	77	56.3 Å²	56.3	41%	0.412	30%	0.301	S	S	.	.	S	Bend	trans	-85.6	118	174.9	179.8	-17.3	0	0	0	110.1	Y240 W245 N246 I247	Y240-N243 PolarHBondContact O-N 3.25Å; N243-W245 PolarHBondContact O-N 3.45Å; N243-W245 VanDerWaalsContact O-N 3.1Å; N243-W245 PolarHBondContact OD1-N 2.95Å; N243-N246 HydrophobicContact CB-CB 4.34Å; N243-N246 WeakPolarHBondContact O-CB 3.2Å; N243-N246 PolarHBondContact O-N 2.78Å; N243-I247 PolarHBondContact O-N 2.74Å; N243-I247 VanDerWaalsContact O-N 3.11Å
244	A	76.7	Confident	79.4	Confident	69 Å²	69	55.3 Å²	55.3	57%	0.57	30%	0.299	S	S	*	.	H	α-helix	trans	-52.6	-34.2	-177.7	0	0	0	0	0	114.3	I247 L248	A244-I247 WeakPolarHBondContact O-CB 2.82Å; A244-I247 PolarHBondContact O-N 2.73Å; A244-L248 PolarHBondContact O-N 3.48Å; A244-L248 VanDerWaalsContact O-N 3.07Å
245	W	76.5	Confident	79.3	Confident	74 Å²	74	53.6 Å²	53.6	28%	0.28	29%	0.287	S	S	.	.	H	α-helix	trans	-67.1	-39.6	177	-66	105.3	0	0	0	112.6	N243 I247 L248 D249 L285 V288	N243-W245 PolarHBondContact O-N 3.45Å; N243-W245 VanDerWaalsContact O-N 3.1Å; N243-W245 PolarHBondContact OD1-N 2.95Å; W245-I247 VanDerWaalsContact C-N 3.32Å; W245-L248 PolarHBondContact O-N 2.98Å; W245-D249 PolarHBondContact O-N 3.33Å; W245-L285 HydrophobicContact CH2-CB 4.4Å; W245-L285 WeakPolarHBondContact CH2-O 3.18Å; W245-L285 HydrophobicContact CZ3-CB 3.88Å; W245-L285 VanDerWaalsContact CZ3-O 3.28Å; W245-L285 WeakPolarHBondContact CZ3-O 3.44Å; W245-V288 HydrophobicContact CH2-CB 4.24Å
246	N	80.1	Confident	79.6	Confident	13 Å²	13	47.4 Å²	47.4	7%	0.07	26%	0.257	C	S	.	.	H	α-helix	trans	-70.2	-29.1	174.3	-71.7	-25.9	0	0	0	111.7	K227 Y240 N243 F250	K227-N246 PolarHBondContact NZ-OD1 3.07Å; Y240-N246 HydrophobicContact CD1-CB 4.39Å; Y240-N246 HydrophobicContact CD2-CB 3.68Å; Y240-N246 VanDerWaalsContact CD2-ND2 3.34Å; Y240-N246 WeakPolarHBondContact CD2-ND2 3.43Å; Y240-N246 HydrophobicContact CE1-CB 4.21Å; Y240-N246 HydrophobicContact CE2-CB 3.45Å; Y240-N246 VanDerWaalsContact CE2-CB 3.45Å; Y240-N246 WeakPolarHBondContact CE2-OD1 3.22Å; Y240-N246 HydrophobicContact CG-CB 4.15Å; Y240-N246 WeakPolarHBondContact O-CB 3.14Å; Y240-N246 PolarHBondContact O-ND2 3.36Å; Y240-N246 VanDerWaalsContact O-ND2 3.1Å; Y240-N246 PolarHBondContact OH-O 2.85Å; N243-N246 HydrophobicContact CB-CB 4.34Å; N243-N246 WeakPolarHBondContact O-CB 3.2Å; N243-N246 PolarHBondContact O-N 2.78Å; N246-F250 WeakPolarHBondContact O-CB 3.26Å; N246-F250 PolarHBondContact O-N 3.21Å
247	I	83.8	Confident	80.1	Confident	75 Å²	75	48.4 Å²	48.4	39%	0.385	26%	0.264	S	S	.	.	H	α-helix	trans	-65.4	-44	172.4	-57.5	174.4	0	0	0	110.3	L241 N243 A244 W245 F250 T251	L241-I247 VanDerWaalsContact O-CD1 3.3Å; L241-I247 WeakPolarHBondContact O-CD1 3.49Å; L241-I247 WeakPolarHBondContact O-CG1 3.24Å; N243-I247 PolarHBondContact O-N 2.74Å; N243-I247 VanDerWaalsContact O-N 3.11Å; A244-I247 WeakPolarHBondContact O-CB 2.82Å; A244-I247 PolarHBondContact O-N 2.73Å; W245-I247 VanDerWaalsContact C-N 3.32Å; I247-F250 PolarHBondContact O-N 3.01Å; I247-T251 WeakPolarHBondContact O-CB 3.49Å; I247-T251 PolarHBondContact O-N 2.67Å; I247-T251 PolarHBondContact O-OG1 2.74Å
248	L	79.1	Confident	80.7	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.199	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-50	174.7	178.8	148.2	0	0	0	111	A244 W245 F250 T251 I252 L285	A244-L248 PolarHBondContact O-N 3.48Å; A244-L248 VanDerWaalsContact O-N 3.07Å; W245-L248 PolarHBondContact O-N 2.98Å; L248-F250 PolarHBondContact O-N 3.42Å; L248-T251 PolarHBondContact O-N 2.79Å; L248-I252 HydrophobicContact CD2-CD1 3.54Å; L248-I252 HydrophobicContact CG-CD1 4.02Å; L248-I252 WeakPolarHBondContact O-CG1 3.29Å; L248-I252 PolarHBondContact O-N 2.89Å; L248-L285 HydrophobicContact CD1-CD1 4.27Å
249	D	79.7	Confident	81	Confident	11 Å²	11	45.8 Å²	45.8	6%	0.059	24%	0.235	C	C	.	.	H	α-helix	trans	-59.8	-44.8	176.7	-73.7	-28.6	0	0	0	112.1	W245 T251 I252 V253 R286	W245-D249 PolarHBondContact O-N 3.33Å; D249-T251 VanDerWaalsContact C-N 3.34Å; D249-T251 PolarHBondContact O-N 3.39Å; D249-I252 PolarHBondContact O-N 3.33Å; D249-V253 WeakPolarHBondContact O-CB 3.37Å; D249-V253 WeakPolarHBondContact O-CG2 3.38Å; D249-V253 PolarHBondContact O-N 3Å; D249-R286 IonicContact OD1-NH1 2.8Å; D249-R286 VanDerWaalsContact OD2-CD 3.3Å; D249-R286 WeakPolarHBondContact OD2-CD 3.45Å; D249-R286 IonicContact OD2-CZ 2.81Å; D249-R286 IonicContact OD2-NE 2.74Å; D249-R286 IonicContact OD2-NH1 2.68Å; D249-R286 PolarHBondContact OD2-NH1 3.05Å
250	F	85.9	Confident	81	Confident	46 Å²	46	49 Å²	49	20%	0.202	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-43.6	176.9	-174.5	-114.3	0	0	0	112	I228 F233 Y240 L241 N246 I247 L248 V253 I254	I228-F250 HydrophobicContact CD1-CD2 4.47Å; I228-F250 HydrophobicContact CD1-CE2 4.27Å; F233-F250 AromaticContact CE2-CE2 3.88Å; F233-F250 HydrophobicContact CE2-CE2 3.88Å; F233-F250 AromaticContact CE2-CZ 3.73Å; F233-F250 HydrophobicContact CE2-CZ 3.73Å; F233-F250 HydrophobicContact CZ-CE2 4.44Å; F233-F250 AromaticContact CZ-CZ 3.85Å; F233-F250 HydrophobicContact CZ-CZ 3.85Å; Y240-F250 HydrophobicContact CE1-CB 4Å; Y240-F250 AromaticContact CE1-CD2 4Å; Y240-F250 HydrophobicContact CE1-CD2 4Å; Y240-F250 HydrophobicContact CE1-CG 4.32Å; L241-F250 HydrophobicContact CD1-CD1 4.31Å; L241-F250 HydrophobicContact CD1-CE1 3.98Å; L241-F250 HydrophobicContact CD1-CZ 4.27Å; L241-F250 HydrophobicContact CD2-CB 3.85Å; L241-F250 HydrophobicContact CD2-CD1 3.62Å; L241-F250 HydrophobicContact CD2-CD2 4.16Å; L241-F250 HydrophobicContact CD2-CE1 4.11Å; L241-F250 HydrophobicContact CD2-CG 3.64Å; N246-F250 WeakPolarHBondContact O-CB 3.26Å; N246-F250 PolarHBondContact O-N 3.21Å; I247-F250 PolarHBondContact O-N 3.01Å; L248-F250 PolarHBondContact O-N 3.42Å; F250-V253 PolarHBondContact O-N 3.29Å; F250-I254 HydrophobicContact CD1-CD1 3.81Å; F250-I254 HydrophobicContact CD2-CD1 4.29Å; F250-I254 HydrophobicContact CE1-CD1 3.4Å; F250-I254 VanDerWaalsContact CE1-CD1 3.4Å; F250-I254 HydrophobicContact CE2-CD1 3.92Å; F250-I254 HydrophobicContact CG-CD1 4.25Å; F250-I254 HydrophobicContact CZ-CD1 3.47Å; F250-I254 VanDerWaalsContact CZ-CD1 3.47Å; F250-I254 WeakPolarHBondContact O-CB 3.28Å; F250-I254 WeakPolarHBondContact O-CG1 3.4Å; F250-I254 PolarHBondContact O-N 3.45Å
251	T	83.2	Confident	80.5	Confident	63 Å²	63	53.5 Å²	53.5	39%	0.387	28%	0.279	S	S	.	.	H	α-helix	trans	-65.2	-43.8	178.4	-54.8	0	0	0	0	111	I247 L248 D249 I254 L255	I247-T251 WeakPolarHBondContact O-CB 3.49Å; I247-T251 PolarHBondContact O-N 2.67Å; I247-T251 PolarHBondContact O-OG1 2.74Å; L248-T251 PolarHBondContact O-N 2.79Å; D249-T251 VanDerWaalsContact C-N 3.34Å; D249-T251 PolarHBondContact O-N 3.39Å; T251-I254 PolarHBondContact O-N 3.38Å; T251-L255 HydrophobicContact CG2-CD1 4.07Å; T251-L255 WeakPolarHBondContact O-CB 3.46Å; T251-L255 WeakPolarHBondContact O-CG 3.16Å; T251-L255 PolarHBondContact O-N 3.19Å
252	I	81.3	Confident	79.9	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-68.9	-33.7	178	-65.7	172	0	0	0	111.8	L248 D249 G256 F279 L282 R283	L248-I252 HydrophobicContact CD2-CD1 3.54Å; L248-I252 HydrophobicContact CG-CD1 4.02Å; L248-I252 WeakPolarHBondContact O-CG1 3.29Å; L248-I252 PolarHBondContact O-N 2.89Å; D249-I252 PolarHBondContact O-N 3.33Å; I252-G256 WeakPolarHBondContact O-CA 3.43Å; I252-G256 PolarHBondContact O-N 3.47Å; I252-F279 WeakPolarHBondContact CD1-O 3.43Å; I252-L282 HydrophobicContact CD1-CB 3.97Å; I252-R283 HydrophobicContact CD1-CG 4.05Å; I252-R283 HydrophobicContact CG2-CG 3.91Å; I252-R283 VanDerWaalsContact CG2-NE 3.32Å
253	V	86.3	Confident	79.5	Confident	9 Å²	9	49.4 Å²	49.4	6%	0.055	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-44.2	172.6	167.7	0	0	0	0	111	F220 T221 D249 F250 G256 L257	F220-V253 HydrophobicContact CB-CG2 3.66Å; T221-V253 WeakPolarHBondContact OG1-CG1 3.45Å; D249-V253 WeakPolarHBondContact O-CB 3.37Å; D249-V253 WeakPolarHBondContact O-CG2 3.38Å; D249-V253 PolarHBondContact O-N 3Å; F250-V253 PolarHBondContact O-N 3.29Å; V253-G256 CarbonylContact O-C 3.25Å; V253-G256 WeakPolarHBondContact O-CA 3.35Å; V253-G256 PolarHBondContact O-N 2.83Å; V253-G256 VanDerWaalsContact O-N 3.17Å; V253-L257 HydrophobicContact CG1-CD1 3.95Å; V253-L257 HydrophobicContact CG1-CG 4.5Å; V253-L257 WeakPolarHBondContact O-CG 2.86Å; V253-L257 PolarHBondContact O-N 3Å
254	I	86.5	Confident	79.2	Confident	66 Å²	66	53.2 Å²	53.2	34%	0.338	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-47.8	177.7	-75.6	175.9	0	0	0	111.4	F250 T251 G256 L257 L258	F250-I254 HydrophobicContact CD1-CD1 3.81Å; F250-I254 HydrophobicContact CD2-CD1 4.29Å; F250-I254 HydrophobicContact CE1-CD1 3.4Å; F250-I254 VanDerWaalsContact CE1-CD1 3.4Å; F250-I254 HydrophobicContact CE2-CD1 3.92Å; F250-I254 HydrophobicContact CG-CD1 4.25Å; F250-I254 HydrophobicContact CZ-CD1 3.47Å; F250-I254 VanDerWaalsContact CZ-CD1 3.47Å; F250-I254 WeakPolarHBondContact O-CB 3.28Å; F250-I254 WeakPolarHBondContact O-CG1 3.4Å; F250-I254 PolarHBondContact O-N 3.45Å; T251-I254 PolarHBondContact O-N 3.38Å; I254-G256 PolarHBondContact O-N 2.75Å; I254-L257 PolarHBondContact O-N 3.32Å; I254-L258 HydrophobicContact CG2-CD1 3.61Å; I254-L258 HydrophobicContact CG2-CG 4.16Å; I254-L258 VanDerWaalsContact O-CB 3.31Å; I254-L258 WeakPolarHBondContact O-CB 3.45Å; I254-L258 VanDerWaalsContact O-CG 3.31Å; I254-L258 WeakPolarHBondContact O-CG 3.21Å; I254-L258 PolarHBondContact O-N 3.05Å
255	L	81.8	Confident	78.9	Confident	38 Å²	38	55.8 Å²	55.8	20%	0.199	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-32.9	172.8	-68.8	172.4	0	0	0	111.5	T251 Q259 F279	T251-L255 HydrophobicContact CG2-CD1 4.07Å; T251-L255 WeakPolarHBondContact O-CB 3.46Å; T251-L255 WeakPolarHBondContact O-CG 3.16Å; T251-L255 PolarHBondContact O-N 3.19Å; L255-Q259 WeakPolarHBondContact O-CB 3.38Å; L255-Q259 PolarHBondContact O-N 3Å; L255-F279 HydrophobicContact CD1-CB 3.83Å; L255-F279 HydrophobicContact CD1-CD1 4.15Å; L255-F279 HydrophobicContact CD1-CD2 3.79Å; L255-F279 HydrophobicContact CD1-CE2 4.38Å; L255-F279 HydrophobicContact CD1-CG 3.65Å
256	G	79.4	Confident	78.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-56.3	-55.3	170.4	0	0	0	0	0	113	I252 V253 I254 R280	I252-G256 WeakPolarHBondContact O-CA 3.43Å; I252-G256 PolarHBondContact O-N 3.47Å; V253-G256 CarbonylContact O-C 3.25Å; V253-G256 WeakPolarHBondContact O-CA 3.35Å; V253-G256 PolarHBondContact O-N 2.83Å; V253-G256 VanDerWaalsContact O-N 3.17Å; I254-G256 PolarHBondContact O-N 2.75Å; G256-R280 PolarHBondContact O-NH2 3.02Å
257	L	83	Confident	77.3	Confident	88 Å²	88	59.7 Å²	59.7	46%	0.461	31%	0.307	S	S	.	.	H	α-helix	trans	-73.3	-29.6	-178	-66.8	169.5	0	0	0	113.4	I217 T221 V253 I254	I217-L257 HydrophobicContact CG2-CD2 3.82Å; I217-L257 HydrophobicContact CG2-CG 4.18Å; T221-L257 HydrophobicContact CG2-CD1 4.23Å; V253-L257 HydrophobicContact CG1-CD1 3.95Å; V253-L257 HydrophobicContact CG1-CG 4.5Å; V253-L257 WeakPolarHBondContact O-CG 2.86Å; V253-L257 PolarHBondContact O-N 3Å; I254-L257 PolarHBondContact O-N 3.32Å
258	L	80.5	Confident	76.1	Confident	72 Å²	72	65.1 Å²	65.1	38%	0.377	33%	0.33	S	S	.	.	H	α-helix	trans	-81.1	-24.5	177	-70.7	178.2	0	0	0	113.1	I254 L261 I262	I254-L258 HydrophobicContact CG2-CD1 3.61Å; I254-L258 HydrophobicContact CG2-CG 4.16Å; I254-L258 VanDerWaalsContact O-CB 3.31Å; I254-L258 WeakPolarHBondContact O-CB 3.45Å; I254-L258 VanDerWaalsContact O-CG 3.31Å; I254-L258 WeakPolarHBondContact O-CG 3.21Å; I254-L258 PolarHBondContact O-N 3.05Å; L258-L261 HydrophobicContact CD2-CD1 4.17Å; L258-L261 WeakPolarHBondContact O-CB 3.27Å; L258-L261 PolarHBondContact O-N 2.84Å; L258-I262 HydrophobicContact CB-CD1 3.88Å; L258-I262 HydrophobicContact CB-CG1 4.34Å; L258-I262 WeakPolarHBondContact O-CG1 3.49Å; L258-I262 PolarHBondContact O-N 3.48Å
259	Q	76.4	Confident	75	Confident	13 Å²	13	67 Å²	67	6%	0.061	35%	0.347	C	S	.	.	H	α-helix	trans	-55.3	-42.8	-175.6	-173.3	-177.7	-55.9	0	0	114	L255 L261 I262 Q263 V273 R280	L255-Q259 WeakPolarHBondContact O-CB 3.38Å; L255-Q259 PolarHBondContact O-N 3Å; Q259-L261 PolarHBondContact O-N 3.43Å; Q259-I262 PolarHBondContact O-N 3.39Å; Q259-Q263 WeakPolarHBondContact O-CB 3.15Å; Q259-Q263 PolarHBondContact O-N 3.43Å; Q259-V273 HydrophobicContact CG-CG1 4.37Å; Q259-R280 VanDerWaalsContact CD-NH2 3.3Å
260	P	73.4	Confident	73.7	Confident	71 Å²	71	70.2 Å²	70.2	46%	0.461	38%	0.383	S	S	.	.	H	α-helix	trans	-63.3	-39.5	175.7	-22.9	35.1	0	0	0	113.1	Q264	P260-Q264 WeakPolarHBondContact O-CB 3.47Å; P260-Q264 PolarHBondContact O-N 3.37Å
261	L	74.9	Confident	72.2	Confident	95 Å²	95	72.8 Å²	72.8	50%	0.497	40%	0.402	S	S	.	.	H	α-helix	trans	-66.2	-43.2	176	-75.2	161	0	0	0	111.5	L258 Q259 Q264 M265	L258-L261 HydrophobicContact CD2-CD1 4.17Å; L258-L261 WeakPolarHBondContact O-CB 3.27Å; L258-L261 PolarHBondContact O-N 2.84Å; Q259-L261 PolarHBondContact O-N 3.43Å; L261-Q264 PolarHBondContact O-N 3.33Å; L261-M265 HydrophobicContact CB-CE 4.46Å; L261-M265 WeakPolarHBondContact O-CE 3.1Å; L261-M265 WeakPolarHBondContact O-CG 3.29Å; L261-M265 PolarHBondContact O-N 3.44Å; L261-M265 VanDerWaalsContact O-N 3.12Å
262	I	72.6	Confident	70.9	Confident	40 Å²	40	73 Å²	73	21%	0.205	40%	0.401	C	S	.	.	H	α-helix	trans	-66.3	-43.5	177.5	-65.2	168.9	0	0	0	110	L258 Q259 Q264 M265 V266 V273 L276	L258-I262 HydrophobicContact CB-CD1 3.88Å; L258-I262 HydrophobicContact CB-CG1 4.34Å; L258-I262 WeakPolarHBondContact O-CG1 3.49Å; L258-I262 PolarHBondContact O-N 3.48Å; Q259-I262 PolarHBondContact O-N 3.39Å; I262-Q264 PolarHBondContact O-N 2.93Å; I262-M265 PolarHBondContact O-N 3.38Å; I262-M265 VanDerWaalsContact O-N 3.12Å; I262-V266 HydrophobicContact CG2-CB 4.4Å; I262-V266 HydrophobicContact CG2-CG2 3.78Å; I262-V266 VanDerWaalsContact O-CB 3.22Å; I262-V266 WeakPolarHBondContact O-CB 3.31Å; I262-V266 VanDerWaalsContact O-CG2 3.27Å; I262-V266 WeakPolarHBondContact O-CG2 3.49Å; I262-V266 PolarHBondContact O-N 3.36Å; I262-V273 HydrophobicContact CB-CG1 4.43Å; I262-V273 HydrophobicContact CG2-CG1 3.86Å; I262-V273 HydrophobicContact CG2-CG2 4.37Å; I262-L276 HydrophobicContact CD1-CD1 3.75Å; I262-L276 HydrophobicContact CG2-CD1 3.98Å
263	Q	70.5	Confident	70.1	Confident	73 Å²	73	73.6 Å²	73.6	34%	0.341	40%	0.404	S	S	.	.	H	α-helix	trans	-58.4	-48.5	176.9	-176.2	172.5	-22.6	0	0	111.1	Q259 M265 V266 E267 V273	Q259-Q263 WeakPolarHBondContact O-CB 3.15Å; Q259-Q263 PolarHBondContact O-N 3.43Å; Q263-M265 PolarHBondContact O-N 3.46Å; Q263-V266 PolarHBondContact O-N 2.94Å; Q263-E267 HydrophobicContact CG-CG 4.28Å; Q263-E267 VanDerWaalsContact CG-OE1 3.26Å; Q263-E267 WeakPolarHBondContact CG-OE1 3.3Å; Q263-E267 PolarHBondContact NE2-OE1 3.5Å; Q263-E267 WeakPolarHBondContact O-CG 3.49Å; Q263-E267 PolarHBondContact O-N 2.97Å; Q263-V273 HydrophobicContact CB-CG1 4.26Å
264	Q	72.2	Confident	68.9	Low	156 Å²	156	78 Å²	78	73%	0.729	42%	0.423	S	S	*	.	H	α-helix	trans	-63	-24.2	177.5	-167.6	175	10.8	0	0	113.9	P260 L261 I262	P260-Q264 WeakPolarHBondContact O-CB 3.47Å; P260-Q264 PolarHBondContact O-N 3.37Å; L261-Q264 PolarHBondContact O-N 3.33Å; I262-Q264 PolarHBondContact O-N 2.93Å
265	M	69.4	Low	67.9	Low	124 Å²	124	77.3 Å²	77.3	61%	0.611	43%	0.427	S	S	*	.	H	α-helix	trans	-89.1	-31.7	174.7	-71.5	-173.6	-70.2	0	0	113.7	L261 I262 Q263	L261-M265 HydrophobicContact CB-CE 4.46Å; L261-M265 WeakPolarHBondContact O-CE 3.1Å; L261-M265 WeakPolarHBondContact O-CG 3.29Å; L261-M265 PolarHBondContact O-N 3.44Å; L261-M265 VanDerWaalsContact O-N 3.12Å; I262-M265 PolarHBondContact O-N 3.38Å; I262-M265 VanDerWaalsContact O-N 3.12Å; Q263-M265 PolarHBondContact O-N 3.46Å
266	V	63.5	Low	67.1	Low	31 Å²	31	77.6 Å²	77.6	19%	0.188	43%	0.428	C	S	.	.	H	α-helix	trans	-101.2	-9.3	-167.1	177.1	0	0	0	0	113	I262 Q263 Q268 S269 V271 V273	I262-V266 HydrophobicContact CG2-CB 4.4Å; I262-V266 HydrophobicContact CG2-CG2 3.78Å; I262-V266 VanDerWaalsContact O-CB 3.22Å; I262-V266 WeakPolarHBondContact O-CB 3.31Å; I262-V266 VanDerWaalsContact O-CG2 3.27Å; I262-V266 WeakPolarHBondContact O-CG2 3.49Å; I262-V266 PolarHBondContact O-N 3.36Å; Q263-V266 PolarHBondContact O-N 2.94Å; V266-Q268 PolarHBondContact O-N 3.38Å; V266-Q268 VanDerWaalsContact O-N 3.08Å; V266-S269 PolarHBondContact O-N 2.97Å; V266-V271 HydrophobicContact CG1-CB 3.77Å; V266-V271 WeakPolarHBondContact CG1-O 3.44Å; V266-V273 HydrophobicContact CB-CG2 3.58Å; V266-V273 HydrophobicContact CG1-CG2 3.44Å; V266-V273 VanDerWaalsContact CG1-CG2 3.44Å
267	E	60.9	Low	66.7	Low	138 Å²	138	79.3 Å²	79.3	65%	0.645	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-20	165	-81.7	170	-174.4	0	0	112.9	Q263	Q263-E267 HydrophobicContact CG-CG 4.28Å; Q263-E267 VanDerWaalsContact CG-OE1 3.26Å; Q263-E267 WeakPolarHBondContact CG-OE1 3.3Å; Q263-E267 PolarHBondContact NE2-OE1 3.5Å; Q263-E267 WeakPolarHBondContact O-CG 3.49Å; Q263-E267 PolarHBondContact O-N 2.97Å
268	Q	58.5	Low	66	Low	189 Å²	189	75.8 Å²	75.8	88%	0.883	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.5	170.2	-65.9	-170.2	-10.1	0	0	115	V266	V266-Q268 PolarHBondContact O-N 3.38Å; V266-Q268 VanDerWaalsContact O-N 3.08Å
269	S	54.5	Low	65.5	Low	77 Å²	77	76.9 Å²	76.9	54%	0.538	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-11.5	-170.9	-48.8	0	0	0	0	114.7	V266 V271	V266-S269 PolarHBondContact O-N 2.97Å; S269-V271 PolarHBondContact O-N 2.92Å
270	G	53.4	Low	65.4	Low	79 Å²	79	76.5 Å²	76.5	81%	0.814	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	13	-176.9	0	0	0	0	0	115.1
271	V	53.4	Low	65.3	Low	100 Å²	100	73.2 Å²	73.2	61%	0.606	40%	0.397	S	S	*	.			trans	-90.1	129.7	176.4	178.6	0	0	0	0	109.2	V266 S269 V273	V266-V271 HydrophobicContact CG1-CB 3.77Å; V266-V271 WeakPolarHBondContact CG1-O 3.44Å; S269-V271 PolarHBondContact O-N 2.92Å; V271-V273 WeakPolarHBondContact O-CG2 3.27Å; V271-V273 PolarHBondContact O-N 3.02Å
272	D	56.7	Low	65.4	Low	68 Å²	68	71.6 Å²	71.6	36%	0.364	39%	0.388	S	S	.	.			trans	-74.4	84.1	-170.3	-146.4	-15.2	0	0	0	111.7	K274 A275 R761	D272-K274 PolarHBondContact O-N 3.02Å; D272-K274 WeakPolarHBondContact OD1-CD 3.23Å; D272-K274 WeakPolarHBondContact OD1-CG 3.41Å; D272-A275 WeakPolarHBondContact O-CB 3.25Å; D272-A275 PolarHBondContact O-N 3.45Å; D272-R761 IonicContact OD2-CZ 3.01Å; D272-R761 IonicContact OD2-NH1 2.9Å; D272-R761 IonicContact OD2-NH2 2.64Å; D272-R761 PolarHBondContact OD2-NH2 2.79Å
273	V	63.3	Low	65.4	Low	18 Å²	18	69.9 Å²	69.9	11%	0.109	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-55.8	-20.8	-177.7	-171.6	0	0	0	0	112.6	Q259 I262 Q263 V266 V271 A275 L276	Q259-V273 HydrophobicContact CG-CG1 4.37Å; I262-V273 HydrophobicContact CB-CG1 4.43Å; I262-V273 HydrophobicContact CG2-CG1 3.86Å; I262-V273 HydrophobicContact CG2-CG2 4.37Å; Q263-V273 HydrophobicContact CB-CG1 4.26Å; V266-V273 HydrophobicContact CB-CG2 3.58Å; V266-V273 HydrophobicContact CG1-CG2 3.44Å; V266-V273 VanDerWaalsContact CG1-CG2 3.44Å; V271-V273 WeakPolarHBondContact O-CG2 3.27Å; V271-V273 PolarHBondContact O-N 3.02Å; V273-A275 PolarHBondContact O-N 3.31Å; V273-A275 VanDerWaalsContact O-N 3.12Å; V273-L276 HydrophobicContact CG1-CD1 4.18Å; V273-L276 WeakPolarHBondContact O-CB 3.18Å; V273-L276 PolarHBondContact O-N 3.24Å
274	K	62.6	Low	65.5	Low	101 Å²	101	66.7 Å²	66.7	44%	0.439	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-48.8	-34.6	169.9	-62.1	179.3	-173.5	171.2	0	112.1	D272 L276 R277	D272-K274 PolarHBondContact O-N 3.02Å; D272-K274 WeakPolarHBondContact OD1-CD 3.23Å; D272-K274 WeakPolarHBondContact OD1-CG 3.41Å; K274-L276 PolarHBondContact O-N 2.82Å; K274-L276 VanDerWaalsContact O-N 3.17Å; K274-R277 WeakPolarHBondContact O-CB 3.39Å; K274-R277 WeakPolarHBondContact O-CG 3.19Å; K274-R277 PolarHBondContact O-N 2.59Å
275	A	64.4	Low	65.5	Low	52 Å²	52	61.7 Å²	61.7	43%	0.43	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-57.6	-29.1	176.4	0	0	0	0	0	113.9	D272 V273 R277 A278	D272-A275 WeakPolarHBondContact O-CB 3.25Å; D272-A275 PolarHBondContact O-N 3.45Å; V273-A275 PolarHBondContact O-N 3.31Å; V273-A275 VanDerWaalsContact O-N 3.12Å; A275-R277 PolarHBondContact O-N 3.43Å; A275-A278 VanDerWaalsContact O-CB 3.23Å; A275-A278 WeakPolarHBondContact O-CB 3.31Å; A275-A278 PolarHBondContact O-N 3.39Å
276	L	66.5	Low	65.7	Low	43 Å²	43	57.3 Å²	57.3	23%	0.225	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-69.6	-19.5	176.4	-62.2	-176.2	0	0	0	113.2	I262 V273 K274 A278 F279	I262-L276 HydrophobicContact CD1-CD1 3.75Å; I262-L276 HydrophobicContact CG2-CD1 3.98Å; V273-L276 HydrophobicContact CG1-CD1 4.18Å; V273-L276 WeakPolarHBondContact O-CB 3.18Å; V273-L276 PolarHBondContact O-N 3.24Å; K274-L276 PolarHBondContact O-N 2.82Å; K274-L276 VanDerWaalsContact O-N 3.17Å; L276-A278 PolarHBondContact O-N 3.3Å; L276-F279 HydrophobicContact CD2-CD2 4.32Å; L276-F279 HydrophobicContact CD2-CE2 4Å; L276-F279 PolarHBondContact O-N 2.97Å
277	R	69.5	Low	66	Low	38 Å²	38	58.1 Å²	58.1	14%	0.143	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.9	-29.4	172.8	-59.8	177.6	-177.5	-151.6	0.7	111.1	E210 K274 A275 F279 R280	E210-R277 IonicContact OE1-CZ 3.72Å; E210-R277 IonicContact OE1-NH1 2.8Å; E210-R277 PolarHBondContact OE1-NH1 2.87Å; E210-R277 IonicContact OE1-NH2 3.51Å; E210-R277 PolarHBondContact OE1-NH2 2.99Å; K274-R277 WeakPolarHBondContact O-CB 3.39Å; K274-R277 WeakPolarHBondContact O-CG 3.19Å; K274-R277 PolarHBondContact O-N 2.59Å; A275-R277 PolarHBondContact O-N 3.43Å; R277-F279 VanDerWaalsContact C-N 3.26Å; R277-F279 PolarHBondContact O-N 3.42Å; R277-R280 VanDerWaalsContact O-CB 3.23Å; R277-R280 WeakPolarHBondContact O-CB 3.45Å; R277-R280 WeakPolarHBondContact O-CG 3.48Å; R277-R280 PolarHBondContact O-N 2.81Å
278	A	69.1	Low	66.5	Low	13 Å²	13	51.8 Å²	51.8	11%	0.107	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-58.3	-32.2	179.8	0	0	0	0	0	113.6	A275 L276 R280 V281 L753 Q756	A275-A278 VanDerWaalsContact O-CB 3.23Å; A275-A278 WeakPolarHBondContact O-CB 3.31Å; A275-A278 PolarHBondContact O-N 3.39Å; L276-A278 PolarHBondContact O-N 3.3Å; A278-R280 PolarHBondContact O-N 2.81Å; A278-R280 VanDerWaalsContact O-N 3.12Å; A278-V281 WeakPolarHBondContact O-CB 3.1Å; A278-V281 WeakPolarHBondContact O-CG2 3.43Å; A278-V281 PolarHBondContact O-N 2.88Å; A278-L753 HydrophobicContact CB-CD1 3.79Å; A278-Q756 HydrophobicContact CB-CB 4.5Å
279	F	70	Confident	67	Low	95 Å²	95	44.3 Å²	44.3	42%	0.417	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-61.1	-23.6	175.4	-71.6	-77.3	0	0	0	113.2	I252 L255 L276 R277 V281 L282	I252-F279 WeakPolarHBondContact CD1-O 3.43Å; L255-F279 HydrophobicContact CD1-CB 3.83Å; L255-F279 HydrophobicContact CD1-CD1 4.15Å; L255-F279 HydrophobicContact CD1-CD2 3.79Å; L255-F279 HydrophobicContact CD1-CE2 4.38Å; L255-F279 HydrophobicContact CD1-CG 3.65Å; L276-F279 HydrophobicContact CD2-CD2 4.32Å; L276-F279 HydrophobicContact CD2-CE2 4Å; L276-F279 PolarHBondContact O-N 2.97Å; R277-F279 VanDerWaalsContact C-N 3.26Å; R277-F279 PolarHBondContact O-N 3.42Å; F279-V281 PolarHBondContact O-N 2.87Å; F279-L282 HydrophobicContact CD1-CD1 4.27Å; F279-L282 WeakPolarHBondContact O-CB 3.26Å; F279-L282 PolarHBondContact O-N 2.84Å
280	R	73.6	Confident	67.5	Low	5 Å²	5	43 Å²	43	2%	0.019	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-72.3	-18.9	177.6	-53.5	173.3	-178.9	-167.2	-5.6	112	E213 G256 Q259 R277 A278 L282 R283	E213-R280 WeakPolarHBondContact OE1-CD 3.37Å; E213-R280 IonicContact OE1-CZ 2.71Å; E213-R280 IonicContact OE1-NE 2.77Å; E213-R280 IonicContact OE1-NH1 2.89Å; E213-R280 PolarHBondContact OE1-NH1 3.01Å; E213-R280 IonicContact OE2-NH1 3.3Å; E213-R280 PolarHBondContact OE2-NH1 2.57Å; G256-R280 PolarHBondContact O-NH2 3.02Å; Q259-R280 VanDerWaalsContact CD-NH2 3.3Å; R277-R280 VanDerWaalsContact O-CB 3.23Å; R277-R280 WeakPolarHBondContact O-CB 3.45Å; R277-R280 WeakPolarHBondContact O-CG 3.48Å; R277-R280 PolarHBondContact O-N 2.81Å; A278-R280 PolarHBondContact O-N 2.81Å; A278-R280 VanDerWaalsContact O-N 3.12Å; R280-L282 PolarHBondContact O-N 3.4Å; R280-R283 WeakPolarHBondContact O-CB 3.37Å; R280-R283 VanDerWaalsContact O-CG 3.32Å; R280-R283 WeakPolarHBondContact O-CG 2.96Å; R280-R283 PolarHBondContact O-N 2.81Å
281	V	72.2	Confident	68.1	Low	3 Å²	3	42.7 Å²	42.7	2%	0.018	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-69.2	-15.9	172.5	-175.9	0	0	0	0	112.2	L191 A278 F279 P284 I749 L752	L191-V281 HydrophobicContact CD1-CG2 4.38Å; A278-V281 WeakPolarHBondContact O-CB 3.1Å; A278-V281 WeakPolarHBondContact O-CG2 3.43Å; A278-V281 PolarHBondContact O-N 2.88Å; F279-V281 PolarHBondContact O-N 2.87Å; V281-P284 WeakPolarHBondContact O-CD 3.28Å; V281-P284 WeakPolarHBondContact O-CG 3.4Å; V281-I749 HydrophobicContact CG1-CG2 4.3Å; V281-I749 WeakPolarHBondContact CG1-O 3.44Å; V281-L752 HydrophobicContact CB-CB 4.43Å; V281-L752 HydrophobicContact CG1-CB 3.5Å; V281-L752 VanDerWaalsContact CG1-CB 3.5Å; V281-L752 HydrophobicContact CG1-CD1 4.16Å; V281-L752 HydrophobicContact CG1-CG 4.48Å; V281-L752 HydrophobicContact CG2-CB 3.99Å
282	L	75.6	Confident	68.6	Low	60 Å²	60	42.3 Å²	42.3	31%	0.314	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-79	-15.6	176.1	-59.3	177.4	0	0	0	113.7	I252 F279 R280 L285	I252-L282 HydrophobicContact CD1-CB 3.97Å; F279-L282 HydrophobicContact CD1-CD1 4.27Å; F279-L282 WeakPolarHBondContact O-CB 3.26Å; F279-L282 PolarHBondContact O-N 2.84Å; R280-L282 PolarHBondContact O-N 3.4Å; L282-L285 HydrophobicContact CB-CD1 4.23Å; L282-L285 HydrophobicContact CD2-CD1 3.99Å; L282-L285 VanDerWaalsContact O-CB 3.27Å; L282-L285 WeakPolarHBondContact O-CB 3.47Å; L282-L285 WeakPolarHBondContact O-CG 3.45Å; L282-L285 PolarHBondContact O-N 3.45Å
283	R	73	Confident	68.8	Low	5 Å²	5	42 Å²	42	2%	0.019	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-48.3	-46.4	176.1	-70.6	176.9	174.3	156.4	3.1	114.3	I184 N187 I252 R280 L285 R286	I184-R283 HydrophobicContact CG2-CB 4.23Å; N187-R283 PolarHBondContact OD1-NH1 3.41Å; I252-R283 HydrophobicContact CD1-CG 4.05Å; I252-R283 HydrophobicContact CG2-CG 3.91Å; I252-R283 VanDerWaalsContact CG2-NE 3.32Å; R280-R283 WeakPolarHBondContact O-CB 3.37Å; R280-R283 VanDerWaalsContact O-CG 3.32Å; R280-R283 WeakPolarHBondContact O-CG 2.96Å; R280-R283 PolarHBondContact O-N 2.81Å; R283-L285 PolarHBondContact O-N 3.15Å; R283-L285 VanDerWaalsContact O-N 3.12Å; R283-R286 WeakPolarHBondContact O-CB 3.43Å; R283-R286 PolarHBondContact O-N 3.13Å
284	P	72.3	Confident	68.9	Low	5 Å²	5	41.3 Å²	41.3	3%	0.032	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-57.9	-19.4	175.9	17.1	-32	0	0	0	115.5	C188 V281 R286 L287 I749	C188-P284 VanDerWaalsContact SG-CD 3.58Å; V281-P284 WeakPolarHBondContact O-CD 3.28Å; V281-P284 WeakPolarHBondContact O-CG 3.4Å; P284-R286 PolarHBondContact O-N 3.19Å; P284-R286 VanDerWaalsContact O-N 3.1Å; P284-L287 HydrophobicContact CB-CD1 4.12Å; P284-L287 VanDerWaalsContact O-CB 3.27Å; P284-L287 WeakPolarHBondContact O-CB 3.26Å; P284-L287 PolarHBondContact O-N 2.73Å; P284-I749 HydrophobicContact CG-CD1 4.39Å; P284-I749 HydrophobicContact CG-CG1 4.01Å
285	L	73.4	Confident	69.2	Low	52 Å²	52	40.3 Å²	40.3	27%	0.272	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-57.7	-26.3	172.6	-67.1	171.9	0	0	0	112	W245 L248 L282 R283 L287 V288 L745 I749	W245-L285 HydrophobicContact CH2-CB 4.4Å; W245-L285 WeakPolarHBondContact CH2-O 3.18Å; W245-L285 HydrophobicContact CZ3-CB 3.88Å; W245-L285 VanDerWaalsContact CZ3-O 3.28Å; W245-L285 WeakPolarHBondContact CZ3-O 3.44Å; L248-L285 HydrophobicContact CD1-CD1 4.27Å; L282-L285 HydrophobicContact CB-CD1 4.23Å; L282-L285 HydrophobicContact CD2-CD1 3.99Å; L282-L285 VanDerWaalsContact O-CB 3.27Å; L282-L285 WeakPolarHBondContact O-CB 3.47Å; L282-L285 WeakPolarHBondContact O-CG 3.45Å; L282-L285 PolarHBondContact O-N 3.45Å; R283-L285 PolarHBondContact O-N 3.15Å; R283-L285 VanDerWaalsContact O-N 3.12Å; L285-L287 PolarHBondContact O-N 2.67Å; L285-V288 WeakPolarHBondContact O-CB 3.37Å; L285-V288 WeakPolarHBondContact O-CG2 3.41Å; L285-V288 PolarHBondContact O-N 2.87Å; L285-L745 HydrophobicContact CD2-CD2 4.21Å; L285-I749 HydrophobicContact CD2-CD1 3.42Å; L285-I749 VanDerWaalsContact CD2-CD1 3.42Å; L285-I749 HydrophobicContact CG-CD1 3.68Å
286	R	72.5	Confident	69.2	Low	32 Å²	32	42.4 Å²	42.4	12%	0.121	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-13.5	174.9	-174.6	166.1	164.1	-166.4	-9.8	114	I184 E223 D249 R283 P284 V288 S289 G290	I184-R286 HydrophobicContact CD1-CB 4.14Å; I184-R286 HydrophobicContact CD1-CG 4.13Å; E223-R286 VanDerWaalsContact CD-NH1 3.31Å; E223-R286 IonicContact OE1-CZ 3.43Å; E223-R286 VanDerWaalsContact OE1-CZ 3.26Å; E223-R286 IonicContact OE1-NH1 3.16Å; E223-R286 PolarHBondContact OE1-NH1 2.98Å; E223-R286 IonicContact OE1-NH2 2.77Å; E223-R286 PolarHBondContact OE1-NH2 3.1Å; E223-R286 IonicContact OE2-CZ 3.38Å; E223-R286 IonicContact OE2-NH1 2.62Å; E223-R286 PolarHBondContact OE2-NH1 3.37Å; E223-R286 IonicContact OE2-NH2 3.19Å; D249-R286 IonicContact OD1-NH1 2.8Å; D249-R286 VanDerWaalsContact OD2-CD 3.3Å; D249-R286 WeakPolarHBondContact OD2-CD 3.45Å; D249-R286 IonicContact OD2-CZ 2.81Å; D249-R286 IonicContact OD2-NE 2.74Å; D249-R286 IonicContact OD2-NH1 2.68Å; D249-R286 PolarHBondContact OD2-NH1 3.05Å; R283-R286 WeakPolarHBondContact O-CB 3.43Å; R283-R286 PolarHBondContact O-N 3.13Å; P284-R286 PolarHBondContact O-N 3.19Å; P284-R286 VanDerWaalsContact O-N 3.1Å; R286-V288 PolarHBondContact O-N 3.39Å; R286-S289 PolarHBondContact O-N 3.31Å; R286-S289 PolarHBondContact O-OG 2.82Å; R286-G290 PolarHBondContact O-N 2.9Å
287	L	71.4	Confident	69.2	Low	47 Å²	47	41.9 Å²	41.9	25%	0.246	24%	0.24	C	C	.	.	H	α-helix	trans	-63.9	-30.5	165.2	-72.9	151.3	0	0	0	111.7	L181 P284 L285 G290 L291 L745	L181-L287 HydrophobicContact CD1-CD2 3.66Å; L181-L287 HydrophobicContact CD1-CG 4.16Å; L181-L287 HydrophobicContact CD2-CD2 4.19Å; L181-L287 HydrophobicContact CG-CD2 3.87Å; P284-L287 HydrophobicContact CB-CD1 4.12Å; P284-L287 VanDerWaalsContact O-CB 3.27Å; P284-L287 WeakPolarHBondContact O-CB 3.26Å; P284-L287 PolarHBondContact O-N 2.73Å; L285-L287 PolarHBondContact O-N 2.67Å; L287-G290 PolarHBondContact O-N 3.31Å; L287-L291 PolarHBondContact O-N 3.48Å; L287-L745 HydrophobicContact CB-CD1 3.89Å; L287-L745 HydrophobicContact CD1-CD1 4.13Å
288	V	70.8	Confident	69.1	Low	6 Å²	6	42.8 Å²	42.8	4%	0.036	25%	0.248	C	C	.	.	H	α-helix	trans	-68.7	-36.6	178	-176.5	0	0	0	0	111.2	W245 L285 R286 L291 L294 Q295 L298 L742 L745	W245-V288 HydrophobicContact CH2-CB 4.24Å; L285-V288 WeakPolarHBondContact O-CB 3.37Å; L285-V288 WeakPolarHBondContact O-CG2 3.41Å; L285-V288 PolarHBondContact O-N 2.87Å; R286-V288 PolarHBondContact O-N 3.39Å; V288-L291 PolarHBondContact O-N 3.37Å; V288-L294 HydrophobicContact CG1-CB 3.91Å; V288-L294 HydrophobicContact CG2-CD1 4.39Å; V288-Q295 WeakPolarHBondContact O-CG 3.27Å; V288-L298 HydrophobicContact CG1-CD2 4.02Å; V288-L742 HydrophobicContact CG2-CD1 4.46Å; V288-L745 HydrophobicContact CG2-CD1 4.16Å; V288-L745 HydrophobicContact CG2-CD2 4.31Å
289	S	68.7	Low	69.2	Low	31 Å²	31	46.5 Å²	46.5	22%	0.217	27%	0.266	C	S	.	.	H	α-helix	trans	-72.4	-28.3	173.5	66.8	0	0	0	0	112.8	R286 L291 Q295	R286-S289 PolarHBondContact O-N 3.31Å; R286-S289 PolarHBondContact O-OG 2.82Å; S289-L291 VanDerWaalsContact C-N 3.34Å; S289-L291 PolarHBondContact O-N 2.79Å; S289-Q295 PolarHBondContact O-NE2 3.4Å
290	G	65.1	Low	69.1	Low	49 Å²	49	43.1 Å²	43.1	51%	0.505	25%	0.254	S	S	.	.	H	α-helix	trans	-73.2	-16.6	172.9	0	0	0	0	0	115.6	R286 L287	R286-G290 PolarHBondContact O-N 2.9Å; L287-G290 PolarHBondContact O-N 3.31Å
291	L	66.7	Low	69	Low	73 Å²	73	43.1 Å²	43.1	38%	0.382	26%	0.255	S	S	.	.			trans	-115.9	101.7	-174.4	-70.1	173.9	0	0	0	111.8	L287 V288 S289 S293 L294 Q295	L287-L291 PolarHBondContact O-N 3.48Å; V288-L291 PolarHBondContact O-N 3.37Å; S289-L291 VanDerWaalsContact C-N 3.34Å; S289-L291 PolarHBondContact O-N 2.79Å; L291-S293 VanDerWaalsContact C-N 3.25Å; L291-S293 PolarHBondContact O-N 3.47Å; L291-S293 VanDerWaalsContact O-N 3.15Å; L291-L294 HydrophobicContact CB-CB 4.2Å; L291-L294 HydrophobicContact CB-CD1 3.89Å; L291-L294 HydrophobicContact CB-CG 3.8Å; L291-L294 HydrophobicContact CD1-CD1 3.6Å; L291-L294 HydrophobicContact CD1-CG 4.2Å; L291-L294 HydrophobicContact CG-CD1 4.38Å; L291-L294 WeakPolarHBondContact O-CB 3.31Å; L291-L294 PolarHBondContact O-N 3.04Å; L291-Q295 PolarHBondContact O-N 3.13Å; L291-Q295 VanDerWaalsContact O-N 3.14Å
292	P	63.4	Low	69	Low	93 Å²	93	48.1 Å²	48.1	60%	0.604	28%	0.279	S	S	*	.	H	α-helix	trans	-65.5	-23	-172.6	24.7	-34.2	0	0	0	114.1	V296	P292-V296 WeakPolarHBondContact O-CG2 3.26Å; P292-V296 PolarHBondContact O-N 3.38Å
293	S	61.8	Low	68.8	Low	62 Å²	62	52.8 Å²	52.8	43%	0.434	29%	0.292	S	S	.	.	H	α-helix	trans	-66.9	-37.8	170.9	57.9	0	0	0	0	112.2	L291 V297 S738	L291-S293 VanDerWaalsContact C-N 3.25Å; L291-S293 PolarHBondContact O-N 3.47Å; L291-S293 VanDerWaalsContact O-N 3.15Å; S293-V297 WeakPolarHBondContact O-CG2 3.46Å; S293-V297 PolarHBondContact O-N 3.36Å; S293-S738 PolarHBondContact OG-OG 2.9Å
294	L	65.3	Low	68.7	Low	2 Å²	2	52.6 Å²	52.6	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-71.4	-38	176.3	-56.4	-172.5	0	0	0	111.4	V288 L291 V296 V297 L298 S738 V741 L742	V288-L294 HydrophobicContact CG1-CB 3.91Å; V288-L294 HydrophobicContact CG2-CD1 4.39Å; L291-L294 HydrophobicContact CB-CB 4.2Å; L291-L294 HydrophobicContact CB-CD1 3.89Å; L291-L294 HydrophobicContact CB-CG 3.8Å; L291-L294 HydrophobicContact CD1-CD1 3.6Å; L291-L294 HydrophobicContact CD1-CG 4.2Å; L291-L294 HydrophobicContact CG-CD1 4.38Å; L291-L294 WeakPolarHBondContact O-CB 3.31Å; L291-L294 PolarHBondContact O-N 3.04Å; L294-V296 VanDerWaalsContact C-N 3.32Å; L294-V296 PolarHBondContact O-N 2.75Å; L294-V297 PolarHBondContact O-N 2.94Å; L294-L298 WeakPolarHBondContact O-CB 3.23Å; L294-L298 PolarHBondContact O-N 2.88Å; L294-S738 WeakPolarHBondContact CD2-O 3.02Å; L294-S738 WeakPolarHBondContact CD2-OG 3.26Å; L294-V741 HydrophobicContact CD1-CG1 4.5Å; L294-L742 HydrophobicContact CD2-CB 4.26Å; L294-L742 HydrophobicContact CD2-CD1 4.46Å
295	Q	67.6	Low	68.7	Low	80 Å²	80	54.9 Å²	54.9	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-42.9	173.9	-64.5	-170.1	9	0	0	112.4	V288 S289 L291 L298 N299	V288-Q295 WeakPolarHBondContact O-CG 3.27Å; S289-Q295 PolarHBondContact O-NE2 3.4Å; L291-Q295 PolarHBondContact O-N 3.13Å; L291-Q295 VanDerWaalsContact O-N 3.14Å; Q295-L298 PolarHBondContact O-N 3.4Å; Q295-N299 WeakPolarHBondContact O-CB 3.45Å; Q295-N299 VanDerWaalsContact O-CG 3.29Å; Q295-N299 PolarHBondContact O-N 3.02Å; Q295-N299 PolarHBondContact O-ND2 3.42Å
296	V	65.6	Low	68.8	Low	97 Å²	97	57.5 Å²	57.5	59%	0.588	32%	0.321	S	S	*	.	H	α-helix	trans	-63.1	-46.4	177.4	172.8	0	0	0	0	110.7	P292 L294 N299 S300	P292-V296 WeakPolarHBondContact O-CG2 3.26Å; P292-V296 PolarHBondContact O-N 3.38Å; L294-V296 VanDerWaalsContact C-N 3.32Å; L294-V296 PolarHBondContact O-N 2.75Å; V296-N299 PolarHBondContact O-N 2.7Å; V296-S300 PolarHBondContact O-N 3.13Å; V296-S300 PolarHBondContact O-OG 2.84Å
297	V	65.9	Low	68.5	Low	31 Å²	31	57.7 Å²	57.7	19%	0.188	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-48.3	177.3	173.6	0	0	0	0	111.1	S293 L294 N299 S300 I301 L742 V831	S293-V297 WeakPolarHBondContact O-CG2 3.46Å; S293-V297 PolarHBondContact O-N 3.36Å; L294-V297 PolarHBondContact O-N 2.94Å; V297-N299 PolarHBondContact O-N 3.33Å; V297-S300 PolarHBondContact O-N 3.37Å; V297-I301 HydrophobicContact CG1-CD1 3.87Å; V297-I301 HydrophobicContact CG1-CG1 4.44Å; V297-I301 VanDerWaalsContact O-CG1 3.29Å; V297-I301 WeakPolarHBondContact O-CG1 3.34Å; V297-I301 PolarHBondContact O-N 2.72Å; V297-L742 HydrophobicContact CG1-CD2 4.11Å; V297-V831 HydrophobicContact CG1-CG1 4.16Å
298	L	67.9	Low	68.6	Low	58 Å²	58	55.8 Å²	55.8	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-59.9	-45.3	178.5	-177	65	0	0	0	112	V288 L294 Q295 S300 I301 M302	V288-L298 HydrophobicContact CG1-CD2 4.02Å; L294-L298 WeakPolarHBondContact O-CB 3.23Å; L294-L298 PolarHBondContact O-N 2.88Å; Q295-L298 PolarHBondContact O-N 3.4Å; L298-S300 VanDerWaalsContact C-N 3.31Å; L298-S300 PolarHBondContact O-N 3.23Å; L298-I301 WeakPolarHBondContact O-CB 3.43Å; L298-I301 PolarHBondContact O-N 2.93Å; L298-I301 VanDerWaalsContact O-N 3.17Å; L298-M302 HydrophobicContact CD1-CG 4.45Å; L298-M302 HydrophobicContact CG-CG 4.46Å; L298-M302 WeakPolarHBondContact O-CG 3.05Å; L298-M302 PolarHBondContact O-N 3.41Å
299	N	69.7	Low	68.8	Low	90 Å²	90	61 Å²	61	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-34.6	177.6	-76	-39.6	0	0	0	112.6	Q295 V296 V297 R303	Q295-N299 WeakPolarHBondContact O-CB 3.45Å; Q295-N299 VanDerWaalsContact O-CG 3.29Å; Q295-N299 PolarHBondContact O-N 3.02Å; Q295-N299 PolarHBondContact O-ND2 3.42Å; V296-N299 PolarHBondContact O-N 2.7Å; V297-N299 PolarHBondContact O-N 3.33Å; N299-R303 WeakPolarHBondContact O-CG 3.43Å; N299-R303 PolarHBondContact O-N 2.92Å
300	S	69.1	Low	69.1	Low	25 Å²	25	64.3 Å²	64.3	18%	0.175	36%	0.355	C	S	.	.	H	α-helix	trans	-68.6	-37.4	171.9	-69.1	0	0	0	0	112.5	V296 V297 L298 A304	V296-S300 PolarHBondContact O-N 3.13Å; V296-S300 PolarHBondContact O-OG 2.84Å; V297-S300 PolarHBondContact O-N 3.37Å; L298-S300 VanDerWaalsContact C-N 3.31Å; L298-S300 PolarHBondContact O-N 3.23Å; S300-A304 VanDerWaalsContact O-CB 3.31Å; S300-A304 WeakPolarHBondContact O-CB 3.41Å; S300-A304 PolarHBondContact O-N 2.95Å
301	I	70.4	Confident	69.8	Low	5 Å²	5	62 Å²	62	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-53.5	173.1	-65.2	165.3	0	0	0	110.2	V297 L298 R303 A304 M305 F477 L742 I827 V831	V297-I301 HydrophobicContact CG1-CD1 3.87Å; V297-I301 HydrophobicContact CG1-CG1 4.44Å; V297-I301 VanDerWaalsContact O-CG1 3.29Å; V297-I301 WeakPolarHBondContact O-CG1 3.34Å; V297-I301 PolarHBondContact O-N 2.72Å; L298-I301 WeakPolarHBondContact O-CB 3.43Å; L298-I301 PolarHBondContact O-N 2.93Å; L298-I301 VanDerWaalsContact O-N 3.17Å; I301-R303 VanDerWaalsContact C-N 3.33Å; I301-R303 PolarHBondContact O-N 3.45Å; I301-A304 CarbonylContact O-C 3.04Å; I301-A304 WeakPolarHBondContact O-CA 3.21Å; I301-A304 PolarHBondContact O-N 3.49Å; I301-M305 PolarHBondContact O-N 2.99Å; I301-F477 HydrophobicContact CG1-CZ 4.46Å; I301-L742 HydrophobicContact CD1-CD2 4.39Å; I301-I827 HydrophobicContact CD1-CG2 4.33Å; I301-I827 HydrophobicContact CG2-CD1 3.66Å; I301-I827 HydrophobicContact CG2-CG1 3.98Å; I301-V831 HydrophobicContact CD1-CG2 3.89Å; I301-V831 HydrophobicContact CG1-CG2 3.78Å
302	M	73.7	Confident	70.4	Confident	107 Å²	107	59.7 Å²	59.7	53%	0.527	32%	0.322	S	S	.	.	H	α-helix	trans	-58	-40.6	-177.2	-70.1	-59.1	-61.9	0	0	113.1	L298 A304 M305	L298-M302 HydrophobicContact CD1-CG 4.45Å; L298-M302 HydrophobicContact CG-CG 4.46Å; L298-M302 WeakPolarHBondContact O-CG 3.05Å; L298-M302 PolarHBondContact O-N 3.41Å; M302-A304 VanDerWaalsContact C-N 3.26Å; M302-A304 PolarHBondContact O-N 3.5Å; M302-M305 PolarHBondContact O-N 3.27Å
303	R	70.7	Confident	71.2	Confident	158 Å²	158	59.2 Å²	59.2	60%	0.596	31%	0.314	S	S	*	.	H	α-helix	trans	-61.7	-37.4	174.5	-76.6	174.8	178.7	178	1.6	112.4	N299 I301 E480	N299-R303 WeakPolarHBondContact O-CG 3.43Å; N299-R303 PolarHBondContact O-N 2.92Å; I301-R303 VanDerWaalsContact C-N 3.33Å; I301-R303 PolarHBondContact O-N 3.45Å; R303-E480 IonicContact CZ-OE1 2.74Å; R303-E480 IonicContact NH1-OE1 2.77Å; R303-E480 PolarHBondContact NH1-OE1 3Å
304	A	70.7	Confident	72.1	Confident	2 Å²	2	57 Å²	57	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-84.9	-15.9	-173.7	0	0	0	0	0	112.7	S300 I301 M302 V306 P307 L473 E476 F477	S300-A304 VanDerWaalsContact O-CB 3.31Å; S300-A304 WeakPolarHBondContact O-CB 3.41Å; S300-A304 PolarHBondContact O-N 2.95Å; I301-A304 CarbonylContact O-C 3.04Å; I301-A304 WeakPolarHBondContact O-CA 3.21Å; I301-A304 PolarHBondContact O-N 3.49Å; M302-A304 VanDerWaalsContact C-N 3.26Å; M302-A304 PolarHBondContact O-N 3.5Å; A304-V306 VanDerWaalsContact C-N 3.26Å; A304-V306 PolarHBondContact O-N 2.83Å; A304-P307 VanDerWaalsContact O-CD 3.25Å; A304-P307 WeakPolarHBondContact O-CD 3.27Å; A304-P307 WeakPolarHBondContact O-CG 3.22Å; A304-L473 HydrophobicContact CB-CD1 4.24Å; A304-L473 HydrophobicContact CB-CD2 3.28Å; A304-L473 HydrophobicContact CB-CG 3.67Å; A304-L473 WeakPolarHBondContact O-CD1 3.3Å; A304-E476 HydrophobicContact CB-CB 4.11Å; A304-F477 HydrophobicContact CB-CE1 4.44Å
305	M	71.9	Confident	72.9	Confident	53 Å²	53	58.1 Å²	58.1	26%	0.261	30%	0.304	S	S	.	.	H	α-helix	trans	-64.8	-25.6	168.2	-165.8	-174.2	-173.8	0	0	113.4	I301 M302 L308 L309 I2475 E2476	I301-M305 PolarHBondContact O-N 2.99Å; M302-M305 PolarHBondContact O-N 3.27Å; M305-L308 HydrophobicContact CG-CD1 4.47Å; M305-L308 WeakPolarHBondContact O-CB 3.07Å; M305-L308 PolarHBondContact O-N 2.97Å; M305-L309 PolarHBondContact O-N 2.71Å; M305-I2475 WeakPolarHBondContact CE-O 3.42Å; M305-E2476 HydrophobicContact CE-CG 4Å
306	V	75.1	Confident	73.7	Confident	106 Å²	106	57.5 Å²	57.5	64%	0.642	30%	0.303	S	S	*	.	H	α-helix	trans	-61.4	-52.2	-178.8	-178.8	0	0	0	0	113.1	A304 L308 L309	A304-V306 VanDerWaalsContact C-N 3.26Å; A304-V306 PolarHBondContact O-N 2.83Å; V306-L308 VanDerWaalsContact C-N 3.28Å; V306-L308 PolarHBondContact O-N 2.71Å; V306-L309 PolarHBondContact O-N 3.25Å
307	P	68	Low	74.6	Confident	37 Å²	37	54.2 Å²	54.2	24%	0.24	28%	0.281	C	S	.	.	H	α-helix	trans	-69.1	-21.3	175.1	26.1	-35	0	0	0	113.9	A304 L309 H310 V472 E476	A304-P307 VanDerWaalsContact O-CD 3.25Å; A304-P307 WeakPolarHBondContact O-CD 3.27Å; A304-P307 WeakPolarHBondContact O-CG 3.22Å; P307-L309 VanDerWaalsContact C-N 3.29Å; P307-L309 PolarHBondContact O-N 3.06Å; P307-H310 PolarHBondContact O-N 2.86Å; P307-V472 HydrophobicContact CB-CG1 3.83Å; P307-V472 HydrophobicContact CG-CG1 3.97Å; P307-E476 HydrophobicContact CG-CG 3.93Å
308	L	73.2	Confident	75.5	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-32.2	173	-65.7	176.4	0	0	0	113.4	M305 V306 H310 I311 A312 V469 L473 H2473 D2474	M305-L308 HydrophobicContact CG-CD1 4.47Å; M305-L308 WeakPolarHBondContact O-CB 3.07Å; M305-L308 PolarHBondContact O-N 2.97Å; V306-L308 VanDerWaalsContact C-N 3.28Å; V306-L308 PolarHBondContact O-N 2.71Å; L308-H310 PolarHBondContact O-N 3.4Å; L308-H310 VanDerWaalsContact O-N 3.13Å; L308-I311 HydrophobicContact CD2-CD1 3.59Å; L308-I311 CarbonylContact O-C 3.54Å; L308-I311 VanDerWaalsContact O-CA 3.29Å; L308-I311 WeakPolarHBondContact O-CA 3.35Å; L308-I311 VanDerWaalsContact O-CB 3.23Å; L308-I311 WeakPolarHBondContact O-CB 3.49Å; L308-I311 PolarHBondContact O-N 3.1Å; L308-A312 PolarHBondContact O-N 2.96Å; L308-V469 HydrophobicContact CD2-CG1 3.59Å; L308-L473 HydrophobicContact CD1-CD1 3.58Å; L308-L473 HydrophobicContact CD2-CD1 3.23Å; L308-L473 HydrophobicContact CG-CD1 3.34Å; L308-H2473 HydrophobicContact CD1-CB 3.4Å; L308-H2473 VanDerWaalsContact CD1-O 3.27Å; L308-H2473 WeakPolarHBondContact CD1-O 3.32Å; L308-H2473 HydrophobicContact CD2-CB 4.41Å; L308-H2473 WeakPolarHBondContact CD2-O 3.36Å; L308-H2473 HydrophobicContact CG-CB 4.46Å; L308-D2474 HydrophobicContact CD1-CB 4.36Å
309	L	74.6	Confident	76.6	Confident	116 Å²	116	51.4 Å²	51.4	61%	0.607	27%	0.266	S	S	*	.	H	α-helix	trans	-58	-33.2	-176.8	-169.5	152.8	0	0	0	111.4	M305 V306 P307 I311 L313	M305-L309 PolarHBondContact O-N 2.71Å; V306-L309 PolarHBondContact O-N 3.25Å; P307-L309 VanDerWaalsContact C-N 3.29Å; P307-L309 PolarHBondContact O-N 3.06Å; L309-I311 VanDerWaalsContact C-N 3.32Å; L309-I311 PolarHBondContact O-N 3.28Å; L309-L313 VanDerWaalsContact O-CB 3.29Å; L309-L313 WeakPolarHBondContact O-CB 3.49Å; L309-L313 PolarHBondContact O-N 2.93Å; L309-L313 VanDerWaalsContact O-N 3.16Å
310	H	75.4	Confident	77.6	Confident	100 Å²	100	49.1 Å²	49.1	46%	0.463	25%	0.253	S	S	.	.	H	α-helix	trans	-69.2	-26.3	172.2	-65.8	-37.6	0	0	0	114.1	P307 L308	P307-H310 PolarHBondContact O-N 2.86Å; L308-H310 PolarHBondContact O-N 3.4Å; L308-H310 VanDerWaalsContact O-N 3.13Å
311	I	79.1	Confident	78.5	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-79.9	-55	175.6	-49.8	173.4	0	0	0	109.9	L308 L309 L313 L314 V315 L468 V469 V472	L308-I311 HydrophobicContact CD2-CD1 3.59Å; L308-I311 CarbonylContact O-C 3.54Å; L308-I311 VanDerWaalsContact O-CA 3.29Å; L308-I311 WeakPolarHBondContact O-CA 3.35Å; L308-I311 VanDerWaalsContact O-CB 3.23Å; L308-I311 WeakPolarHBondContact O-CB 3.49Å; L308-I311 PolarHBondContact O-N 3.1Å; L309-I311 VanDerWaalsContact C-N 3.32Å; L309-I311 PolarHBondContact O-N 3.28Å; I311-L313 PolarHBondContact O-N 2.86Å; I311-L314 CarbonylContact O-C 3.51Å; I311-L314 VanDerWaalsContact O-CA 3.3Å; I311-L314 WeakPolarHBondContact O-CA 3.34Å; I311-L314 VanDerWaalsContact O-CB 3.3Å; I311-L314 WeakPolarHBondContact O-CB 3.46Å; I311-L314 PolarHBondContact O-N 3.48Å; I311-V315 HydrophobicContact CG2-CG2 4.22Å; I311-V315 WeakPolarHBondContact O-CG2 3.47Å; I311-V315 PolarHBondContact O-N 2.97Å; I311-L468 HydrophobicContact CB-CD2 4.04Å; I311-L468 HydrophobicContact CD1-CD2 3.98Å; I311-L468 HydrophobicContact CG1-CD2 3.64Å; I311-L468 HydrophobicContact CG2-CD2 3.46Å; I311-L468 VanDerWaalsContact CG2-CD2 3.46Å; I311-V469 HydrophobicContact CD1-CB 4.5Å; I311-V469 HydrophobicContact CD1-CG1 4.02Å; I311-V469 HydrophobicContact CG2-CB 4.29Å; I311-V469 HydrophobicContact CG2-CG1 4.15Å; I311-V469 HydrophobicContact CG2-CG2 3.73Å; I311-V472 HydrophobicContact CD1-CB 3.65Å; I311-V472 HydrophobicContact CD1-CG1 3.92Å; I311-V472 HydrophobicContact CD1-CG2 3.5Å; I311-V472 HydrophobicContact CG1-CG2 4.27Å
312	A	79.3	Confident	79.6	Confident	23 Å²	23	50.6 Å²	50.6	19%	0.19	26%	0.257	C	S	.	.	H	α-helix	trans	-53.5	-40.4	-179.9	0	0	0	0	0	111.5	L308 L314 V315 I316	L308-A312 PolarHBondContact O-N 2.96Å; A312-L314 PolarHBondContact O-N 3.47Å; A312-V315 PolarHBondContact O-N 3.25Å; A312-V315 VanDerWaalsContact O-N 3.15Å; A312-I316 WeakPolarHBondContact O-CB 3.13Å; A312-I316 VanDerWaalsContact O-CG1 3.27Å; A312-I316 WeakPolarHBondContact O-CG1 3.43Å; A312-I316 PolarHBondContact O-N 2.86Å
313	L	80.1	Confident	80.5	Confident	83 Å²	83	45.5 Å²	45.5	44%	0.435	23%	0.232	S	C	.	.	H	α-helix	trans	-59.6	-42	172.5	-163.5	171.5	0	0	0	112.2	L309 I311 F317 I1463	L309-L313 VanDerWaalsContact O-CB 3.29Å; L309-L313 WeakPolarHBondContact O-CB 3.49Å; L309-L313 PolarHBondContact O-N 2.93Å; L309-L313 VanDerWaalsContact O-N 3.16Å; I311-L313 PolarHBondContact O-N 2.86Å; L313-F317 VanDerWaalsContact O-CB 3.25Å; L313-F317 WeakPolarHBondContact O-CB 3.13Å; L313-F317 PolarHBondContact O-N 3.11Å; L313-I1463 HydrophobicContact CD1-CD1 4.44Å; L313-I1463 HydrophobicContact CD2-CD1 3.76Å
314	L	80.4	Confident	81.5	Confident	17 Å²	17	38 Å²	38	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-65.4	-40.7	172.4	177.5	153.4	0	0	0	111.9	I311 A312 F317 V318 V465 I1463 L1466	I311-L314 CarbonylContact O-C 3.51Å; I311-L314 VanDerWaalsContact O-CA 3.3Å; I311-L314 WeakPolarHBondContact O-CA 3.34Å; I311-L314 VanDerWaalsContact O-CB 3.3Å; I311-L314 WeakPolarHBondContact O-CB 3.46Å; I311-L314 PolarHBondContact O-N 3.48Å; A312-L314 PolarHBondContact O-N 3.47Å; L314-F317 PolarHBondContact O-N 3Å; L314-V318 HydrophobicContact CD2-CG2 4.18Å; L314-V318 WeakPolarHBondContact O-CG2 3.24Å; L314-V318 PolarHBondContact O-N 3Å; L314-V465 HydrophobicContact CD2-CG2 4.35Å; L314-I1463 HydrophobicContact CD1-CG2 4.11Å; L314-L1466 HydrophobicContact CD1-CD2 3.69Å
315	V	82.3	Confident	82.4	Confident	24 Å²	24	39 Å²	39	15%	0.145	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-51.7	177.5	-171.3	0	0	0	0	110.8	I311 A312 F317 V318 I319 V465	I311-V315 HydrophobicContact CG2-CG2 4.22Å; I311-V315 WeakPolarHBondContact O-CG2 3.47Å; I311-V315 PolarHBondContact O-N 2.97Å; A312-V315 PolarHBondContact O-N 3.25Å; A312-V315 VanDerWaalsContact O-N 3.15Å; V315-F317 PolarHBondContact O-N 3.45Å; V315-V318 PolarHBondContact O-N 3.42Å; V315-V318 VanDerWaalsContact O-N 3.1Å; V315-I319 HydrophobicContact CG1-CD1 3.92Å; V315-I319 HydrophobicContact CG1-CG1 4.48Å; V315-I319 WeakPolarHBondContact O-CG1 3.26Å; V315-I319 PolarHBondContact O-N 3.32Å; V315-V465 HydrophobicContact CB-CG1 4.25Å; V315-V465 HydrophobicContact CG1-CG1 3.91Å; V315-V465 HydrophobicContact CG1-CG2 4.39Å; V315-V465 HydrophobicContact CG2-CB 4.35Å; V315-V465 HydrophobicContact CG2-CG1 3.34Å; V315-V465 HydrophobicContact CG2-CG2 4.09Å
316	I	84.7	Confident	83.3	Confident	67 Å²	67	36.4 Å²	36.4	34%	0.344	20%	0.197	S	C	.	.	H	α-helix	trans	-56.6	-41.5	176.6	-68.5	163.9	0	0	0	110.2	A312 I319 I320	A312-I316 WeakPolarHBondContact O-CB 3.13Å; A312-I316 VanDerWaalsContact O-CG1 3.27Å; A312-I316 WeakPolarHBondContact O-CG1 3.43Å; A312-I316 PolarHBondContact O-N 2.86Å; I316-I319 PolarHBondContact O-N 2.83Å; I316-I320 HydrophobicContact CG2-CD1 3.77Å; I316-I320 HydrophobicContact CG2-CG1 4.45Å; I316-I320 WeakPolarHBondContact O-CB 3.38Å; I316-I320 WeakPolarHBondContact O-CD1 3.37Å; I316-I320 WeakPolarHBondContact O-CG1 3.44Å; I316-I320 PolarHBondContact O-N 2.92Å
317	F	84.4	Confident	84	Confident	28 Å²	28	31.4 Å²	31.4	12%	0.123	17%	0.166	C	C	.	.	H	α-helix	trans	-66.3	-38.4	177.4	-173.4	-93.9	0	0	0	113.4	L313 L314 V315 I320 I321 L1453 L1456 L1457	L313-F317 VanDerWaalsContact O-CB 3.25Å; L313-F317 WeakPolarHBondContact O-CB 3.13Å; L313-F317 PolarHBondContact O-N 3.11Å; L314-F317 PolarHBondContact O-N 3Å; V315-F317 PolarHBondContact O-N 3.45Å; F317-I320 PolarHBondContact O-N 2.93Å; F317-I321 HydrophobicContact CD1-CD1 3.94Å; F317-I321 HydrophobicContact CE1-CD1 3.37Å; F317-I321 HydrophobicContact CE1-CG1 4.3Å; F317-I321 HydrophobicContact CZ-CD1 3.94Å; F317-I321 PolarHBondContact O-N 3.4Å; F317-I321 VanDerWaalsContact O-N 3.14Å; F317-L1453 HydrophobicContact CE2-CD2 4.06Å; F317-L1453 HydrophobicContact CZ-CB 4.18Å; F317-L1453 HydrophobicContact CZ-CD2 4.36Å; F317-L1453 WeakPolarHBondContact CZ-O 3.23Å; F317-L1456 HydrophobicContact CE2-CB 4.12Å; F317-L1456 HydrophobicContact CE2-CD1 3.98Å; F317-L1456 HydrophobicContact CZ-CB 4.27Å; F317-L1457 HydrophobicContact CD1-CD1 4.35Å; F317-L1457 HydrophobicContact CD1-CD2 3.62Å; F317-L1457 HydrophobicContact CD1-CG 4.09Å; F317-L1457 HydrophobicContact CE1-CD1 3.8Å; F317-L1457 HydrophobicContact CE1-CD2 3.58Å; F317-L1457 HydrophobicContact CE1-CG 3.51Å; F317-L1457 HydrophobicContact CG-CD2 4.3Å; F317-L1457 HydrophobicContact CZ-CD2 4.24Å; F317-L1457 HydrophobicContact CZ-CG 4.05Å
318	V	85.7	Confident	84.9	Confident	23 Å²	23	30.3 Å²	30.3	14%	0.139	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-45.6	173.2	169.6	0	0	0	0	110.7	L314 V315 I320 I321 Y322 I460	L314-V318 HydrophobicContact CD2-CG2 4.18Å; L314-V318 WeakPolarHBondContact O-CG2 3.24Å; L314-V318 PolarHBondContact O-N 3Å; V315-V318 PolarHBondContact O-N 3.42Å; V315-V318 VanDerWaalsContact O-N 3.1Å; V318-I320 VanDerWaalsContact C-N 3.34Å; V318-I320 PolarHBondContact O-N 3.49Å; V318-I321 PolarHBondContact O-N 2.68Å; V318-Y322 HydrophobicContact CG1-CD2 3.87Å; V318-Y322 HydrophobicContact CG1-CE2 4.12Å; V318-Y322 WeakPolarHBondContact O-CD2 3.48Å; V318-Y322 PolarHBondContact O-N 2.86Å; V318-I460 HydrophobicContact CG1-CG2 4.21Å
319	I	90.1	Very high	85.5	Confident	8 Å²	8	31.6 Å²	31.6	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-56.4	-47.2	175	-70.1	166.8	0	0	0	110.6	V315 I316 I321 Y322 A323 M422 V425 F426 I429	V315-I319 HydrophobicContact CG1-CD1 3.92Å; V315-I319 HydrophobicContact CG1-CG1 4.48Å; V315-I319 WeakPolarHBondContact O-CG1 3.26Å; V315-I319 PolarHBondContact O-N 3.32Å; I316-I319 PolarHBondContact O-N 2.83Å; I319-I321 VanDerWaalsContact C-N 3.33Å; I319-I321 PolarHBondContact O-N 3.06Å; I319-Y322 PolarHBondContact O-N 3.13Å; I319-A323 VanDerWaalsContact O-CB 3.23Å; I319-A323 WeakPolarHBondContact O-CB 3.29Å; I319-A323 PolarHBondContact O-N 3.12Å; I319-M422 HydrophobicContact CG2-CE 4.11Å; I319-M422 HydrophobicContact CG2-CG 3.71Å; I319-M422 HydrophobicContact CG2-SD 4.47Å; I319-V425 HydrophobicContact CB-CG1 4.44Å; I319-V425 HydrophobicContact CG1-CG1 4.5Å; I319-V425 HydrophobicContact CG2-CG1 4.09Å; I319-F426 HydrophobicContact CD1-CD2 4.25Å; I319-I429 HydrophobicContact CG1-CD1 3.77Å
320	I	89.9	Confident	86.2	Confident	42 Å²	42	26.7 Å²	26.7	22%	0.215	14%	0.138	C	C	.	.	H	α-helix	trans	-59.9	-41.5	178.8	-70.9	165.8	0	0	0	111.6	I316 F317 V318 I324 F418	I316-I320 HydrophobicContact CG2-CD1 3.77Å; I316-I320 HydrophobicContact CG2-CG1 4.45Å; I316-I320 WeakPolarHBondContact O-CB 3.38Å; I316-I320 WeakPolarHBondContact O-CD1 3.37Å; I316-I320 WeakPolarHBondContact O-CG1 3.44Å; I316-I320 PolarHBondContact O-N 2.92Å; F317-I320 PolarHBondContact O-N 2.93Å; V318-I320 VanDerWaalsContact C-N 3.34Å; V318-I320 PolarHBondContact O-N 3.49Å; I320-I324 HydrophobicContact CG2-CD1 3.83Å; I320-I324 WeakPolarHBondContact O-CG1 3.3Å; I320-I324 PolarHBondContact O-N 3.04Å; I320-F418 HydrophobicContact CG1-CZ 4.21Å; I320-F418 HydrophobicContact CG2-CE2 4.39Å
321	I	89.5	Confident	86.7	Confident	31 Å²	31	23.1 Å²	23.1	16%	0.159	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-52.6	175.4	-73.9	173	0	0	0	110.5	F317 V318 I319 A323 I324 V325 L1453 V1454	F317-I321 HydrophobicContact CD1-CD1 3.94Å; F317-I321 HydrophobicContact CE1-CD1 3.37Å; F317-I321 HydrophobicContact CE1-CG1 4.3Å; F317-I321 HydrophobicContact CZ-CD1 3.94Å; F317-I321 PolarHBondContact O-N 3.4Å; F317-I321 VanDerWaalsContact O-N 3.14Å; V318-I321 PolarHBondContact O-N 2.68Å; I319-I321 VanDerWaalsContact C-N 3.33Å; I319-I321 PolarHBondContact O-N 3.06Å; I321-A323 VanDerWaalsContact C-N 3.3Å; I321-A323 PolarHBondContact O-N 3.09Å; I321-I324 PolarHBondContact O-N 3.03Å; I321-V325 HydrophobicContact CG2-CG2 4.41Å; I321-V325 WeakPolarHBondContact O-CG2 3.46Å; I321-V325 PolarHBondContact O-N 3.46Å; I321-L1453 HydrophobicContact CD1-CB 4.26Å; I321-L1453 HydrophobicContact CG1-CB 4.12Å; I321-L1453 HydrophobicContact CG1-CD1 3.8Å; I321-V1454 HydrophobicContact CD1-CG2 4.24Å
322	Y	91.8	Very high	86.8	Confident	29 Å²	29	23.8 Å²	23.8	11%	0.114	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-33.8	-178.1	-86.6	-83.6	0	0	0	112.6	V318 I319 V325 G326 Y453 S456 M457	V318-Y322 HydrophobicContact CG1-CD2 3.87Å; V318-Y322 HydrophobicContact CG1-CE2 4.12Å; V318-Y322 WeakPolarHBondContact O-CD2 3.48Å; V318-Y322 PolarHBondContact O-N 2.86Å; I319-Y322 PolarHBondContact O-N 3.13Å; Y322-V325 PolarHBondContact O-N 3.29Å; Y322-G326 PolarHBondContact O-N 2.88Å; Y322-Y453 HydrophobicContact CD1-CD2 4.02Å; Y322-Y453 AromaticContact CD1-CE2 3.61Å; Y322-Y453 HydrophobicContact CD1-CE2 3.61Å; Y322-Y453 HydrophobicContact CE1-CD2 4.28Å; Y322-Y453 HydrophobicContact CE1-CE2 4.32Å; Y322-Y453 PolarHBondContact O-OH 3.26Å; Y322-S456 PolarHBondContact OH-O 3.5Å; Y322-S456 PolarHBondContact OH-OG 2.89Å; Y322-M457 HydrophobicContact CD1-CB 3.67Å; Y322-M457 HydrophobicContact CD1-CG 3.78Å; Y322-M457 HydrophobicContact CD1-SD 3.96Å; Y322-M457 HydrophobicContact CD2-CG 4.47Å; Y322-M457 HydrophobicContact CE1-CB 3.51Å; Y322-M457 HydrophobicContact CE1-CG 4.1Å; Y322-M457 HydrophobicContact CG-CB 4.34Å; Y322-M457 HydrophobicContact CG-CG 4Å; Y322-M457 HydrophobicContact CG-SD 4.2Å; Y322-M457 PolarHBondContact OH-N 3.22Å
323	A	93.1	Very high	87	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-68.7	-40.5	175.8	0	0	0	0	0	112.8	I319 I321 G326 L327 F418 S421 M422 V425	I319-A323 VanDerWaalsContact O-CB 3.23Å; I319-A323 WeakPolarHBondContact O-CB 3.29Å; I319-A323 PolarHBondContact O-N 3.12Å; I321-A323 VanDerWaalsContact C-N 3.3Å; I321-A323 PolarHBondContact O-N 3.09Å; A323-G326 PolarHBondContact O-N 3.45Å; A323-L327 VanDerWaalsContact O-CB 3.26Å; A323-L327 WeakPolarHBondContact O-CB 3.41Å; A323-L327 PolarHBondContact O-N 3.07Å; A323-F418 HydrophobicContact CB-CD2 4.5Å; A323-F418 HydrophobicContact CB-CE2 4.29Å; A323-S421 VanDerWaalsContact CA-OG 3.27Å; A323-S421 WeakPolarHBondContact CA-OG 3.46Å; A323-S421 PolarHBondContact O-OG 2.93Å; A323-M422 HydrophobicContact CB-CB 4.18Å; A323-V425 HydrophobicContact CB-CG2 4.38Å
324	I	91.4	Very high	87.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-71.7	-36.5	175.4	-65.5	167.7	0	0	0	110.7	I320 I321 L327 E328 F418 T1363 L1366 A1367 V1450 L1453	I320-I324 HydrophobicContact CG2-CD1 3.83Å; I320-I324 WeakPolarHBondContact O-CG1 3.3Å; I320-I324 PolarHBondContact O-N 3.04Å; I321-I324 PolarHBondContact O-N 3.03Å; I324-L327 PolarHBondContact O-N 3.45Å; I324-E328 WeakPolarHBondContact O-CG 3.43Å; I324-E328 PolarHBondContact O-N 2.96Å; I324-F418 HydrophobicContact CD1-CE2 4.28Å; I324-F418 HydrophobicContact CG1-CD2 3.96Å; I324-F418 HydrophobicContact CG1-CE2 3.91Å; I324-T1363 HydrophobicContact CD1-CG2 4.06Å; I324-L1366 HydrophobicContact CG2-CB 3.92Å; I324-A1367 HydrophobicContact CD1-CB 4.27Å; I324-A1367 HydrophobicContact CG1-CB 4.43Å; I324-V1450 HydrophobicContact CB-CG1 4.12Å; I324-V1450 HydrophobicContact CG2-CB 4.44Å; I324-V1450 HydrophobicContact CG2-CG1 3.77Å; I324-V1450 HydrophobicContact CG2-CG2 3.84Å; I324-L1453 HydrophobicContact CD1-CD1 4Å
325	V	90.3	Very high	87.8	Confident	23 Å²	23	22.4 Å²	22.4	14%	0.139	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-44.9	171.9	170.5	0	0	0	0	111.1	I321 Y322 E328 L329 Y453 L1447 V1450	I321-V325 HydrophobicContact CG2-CG2 4.41Å; I321-V325 WeakPolarHBondContact O-CG2 3.46Å; I321-V325 PolarHBondContact O-N 3.46Å; Y322-V325 PolarHBondContact O-N 3.29Å; V325-E328 PolarHBondContact O-N 2.8Å; V325-L329 HydrophobicContact CG1-CD1 3.73Å; V325-L329 HydrophobicContact CG1-CG 4.37Å; V325-L329 WeakPolarHBondContact O-CB 3.36Å; V325-L329 WeakPolarHBondContact O-CG 3.46Å; V325-L329 PolarHBondContact O-N 2.84Å; V325-Y453 HydrophobicContact CB-CE2 4.04Å; V325-Y453 HydrophobicContact CG1-CD2 3.7Å; V325-Y453 HydrophobicContact CG1-CE2 3.6Å; V325-L1447 HydrophobicContact CB-CD2 4.41Å; V325-L1447 HydrophobicContact CG1-CD2 3.86Å; V325-L1447 HydrophobicContact CG2-CD2 4.2Å; V325-V1450 HydrophobicContact CG2-CB 4.42Å; V325-V1450 HydrophobicContact CG2-CG1 3.99Å
326	G	90	Very high	87.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-44.3	176.2	0	0	0	0	0	112.8	Y322 A323 E328 L329 F330	Y322-G326 PolarHBondContact O-N 2.88Å; A323-G326 PolarHBondContact O-N 3.45Å; G326-E328 VanDerWaalsContact C-N 3.28Å; G326-E328 PolarHBondContact O-N 2.71Å; G326-L329 PolarHBondContact O-N 3.46Å; G326-F330 PolarHBondContact O-N 2.77Å
327	L	90.8	Very high	87.9	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62	-31.1	175	-177.8	65.5	0	0	0	112.8	A323 I324 S331 F415 F418 K1369	A323-L327 VanDerWaalsContact O-CB 3.26Å; A323-L327 WeakPolarHBondContact O-CB 3.41Å; A323-L327 PolarHBondContact O-N 3.07Å; I324-L327 PolarHBondContact O-N 3.45Å; L327-S331 WeakPolarHBondContact O-CB 3.37Å; L327-F415 WeakPolarHBondContact CD1-O 3.43Å; L327-F418 HydrophobicContact CD2-CB 4.13Å; L327-K1369 HydrophobicContact CD2-CB 4.26Å; L327-K1369 HydrophobicContact CG-CB 4.42Å; L327-K1369 HydrophobicContact CG-CD 4.39Å; L327-K1369 PolarHBondContact O-NZ 3.39Å
328	E	87.4	Confident	87.9	Confident	14 Å²	14	17 Å²	17	7%	0.065	9%	0.091	C	C	.	.	H	α-helix	trans	-81.4	-31.1	175.4	-73	-69.2	-164.9	0	0	114.1	I324 V325 G326 K1369 V1450	I324-E328 WeakPolarHBondContact O-CG 3.43Å; I324-E328 PolarHBondContact O-N 2.96Å; V325-E328 PolarHBondContact O-N 2.8Å; G326-E328 VanDerWaalsContact C-N 3.28Å; G326-E328 PolarHBondContact O-N 2.71Å; E328-K1369 IonicContact OE2-NZ 3.5Å; E328-K1369 PolarHBondContact OE2-NZ 2.87Å; E328-V1450 HydrophobicContact CG-CG2 4.39Å
329	L	85.9	Confident	87.4	Confident	34 Å²	34	16.5 Å²	16.5	18%	0.178	9%	0.086	C	C	.	.	H	α-helix	trans	-88.6	-41.4	-178.6	-66	176.6	0	0	0	114	V325 G326 N1443 L1447	V325-L329 HydrophobicContact CG1-CD1 3.73Å; V325-L329 HydrophobicContact CG1-CG 4.37Å; V325-L329 WeakPolarHBondContact O-CB 3.36Å; V325-L329 WeakPolarHBondContact O-CG 3.46Å; V325-L329 PolarHBondContact O-N 2.84Å; G326-L329 PolarHBondContact O-N 3.46Å; L329-N1443 HydrophobicContact CD2-CB 4.27Å; L329-L1447 HydrophobicContact CD1-CD2 4.43Å; L329-L1447 HydrophobicContact CD2-CD2 4.18Å; L329-L1447 HydrophobicContact CG-CD2 4.19Å
330	F	87.9	Confident	86.6	Confident	13 Å²	13	17.9 Å²	17.9	6%	0.057	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-4.7	-161.5	-49.1	-48.8	0	0	0	115.4	G326 G332 K333 F415 V441 Y453	G326-F330 PolarHBondContact O-N 2.77Å; F330-G332 PolarHBondContact O-N 2.75Å; F330-K333 VanDerWaalsContact O-CB 3.29Å; F330-K333 WeakPolarHBondContact O-CB 3.34Å; F330-K333 WeakPolarHBondContact O-CG 3.38Å; F330-K333 PolarHBondContact O-N 3.49Å; F330-K333 VanDerWaalsContact O-N 3.17Å; F330-F415 HydrophobicContact CB-CB 3.87Å; F330-F415 HydrophobicContact CB-CD2 3.85Å; F330-F415 HydrophobicContact CB-CG 3.94Å; F330-F415 HydrophobicContact CD2-CD1 4.38Å; F330-F415 HydrophobicContact CD2-CD2 4.08Å; F330-F415 HydrophobicContact CD2-CE1 4.44Å; F330-F415 HydrophobicContact CD2-CE2 4.14Å; F330-F415 HydrophobicContact CD2-CG 4.21Å; F330-F415 HydrophobicContact CD2-CZ 4.33Å; F330-F415 HydrophobicContact CG-CD2 4.4Å; F330-V441 HydrophobicContact CD1-CG1 3.64Å; F330-V441 HydrophobicContact CE1-CG1 3.42Å; F330-V441 VanDerWaalsContact CE1-CG1 3.42Å; F330-V441 HydrophobicContact CE2-CG1 4.36Å; F330-V441 HydrophobicContact CG-CG1 4.22Å; F330-V441 HydrophobicContact CZ-CG1 3.81Å; F330-Y453 AromaticContact CE2-CD1 3.92Å; F330-Y453 HydrophobicContact CE2-CD1 3.92Å; F330-Y453 HydrophobicContact CE2-CE1 4.02Å; F330-Y453 HydrophobicContact CE2-CG 4.19Å; F330-Y453 HydrophobicContact CZ-CD1 4.49Å
331	S	86.6	Confident	85.7	Confident	25 Å²	25	23 Å²	23	18%	0.175	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	130.2	175	173.7	0	0	0	0	112.2	L327 K333 F415	L327-S331 WeakPolarHBondContact O-CB 3.37Å; S331-K333 VanDerWaalsContact C-N 3.29Å; S331-K333 PolarHBondContact O-N 3.08Å; S331-F415 WeakPolarHBondContact CA-O 3.37Å; S331-F415 WeakPolarHBondContact CB-O 3.35Å
332	G	80.4	Confident	84.6	Confident	16 Å²	16	26.9 Å²	26.9	17%	0.165	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	21.2	-179.8	0	0	0	0	0	114.6	F330 D416	F330-G332 PolarHBondContact O-N 2.75Å; G332-D416 PolarHBondContact N-OD1 3.35Å
333	K	84.9	Confident	83.5	Confident	79 Å²	79	27.8 Å²	27.8	34%	0.343	14%	0.144	S	C	.	.			trans	-101.2	-15.9	179.4	-60.5	-52.3	-169.2	-175.3	0	115	F330 S331	F330-K333 VanDerWaalsContact O-CB 3.29Å; F330-K333 WeakPolarHBondContact O-CB 3.34Å; F330-K333 WeakPolarHBondContact O-CG 3.38Å; F330-K333 PolarHBondContact O-N 3.49Å; F330-K333 VanDerWaalsContact O-N 3.17Å; S331-K333 VanDerWaalsContact C-N 3.29Å; S331-K333 PolarHBondContact O-N 3.08Å
334	L	88.4	Confident	82.2	Confident	2 Å²	2	29 Å²	29	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	-103.1	12.9	-170.8	-60.6	175.7	0	0	0	114	P352 W405 G407 F415 W440 V441	L334-P352 HydrophobicContact CD2-CB 4.02Å; L334-P352 HydrophobicContact CD2-CG 4.03Å; L334-W405 VanDerWaalsContact O-CE3 3.3Å; L334-W405 WeakPolarHBondContact O-CZ3 3.32Å; L334-G407 WeakPolarHBondContact O-CA 3.3Å; L334-F415 HydrophobicContact CD1-CD2 4.18Å; L334-W440 HydrophobicContact CD2-CB 4.43Å; L334-V441 HydrophobicContact CD2-CG2 4.49Å
335	H	87.4	Confident	81.2	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.056	17%	0.171	C	C	.	.			trans	-96.4	-11.5	176.5	-57.4	-58.7	0	0	0	114.1	R404 W405 V406 D416 E1371	H335-R404 PolarHBondContact CD2-NH2 3.36Å; H335-W405 PolarHBondContact ND1-O 3.31Å; H335-V406 PolarHBondContact CE1-O 3.15Å; H335-V406 PolarHBondContact ND1-O 3Å; H335-D416 IonicContact CE1-OD2 3.97Å; H335-D416 PolarHBondContact CE1-OD2 3.23Å; H335-D416 IonicContact NE2-OD1 2.75Å; H335-D416 IonicContact NE2-OD2 3.22Å; H335-D416 PolarHBondContact NE2-OD2 3.28Å; H335-E1371 IonicContact CD2-OE1 3.58Å; H335-E1371 IonicContact NE2-OE2 3.42Å
336	A	84.1	Confident	80.5	Confident	6 Å²	6	33.1 Å²	33.1	5%	0.05	18%	0.175	C	C	.	.			trans	-80.5	123.6	176.8	0	0	0	0	0	109.6	P352 C353 L355 Y369 D370	A336-P352 CarbonylContact O-C 3.49Å; A336-P352 VanDerWaalsContact O-CA 3.29Å; A336-P352 WeakPolarHBondContact O-CA 3.08Å; A336-C353 VanDerWaalsContact C-SG 3.54Å; A336-C353 WeakPolarHBondContact CB-O 3.46Å; A336-C353 PolarHBondContact O-N 2.79Å; A336-L355 HydrophobicContact CB-CD2 4.38Å; A336-L355 HydrophobicContact CB-CG 4.35Å; A336-Y369 CarbonylContact C-O 3.48Å; A336-Y369 VanDerWaalsContact CA-O 3.25Å; A336-Y369 WeakPolarHBondContact CA-O 3.29Å; A336-D370 HydrophobicContact CB-CB 4.1Å
337	T	84.9	Confident	79.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	174.4	176.2	-165.6	0	0	0	0	110.7	Y339 I346 P350 S351 C353 C368 Y369 W405	T337-Y339 HydrophobicContact CG2-CD2 4.1Å; T337-Y339 HydrophobicContact CG2-CE2 3.49Å; T337-Y339 VanDerWaalsContact CG2-CE2 3.49Å; T337-Y339 WeakPolarHBondContact O-CD2 3.24Å; T337-I346 HydrophobicContact CG2-CG1 4.21Å; T337-I346 HydrophobicContact CG2-CG2 3.8Å; T337-P350 WeakPolarHBondContact OG1-CA 3.32Å; T337-S351 PolarHBondContact OG1-O 2.9Å; T337-C353 VanDerWaalsContact CA-SG 3.52Å; T337-C353 PolarHBondContact N-SG 2.73Å; T337-C353 PolarHBondContact O-SG 2.96Å; T337-C353 VanDerWaalsContact O-SG 3.35Å; T337-C368 WeakPolarHBondContact O-CA 3.26Å; T337-Y369 PolarHBondContact N-O 3.42Å; T337-Y369 PolarHBondContact O-N 3.27Å; T337-W405 HydrophobicContact CG2-CB 3.79Å; T337-W405 HydrophobicContact CG2-CD2 4.08Å; T337-W405 HydrophobicContact CG2-CE3 4.02Å; T337-W405 HydrophobicContact CG2-CG 4.01Å
338	C	84.4	Confident	78.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	127.7	176.8	-55	0	0	0	0	109.2	E347 C362 I367	C338-E347 HydrophobicContact CB-CB 3.96Å; C338-E347 WeakPolarHBondContact CB-OE2 3.46Å; C338-E347 WeakPolarHBondContact O-CB 3.43Å; C338-E347 PolarHBondContact O-N 2.81Å; C338-C362 HydrophobicContact CB-CB 3.76Å; C338-C362 WeakPolarHBondContact CB-SG 3.35Å; C338-C362 WeakPolarHBondContact SG-CA 3.43Å; C338-C362 WeakPolarHBondContact SG-CB 3.4Å; C338-C362 CovalentContact SG-SG 2.04Å; C338-C362 PolarHBondContact SG-SG 2.86Å; C338-I367 WeakPolarHBondContact CA-O 3.43Å
339	Y	77	Confident	77.4	Confident	12 Å²	12	39.4 Å²	39.4	5%	0.047	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144.4	173.3	-64.7	-105.9	0	0	0	108.9	T337 E345 I346 T366 I367 Y369 P402 W405	T337-Y339 HydrophobicContact CG2-CD2 4.1Å; T337-Y339 HydrophobicContact CG2-CE2 3.49Å; T337-Y339 VanDerWaalsContact CG2-CE2 3.49Å; T337-Y339 WeakPolarHBondContact O-CD2 3.24Å; Y339-E345 CarbonylContact C-O 3.09Å; Y339-E345 WeakPolarHBondContact CA-O 3.43Å; Y339-E345 WeakPolarHBondContact CB-O 3.09Å; Y339-I346 HydrophobicContact CD1-CG1 3.82Å; Y339-I346 HydrophobicContact CE1-CD1 4.29Å; Y339-I346 HydrophobicContact CE1-CG1 3.42Å; Y339-I346 VanDerWaalsContact CE1-CG1 3.42Å; Y339-T366 CarbonylContact O-C 3.52Å; Y339-T366 VanDerWaalsContact O-CA 3.24Å; Y339-T366 WeakPolarHBondContact O-CA 3.27Å; Y339-I367 PolarHBondContact N-O 3.01Å; Y339-I367 PolarHBondContact O-N 3.18Å; Y339-Y369 WeakPolarHBondContact CE2-O 3.42Å; Y339-P402 HydrophobicContact CE1-CB 4.43Å; Y339-W405 PolarHBondContact OH-N 3.11Å
340	D	73.2	Confident	76.9	Confident	38 Å²	38	38.9 Å²	38.9	20%	0.203	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	135.7	168	163.2	37.5	0	0	0	110.2	I342 T343 G344 E345	D340-I342 VanDerWaalsContact C-N 3.27Å; D340-I342 PolarHBondContact O-N 3.46Å; D340-I342 PolarHBondContact OD1-N 2.96Å; D340-T343 WeakPolarHBondContact CB-OG1 3.32Å; D340-T343 VanDerWaalsContact OD2-CB 3.28Å; D340-T343 WeakPolarHBondContact OD2-CB 3.39Å; D340-T343 VanDerWaalsContact OD2-CG2 3.27Å; D340-T343 WeakPolarHBondContact OD2-CG2 3.23Å; D340-T343 PolarHBondContact OD2-N 3.47Å; D340-T343 PolarHBondContact OD2-OG1 3.44Å; D340-G344 WeakPolarHBondContact O-CA 3.13Å; D340-G344 PolarHBondContact O-N 2.83Å; D340-G344 VanDerWaalsContact O-N 3.12Å; D340-E345 PolarHBondContact N-O 3.16Å
341	F	69.7	Low	76.5	Confident	149 Å²	149	39.4 Å²	39.4	65%	0.654	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-20.1	-178.9	85.9	-82.6	0	0	0	114	A365	F341-A365 WeakPolarHBondContact CD1-O 3.45Å; F341-A365 PolarHBondContact N-O 3.26Å
342	I	66.8	Low	76.5	Confident	113 Å²	113	38.2 Å²	38.2	58%	0.579	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-59.4	-179	-55	-178.7	0	0	0	111.2	D340	D340-I342 VanDerWaalsContact C-N 3.27Å; D340-I342 PolarHBondContact O-N 3.46Å; D340-I342 PolarHBondContact OD1-N 2.96Å
343	T	68.8	Low	76.7	Confident	48 Å²	48	37.6 Å²	37.6	29%	0.294	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-29	-175.2	58.2	0	0	0	0	112.8	D340 E345	D340-T343 WeakPolarHBondContact CB-OG1 3.32Å; D340-T343 VanDerWaalsContact OD2-CB 3.28Å; D340-T343 WeakPolarHBondContact OD2-CB 3.39Å; D340-T343 VanDerWaalsContact OD2-CG2 3.27Å; D340-T343 WeakPolarHBondContact OD2-CG2 3.23Å; D340-T343 PolarHBondContact OD2-N 3.47Å; D340-T343 PolarHBondContact OD2-OG1 3.44Å; T343-E345 PolarHBondContact O-N 3.35Å; T343-E345 WeakPolarHBondContact OG1-CB 3.35Å; T343-E345 PolarHBondContact OG1-N 3Å; T343-E345 VanDerWaalsContact OG1-N 3.15Å
344	G	65.9	Low	76.5	Confident	26 Å²	26	34.7 Å²	34.7	27%	0.268	19%	0.186	S	C	.	.			trans	70	10.9	-167.4	0	0	0	0	0	113.6	D340 P402	D340-G344 WeakPolarHBondContact O-CA 3.13Å; D340-G344 PolarHBondContact O-N 2.83Å; D340-G344 VanDerWaalsContact O-N 3.12Å; G344-P402 WeakPolarHBondContact O-CB 3.3Å
345	E	71.3	Confident	75.7	Confident	64 Å²	64	38.9 Å²	38.9	30%	0.299	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-73.4	157.4	169.5	-66.9	175.1	-177.5	0	0	110.4	Y339 D340 T343 R1213	Y339-E345 CarbonylContact C-O 3.09Å; Y339-E345 WeakPolarHBondContact CA-O 3.43Å; Y339-E345 WeakPolarHBondContact CB-O 3.09Å; D340-E345 PolarHBondContact N-O 3.16Å; T343-E345 PolarHBondContact O-N 3.35Å; T343-E345 WeakPolarHBondContact OG1-CB 3.35Å; T343-E345 PolarHBondContact OG1-N 3Å; T343-E345 VanDerWaalsContact OG1-N 3.15Å; E345-R1213 IonicContact OE1-CZ 3.3Å; E345-R1213 IonicContact OE1-NH2 2.75Å; E345-R1213 PolarHBondContact OE1-NH2 3.27Å; E345-R1213 IonicContact OE2-CZ 3.91Å; E345-R1213 VanDerWaalsContact OE2-CZ 3.22Å; E345-R1213 IonicContact OE2-NH1 2.67Å; E345-R1213 PolarHBondContact OE2-NH1 3.43Å; E345-R1213 IonicContact OE2-NH2 3.03Å; E345-R1213 PolarHBondContact OE2-NH2 2.63Å
346	I	73.9	Confident	74.7	Confident	44 Å²	44	45.6 Å²	45.6	23%	0.226	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-71.7	129.6	170.8	-63.1	163.9	0	0	0	107.1	T337 Y339 D348 P350 W405	T337-I346 HydrophobicContact CG2-CG1 4.21Å; T337-I346 HydrophobicContact CG2-CG2 3.8Å; Y339-I346 HydrophobicContact CD1-CG1 3.82Å; Y339-I346 HydrophobicContact CE1-CD1 4.29Å; Y339-I346 HydrophobicContact CE1-CG1 3.42Å; Y339-I346 VanDerWaalsContact CE1-CG1 3.42Å; I346-D348 PolarHBondContact O-N 3.21Å; I346-P350 HydrophobicContact CG2-CB 3.85Å; I346-W405 HydrophobicContact CD1-CB 3.9Å; I346-W405 HydrophobicContact CD1-CG 4.25Å
347	E	72.3	Confident	73.6	Confident	44 Å²	44	50.8 Å²	50.8	21%	0.206	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-52.6	134.9	170.9	173.8	172.6	-167.7	0	0	108.9	C338 N349 T363 T366	C338-E347 HydrophobicContact CB-CB 3.96Å; C338-E347 WeakPolarHBondContact CB-OE2 3.46Å; C338-E347 WeakPolarHBondContact O-CB 3.43Å; C338-E347 PolarHBondContact O-N 2.81Å; E347-N349 CarbonylContact O-C 3.56Å; E347-N349 PolarHBondContact O-N 2.92Å; E347-N349 VanDerWaalsContact O-N 3.1Å; E347-T363 WeakPolarHBondContact OE1-CG2 3.43Å; E347-T363 PolarHBondContact OE1-OG1 2.73Å; E347-T366 HydrophobicContact CB-CG2 3.88Å; E347-T366 HydrophobicContact CG-CG2 4.03Å; E347-T366 VanDerWaalsContact OE2-CB 3.28Å; E347-T366 WeakPolarHBondContact OE2-CB 3.2Å; E347-T366 WeakPolarHBondContact OE2-CG2 3.47Å; E347-T366 PolarHBondContact OE2-OG1 3.45Å
348	D	63.9	Low	72	Confident	50 Å²	50	61.9 Å²	61.9	27%	0.267	31%	0.309	S	S	.	.	S	Bend	trans	-23.3	-76.1	-178.6	-77	57.2	0	0	0	112.1	I346 P350 P2456 Y2563	I346-D348 PolarHBondContact O-N 3.21Å; D348-P350 WeakPolarHBondContact O-CD 3.49Å; D348-P2456 VanDerWaalsContact C-CG 3.41Å; D348-P2456 HydrophobicContact CB-CB 3.97Å; D348-P2456 VanDerWaalsContact O-CB 3.22Å; D348-P2456 WeakPolarHBondContact O-CB 3.29Å; D348-P2456 WeakPolarHBondContact O-CG 3.43Å; D348-Y2563 VanDerWaalsContact CA-OH 3.27Å; D348-Y2563 WeakPolarHBondContact CA-OH 3.4Å; D348-Y2563 PolarHBondContact OD1-OH 3.3Å
349	N	68.7	Low	70.3	Confident	53 Å²	53	65.2 Å²	65.2	28%	0.283	34%	0.343	S	S	.	.	S	Bend	trans	-78.1	97.1	-174.7	-49.3	18.5	0	0	0	111.8	E347 S351 P2456 P2457	E347-N349 CarbonylContact O-C 3.56Å; E347-N349 PolarHBondContact O-N 2.92Å; E347-N349 VanDerWaalsContact O-N 3.1Å; N349-S351 VanDerWaalsContact C-N 3.33Å; N349-S351 PolarHBondContact O-N 3.49Å; N349-P2456 WeakPolarHBondContact CA-O 3.26Å; N349-P2456 HydrophobicContact CB-CB 4.44Å; N349-P2456 WeakPolarHBondContact CB-O 3.11Å; N349-P2456 VanDerWaalsContact CG-C 3.4Å; N349-P2457 VanDerWaalsContact CG-N 3.3Å; N349-P2457 WeakPolarHBondContact ND2-CA 3.45Å; N349-P2457 PolarHBondContact ND2-O 2.71Å; N349-P2457 WeakPolarHBondContact OD1-CD 3.47Å
350	P	75.4	Confident	69.4	Low	23 Å²	23	67.8 Å²	67.8	15%	0.149	37%	0.368	C	S	.	.			trans	-79.2	87.2	-173.1	37.7	-37.8	0	0	0	109.7	T337 I346 D348 W405	T337-P350 WeakPolarHBondContact OG1-CA 3.32Å; I346-P350 HydrophobicContact CG2-CB 3.85Å; D348-P350 WeakPolarHBondContact O-CD 3.49Å; P350-W405 HydrophobicContact CB-CD2 4.3Å; P350-W405 HydrophobicContact CB-CH2 4.29Å; P350-W405 HydrophobicContact CB-CZ2 3.61Å; P350-W405 HydrophobicContact CG-CZ2 3.87Å; P350-W405 WeakPolarHBondContact O-CH2 3.05Å; P350-W405 WeakPolarHBondContact O-CZ2 3.37Å
351	S	78.4	Confident	69.1	Low	24 Å²	24	67.6 Å²	67.6	17%	0.168	37%	0.366	C	S	.	.			trans	-91.2	135.6	174.3	49.4	0	0	0	0	109.6	T337 N349 C353 L361	T337-S351 PolarHBondContact OG1-O 2.9Å; N349-S351 VanDerWaalsContact C-N 3.33Å; N349-S351 PolarHBondContact O-N 3.49Å; S351-C353 PolarHBondContact O-N 3.45Å; S351-L361 WeakPolarHBondContact OG-CD2 3.14Å
352	P	86.9	Confident	69.3	Low	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.339	C	S	.	.			trans	-63	124.4	177.9	-24.2	34.6	0	0	0	111.5	L334 A336 W405 P408 W440 D443 S444	L334-P352 HydrophobicContact CD2-CB 4.02Å; L334-P352 HydrophobicContact CD2-CG 4.03Å; A336-P352 CarbonylContact O-C 3.49Å; A336-P352 VanDerWaalsContact O-CA 3.29Å; A336-P352 WeakPolarHBondContact O-CA 3.08Å; P352-W405 HydrophobicContact CB-CZ3 4.32Å; P352-W405 HydrophobicContact CG-CH2 3.78Å; P352-W405 HydrophobicContact CG-CZ3 3.92Å; P352-P408 HydrophobicContact CG-CG 3.93Å; P352-W440 VanDerWaalsContact CD-CD1 3.49Å; P352-W440 HydrophobicContact CG-CB 3.84Å; P352-W440 HydrophobicContact CG-CG 4.04Å; P352-D443 CarbonylContact O-C 3.32Å; P352-D443 VanDerWaalsContact O-C 3.23Å; P352-D443 WeakPolarHBondContact O-CB 3.02Å; P352-S444 PolarHBondContact O-N 2.85Å
353	C	84.4	Confident	69.2	Low	3 Å²	3	59.6 Å²	59.6	2%	0.02	34%	0.335	C	S	.	.			trans	-111.4	152.4	-173.9	74.1	0	0	0	0	112.3	A336 T337 S351 L361 C368	A336-C353 VanDerWaalsContact C-SG 3.54Å; A336-C353 WeakPolarHBondContact CB-O 3.46Å; A336-C353 PolarHBondContact O-N 2.79Å; T337-C353 VanDerWaalsContact CA-SG 3.52Å; T337-C353 PolarHBondContact N-SG 2.73Å; T337-C353 PolarHBondContact O-SG 2.96Å; T337-C353 VanDerWaalsContact O-SG 3.35Å; S351-C353 PolarHBondContact O-N 3.45Å; C353-L361 HydrophobicContact CB-CD2 3.86Å; C353-C368 HydrophobicContact CB-CB 3.79Å; C353-C368 WeakPolarHBondContact CB-SG 3.23Å; C353-C368 WeakPolarHBondContact SG-CA 3.36Å; C353-C368 WeakPolarHBondContact SG-CB 3.42Å; C353-C368 CovalentContact SG-SG 2.03Å; C353-C368 PolarHBondContact SG-SG 3.07Å
354	S	80	Confident	68.8	Low	17 Å²	17	61.9 Å²	61.9	12%	0.119	37%	0.369	C	S	.	.			trans	-95.7	114.1	179.1	-154.1	0	0	0	0	112	N356 Q357 C368 S444	S354-N356 PolarHBondContact O-N 3.15Å; S354-Q357 PolarHBondContact O-N 3.36Å; S354-C368 VanDerWaalsContact C-SG 3.6Å; S354-S444 VanDerWaalsContact CB-O 3.28Å; S354-S444 WeakPolarHBondContact CB-O 3.38Å; S354-S444 PolarHBondContact OG-O 2.73Å
355	L	73	Confident	69	Low	90 Å²	90	63 Å²	63	47%	0.471	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-23.8	177.2	-62.3	172.7	0	0	0	113.9	A336	A336-L355 HydrophobicContact CB-CD2 4.38Å; A336-L355 HydrophobicContact CB-CG 4.35Å
356	N	66.1	Low	69.1	Low	153 Å²	153	61 Å²	61	82%	0.818	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-19.7	177.6	-68.7	-21.3	0	0	0	113.6	S354	S354-N356 PolarHBondContact O-N 3.15Å
357	Q	61.1	Low	69.1	Low	115 Å²	115	63.6 Å²	63.6	54%	0.537	38%	0.381	S	S	.	.	S	Bend	trans	-111.7	66.8	-177.3	-60.6	-170.8	9.4	0	0	110.5	S354 G359	S354-Q357 PolarHBondContact O-N 3.36Å; Q357-G359 PolarHBondContact O-N 2.94Å; Q357-G359 VanDerWaalsContact O-N 3.17Å
358	R	50	Low	69.5	Low	233 Å²	233	62.4 Å²	62.4	88%	0.879	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	116.9	178.4	-65.7	-179.3	177.1	-176.3	-3.8	110.8
359	G	50.4	Low	70	Confident	70 Å²	70	65 Å²	65	72%	0.722	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	19.4	165.4	0	0	0	0	0	118	Q357	Q357-G359 PolarHBondContact O-N 2.94Å; Q357-G359 VanDerWaalsContact O-N 3.17Å
360	A	57.1	Low	70.3	Confident	67 Å²	67	63.5 Å²	63.5	55%	0.554	38%	0.376	S	S	*	.	S	Bend	trans	-112.5	-17.7	176.8	0	0	0	0	0	115.2	R1513	A360-R1513 PolarHBondContact O-NH1 2.87Å
361	L	67.3	Low	69.8	Low	33 Å²	33	63.7 Å²	63.7	17%	0.173	37%	0.374	C	S	.	.	S	Bend	trans	-105.2	-57.8	178.4	-155.5	94.6	0	0	0	111.1	S351 C353 D443	S351-L361 WeakPolarHBondContact OG-CD2 3.14Å; C353-L361 HydrophobicContact CB-CD2 3.86Å; L361-D443 HydrophobicContact CD1-CB 3.83Å; L361-D443 HydrophobicContact CD2-CB 4.37Å
362	C	72.6	Confident	69.1	Low	14 Å²	14	66.5 Å²	66.5	10%	0.095	38%	0.384	C	S	.	.	S	Bend	trans	-66.8	149	175.7	-50.9	0	0	0	0	111.6	C338 T366	C338-C362 HydrophobicContact CB-CB 3.76Å; C338-C362 WeakPolarHBondContact CB-SG 3.35Å; C338-C362 WeakPolarHBondContact SG-CA 3.43Å; C338-C362 WeakPolarHBondContact SG-CB 3.4Å; C338-C362 CovalentContact SG-SG 2.04Å; C338-C362 PolarHBondContact SG-SG 2.86Å; C362-T366 VanDerWaalsContact CB-O 3.29Å; C362-T366 WeakPolarHBondContact CB-O 3.49Å; C362-T366 WeakPolarHBondContact CB-OG1 3.43Å
363	T	66.2	Low	67.4	Low	80 Å²	80	73.4 Å²	73.4	49%	0.491	42%	0.42	S	S	.	.			trans	-76	173.3	178.2	62.3	0	0	0	0	111.8	E347 A365 T366	E347-T363 WeakPolarHBondContact OE1-CG2 3.43Å; E347-T363 PolarHBondContact OE1-OG1 2.73Å; T363-A365 PolarHBondContact O-N 2.87Å; T363-T366 PolarHBondContact N-OG1 2.99Å; T363-T366 PolarHBondContact O-N 3.5Å; T363-T366 PolarHBondContact OG1-OG1 2.88Å
364	G	60.9	Low	65.6	Low	97 Å²	97	80.4 Å²	80.4	100%	1	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-14.3	-174.5	0	0	0	0	0	115.6
365	A	68.7	Low	64	Low	48 Å²	48	81.4 Å²	81.4	40%	0.397	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-0.8	176.4	0	0	0	0	0	113.4	F341 T363	F341-A365 WeakPolarHBondContact CD1-O 3.45Å; F341-A365 PolarHBondContact N-O 3.26Å; T363-A365 PolarHBondContact O-N 2.87Å
366	T	73.2	Confident	62.5	Low	23 Å²	23	80.9 Å²	80.9	14%	0.141	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.8	-175	63.2	0	0	0	0	112.2	Y339 E347 C362 T363	Y339-T366 CarbonylContact O-C 3.52Å; Y339-T366 VanDerWaalsContact O-CA 3.24Å; Y339-T366 WeakPolarHBondContact O-CA 3.27Å; E347-T366 HydrophobicContact CB-CG2 3.88Å; E347-T366 HydrophobicContact CG-CG2 4.03Å; E347-T366 VanDerWaalsContact OE2-CB 3.28Å; E347-T366 WeakPolarHBondContact OE2-CB 3.2Å; E347-T366 WeakPolarHBondContact OE2-CG2 3.47Å; E347-T366 PolarHBondContact OE2-OG1 3.45Å; C362-T366 VanDerWaalsContact CB-O 3.29Å; C362-T366 WeakPolarHBondContact CB-O 3.49Å; C362-T366 WeakPolarHBondContact CB-OG1 3.43Å; T363-T366 PolarHBondContact N-OG1 2.99Å; T363-T366 PolarHBondContact O-N 3.5Å; T363-T366 PolarHBondContact OG1-OG1 2.88Å
367	I	74.6	Confident	61.3	Low	99 Å²	99	84 Å²	84	51%	0.508	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.3	-175.3	-171.6	169	0	0	0	111.1	C338 Y339 Y369	C338-I367 WeakPolarHBondContact CA-O 3.43Å; Y339-I367 PolarHBondContact N-O 3.01Å; Y339-I367 PolarHBondContact O-N 3.18Å; I367-Y369 PolarHBondContact O-N 3.35Å
368	C	79.7	Confident	60.2	Low	19 Å²	19	81.6 Å²	81.6	13%	0.128	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	118.9	174.1	179.1	0	0	0	0	111.1	T337 C353 S354	T337-C368 WeakPolarHBondContact O-CA 3.26Å; C353-C368 HydrophobicContact CB-CB 3.79Å; C353-C368 WeakPolarHBondContact CB-SG 3.23Å; C353-C368 WeakPolarHBondContact SG-CA 3.36Å; C353-C368 WeakPolarHBondContact SG-CB 3.42Å; C353-C368 CovalentContact SG-SG 2.03Å; C353-C368 PolarHBondContact SG-SG 3.07Å; S354-C368 VanDerWaalsContact C-SG 3.6Å
369	Y	74.6	Confident	60	Low	103 Å²	103	71.5 Å²	71.5	40%	0.404	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	158.1	-178.3	-151.1	-98.5	0	0	0	112.6	A336 T337 Y339 I367 F371	A336-Y369 CarbonylContact C-O 3.48Å; A336-Y369 VanDerWaalsContact CA-O 3.25Å; A336-Y369 WeakPolarHBondContact CA-O 3.29Å; T337-Y369 PolarHBondContact N-O 3.42Å; T337-Y369 PolarHBondContact O-N 3.27Å; Y339-Y369 WeakPolarHBondContact CE2-O 3.42Å; I367-Y369 PolarHBondContact O-N 3.35Å; Y369-F371 HydrophobicContact CE1-CD2 4.44Å
370	D	75.3	Confident	59.8	Low	23 Å²	23	71.2 Å²	71.2	12%	0.123	42%	0.416	C	S	.	.			trans	-126.2	113.9	169.6	174.1	1.8	0	0	0	108.1	A336 K372 R404	A336-D370 HydrophobicContact CB-CB 4.1Å; D370-K372 PolarHBondContact O-N 3.48Å; D370-K372 WeakPolarHBondContact OD2-CE 3.41Å; D370-K372 IonicContact OD2-NZ 3.95Å; D370-R404 IonicContact OD1-CZ 3.75Å; D370-R404 IonicContact OD1-NE 3.73Å; D370-R404 PolarHBondContact OD1-NE 3.42Å; D370-R404 IonicContact OD1-NH2 2.66Å; D370-R404 PolarHBondContact OD1-NH2 2.96Å; D370-R404 IonicContact OD2-NH2 3.5Å; D370-R404 PolarHBondContact OD2-NH2 2.92Å
371	F	65.4	Low	59.2	Low	26 Å²	26	70.1 Å²	70.1	11%	0.114	41%	0.407	C	S	.	.			trans	-86.5	74.1	-174.2	-171	-115.4	0	0	0	112.7	Y369 M375 R383 P402 R404	Y369-F371 HydrophobicContact CE1-CD2 4.44Å; F371-M375 HydrophobicContact CE2-CE 4.37Å; F371-R383 VanDerWaalsContact CE2-NH2 3.33Å; F371-P402 HydrophobicContact CD1-CG 4.06Å; F371-P402 WeakPolarHBondContact CD1-O 3.44Å; F371-P402 HydrophobicContact CD2-CG 4.33Å; F371-P402 HydrophobicContact CE1-CG 4.21Å; F371-P402 WeakPolarHBondContact CE1-O 3.11Å; F371-P402 HydrophobicContact CG-CG 4.13Å; F371-P402 HydrophobicContact CZ-CG 4.46Å; F371-R404 HydrophobicContact CB-CB 4.49Å; F371-R404 VanDerWaalsContact O-CB 3.32Å; F371-R404 WeakPolarHBondContact O-CB 3.3Å; F371-R404 VanDerWaalsContact O-CD 3.29Å; F371-R404 WeakPolarHBondContact O-CD 3.41Å; F371-R404 WeakPolarHBondContact O-CG 3.46Å
372	K	63.8	Low	58	Low	83 Å²	83	75 Å²	75	36%	0.361	43%	0.429	S	S	.	.			trans	-71	132.7	175	-57.1	-152.3	178.5	-148.7	0	111.7	D370 D374 R404 E1371	D370-K372 PolarHBondContact O-N 3.48Å; D370-K372 WeakPolarHBondContact OD2-CE 3.41Å; D370-K372 IonicContact OD2-NZ 3.95Å; K372-D374 VanDerWaalsContact C-N 3.33Å; K372-D374 PolarHBondContact O-N 3.1Å; K372-R404 VanDerWaalsContact CE-NH2 3.29Å; K372-E1371 IonicContact NZ-OE1 2.96Å; K372-E1371 PolarHBondContact NZ-OE1 3.16Å
373	L	50.7	Low	56.7	Low	146 Å²	146	79.2 Å²	79.2	76%	0.764	44%	0.442	S	S	*	.	S	Bend	trans	-65.2	-35.7	175.4	-75	86.8	0	0	0	112.2	M375	L373-M375 PolarHBondContact O-N 2.96Å
374	D	46	Very low	55.7	Low	149 Å²	149	81.3 Å²	81.3	80%	0.797	45%	0.445	S	S	*	.	S	Bend	trans	-76.9	53.9	172.7	-68.2	-40.5	0	0	0	111.7	K372	K372-D374 VanDerWaalsContact C-N 3.33Å; K372-D374 PolarHBondContact O-N 3.1Å
375	M	46.8	Very low	55.1	Low	39 Å²	39	81.5 Å²	81.5	19%	0.192	42%	0.42	C	S	.	.			trans	-70.1	136	176.6	-174.6	157.5	60.2	0	0	110	F371 L373 A379 V380 R383	F371-M375 HydrophobicContact CE2-CE 4.37Å; L373-M375 PolarHBondContact O-N 2.96Å; M375-A379 HydrophobicContact CG-CB 3.47Å; M375-A379 VanDerWaalsContact CG-CB 3.47Å; M375-A379 HydrophobicContact SD-CB 3.69Å; M375-V380 HydrophobicContact CB-CG2 3.83Å; M375-V380 HydrophobicContact CE-CG2 4.08Å; M375-V380 HydrophobicContact CG-CG2 4.06Å; M375-V380 VanDerWaalsContact O-CG2 3.32Å; M375-V380 WeakPolarHBondContact O-CG2 3.3Å; M375-R383 HydrophobicContact CE-CB 4.29Å; M375-R383 HydrophobicContact CE-CG 3.95Å
376	S	41.9	Very low	54.1	Low	78 Å²	78	84.4 Å²	84.4	55%	0.545	43%	0.428	S	S	.	.			trans	-50.2	142.6	178	172.2	0	0	0	0	111.5	A378 A379 V380	S376-A378 PolarHBondContact O-N 2.8Å; S376-A378 PolarHBondContact OG-N 3.19Å; S376-A379 PolarHBondContact O-N 2.89Å; S376-V380 PolarHBondContact O-N 3Å
377	Y	40.7	Very low	52.9	Low	220 Å²	220	85.8 Å²	85.8	86%	0.863	44%	0.442	S	S	*	.	H	α-helix	trans	-49.2	-28.9	175	-110.5	-88	0	0	0	113	A381	Y377-A381 VanDerWaalsContact O-CB 3.22Å; Y377-A381 WeakPolarHBondContact O-CB 3.38Å; Y377-A381 PolarHBondContact O-N 3.31Å
378	A	38.9	Very low	51.6	Low	64 Å²	64	85 Å²	85	53%	0.529	44%	0.436	S	S	.	.	H	α-helix	trans	-69.7	-48.2	173.7	0	0	0	0	0	113.2	S376 A381 E382	S376-A378 PolarHBondContact O-N 2.8Å; S376-A378 PolarHBondContact OG-N 3.19Å; A378-A381 CarbonylContact O-C 3.53Å; A378-A381 WeakPolarHBondContact O-CA 3.48Å; A378-A381 WeakPolarHBondContact O-CB 3.34Å; A378-A381 PolarHBondContact O-N 2.98Å; A378-A381 VanDerWaalsContact O-N 3.1Å; A378-E382 PolarHBondContact O-N 3.3Å
379	A	44.3	Very low	50.2	Low	20 Å²	20	86.4 Å²	86.4	17%	0.165	45%	0.449	C	S	.	.	H	α-helix	trans	-77.8	-25.3	179.9	0	0	0	0	0	112.6	M375 S376 A381 R383	M375-A379 HydrophobicContact CG-CB 3.47Å; M375-A379 VanDerWaalsContact CG-CB 3.47Å; M375-A379 HydrophobicContact SD-CB 3.69Å; S376-A379 PolarHBondContact O-N 2.89Å; A379-A381 VanDerWaalsContact C-N 3.35Å; A379-R383 PolarHBondContact O-N 3.46Å
380	V	47.4	Very low	48.8	Very low	65 Å²	65	83.4 Å²	83.4	39%	0.394	44%	0.439	S	S	.	.	H	α-helix	trans	-64.5	-40.1	162	176	0	0	0	0	110.3	M375 S376 K384	M375-V380 HydrophobicContact CB-CG2 3.83Å; M375-V380 HydrophobicContact CE-CG2 4.08Å; M375-V380 HydrophobicContact CG-CG2 4.06Å; M375-V380 VanDerWaalsContact O-CG2 3.32Å; M375-V380 WeakPolarHBondContact O-CG2 3.3Å; S376-V380 PolarHBondContact O-N 3Å; V380-K384 WeakPolarHBondContact O-CB 3.4Å; V380-K384 PolarHBondContact O-N 3.36Å
381	A	43.5	Very low	47.3	Very low	43 Å²	43	89.7 Å²	89.7	36%	0.355	47%	0.472	S	S	.	.	H	α-helix	trans	-68.1	-37.1	174.5	0	0	0	0	0	112.8	Y377 A378 A379 K384 Q385	Y377-A381 VanDerWaalsContact O-CB 3.22Å; Y377-A381 WeakPolarHBondContact O-CB 3.38Å; Y377-A381 PolarHBondContact O-N 3.31Å; A378-A381 CarbonylContact O-C 3.53Å; A378-A381 WeakPolarHBondContact O-CA 3.48Å; A378-A381 WeakPolarHBondContact O-CB 3.34Å; A378-A381 PolarHBondContact O-N 2.98Å; A378-A381 VanDerWaalsContact O-N 3.1Å; A379-A381 VanDerWaalsContact C-N 3.35Å; A381-K384 PolarHBondContact O-N 2.86Å; A381-Q385 WeakPolarHBondContact O-CB 3.2Å; A381-Q385 WeakPolarHBondContact O-CG 3.18Å; A381-Q385 PolarHBondContact O-N 3.32Å
382	E	42.9	Very low	46.6	Very low	136 Å²	136	92 Å²	92	64%	0.636	50%	0.496	S	S	*	.	H	α-helix	trans	-62.1	-50.1	171.7	-72	177.9	139.2	0	0	111.2	A378 K384 Q385 L386	A378-E382 PolarHBondContact O-N 3.3Å; E382-K384 PolarHBondContact O-N 3.01Å; E382-Q385 PolarHBondContact O-N 3.42Å; E382-L386 WeakPolarHBondContact O-CB 3.27Å; E382-L386 PolarHBondContact O-N 2.96Å
383	R	45.1	Very low	45.5	Very low	102 Å²	102	90.9 Å²	90.9	39%	0.385	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-30.4	173.1	-83.5	-145.1	-178.3	176.2	1.7	112.8	F371 M375 A379 A387	F371-R383 VanDerWaalsContact CE2-NH2 3.33Å; M375-R383 HydrophobicContact CE-CB 4.29Å; M375-R383 HydrophobicContact CE-CG 3.95Å; A379-R383 PolarHBondContact O-N 3.46Å; R383-A387 WeakPolarHBondContact O-CB 3.37Å; R383-A387 PolarHBondContact O-N 3.03Å
384	K	46.4	Very low	45.5	Very low	124 Å²	124	91.4 Å²	91.4	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-75.7	-37.3	177.3	-165.3	175.3	-177.7	-172.1	0	112.2	V380 A381 E382 A387 E388	V380-K384 WeakPolarHBondContact O-CB 3.4Å; V380-K384 PolarHBondContact O-N 3.36Å; A381-K384 PolarHBondContact O-N 2.86Å; E382-K384 PolarHBondContact O-N 3.01Å; K384-A387 PolarHBondContact O-N 3.43Å; K384-E388 VanDerWaalsContact CE-OE1 3.23Å; K384-E388 WeakPolarHBondContact CE-OE1 3.39Å; K384-E388 VanDerWaalsContact O-CB 3.31Å; K384-E388 WeakPolarHBondContact O-CB 3.46Å; K384-E388 VanDerWaalsContact O-CG 3.25Å; K384-E388 WeakPolarHBondContact O-CG 3.49Å; K384-E388 PolarHBondContact O-N 3.15Å
385	Q	46.7	Very low	45.6	Very low	102 Å²	102	89.3 Å²	89.3	48%	0.477	50%	0.499	S	S	.	.	H	α-helix	trans	-65.4	-41	170.4	-74.1	178.3	4.1	0	0	111.3	A381 E382 E388 A389	A381-Q385 WeakPolarHBondContact O-CB 3.2Å; A381-Q385 WeakPolarHBondContact O-CG 3.18Å; A381-Q385 PolarHBondContact O-N 3.32Å; E382-Q385 PolarHBondContact O-N 3.42Å; Q385-E388 PolarHBondContact O-N 3.01Å; Q385-A389 WeakPolarHBondContact O-CB 3.34Å; Q385-A389 PolarHBondContact O-N 3.4Å
386	L	47.5	Very low	45.6	Very low	109 Å²	109	93.9 Å²	93.9	57%	0.571	53%	0.53	S	S	*	.	H	α-helix	trans	-62.9	-44.7	173.1	-163.5	77.1	0	0	0	111.2	E382 A389 I390	E382-L386 WeakPolarHBondContact O-CB 3.27Å; E382-L386 PolarHBondContact O-N 2.96Å; L386-A389 PolarHBondContact O-N 3.01Å; L386-I390 HydrophobicContact CG-CD1 4.23Å; L386-I390 WeakPolarHBondContact O-CD1 3.46Å; L386-I390 VanDerWaalsContact O-CG1 3.27Å; L386-I390 WeakPolarHBondContact O-CG1 3.48Å; L386-I390 PolarHBondContact O-N 2.95Å
387	A	48.1	Very low	45.6	Very low	52 Å²	52	94.7 Å²	94.7	43%	0.43	53%	0.533	S	S	.	.	H	α-helix	trans	-66.3	-38.4	177.2	0	0	0	0	0	112.7	R383 K384 I390 L391	R383-A387 WeakPolarHBondContact O-CB 3.37Å; R383-A387 PolarHBondContact O-N 3.03Å; K384-A387 PolarHBondContact O-N 3.43Å; A387-I390 PolarHBondContact O-N 3.43Å; A387-L391 WeakPolarHBondContact O-CB 3.35Å; A387-L391 PolarHBondContact O-N 2.85Å
388	E	47.4	Very low	45.9	Very low	82 Å²	82	89.8 Å²	89.8	38%	0.383	53%	0.528	S	S	.	.	H	α-helix	trans	-68.4	-34.1	174.3	-74.7	168.4	-174.3	0	0	111.4	K384 Q385 L391 A392	K384-E388 VanDerWaalsContact CE-OE1 3.23Å; K384-E388 WeakPolarHBondContact CE-OE1 3.39Å; K384-E388 VanDerWaalsContact O-CB 3.31Å; K384-E388 WeakPolarHBondContact O-CB 3.46Å; K384-E388 VanDerWaalsContact O-CG 3.25Å; K384-E388 WeakPolarHBondContact O-CG 3.49Å; K384-E388 PolarHBondContact O-N 3.15Å; Q385-E388 PolarHBondContact O-N 3.01Å; E388-L391 PolarHBondContact O-N 3.15Å; E388-A392 PolarHBondContact O-N 2.99Å; E388-A392 VanDerWaalsContact O-N 3.1Å
389	A	50.4	Low	46.3	Very low	49 Å²	49	91.9 Å²	91.9	41%	0.405	53%	0.53	S	S	.	.	H	α-helix	trans	-69.3	-34.6	171.3	0	0	0	0	0	113.1	Q385 L386 A392	Q385-A389 WeakPolarHBondContact O-CB 3.34Å; Q385-A389 PolarHBondContact O-N 3.4Å; L386-A389 PolarHBondContact O-N 3.01Å; A389-A392 WeakPolarHBondContact O-CB 3.38Å; A389-A392 PolarHBondContact O-N 3.25Å
390	I	46.4	Very low	46.6	Very low	39 Å²	39	95 Å²	95	20%	0.2	55%	0.548	C	S	.	.	I	π-helix	trans	-69.7	-42.4	171.6	-69.1	161.3	0	0	0	110.3	L386 A387 A392 G393 I395 P397	L386-I390 HydrophobicContact CG-CD1 4.23Å; L386-I390 WeakPolarHBondContact O-CD1 3.46Å; L386-I390 VanDerWaalsContact O-CG1 3.27Å; L386-I390 WeakPolarHBondContact O-CG1 3.48Å; L386-I390 PolarHBondContact O-N 2.95Å; A387-I390 PolarHBondContact O-N 3.43Å; I390-A392 PolarHBondContact O-N 3.23Å; I390-G393 PolarHBondContact O-N 3.09Å; I390-I395 HydrophobicContact CG1-CB 4.4Å; I390-I395 HydrophobicContact CG1-CD1 4.25Å; I390-P397 HydrophobicContact CG2-CB 4.11Å
391	L	44	Very low	46.8	Very low	155 Å²	155	100.2 Å²	100.2	81%	0.812	57%	0.569	S	S	*	*	I	π-helix	trans	-63.7	-20.2	176.9	-148.3	78.6	0	0	0	112.9	A387 E388 G393	A387-L391 WeakPolarHBondContact O-CB 3.35Å; A387-L391 PolarHBondContact O-N 2.85Å; E388-L391 PolarHBondContact O-N 3.15Å; L391-G393 PolarHBondContact O-N 3.43Å
392	A	49.4	Very low	47.5	Very low	74 Å²	74	99.2 Å²	99.2	61%	0.612	56%	0.558	S	S	*	*	I	π-helix	trans	-75.9	0.1	173.7	0	0	0	0	0	114.3	E388 A389 I390	E388-A392 PolarHBondContact O-N 2.99Å; E388-A392 VanDerWaalsContact O-N 3.1Å; A389-A392 WeakPolarHBondContact O-CB 3.38Å; A389-A392 PolarHBondContact O-N 3.25Å; I390-A392 PolarHBondContact O-N 3.23Å
393	G	40.6	Very low	48.5	Very low	60 Å²	60	100.2 Å²	100.2	62%	0.619	56%	0.563	S	S	*	*	I	π-helix	trans	90.2	4.8	161.8	0	0	0	0	0	117.2	I390 L391	I390-G393 PolarHBondContact O-N 3.09Å; L391-G393 PolarHBondContact O-N 3.43Å
394	N	52.2	Low	50	Low	158 Å²	158	97.8 Å²	97.8	85%	0.845	55%	0.554	S	S	*	*	I	π-helix	trans	-85.4	-4.3	174.8	-81.1	-12.3	0	0	0	114.1
395	I	47.4	Very low	51.8	Low	104 Å²	104	93 Å²	93	53%	0.533	53%	0.533	S	S	.	.	S	Bend	trans	-138.9	133.4	176.7	-56.5	178.3	0	0	0	108.1	I390 P397	I390-I395 HydrophobicContact CG1-CB 4.4Å; I390-I395 HydrophobicContact CG1-CD1 4.25Å; I395-P397 WeakPolarHBondContact O-CD 3.44Å
396	T	45.7	Very low	53.5	Low	135 Å²	135	91.8 Å²	91.8	83%	0.828	53%	0.532	S	S	*	.			trans	-74.7	123.5	179.2	44.7	0	0	0	0	111.8
397	P	43.2	Very low	55.4	Low	95 Å²	95	86.6 Å²	86.6	62%	0.617	51%	0.505	S	S	*	.			trans	-95.8	169	-178.5	38.2	-35.8	0	0	0	113.2	I390 I395	I390-P397 HydrophobicContact CG2-CB 4.11Å; I395-P397 WeakPolarHBondContact O-CD 3.44Å
398	P	47	Very low	57.3	Low	117 Å²	117	84.3 Å²	84.3	76%	0.76	49%	0.486	S	S	*	.			cis	-107.6	147.1	-3.5	37.4	-28.3	0	0	0	112.9
399	L	47	Very low	59.1	Low	109 Å²	109	82.2 Å²	82.2	57%	0.571	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-64.2	137.4	153.7	-73.3	167.9	0	0	0	108.2
400	P	49.7	Very low	60.7	Low	84 Å²	84	84.5 Å²	84.5	55%	0.545	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-58.2	152.6	168.4	26.9	-33.4	0	0	0	109.5	P402	P400-P402 VanDerWaalsContact O-CD 3.31Å; P400-P402 WeakPolarHBondContact O-CD 3.19Å
401	Q	52.9	Low	62.5	Low	175 Å²	175	83.2 Å²	83.2	82%	0.818	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-67	119.4	165.5	-67.8	-166.7	3.4	0	0	106.8	E403	Q401-E403 PolarHBondContact O-N 2.85Å
402	P	57.2	Low	64.6	Low	22 Å²	22	76.5 Å²	76.5	14%	0.143	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-61.5	125.4	-176.7	24	-33	0	0	0	108.7	Y339 G344 F371 P400 R404	Y339-P402 HydrophobicContact CE1-CB 4.43Å; G344-P402 WeakPolarHBondContact O-CB 3.3Å; F371-P402 HydrophobicContact CD1-CG 4.06Å; F371-P402 WeakPolarHBondContact CD1-O 3.44Å; F371-P402 HydrophobicContact CD2-CG 4.33Å; F371-P402 HydrophobicContact CE1-CG 4.21Å; F371-P402 WeakPolarHBondContact CE1-O 3.11Å; F371-P402 HydrophobicContact CG-CG 4.13Å; F371-P402 HydrophobicContact CZ-CG 4.46Å; P400-P402 VanDerWaalsContact O-CD 3.31Å; P400-P402 WeakPolarHBondContact O-CD 3.19Å; P402-R404 PolarHBondContact O-N 3.25Å
403	E	64.6	Low	66.5	Low	158 Å²	158	73 Å²	73	74%	0.738	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-69.3	128.8	-180	-171.8	165.7	-177.4	0	0	109	Q401 W405	Q401-E403 PolarHBondContact O-N 2.85Å; E403-W405 PolarHBondContact O-N 3.08Å; E403-W405 VanDerWaalsContact O-N 3.13Å
404	R	76.8	Confident	68.8	Low	50 Å²	50	70.6 Å²	70.6	19%	0.189	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-67	116.5	178.2	-174.8	-173.3	-172.5	-150.9	1.1	108.3	H335 D370 F371 K372 P402 V406 E1371	H335-R404 PolarHBondContact CD2-NH2 3.36Å; D370-R404 IonicContact OD1-CZ 3.75Å; D370-R404 IonicContact OD1-NE 3.73Å; D370-R404 PolarHBondContact OD1-NE 3.42Å; D370-R404 IonicContact OD1-NH2 2.66Å; D370-R404 PolarHBondContact OD1-NH2 2.96Å; D370-R404 IonicContact OD2-NH2 3.5Å; D370-R404 PolarHBondContact OD2-NH2 2.92Å; F371-R404 HydrophobicContact CB-CB 4.49Å; F371-R404 VanDerWaalsContact O-CB 3.32Å; F371-R404 WeakPolarHBondContact O-CB 3.3Å; F371-R404 VanDerWaalsContact O-CD 3.29Å; F371-R404 WeakPolarHBondContact O-CD 3.41Å; F371-R404 WeakPolarHBondContact O-CG 3.46Å; K372-R404 VanDerWaalsContact CE-NH2 3.29Å; P402-R404 PolarHBondContact O-N 3.25Å; R404-V406 PolarHBondContact O-N 2.75Å; R404-V406 VanDerWaalsContact O-N 3.08Å; R404-E1371 IonicContact CZ-OE1 3.3Å; R404-E1371 IonicContact CZ-OE2 2.74Å; R404-E1371 IonicContact NH1-OE1 2.9Å; R404-E1371 IonicContact NH1-OE2 2.89Å; R404-E1371 PolarHBondContact NH1-OE2 3.16Å; R404-E1371 IonicContact NH2-OE1 2.79Å; R404-E1371 PolarHBondContact NH2-OE1 2.7Å; R404-E1371 IonicContact NH2-OE2 2.83Å
405	W	83.4	Confident	70.7	Confident	25 Å²	25	63.1 Å²	63.1	10%	0.095	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-55.4	118.6	176	-172.1	54.9	0	0	0	111.8	L334 H335 T337 Y339 I346 P350 P352 E403 G407 P408	L334-W405 VanDerWaalsContact O-CE3 3.3Å; L334-W405 WeakPolarHBondContact O-CZ3 3.32Å; H335-W405 PolarHBondContact ND1-O 3.31Å; T337-W405 HydrophobicContact CG2-CB 3.79Å; T337-W405 HydrophobicContact CG2-CD2 4.08Å; T337-W405 HydrophobicContact CG2-CE3 4.02Å; T337-W405 HydrophobicContact CG2-CG 4.01Å; Y339-W405 PolarHBondContact OH-N 3.11Å; I346-W405 HydrophobicContact CD1-CB 3.9Å; I346-W405 HydrophobicContact CD1-CG 4.25Å; P350-W405 HydrophobicContact CB-CD2 4.3Å; P350-W405 HydrophobicContact CB-CH2 4.29Å; P350-W405 HydrophobicContact CB-CZ2 3.61Å; P350-W405 HydrophobicContact CG-CZ2 3.87Å; P350-W405 WeakPolarHBondContact O-CH2 3.05Å; P350-W405 WeakPolarHBondContact O-CZ2 3.37Å; P352-W405 HydrophobicContact CB-CZ3 4.32Å; P352-W405 HydrophobicContact CG-CH2 3.78Å; P352-W405 HydrophobicContact CG-CZ3 3.92Å; E403-W405 PolarHBondContact O-N 3.08Å; E403-W405 VanDerWaalsContact O-N 3.13Å; W405-G407 VanDerWaalsContact CE2-C 3.49Å; W405-G407 PolarHBondContact O-N 3.24Å; W405-P408 HydrophobicContact CH2-CG 3.76Å; W405-P408 HydrophobicContact CZ2-CG 4.18Å
406	V	82.6	Confident	72.7	Confident	76 Å²	76	58.4 Å²	58.4	46%	0.461	32%	0.317	S	S	.	.			trans	-67.9	-14.4	-178.1	-67.9	0	0	0	0	113.3	H335 R404 Y410 G411	H335-V406 PolarHBondContact CE1-O 3.15Å; H335-V406 PolarHBondContact ND1-O 3Å; R404-V406 PolarHBondContact O-N 2.75Å; R404-V406 VanDerWaalsContact O-N 3.08Å; V406-Y410 VanDerWaalsContact CG2-C 3.49Å; V406-G411 WeakPolarHBondContact O-CA 3.45Å
407	G	86.6	Confident	74.7	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.293	C	S	.	.			trans	106.6	179.1	-177.5	0	0	0	0	0	112.9	L334 W405 G411	L334-G407 WeakPolarHBondContact O-CA 3.3Å; W405-G407 VanDerWaalsContact CE2-C 3.49Å; W405-G407 PolarHBondContact O-N 3.24Å; G407-G411 PolarHBondContact O-N 3.2Å
408	P	87.9	Confident	77	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-55.9	150.2	-176.4	-25.2	33.5	0	0	0	113.6	P352 W405 Y410 G411 I412 T413 W440	P352-P408 HydrophobicContact CG-CG 3.93Å; W405-P408 HydrophobicContact CH2-CG 3.76Å; W405-P408 HydrophobicContact CZ2-CG 4.18Å; P408-Y410 PolarHBondContact O-N 3.01Å; P408-G411 PolarHBondContact O-N 2.95Å; P408-I412 PolarHBondContact O-N 2.83Å; P408-T413 PolarHBondContact O-OG1 3.45Å; P408-W440 HydrophobicContact CB-CD2 3.69Å; P408-W440 HydrophobicContact CB-CE3 3.49Å; P408-W440 VanDerWaalsContact CB-CE3 3.49Å; P408-W440 HydrophobicContact CB-CG 4.44Å; P408-W440 HydrophobicContact CB-CH2 3.99Å; P408-W440 HydrophobicContact CB-CZ2 4.13Å; P408-W440 HydrophobicContact CB-CZ3 3.66Å; P408-W440 HydrophobicContact CG-CB 4.4Å; P408-W440 HydrophobicContact CG-CD2 3.76Å; P408-W440 HydrophobicContact CG-CE3 3.84Å; P408-W440 HydrophobicContact CG-CG 3.99Å; P408-W440 HydrophobicContact CG-CZ3 4.5Å
409	N	86.5	Confident	78.9	Confident	38 Å²	38	48.7 Å²	48.7	20%	0.203	25%	0.251	C	S	.	.	H	α-helix	trans	47.8	55.7	179.1	-59.5	-15.6	0	0	0	112.5	G411 I412 T413 W440 Y798	N409-G411 PolarHBondContact O-N 3.34Å; N409-G411 VanDerWaalsContact O-N 3.15Å; N409-I412 VanDerWaalsContact O-CB 3.3Å; N409-I412 WeakPolarHBondContact O-CB 3.24Å; N409-I412 VanDerWaalsContact O-CG1 3.25Å; N409-I412 WeakPolarHBondContact O-CG1 3.33Å; N409-I412 PolarHBondContact O-N 3.09Å; N409-T413 HydrophobicContact CB-CG2 4.34Å; N409-W440 WeakPolarHBondContact ND2-CH2 3.46Å; N409-Y798 HydrophobicContact CB-CD2 4.1Å; N409-Y798 HydrophobicContact CB-CE1 4.45Å; N409-Y798 HydrophobicContact CB-CE2 4.06Å; N409-Y798 HydrophobicContact CB-CG 4.35Å; N409-Y798 WeakPolarHBondContact ND2-CE2 3.29Å; N409-Y798 PolarHBondContact ND2-OH 2.76Å
410	Y	84	Confident	80.9	Confident	97 Å²	97	44.4 Å²	44.4	38%	0.38	23%	0.229	S	C	.	.	H	α-helix	trans	56.1	27.6	-178.7	-42.9	-78.9	0	0	0	114.2	V406 P408 E767 R802	V406-Y410 VanDerWaalsContact CG2-C 3.49Å; P408-Y410 PolarHBondContact O-N 3.01Å; Y410-E767 PolarHBondContact OH-OE1 2.9Å; Y410-E767 PolarHBondContact OH-OE2 2.81Å; Y410-E767 VanDerWaalsContact OH-OE2 3.07Å; Y410-R802 VanDerWaalsContact CZ-NH1 3.35Å; Y410-R802 PolarHBondContact OH-NH1 2.61Å; Y410-R802 VanDerWaalsContact OH-NH1 3.15Å
411	G	84.1	Confident	83	Confident	12 Å²	12	40.4 Å²	40.4	12%	0.124	20%	0.203	C	C	.	.	H	α-helix	trans	78.5	18	-177.3	0	0	0	0	0	114.8	V406 G407 P408 N409 N414	V406-G411 WeakPolarHBondContact O-CA 3.45Å; G407-G411 PolarHBondContact O-N 3.2Å; P408-G411 PolarHBondContact O-N 2.95Å; N409-G411 PolarHBondContact O-N 3.34Å; N409-G411 VanDerWaalsContact O-N 3.15Å; G411-N414 PolarHBondContact O-ND2 3.3Å
412	I	88	Confident	84.8	Confident	13 Å²	13	34.8 Å²	34.8	7%	0.067	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-45	178.5	-60.7	169.4	0	0	0	111.2	P408 N409 N414 L423 Y798 I801	P408-I412 PolarHBondContact O-N 2.83Å; N409-I412 VanDerWaalsContact O-CB 3.3Å; N409-I412 WeakPolarHBondContact O-CB 3.24Å; N409-I412 VanDerWaalsContact O-CG1 3.25Å; N409-I412 WeakPolarHBondContact O-CG1 3.33Å; N409-I412 PolarHBondContact O-N 3.09Å; I412-N414 VanDerWaalsContact C-N 3.35Å; I412-N414 PolarHBondContact O-N 3.41Å; I412-N414 VanDerWaalsContact O-N 3.16Å; I412-L423 HydrophobicContact CG2-CD2 4.19Å; I412-Y798 HydrophobicContact CB-CD1 4.31Å; I412-Y798 HydrophobicContact CD1-CD1 4.01Å; I412-Y798 HydrophobicContact CD1-CG 4.34Å; I412-Y798 HydrophobicContact CG2-CD1 3.97Å; I412-Y798 HydrophobicContact CG2-CE1 4.17Å; I412-I801 HydrophobicContact CD1-CB 3.98Å; I412-I801 HydrophobicContact CD1-CD1 4.19Å; I412-I801 HydrophobicContact CD1-CG2 3.87Å; I412-I801 HydrophobicContact CG1-CG2 4.23Å; I412-I801 HydrophobicContact CG2-CD1 3.94Å
413	T	89.6	Confident	86.4	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.006	17%	0.174	C	C	.	.	S	Bend	trans	-90.7	65.8	-176.6	50.3	0	0	0	0	111.6	P408 N409 T424 Y798	P408-T413 PolarHBondContact O-OG1 3.45Å; N409-T413 HydrophobicContact CB-CG2 4.34Å; T413-T424 WeakPolarHBondContact CA-OG1 3.34Å; T413-Y798 HydrophobicContact CG2-CE1 3.78Å; T413-Y798 VanDerWaalsContact CG2-OH 3.25Å; T413-Y798 WeakPolarHBondContact CG2-OH 3.35Å
414	N	89.1	Confident	87.8	Confident	10 Å²	10	26.9 Å²	26.9	5%	0.053	14%	0.139	C	C	.	.			trans	-128.3	167.4	-179.3	71.5	18.1	0	0	0	113.6	G411 I412 D416 L420 S421 T424	G411-N414 PolarHBondContact O-ND2 3.3Å; I412-N414 VanDerWaalsContact C-N 3.35Å; I412-N414 PolarHBondContact O-N 3.41Å; I412-N414 VanDerWaalsContact O-N 3.16Å; N414-D416 VanDerWaalsContact CB-OD2 3.24Å; N414-D416 WeakPolarHBondContact CB-OD2 3.33Å; N414-D416 PolarHBondContact ND2-OD2 3.14Å; N414-L420 CarbonylContact O-C 3.6Å; N414-L420 WeakPolarHBondContact OD1-CB 3.01Å; N414-L420 WeakPolarHBondContact OD1-CD1 3.3Å; N414-S421 PolarHBondContact O-N 3.47Å; N414-T424 PolarHBondContact O-OG1 3.38Å
415	F	92	Very high	88.5	Confident	1 Å²	1	24.6 Å²	24.6	0%	0.004	13%	0.13	C	C	.	.	S	Bend	trans	-111.2	25.2	-178.5	-67	-82.9	0	0	0	111.9	L327 F330 S331 L334 S421 T424 V425 V437 V441 F454	L327-F415 WeakPolarHBondContact CD1-O 3.43Å; F330-F415 HydrophobicContact CB-CB 3.87Å; F330-F415 HydrophobicContact CB-CD2 3.85Å; F330-F415 HydrophobicContact CB-CG 3.94Å; F330-F415 HydrophobicContact CD2-CD1 4.38Å; F330-F415 HydrophobicContact CD2-CD2 4.08Å; F330-F415 HydrophobicContact CD2-CE1 4.44Å; F330-F415 HydrophobicContact CD2-CE2 4.14Å; F330-F415 HydrophobicContact CD2-CG 4.21Å; F330-F415 HydrophobicContact CD2-CZ 4.33Å; F330-F415 HydrophobicContact CG-CD2 4.4Å; S331-F415 WeakPolarHBondContact CA-O 3.37Å; S331-F415 WeakPolarHBondContact CB-O 3.35Å; L334-F415 HydrophobicContact CD1-CD2 4.18Å; F415-S421 WeakPolarHBondContact CD1-OG 3.31Å; F415-T424 HydrophobicContact CE1-CG2 4.41Å; F415-T424 HydrophobicContact CE2-CG2 4.17Å; F415-T424 HydrophobicContact CZ-CG2 3.84Å; F415-V425 HydrophobicContact CE1-CG2 4.26Å; F415-V437 HydrophobicContact CE2-CG1 3.95Å; F415-V437 HydrophobicContact CZ-CG1 4.24Å; F415-V441 HydrophobicContact CE2-CG2 4.34Å; F415-F454 HydrophobicContact CZ-CZ 4.47Å
416	D	89	Confident	88.9	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.021	13%	0.13	C	C	.	.	S	Bend	trans	-89.7	-21.1	-168.2	-61	-39.1	0	0	0	113.8	G332 H335 N414 E1371	G332-D416 PolarHBondContact N-OD1 3.35Å; H335-D416 IonicContact CE1-OD2 3.97Å; H335-D416 PolarHBondContact CE1-OD2 3.23Å; H335-D416 IonicContact NE2-OD1 2.75Å; H335-D416 IonicContact NE2-OD2 3.22Å; H335-D416 PolarHBondContact NE2-OD2 3.28Å; N414-D416 VanDerWaalsContact CB-OD2 3.24Å; N414-D416 WeakPolarHBondContact CB-OD2 3.33Å; N414-D416 PolarHBondContact ND2-OD2 3.14Å; D416-E1371 HydrophobicContact CB-CB 4.01Å; D416-E1371 PolarHBondContact O-N 2.94Å
417	N	88.4	Confident	89.4	Confident	63 Å²	63	20.9 Å²	20.9	34%	0.337	11%	0.109	S	C	.	.	S	Bend	trans	-135.8	145.7	176.8	-73.8	-84.9	0	0	0	109.2	G419 L420 S421 V1370	N417-G419 PolarHBondContact O-N 3.49Å; N417-L420 PolarHBondContact O-N 3.39Å; N417-S421 VanDerWaalsContact O-CB 3.31Å; N417-S421 WeakPolarHBondContact O-CB 3.46Å; N417-S421 PolarHBondContact O-N 3.49Å; N417-V1370 WeakPolarHBondContact OD1-CG1 3.4Å
418	F	90.6	Very high	89.6	Confident	56 Å²	56	20.9 Å²	20.9	25%	0.246	11%	0.109	C	C	.	.	H	α-helix	trans	-53.6	-38.4	177.6	171.5	-102.7	0	0	0	113.6	I320 A323 I324 L327 M422 A1367	I320-F418 HydrophobicContact CG1-CZ 4.21Å; I320-F418 HydrophobicContact CG2-CE2 4.39Å; A323-F418 HydrophobicContact CB-CD2 4.5Å; A323-F418 HydrophobicContact CB-CE2 4.29Å; I324-F418 HydrophobicContact CD1-CE2 4.28Å; I324-F418 HydrophobicContact CG1-CD2 3.96Å; I324-F418 HydrophobicContact CG1-CE2 3.91Å; L327-F418 HydrophobicContact CD2-CB 4.13Å; F418-M422 HydrophobicContact CE1-SD 4.45Å; F418-M422 HydrophobicContact CZ-SD 4.35Å; F418-M422 VanDerWaalsContact O-CB 3.22Å; F418-M422 WeakPolarHBondContact O-CB 3.33Å; F418-M422 PolarHBondContact O-N 3.04Å; F418-A1367 HydrophobicContact CB-CB 4.36Å; F418-A1367 WeakPolarHBondContact CB-O 3.3Å; F418-A1367 HydrophobicContact CD1-CB 4.44Å; F418-A1367 HydrophobicContact CD2-CB 3.84Å; F418-A1367 HydrophobicContact CE2-CB 4.27Å; F418-A1367 HydrophobicContact CG-CB 3.94Å
419	G	87.9	Confident	89.7	Confident	24 Å²	24	21.1 Å²	21.1	25%	0.247	11%	0.11	C	C	.	.	H	α-helix	trans	-68.1	-42	179.1	0	0	0	0	0	114.4	N417 M422 L423	N417-G419 PolarHBondContact O-N 3.49Å; G419-M422 PolarHBondContact O-N 3.42Å; G419-L423 PolarHBondContact O-N 3.28Å
420	L	88.8	Confident	89.7	Confident	20 Å²	20	20.2 Å²	20.2	11%	0.105	11%	0.106	C	C	.	.	H	α-helix	trans	-76	-35.8	178.3	-63.1	174.8	0	0	0	111.5	N414 N417 M422 L423 T424 I811	N414-L420 CarbonylContact O-C 3.6Å; N414-L420 WeakPolarHBondContact OD1-CB 3.01Å; N414-L420 WeakPolarHBondContact OD1-CD1 3.3Å; N417-L420 PolarHBondContact O-N 3.39Å; L420-M422 VanDerWaalsContact C-N 3.34Å; L420-M422 PolarHBondContact O-N 2.75Å; L420-L423 PolarHBondContact O-N 2.93Å; L420-T424 WeakPolarHBondContact O-CB 3.45Å; L420-T424 PolarHBondContact O-N 2.67Å; L420-T424 PolarHBondContact O-OG1 3.07Å; L420-I811 HydrophobicContact CD2-CD1 4.12Å; L420-I811 HydrophobicContact CD2-CG1 4.32Å; L420-I811 HydrophobicContact CD2-CG2 4.31Å
421	S	92.3	Very high	89.9	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59	-44.7	168.1	-178.3	0	0	0	0	111.3	A323 N414 F415 N417 L423 T424 V425	A323-S421 VanDerWaalsContact CA-OG 3.27Å; A323-S421 WeakPolarHBondContact CA-OG 3.46Å; A323-S421 PolarHBondContact O-OG 2.93Å; N414-S421 PolarHBondContact O-N 3.47Å; F415-S421 WeakPolarHBondContact CD1-OG 3.31Å; N417-S421 VanDerWaalsContact O-CB 3.31Å; N417-S421 WeakPolarHBondContact O-CB 3.46Å; N417-S421 PolarHBondContact O-N 3.49Å; S421-L423 PolarHBondContact O-N 3Å; S421-T424 PolarHBondContact O-N 3.21Å; S421-V425 VanDerWaalsContact O-CB 3.32Å; S421-V425 WeakPolarHBondContact O-CB 3.38Å; S421-V425 VanDerWaalsContact O-CG2 3.28Å; S421-V425 WeakPolarHBondContact O-CG2 3.5Å; S421-V425 PolarHBondContact O-N 3.45Å
422	M	91.2	Very high	90	Very high	56 Å²	56	15.8 Å²	15.8	28%	0.276	9%	0.086	S	C	.	.	H	α-helix	trans	-63	-39	175.3	176.5	167.5	-179.3	0	0	112.6	I319 A323 F418 G419 L420 F426	I319-M422 HydrophobicContact CG2-CE 4.11Å; I319-M422 HydrophobicContact CG2-CG 3.71Å; I319-M422 HydrophobicContact CG2-SD 4.47Å; A323-M422 HydrophobicContact CB-CB 4.18Å; F418-M422 HydrophobicContact CE1-SD 4.45Å; F418-M422 HydrophobicContact CZ-SD 4.35Å; F418-M422 VanDerWaalsContact O-CB 3.22Å; F418-M422 WeakPolarHBondContact O-CB 3.33Å; F418-M422 PolarHBondContact O-N 3.04Å; G419-M422 PolarHBondContact O-N 3.42Å; L420-M422 VanDerWaalsContact C-N 3.34Å; L420-M422 PolarHBondContact O-N 2.75Å; M422-F426 WeakPolarHBondContact O-CB 3.47Å; M422-F426 PolarHBondContact O-N 3.02Å
423	L	91.3	Very high	89.9	Confident	14 Å²	14	15.2 Å²	15.2	7%	0.073	8%	0.082	C	C	.	.	H	α-helix	trans	-67.6	-44.6	175.6	-174.4	62.1	0	0	0	111.9	I412 G419 L420 S421 F426 Q427 M797 I801 C814 V818	I412-L423 HydrophobicContact CG2-CD2 4.19Å; G419-L423 PolarHBondContact O-N 3.28Å; L420-L423 PolarHBondContact O-N 2.93Å; S421-L423 PolarHBondContact O-N 3Å; L423-F426 PolarHBondContact O-N 3.4Å; L423-Q427 PolarHBondContact O-N 2.98Å; L423-M797 HydrophobicContact CD1-CE 4.27Å; L423-M797 HydrophobicContact CD1-SD 3.92Å; L423-M797 HydrophobicContact CD2-CE 4.2Å; L423-M797 HydrophobicContact CD2-SD 4.31Å; L423-M797 HydrophobicContact CG-CE 4.27Å; L423-M797 HydrophobicContact CG-SD 4.46Å; L423-I801 HydrophobicContact CD2-CD1 4.26Å; L423-C814 HydrophobicContact CD1-CB 4.06Å; L423-C814 HydrophobicContact CD2-CB 4.09Å; L423-V818 HydrophobicContact CD1-CG2 4.45Å
424	T	92.7	Very high	90	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-64.3	-40.4	177.9	-54.7	0	0	0	0	111.5	T413 N414 F415 L420 S421 Q427 C428 V437	T413-T424 WeakPolarHBondContact CA-OG1 3.34Å; N414-T424 PolarHBondContact O-OG1 3.38Å; F415-T424 HydrophobicContact CE1-CG2 4.41Å; F415-T424 HydrophobicContact CE2-CG2 4.17Å; F415-T424 HydrophobicContact CZ-CG2 3.84Å; L420-T424 WeakPolarHBondContact O-CB 3.45Å; L420-T424 PolarHBondContact O-N 2.67Å; L420-T424 PolarHBondContact O-OG1 3.07Å; S421-T424 PolarHBondContact O-N 3.21Å; T424-Q427 PolarHBondContact O-N 3.4Å; T424-C428 PolarHBondContact O-N 3.5Å; T424-C428 PolarHBondContact O-SG 3.33Å; T424-V437 HydrophobicContact CG2-CG1 3.85Å; T424-V437 HydrophobicContact CG2-CG2 4.27Å
425	V	93.5	Very high	90.2	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.006	8%	0.08	C	C	.	.	H	α-helix	trans	-67.5	-40.9	173.8	165.1	0	0	0	0	111.7	I319 A323 F415 S421 C428 I429 Y453 M457	I319-V425 HydrophobicContact CB-CG1 4.44Å; I319-V425 HydrophobicContact CG1-CG1 4.5Å; I319-V425 HydrophobicContact CG2-CG1 4.09Å; A323-V425 HydrophobicContact CB-CG2 4.38Å; F415-V425 HydrophobicContact CE1-CG2 4.26Å; S421-V425 VanDerWaalsContact O-CB 3.32Å; S421-V425 WeakPolarHBondContact O-CB 3.38Å; S421-V425 VanDerWaalsContact O-CG2 3.28Å; S421-V425 WeakPolarHBondContact O-CG2 3.5Å; S421-V425 PolarHBondContact O-N 3.45Å; V425-C428 PolarHBondContact O-N 3.33Å; V425-I429 HydrophobicContact CG1-CD1 3.8Å; V425-I429 WeakPolarHBondContact O-CB 3.47Å; V425-I429 VanDerWaalsContact O-CG1 3.32Å; V425-I429 WeakPolarHBondContact O-CG1 3.47Å; V425-I429 PolarHBondContact O-N 3.43Å; V425-Y453 WeakPolarHBondContact CG2-OH 3.35Å; V425-M457 HydrophobicContact CB-SD 4.29Å; V425-M457 HydrophobicContact CG1-SD 3.89Å; V425-M457 HydrophobicContact CG2-SD 4.01Å
426	F	91.1	Very high	90.1	Very high	22 Å²	22	15.6 Å²	15.6	10%	0.096	8%	0.084	C	C	.	.	H	α-helix	trans	-59.3	-49.1	173.1	172.9	-98.2	0	0	0	110.9	I319 M422 L423 C428 I429 T430 W793 V818 F821 I822	I319-F426 HydrophobicContact CD1-CD2 4.25Å; M422-F426 WeakPolarHBondContact O-CB 3.47Å; M422-F426 PolarHBondContact O-N 3.02Å; L423-F426 PolarHBondContact O-N 3.4Å; F426-C428 PolarHBondContact O-N 2.83Å; F426-I429 WeakPolarHBondContact O-CB 3.39Å; F426-I429 PolarHBondContact O-N 3.14Å; F426-I429 VanDerWaalsContact O-N 3.12Å; F426-T430 HydrophobicContact CE1-CG2 4.06Å; F426-T430 HydrophobicContact CZ-CG2 4.06Å; F426-T430 WeakPolarHBondContact O-CG2 3.31Å; F426-T430 PolarHBondContact O-N 3.01Å; F426-T430 VanDerWaalsContact O-N 3.14Å; F426-W793 HydrophobicContact CD1-CH2 4Å; F426-W793 AromaticContact CE1-CH2 3.72Å; F426-W793 HydrophobicContact CE1-CH2 3.72Å; F426-W793 HydrophobicContact CE1-CZ2 4.25Å; F426-W793 HydrophobicContact CE1-CZ3 4.44Å; F426-V818 HydrophobicContact CD1-CG2 4.12Å; F426-V818 HydrophobicContact CE1-CB 4.49Å; F426-V818 HydrophobicContact CE1-CG1 4.4Å; F426-V818 HydrophobicContact CE1-CG2 3.82Å; F426-V818 HydrophobicContact CZ-CG1 4.15Å; F426-V818 HydrophobicContact CZ-CG2 4.39Å; F426-F821 HydrophobicContact CZ-CD1 4.06Å; F426-I822 HydrophobicContact CE2-CD1 3.77Å; F426-I822 HydrophobicContact CE2-CG1 4.13Å; F426-I822 HydrophobicContact CZ-CD1 3.92Å; F426-I822 HydrophobicContact CZ-CG1 3.89Å
427	Q	92	Very high	90.2	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.009	8%	0.083	C	C	.	.	H	α-helix	trans	-53.6	-55.3	175.3	178.2	-173.3	-28.9	0	0	111.1	L423 T424 I429 T430 E432 W793 N794 Y798	L423-Q427 PolarHBondContact O-N 2.98Å; T424-Q427 PolarHBondContact O-N 3.4Å; Q427-I429 PolarHBondContact O-N 3.28Å; Q427-I429 VanDerWaalsContact O-N 3.11Å; Q427-T430 WeakPolarHBondContact O-CB 3.41Å; Q427-T430 PolarHBondContact O-N 3Å; Q427-T430 PolarHBondContact O-OG1 3.28Å; Q427-E432 WeakPolarHBondContact CG-O 3.37Å; Q427-E432 PolarHBondContact NE2-O 3.23Å; Q427-W793 HydrophobicContact CB-CH2 4.34Å; Q427-W793 HydrophobicContact CB-CZ2 4.37Å; Q427-W793 HydrophobicContact CG-CZ2 4.26Å; Q427-N794 HydrophobicContact CG-CB 4.48Å; Q427-Y798 VanDerWaalsContact CD-OH 3.23Å; Q427-Y798 PolarHBondContact NE2-OH 2.83Å; Q427-Y798 PolarHBondContact OE1-OH 3.28Å
428	C	91.9	Very high	90.4	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.3	-25.7	-179	-62.6	0	0	0	0	113.4	T424 V425 F426 M431 W434 M457	T424-C428 PolarHBondContact O-N 3.5Å; T424-C428 PolarHBondContact O-SG 3.33Å; V425-C428 PolarHBondContact O-N 3.33Å; F426-C428 PolarHBondContact O-N 2.83Å; C428-M431 PolarHBondContact O-N 3.5Å; C428-W434 HydrophobicContact CB-CB 4.01Å; C428-M457 HydrophobicContact CB-CE 3.38Å; C428-M457 HydrophobicContact CB-SD 4.34Å
429	I	89.8	Confident	90.4	Very high	8 Å²	8	10.7 Å²	10.7	4%	0.041	6%	0.059	C	C	.	.	H	α-helix	trans	-75.8	-26.7	175.7	-81.2	171.4	0	0	0	112.5	I319 V425 F426 Q427 M431 M457 G461	I319-I429 HydrophobicContact CG1-CD1 3.77Å; V425-I429 HydrophobicContact CG1-CD1 3.8Å; V425-I429 WeakPolarHBondContact O-CB 3.47Å; V425-I429 VanDerWaalsContact O-CG1 3.32Å; V425-I429 WeakPolarHBondContact O-CG1 3.47Å; V425-I429 PolarHBondContact O-N 3.43Å; F426-I429 WeakPolarHBondContact O-CB 3.39Å; F426-I429 PolarHBondContact O-N 3.14Å; F426-I429 VanDerWaalsContact O-N 3.12Å; Q427-I429 PolarHBondContact O-N 3.28Å; Q427-I429 VanDerWaalsContact O-N 3.11Å; I429-M431 PolarHBondContact O-N 3.04Å; I429-M457 HydrophobicContact CD1-CG 4.23Å; I429-M457 HydrophobicContact CG1-CG 3.92Å; I429-G461 WeakPolarHBondContact CG2-O 3.39Å
430	T	87.1	Confident	90.6	Very high	20 Å²	20	10 Å²	10	12%	0.123	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-7.9	170.8	69.9	0	0	0	0	113.8	F426 Q427 E432 W793 F821	F426-T430 HydrophobicContact CE1-CG2 4.06Å; F426-T430 HydrophobicContact CZ-CG2 4.06Å; F426-T430 WeakPolarHBondContact O-CG2 3.31Å; F426-T430 PolarHBondContact O-N 3.01Å; F426-T430 VanDerWaalsContact O-N 3.14Å; Q427-T430 WeakPolarHBondContact O-CB 3.41Å; Q427-T430 PolarHBondContact O-N 3Å; Q427-T430 PolarHBondContact O-OG1 3.28Å; T430-E432 PolarHBondContact O-N 3.22Å; T430-E432 WeakPolarHBondContact OG1-CB 3.31Å; T430-E432 PolarHBondContact OG1-N 3.02Å; T430-W793 HydrophobicContact CG2-CZ2 3.66Å; T430-W793 WeakPolarHBondContact OG1-CZ2 3.45Å; T430-W793 PolarHBondContact OG1-NE1 3.37Å; T430-F821 VanDerWaalsContact CB-CZ 3.47Å; T430-F821 HydrophobicContact CG2-CD1 4.07Å; T430-F821 HydrophobicContact CG2-CE1 3.38Å; T430-F821 HydrophobicContact CG2-CE2 4.06Å; T430-F821 HydrophobicContact CG2-CZ 3.4Å; T430-F821 VanDerWaalsContact CG2-CZ 3.4Å
431	M	86.6	Confident	90.7	Very high	15 Å²	15	9 Å²	9	7%	0.074	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	7	-168.1	-51.2	-173.7	-63.2	0	0	115	C428 I429 W434 I458 S462 F463 T1532 F2463 E2465	C428-M431 PolarHBondContact O-N 3.5Å; I429-M431 PolarHBondContact O-N 3.04Å; M431-W434 VanDerWaalsContact O-CD1 3.27Å; M431-I458 HydrophobicContact CG-CG2 4.49Å; M431-I458 HydrophobicContact SD-CG2 4.49Å; M431-S462 PolarHBondContact SD-OG 3.42Å; M431-F463 HydrophobicContact SD-CD2 4.48Å; M431-F463 HydrophobicContact SD-CE2 3.9Å; M431-T1532 HydrophobicContact SD-CG2 4.02Å; M431-F2463 WeakPolarHBondContact O-CE1 3.22Å; M431-F2463 VanDerWaalsContact O-CZ 3.3Å; M431-F2463 WeakPolarHBondContact O-CZ 3.27Å; M431-E2465 HydrophobicContact CE-CB 4Å; M431-E2465 HydrophobicContact CE-CG 3.67Å
432	E	87.2	Confident	90.5	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.005	5%	0.046	C	C	.	.	S	Bend	trans	-88.3	135	173	175.5	56.8	-103.6	0	0	112.7	Q427 T430 W434 D792 W793 N794 F2463	Q427-E432 WeakPolarHBondContact CG-O 3.37Å; Q427-E432 PolarHBondContact NE2-O 3.23Å; T430-E432 PolarHBondContact O-N 3.22Å; T430-E432 WeakPolarHBondContact OG1-CB 3.31Å; T430-E432 PolarHBondContact OG1-N 3.02Å; E432-W434 PolarHBondContact O-N 3.35Å; E432-W434 VanDerWaalsContact O-N 3.14Å; E432-D792 PolarHBondContact OE2-N 3.43Å; E432-W793 VanDerWaalsContact CB-NE1 3.26Å; E432-W793 HydrophobicContact CG-CG 4.45Å; E432-N794 HydrophobicContact CG-CB 3.93Å; E432-N794 VanDerWaalsContact CG-CG 3.46Å; E432-N794 WeakPolarHBondContact CG-ND2 3.29Å; E432-N794 PolarHBondContact OE1-ND2 3.01Å; E432-F2463 VanDerWaalsContact CA-CE1 3.46Å; E432-F2463 HydrophobicContact CB-CE1 4.34Å; E432-F2463 VanDerWaalsContact CD-CG 3.49Å; E432-F2463 HydrophobicContact CG-CD1 4.49Å; E432-F2463 VanDerWaalsContact OE1-CD1 3.3Å; E432-F2463 WeakPolarHBondContact OE1-CD1 3.42Å; E432-F2463 WeakPolarHBondContact OE1-CD2 3.45Å; E432-F2463 WeakPolarHBondContact OE1-CE2 3.46Å; E432-F2463 WeakPolarHBondContact OE1-CG 3.44Å; E432-F2463 WeakPolarHBondContact OE2-CD1 3.41Å; E432-F2463 VanDerWaalsContact OE2-CG 3.3Å; E432-F2463 WeakPolarHBondContact OE2-CG 3.46Å
433	G	85.6	Confident	90.2	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.039	C	C	.	.	S	Bend	trans	55.1	23	176.8	0	0	0	0	0	116.7
434	W	92.8	Very high	89.9	Confident	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-80.4	-32	-168	74.6	-96.7	0	0	0	113.5	C428 M431 E432 Q436 V437 L438 F454 I458 F1528 T1532 E1534	C428-W434 HydrophobicContact CB-CB 4.01Å; M431-W434 VanDerWaalsContact O-CD1 3.27Å; E432-W434 PolarHBondContact O-N 3.35Å; E432-W434 VanDerWaalsContact O-N 3.14Å; W434-Q436 VanDerWaalsContact C-N 3.3Å; W434-V437 PolarHBondContact O-N 2.92Å; W434-L438 HydrophobicContact CE3-CD2 4.5Å; W434-L438 HydrophobicContact CZ3-CD2 3.8Å; W434-L438 PolarHBondContact O-N 2.86Å; W434-F454 HydrophobicContact CE3-CB 4.44Å; W434-I458 HydrophobicContact CD2-CD1 3.25Å; W434-I458 HydrophobicContact CD2-CG1 4.42Å; W434-I458 HydrophobicContact CE3-CD1 3.37Å; W434-I458 HydrophobicContact CG-CD1 3.77Å; W434-I458 HydrophobicContact CH2-CD1 4.01Å; W434-I458 HydrophobicContact CZ2-CD1 3.89Å; W434-I458 HydrophobicContact CZ3-CD1 3.75Å; W434-F1528 AromaticContact CH2-CD1 3.65Å; W434-F1528 HydrophobicContact CH2-CD1 3.65Å; W434-F1528 AromaticContact CH2-CE1 3.88Å; W434-F1528 HydrophobicContact CH2-CE1 3.88Å; W434-F1528 AromaticContact CZ2-CD1 3.72Å; W434-F1528 HydrophobicContact CZ2-CD1 3.72Å; W434-F1528 AromaticContact CZ2-CE1 3.82Å; W434-F1528 HydrophobicContact CZ2-CE1 3.82Å; W434-T1532 HydrophobicContact CZ2-CG2 4.31Å; W434-T1532 PolarHBondContact NE1-OG1 3.26Å; W434-T1532 VanDerWaalsContact NE1-OG1 3.13Å; W434-E1534 PolarHBondContact N-OE2 3.1Å; W434-E1534 PolarHBondContact NE1-OE2 2.83Å; W434-E1534 VanDerWaalsContact NE1-OE2 3.11Å
435	T	92.1	Very high	89.3	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-70.3	-30.9	175.9	75.7	0	0	0	0	111.4	V437 L438 Y439 R1529 E1534	T435-V437 PolarHBondContact O-N 2.94Å; T435-L438 CarbonylContact O-C 3.59Å; T435-L438 WeakPolarHBondContact O-CB 3.33Å; T435-L438 PolarHBondContact O-N 3.17Å; T435-Y439 WeakPolarHBondContact O-CB 3.46Å; T435-Y439 WeakPolarHBondContact O-CD1 3.39Å; T435-Y439 PolarHBondContact O-N 3.44Å; T435-R1529 HydrophobicContact CG2-CB 4.05Å; T435-R1529 HydrophobicContact CG2-CG 3.87Å; T435-R1529 PolarHBondContact OG1-NH1 3.17Å; T435-E1534 WeakPolarHBondContact CA-OE1 3.44Å; T435-E1534 VanDerWaalsContact CB-OE1 3.26Å; T435-E1534 WeakPolarHBondContact CB-OE1 3.47Å; T435-E1534 VanDerWaalsContact CG2-CD 3.43Å; T435-E1534 HydrophobicContact CG2-CG 4.04Å; T435-E1534 VanDerWaalsContact CG2-OE2 3.25Å; T435-E1534 WeakPolarHBondContact CG2-OE2 3.35Å; T435-E1534 VanDerWaalsContact N-CD 3.31Å; T435-E1534 PolarHBondContact N-OE1 3.47Å; T435-E1534 PolarHBondContact N-OE2 3.29Å; T435-E1534 PolarHBondContact OG1-OE1 2.79Å
436	Q	89.6	Confident	88.7	Confident	20 Å²	20	12 Å²	12	9%	0.093	6%	0.062	C	C	.	.	H	α-helix	trans	-55.4	-51.6	173.3	-50.4	177.7	10.9	0	0	110.6	W434 L438 Y439 W440 C2460	W434-Q436 VanDerWaalsContact C-N 3.3Å; Q436-L438 PolarHBondContact O-N 2.85Å; Q436-Y439 PolarHBondContact O-N 3.4Å; Q436-W440 HydrophobicContact CB-CH2 3.95Å; Q436-W440 HydrophobicContact CB-CZ2 4.2Å; Q436-W440 HydrophobicContact CB-CZ3 4.18Å; Q436-W440 VanDerWaalsContact O-CD2 3.3Å; Q436-W440 VanDerWaalsContact O-CG 3.32Å; Q436-W440 PolarHBondContact O-N 3.38Å; Q436-C2460 PolarHBondContact OE1-SG 3.45Å; Q436-C2460 VanDerWaalsContact OE1-SG 3.38Å
437	V	92.1	Very high	88	Confident	1 Å²	1	14.2 Å²	14.2	1%	0.006	7%	0.074	C	C	.	.	H	α-helix	trans	-65.3	-38.4	177.8	-172.1	0	0	0	0	111.7	F415 T424 W434 T435 W440 V441 F454	F415-V437 HydrophobicContact CE2-CG1 3.95Å; F415-V437 HydrophobicContact CZ-CG1 4.24Å; T424-V437 HydrophobicContact CG2-CG1 3.85Å; T424-V437 HydrophobicContact CG2-CG2 4.27Å; W434-V437 PolarHBondContact O-N 2.92Å; T435-V437 PolarHBondContact O-N 2.94Å; V437-W440 HydrophobicContact CG2-CE3 4.27Å; V437-W440 HydrophobicContact CG2-CZ3 4.16Å; V437-V441 WeakPolarHBondContact O-CG2 3.22Å; V437-V441 PolarHBondContact O-N 3.32Å; V437-V441 VanDerWaalsContact O-N 3.12Å; V437-F454 HydrophobicContact CB-CE1 4.11Å; V437-F454 HydrophobicContact CB-CZ 4.41Å; V437-F454 HydrophobicContact CG1-CE1 3.84Å; V437-F454 HydrophobicContact CG1-CZ 3.84Å
438	L	92.4	Very high	87.3	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.7	-43.6	172.2	168.2	63.1	0	0	0	112	W434 T435 Q436 V441 N442 P450 W451 F454 L1525	W434-L438 HydrophobicContact CE3-CD2 4.5Å; W434-L438 HydrophobicContact CZ3-CD2 3.8Å; W434-L438 PolarHBondContact O-N 2.86Å; T435-L438 CarbonylContact O-C 3.59Å; T435-L438 WeakPolarHBondContact O-CB 3.33Å; T435-L438 PolarHBondContact O-N 3.17Å; Q436-L438 PolarHBondContact O-N 2.85Å; L438-V441 PolarHBondContact O-N 3.12Å; L438-N442 WeakPolarHBondContact O-CB 3.41Å; L438-N442 VanDerWaalsContact O-CG 3.28Å; L438-N442 PolarHBondContact O-N 3.08Å; L438-P450 HydrophobicContact CD1-CB 4.02Å; L438-W451 HydrophobicContact CD1-CB 4.25Å; L438-F454 HydrophobicContact CB-CD1 4.36Å; L438-F454 HydrophobicContact CB-CD2 3.97Å; L438-F454 HydrophobicContact CB-CE2 4.27Å; L438-F454 HydrophobicContact CB-CG 4.04Å; L438-F454 HydrophobicContact CD1-CB 4.46Å; L438-F454 HydrophobicContact CD1-CD2 3.55Å; L438-F454 HydrophobicContact CD1-CE2 4.12Å; L438-F454 HydrophobicContact CD1-CG 4.2Å; L438-F454 HydrophobicContact CG-CD2 4.32Å; L438-L1525 HydrophobicContact CD2-CD1 4.23Å
439	Y	90.9	Very high	86.8	Confident	20 Å²	20	28.7 Å²	28.7	8%	0.078	14%	0.139	C	C	.	.	H	α-helix	trans	-67.2	-43.3	-178	-63.3	-7.1	0	0	0	110.8	T435 Q436 V441 N442 D443 N1514 N1515 L1525 R1529	T435-Y439 WeakPolarHBondContact O-CB 3.46Å; T435-Y439 WeakPolarHBondContact O-CD1 3.39Å; T435-Y439 PolarHBondContact O-N 3.44Å; Q436-Y439 PolarHBondContact O-N 3.4Å; Y439-V441 VanDerWaalsContact C-N 3.29Å; Y439-V441 PolarHBondContact O-N 3.37Å; Y439-N442 CarbonylContact O-C 3.55Å; Y439-N442 WeakPolarHBondContact O-CB 3.43Å; Y439-N442 PolarHBondContact O-N 2.95Å; Y439-N442 VanDerWaalsContact O-N 3.08Å; Y439-D443 VanDerWaalsContact O-CG 3.31Å; Y439-D443 PolarHBondContact O-N 2.87Å; Y439-N1514 HydrophobicContact CD1-CB 3.47Å; Y439-N1514 VanDerWaalsContact CD1-CB 3.47Å; Y439-N1514 HydrophobicContact CD2-CB 4.07Å; Y439-N1514 HydrophobicContact CE1-CB 3.74Å; Y439-N1514 HydrophobicContact CE2-CB 4.3Å; Y439-N1514 HydrophobicContact CG-CB 3.66Å; Y439-N1515 HydrophobicContact CE2-CB 4.32Å; Y439-N1515 WeakPolarHBondContact OH-CB 3.49Å; Y439-N1515 PolarHBondContact OH-OD1 2.86Å; Y439-L1525 HydrophobicContact CE1-CD2 4.42Å; Y439-R1529 PolarHBondContact OH-NH1 2.9Å
440	W	91	Very high	86.7	Confident	8 Å²	8	28.7 Å²	28.7	3%	0.03	14%	0.14	C	C	.	.	H	α-helix	trans	-58.8	-35.4	172.4	-68.5	-24	0	0	0	113.8	L334 P352 P408 N409 Q436 V437 S444 V2458	L334-W440 HydrophobicContact CD2-CB 4.43Å; P352-W440 VanDerWaalsContact CD-CD1 3.49Å; P352-W440 HydrophobicContact CG-CB 3.84Å; P352-W440 HydrophobicContact CG-CG 4.04Å; P408-W440 HydrophobicContact CB-CD2 3.69Å; P408-W440 HydrophobicContact CB-CE3 3.49Å; P408-W440 VanDerWaalsContact CB-CE3 3.49Å; P408-W440 HydrophobicContact CB-CG 4.44Å; P408-W440 HydrophobicContact CB-CH2 3.99Å; P408-W440 HydrophobicContact CB-CZ2 4.13Å; P408-W440 HydrophobicContact CB-CZ3 3.66Å; P408-W440 HydrophobicContact CG-CB 4.4Å; P408-W440 HydrophobicContact CG-CD2 3.76Å; P408-W440 HydrophobicContact CG-CE3 3.84Å; P408-W440 HydrophobicContact CG-CG 3.99Å; P408-W440 HydrophobicContact CG-CZ3 4.5Å; N409-W440 WeakPolarHBondContact ND2-CH2 3.46Å; Q436-W440 HydrophobicContact CB-CH2 3.95Å; Q436-W440 HydrophobicContact CB-CZ2 4.2Å; Q436-W440 HydrophobicContact CB-CZ3 4.18Å; Q436-W440 VanDerWaalsContact O-CD2 3.3Å; Q436-W440 VanDerWaalsContact O-CG 3.32Å; Q436-W440 PolarHBondContact O-N 3.38Å; V437-W440 HydrophobicContact CG2-CE3 4.27Å; V437-W440 HydrophobicContact CG2-CZ3 4.16Å; W440-S444 PolarHBondContact O-N 3.27Å; W440-S444 PolarHBondContact O-OG 3.45Å; W440-V2458 HydrophobicContact CZ2-CG1 4.14Å
441	V	90.6	Very high	86.8	Confident	1 Å²	1	33 Å²	33	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-77.3	-33.8	173.3	179.2	0	0	0	0	111.9	F330 L334 F415 V437 L438 Y439 S444 Q445 P450 F454	F330-V441 HydrophobicContact CD1-CG1 3.64Å; F330-V441 HydrophobicContact CE1-CG1 3.42Å; F330-V441 VanDerWaalsContact CE1-CG1 3.42Å; F330-V441 HydrophobicContact CE2-CG1 4.36Å; F330-V441 HydrophobicContact CG-CG1 4.22Å; F330-V441 HydrophobicContact CZ-CG1 3.81Å; L334-V441 HydrophobicContact CD2-CG2 4.49Å; F415-V441 HydrophobicContact CE2-CG2 4.34Å; V437-V441 WeakPolarHBondContact O-CG2 3.22Å; V437-V441 PolarHBondContact O-N 3.32Å; V437-V441 VanDerWaalsContact O-N 3.12Å; L438-V441 PolarHBondContact O-N 3.12Å; Y439-V441 VanDerWaalsContact C-N 3.29Å; Y439-V441 PolarHBondContact O-N 3.37Å; V441-S444 PolarHBondContact O-OG 2.97Å; V441-Q445 WeakPolarHBondContact O-CB 3.46Å; V441-Q445 PolarHBondContact O-N 3.45Å; V441-P450 HydrophobicContact CB-CB 4.39Å; V441-P450 HydrophobicContact CG1-CB 3.69Å; V441-P450 HydrophobicContact CG1-CG 3.75Å; V441-F454 HydrophobicContact CB-CE2 4.26Å; V441-F454 HydrophobicContact CG2-CE2 4.27Å; V441-F454 HydrophobicContact CG2-CZ 4.19Å
442	N	88.4	Confident	86.9	Confident	6 Å²	6	36.5 Å²	36.5	3%	0.032	17%	0.172	C	C	.	.	H	α-helix	trans	-65.5	-41.1	173.5	-76.1	-12.9	0	0	0	112.3	L438 Y439 G446 M447 N1514	L438-N442 WeakPolarHBondContact O-CB 3.41Å; L438-N442 VanDerWaalsContact O-CG 3.28Å; L438-N442 PolarHBondContact O-N 3.08Å; Y439-N442 CarbonylContact O-C 3.55Å; Y439-N442 WeakPolarHBondContact O-CB 3.43Å; Y439-N442 PolarHBondContact O-N 2.95Å; Y439-N442 VanDerWaalsContact O-N 3.08Å; N442-G446 CarbonylContact O-C 3.5Å; N442-G446 WeakPolarHBondContact O-CA 3.48Å; N442-G446 PolarHBondContact O-N 3.43Å; N442-M447 HydrophobicContact CB-CG 4.41Å; N442-N1514 WeakPolarHBondContact CB-OD1 3.32Å; N442-N1514 PolarHBondContact ND2-OD1 3.38Å
443	D	86	Confident	87.1	Confident	26 Å²	26	37.2 Å²	37.2	14%	0.139	18%	0.175	C	C	.	.	H	α-helix	trans	-75	-28.6	-176.4	-66.9	-21.5	0	0	0	111.8	P352 L361 Y439 N1514	P352-D443 CarbonylContact O-C 3.32Å; P352-D443 VanDerWaalsContact O-C 3.23Å; P352-D443 WeakPolarHBondContact O-CB 3.02Å; L361-D443 HydrophobicContact CD1-CB 3.83Å; L361-D443 HydrophobicContact CD2-CB 4.37Å; Y439-D443 VanDerWaalsContact O-CG 3.31Å; Y439-D443 PolarHBondContact O-N 2.87Å; D443-N1514 PolarHBondContact OD1-ND2 2.91Å; D443-N1514 PolarHBondContact OD2-ND2 3.09Å
444	S	84.8	Confident	87.5	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.014	18%	0.175	C	C	.	.	H	α-helix	trans	-85.6	-37.6	175	56.8	0	0	0	0	114.6	P352 S354 W440 V441	P352-S444 PolarHBondContact O-N 2.85Å; S354-S444 VanDerWaalsContact CB-O 3.28Å; S354-S444 WeakPolarHBondContact CB-O 3.38Å; S354-S444 PolarHBondContact OG-O 2.73Å; W440-S444 PolarHBondContact O-N 3.27Å; W440-S444 PolarHBondContact O-OG 3.45Å; V441-S444 PolarHBondContact O-OG 2.97Å
445	Q	80.4	Confident	87.4	Confident	81 Å²	81	38.8 Å²	38.8	38%	0.379	18%	0.183	S	C	.	.	H	α-helix	trans	-113.1	-12	-175.3	-62.1	-58.7	-91.3	0	0	115.5	V441	V441-Q445 WeakPolarHBondContact O-CB 3.46Å; V441-Q445 PolarHBondContact O-N 3.45Å
446	G	79.5	Confident	87.3	Confident	18 Å²	18	40.8 Å²	40.8	19%	0.186	20%	0.197	C	C	.	.			trans	91.8	146.5	-174.9	0	0	0	0	0	113.5	N442 L448 P450	N442-G446 CarbonylContact O-C 3.5Å; N442-G446 WeakPolarHBondContact O-CA 3.48Å; N442-G446 PolarHBondContact O-N 3.43Å; G446-L448 VanDerWaalsContact C-N 3.26Å; G446-L448 PolarHBondContact O-N 3.07Å; G446-L448 VanDerWaalsContact O-N 3.09Å; G446-P450 WeakPolarHBondContact O-CD 3.41Å
447	M	78.1	Confident	87.3	Confident	70 Å²	70	39.9 Å²	39.9	35%	0.345	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.4	-167.3	-48.6	175.3	115.4	0	0	116.4	N442 Y449 W451 R1513 N1514 Q1522	N442-M447 HydrophobicContact CB-CG 4.41Å; M447-Y449 PolarHBondContact O-N 2.92Å; M447-W451 VanDerWaalsContact O-CD1 3.28Å; M447-R1513 WeakPolarHBondContact CE-O 3.33Å; M447-N1514 HydrophobicContact CE-CB 4.46Å; M447-N1514 WeakPolarHBondContact CE-OD1 3.47Å; M447-Q1522 VanDerWaalsContact CE-NE2 3.26Å
448	L	76.6	Confident	87.2	Confident	134 Å²	134	39.8 Å²	39.8	70%	0.702	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-30.9	-160.8	-71.4	173.8	0	0	0	115.2	G446 W451	G446-L448 VanDerWaalsContact C-N 3.26Å; G446-L448 PolarHBondContact O-N 3.07Å; G446-L448 VanDerWaalsContact O-N 3.09Å; L448-W451 PolarHBondContact O-NE1 3.11Å
449	Y	81.5	Confident	86.8	Confident	171 Å²	171	42.9 Å²	42.9	67%	0.671	21%	0.208	S	C	*	.	S	Bend	trans	-123.9	-32.9	-170.8	-60.7	-69.7	0	0	0	116	M447 W451 I452	M447-Y449 PolarHBondContact O-N 2.92Å; Y449-W451 VanDerWaalsContact C-N 3.32Å; Y449-W451 PolarHBondContact O-N 3.01Å; Y449-I452 WeakPolarHBondContact O-CB 3.25Å; Y449-I452 PolarHBondContact O-N 3.34Å; Y449-I452 VanDerWaalsContact O-N 3.12Å
450	P	87.9	Confident	86.3	Confident	8 Å²	8	45 Å²	45	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-57.3	-39.1	-174.1	-29	36.6	0	0	0	114.5	L438 V441 G446 I452 Y453 F454	L438-P450 HydrophobicContact CD1-CB 4.02Å; V441-P450 HydrophobicContact CB-CB 4.39Å; V441-P450 HydrophobicContact CG1-CB 3.69Å; V441-P450 HydrophobicContact CG1-CG 3.75Å; G446-P450 WeakPolarHBondContact O-CD 3.41Å; P450-I452 PolarHBondContact O-N 3.05Å; P450-Y453 WeakPolarHBondContact O-CB 3.33Å; P450-Y453 PolarHBondContact O-N 3.33Å; P450-F454 WeakPolarHBondContact O-CD2 3.33Å; P450-F454 PolarHBondContact O-N 2.92Å
451	W	88.7	Confident	85.7	Confident	112 Å²	112	44.7 Å²	44.7	42%	0.424	22%	0.219	S	C	.	.	H	α-helix	trans	-54.5	-28.5	178.8	68.5	-88.8	0	0	0	113.8	L438 M447 L448 Y449 F454 I455 L1525	L438-W451 HydrophobicContact CD1-CB 4.25Å; M447-W451 VanDerWaalsContact O-CD1 3.28Å; L448-W451 PolarHBondContact O-NE1 3.11Å; Y449-W451 VanDerWaalsContact C-N 3.32Å; Y449-W451 PolarHBondContact O-N 3.01Å; W451-F454 PolarHBondContact O-N 2.95Å; W451-I455 HydrophobicContact CE3-CD1 4.12Å; W451-I455 WeakPolarHBondContact O-CB 3.21Å; W451-I455 WeakPolarHBondContact O-CG1 3.13Å; W451-I455 PolarHBondContact O-N 3.34Å; W451-L1525 HydrophobicContact CB-CD1 4.39Å
452	I	89.5	Confident	84.9	Confident	87 Å²	87	44.9 Å²	44.9	45%	0.446	22%	0.221	S	C	.	.	H	α-helix	trans	-67.1	-39.2	177.2	-54.9	177.8	0	0	0	110.6	Y449 P450 S456	Y449-I452 WeakPolarHBondContact O-CB 3.25Å; Y449-I452 PolarHBondContact O-N 3.34Å; Y449-I452 VanDerWaalsContact O-N 3.12Å; P450-I452 PolarHBondContact O-N 3.05Å; I452-S456 WeakPolarHBondContact O-CB 3.17Å; I452-S456 PolarHBondContact O-N 2.72Å; I452-S456 PolarHBondContact O-OG 3.04Å
453	Y	91.4	Very high	84	Confident	16 Å²	16	46.4 Å²	46.4	6%	0.063	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-55.2	174.4	171.9	-94.7	0	0	0	110.1	Y322 V325 F330 V425 P450 S456 M457	Y322-Y453 HydrophobicContact CD1-CD2 4.02Å; Y322-Y453 AromaticContact CD1-CE2 3.61Å; Y322-Y453 HydrophobicContact CD1-CE2 3.61Å; Y322-Y453 HydrophobicContact CE1-CD2 4.28Å; Y322-Y453 HydrophobicContact CE1-CE2 4.32Å; Y322-Y453 PolarHBondContact O-OH 3.26Å; V325-Y453 HydrophobicContact CB-CE2 4.04Å; V325-Y453 HydrophobicContact CG1-CD2 3.7Å; V325-Y453 HydrophobicContact CG1-CE2 3.6Å; F330-Y453 AromaticContact CE2-CD1 3.92Å; F330-Y453 HydrophobicContact CE2-CD1 3.92Å; F330-Y453 HydrophobicContact CE2-CE1 4.02Å; F330-Y453 HydrophobicContact CE2-CG 4.19Å; F330-Y453 HydrophobicContact CZ-CD1 4.49Å; V425-Y453 WeakPolarHBondContact CG2-OH 3.35Å; P450-Y453 WeakPolarHBondContact O-CB 3.33Å; P450-Y453 PolarHBondContact O-N 3.33Å; Y453-S456 PolarHBondContact O-N 3.33Å; Y453-S456 PolarHBondContact O-OG 3.03Å; Y453-M457 HydrophobicContact CD1-CE 4.43Å; Y453-M457 HydrophobicContact CE1-CE 3.93Å; Y453-M457 HydrophobicContact CE1-SD 4.18Å; Y453-M457 VanDerWaalsContact O-CB 3.29Å; Y453-M457 WeakPolarHBondContact O-CB 3.02Å; Y453-M457 PolarHBondContact O-N 2.89Å
454	F	93	Very high	83.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-48.8	-176.3	-70.3	-85.5	0	0	0	113.3	F415 W434 V437 L438 V441 P450 W451 S456 M457 I458	F415-F454 HydrophobicContact CZ-CZ 4.47Å; W434-F454 HydrophobicContact CE3-CB 4.44Å; V437-F454 HydrophobicContact CB-CE1 4.11Å; V437-F454 HydrophobicContact CB-CZ 4.41Å; V437-F454 HydrophobicContact CG1-CE1 3.84Å; V437-F454 HydrophobicContact CG1-CZ 3.84Å; L438-F454 HydrophobicContact CB-CD1 4.36Å; L438-F454 HydrophobicContact CB-CD2 3.97Å; L438-F454 HydrophobicContact CB-CE2 4.27Å; L438-F454 HydrophobicContact CB-CG 4.04Å; L438-F454 HydrophobicContact CD1-CB 4.46Å; L438-F454 HydrophobicContact CD1-CD2 3.55Å; L438-F454 HydrophobicContact CD1-CE2 4.12Å; L438-F454 HydrophobicContact CD1-CG 4.2Å; L438-F454 HydrophobicContact CG-CD2 4.32Å; V441-F454 HydrophobicContact CB-CE2 4.26Å; V441-F454 HydrophobicContact CG2-CE2 4.27Å; V441-F454 HydrophobicContact CG2-CZ 4.19Å; P450-F454 WeakPolarHBondContact O-CD2 3.33Å; P450-F454 PolarHBondContact O-N 2.92Å; W451-F454 PolarHBondContact O-N 2.95Å; F454-S456 VanDerWaalsContact C-N 3.34Å; F454-S456 PolarHBondContact O-N 3.25Å; F454-M457 HydrophobicContact CD1-CE 3.59Å; F454-M457 HydrophobicContact CE1-CE 4Å; F454-M457 HydrophobicContact CG-CE 4.41Å; F454-M457 WeakPolarHBondContact O-CB 3.25Å; F454-M457 PolarHBondContact O-N 3.32Å; F454-M457 VanDerWaalsContact O-N 3.16Å; F454-I458 WeakPolarHBondContact O-CD1 3.46Å; F454-I458 WeakPolarHBondContact O-CG1 3.19Å; F454-I458 PolarHBondContact O-N 2.82Å
455	I	90.8	Very high	82.4	Confident	34 Å²	34	48.7 Å²	48.7	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-36	-179.8	-64.6	-173.5	0	0	0	111.4	W451 I459 F1528	W451-I455 HydrophobicContact CE3-CD1 4.12Å; W451-I455 WeakPolarHBondContact O-CB 3.21Å; W451-I455 WeakPolarHBondContact O-CG1 3.13Å; W451-I455 PolarHBondContact O-N 3.34Å; I455-I459 HydrophobicContact CG2-CD1 3.69Å; I455-I459 HydrophobicContact CG2-CG1 4.37Å; I455-I459 WeakPolarHBondContact O-CB 3.28Å; I455-I459 VanDerWaalsContact O-CG1 3.28Å; I455-I459 WeakPolarHBondContact O-CG1 3.13Å; I455-I459 PolarHBondContact O-N 2.9Å; I455-F1528 HydrophobicContact CD1-CD1 4.33Å; I455-F1528 HydrophobicContact CG1-CD1 4.32Å; I455-F1528 HydrophobicContact CG1-CE1 4.12Å; I455-F1528 HydrophobicContact CG2-CE1 4.46Å; I455-F1528 HydrophobicContact CG2-CE2 4.44Å; I455-F1528 HydrophobicContact CG2-CZ 4.14Å
456	S	89.4	Confident	81.6	Confident	41 Å²	41	47.3 Å²	47.3	29%	0.287	23%	0.23	S	C	.	.	H	α-helix	trans	-67.7	-39	173.3	73	0	0	0	0	112.4	Y322 I452 Y453 F454 I460	Y322-S456 PolarHBondContact OH-O 3.5Å; Y322-S456 PolarHBondContact OH-OG 2.89Å; I452-S456 WeakPolarHBondContact O-CB 3.17Å; I452-S456 PolarHBondContact O-N 2.72Å; I452-S456 PolarHBondContact O-OG 3.04Å; Y453-S456 PolarHBondContact O-N 3.33Å; Y453-S456 PolarHBondContact O-OG 3.03Å; F454-S456 VanDerWaalsContact C-N 3.34Å; F454-S456 PolarHBondContact O-N 3.25Å; S456-I460 WeakPolarHBondContact O-CB 3.32Å; S456-I460 WeakPolarHBondContact O-CG1 3.49Å; S456-I460 PolarHBondContact O-N 3.17Å
457	M	90.5	Very high	80.9	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-40.3	176.4	-175.5	171.2	55.6	0	0	111.9	Y322 V425 C428 I429 Y453 F454 G461	Y322-M457 HydrophobicContact CD1-CB 3.67Å; Y322-M457 HydrophobicContact CD1-CG 3.78Å; Y322-M457 HydrophobicContact CD1-SD 3.96Å; Y322-M457 HydrophobicContact CD2-CG 4.47Å; Y322-M457 HydrophobicContact CE1-CB 3.51Å; Y322-M457 HydrophobicContact CE1-CG 4.1Å; Y322-M457 HydrophobicContact CG-CB 4.34Å; Y322-M457 HydrophobicContact CG-CG 4Å; Y322-M457 HydrophobicContact CG-SD 4.2Å; Y322-M457 PolarHBondContact OH-N 3.22Å; V425-M457 HydrophobicContact CB-SD 4.29Å; V425-M457 HydrophobicContact CG1-SD 3.89Å; V425-M457 HydrophobicContact CG2-SD 4.01Å; C428-M457 HydrophobicContact CB-CE 3.38Å; C428-M457 HydrophobicContact CB-SD 4.34Å; I429-M457 HydrophobicContact CD1-CG 4.23Å; I429-M457 HydrophobicContact CG1-CG 3.92Å; Y453-M457 HydrophobicContact CD1-CE 4.43Å; Y453-M457 HydrophobicContact CE1-CE 3.93Å; Y453-M457 HydrophobicContact CE1-SD 4.18Å; Y453-M457 VanDerWaalsContact O-CB 3.29Å; Y453-M457 WeakPolarHBondContact O-CB 3.02Å; Y453-M457 PolarHBondContact O-N 2.89Å; F454-M457 HydrophobicContact CD1-CE 3.59Å; F454-M457 HydrophobicContact CE1-CE 4Å; F454-M457 HydrophobicContact CG-CE 4.41Å; F454-M457 WeakPolarHBondContact O-CB 3.25Å; F454-M457 PolarHBondContact O-N 3.32Å; F454-M457 VanDerWaalsContact O-N 3.16Å; M457-G461 WeakPolarHBondContact O-CA 3.29Å; M457-G461 PolarHBondContact O-N 2.8Å
458	I	89.4	Confident	80.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-72.1	-46.4	178.8	-66.6	156.4	0	0	0	110.7	M431 W434 F454 I460 S462 F463 F1528 T1532	M431-I458 HydrophobicContact CG-CG2 4.49Å; M431-I458 HydrophobicContact SD-CG2 4.49Å; W434-I458 HydrophobicContact CD2-CD1 3.25Å; W434-I458 HydrophobicContact CD2-CG1 4.42Å; W434-I458 HydrophobicContact CE3-CD1 3.37Å; W434-I458 HydrophobicContact CG-CD1 3.77Å; W434-I458 HydrophobicContact CH2-CD1 4.01Å; W434-I458 HydrophobicContact CZ2-CD1 3.89Å; W434-I458 HydrophobicContact CZ3-CD1 3.75Å; F454-I458 WeakPolarHBondContact O-CD1 3.46Å; F454-I458 WeakPolarHBondContact O-CG1 3.19Å; F454-I458 PolarHBondContact O-N 2.82Å; I458-I460 VanDerWaalsContact C-N 3.32Å; I458-I460 PolarHBondContact O-N 3.35Å; I458-S462 WeakPolarHBondContact O-CA 3.39Å; I458-S462 WeakPolarHBondContact O-CB 3.47Å; I458-S462 PolarHBondContact O-N 2.8Å; I458-F463 HydrophobicContact CG2-CD2 3.93Å; I458-F463 HydrophobicContact CG2-CE2 3.75Å; I458-F463 PolarHBondContact O-N 2.78Å; I458-F1528 HydrophobicContact CB-CZ 4.45Å; I458-F1528 HydrophobicContact CD1-CE1 4.13Å; I458-F1528 HydrophobicContact CG2-CE1 4.19Å; I458-F1528 HydrophobicContact CG2-CZ 3.95Å; I458-T1532 HydrophobicContact CG2-CG2 4.19Å
459	I	84.4	Confident	80	Confident	64 Å²	64	37.7 Å²	37.7	33%	0.328	18%	0.176	S	C	.	.	I	π-helix	trans	-63	-37.6	179.3	-69.4	172.5	0	0	0	111.6	I455 F463 F464 F1528	I455-I459 HydrophobicContact CG2-CD1 3.69Å; I455-I459 HydrophobicContact CG2-CG1 4.37Å; I455-I459 WeakPolarHBondContact O-CB 3.28Å; I455-I459 VanDerWaalsContact O-CG1 3.28Å; I455-I459 WeakPolarHBondContact O-CG1 3.13Å; I455-I459 PolarHBondContact O-N 2.9Å; I459-F463 WeakPolarHBondContact O-CB 3.17Å; I459-F464 HydrophobicContact CG2-CE1 3.87Å; I459-F464 HydrophobicContact CG2-CE2 4.04Å; I459-F464 HydrophobicContact CG2-CZ 3.47Å; I459-F464 VanDerWaalsContact CG2-CZ 3.47Å; I459-F464 VanDerWaalsContact O-CD1 3.28Å; I459-F464 WeakPolarHBondContact O-CD1 3.35Å; I459-F464 VanDerWaalsContact O-CG 3.27Å; I459-F464 WeakPolarHBondContact O-CG 3.48Å; I459-F464 PolarHBondContact O-N 3.42Å; I459-F1528 HydrophobicContact CG1-CZ 4.43Å
460	I	81.5	Confident	79.2	Confident	65 Å²	65	29.7 Å²	29.7	33%	0.333	15%	0.145	S	C	.	.	I	π-helix	trans	-86.2	-43.7	179.8	-65.3	172.9	0	0	0	111.7	V318 S456 I458 F464 V465	V318-I460 HydrophobicContact CG1-CG2 4.21Å; S456-I460 WeakPolarHBondContact O-CB 3.32Å; S456-I460 WeakPolarHBondContact O-CG1 3.49Å; S456-I460 PolarHBondContact O-N 3.17Å; I458-I460 VanDerWaalsContact C-N 3.32Å; I458-I460 PolarHBondContact O-N 3.35Å; I460-F464 HydrophobicContact CB-CD2 4.32Å; I460-F464 HydrophobicContact CG1-CD2 4.02Å; I460-F464 HydrophobicContact CG1-CE2 3.94Å; I460-F464 WeakPolarHBondContact O-CB 3.5Å; I460-V465 PolarHBondContact O-N 2.67Å
461	G	76.8	Confident	78.2	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.01	14%	0.143	C	C	.	.	I	π-helix	trans	-88.7	-29.8	-170.1	0	0	0	0	0	115.4	I429 M457 V465	I429-G461 WeakPolarHBondContact CG2-O 3.39Å; M457-G461 WeakPolarHBondContact O-CA 3.29Å; M457-G461 PolarHBondContact O-N 2.8Å; G461-V465 VanDerWaalsContact O-CB 3.26Å; G461-V465 WeakPolarHBondContact O-CB 3.19Å
462	S	75.3	Confident	77.2	Confident	6 Å²	6	24.6 Å²	24.6	4%	0.042	13%	0.127	C	C	.	.	I	π-helix	trans	-94.9	-69.8	165.2	171.7	0	0	0	0	109.7	M431 I458 F464 V465 M466	M431-S462 PolarHBondContact SD-OG 3.42Å; I458-S462 WeakPolarHBondContact O-CA 3.39Å; I458-S462 WeakPolarHBondContact O-CB 3.47Å; I458-S462 PolarHBondContact O-N 2.8Å; S462-F464 VanDerWaalsContact C-N 3.3Å; S462-F464 PolarHBondContact O-N 3.29Å; S462-F464 VanDerWaalsContact O-N 3.09Å; S462-V465 PolarHBondContact O-N 2.64Å; S462-M466 VanDerWaalsContact O-CB 3.22Å; S462-M466 WeakPolarHBondContact O-CB 3.49Å; S462-M466 VanDerWaalsContact O-CG 3.27Å; S462-M466 WeakPolarHBondContact O-CG 3.4Å; S462-M466 PolarHBondContact O-N 2.95Å
463	F	69.4	Low	76	Confident	38 Å²	38	20.5 Å²	20.5	17%	0.167	11%	0.105	C	C	.	.	I	π-helix	trans	-62	-29.7	-164.6	-74.6	-109.6	0	0	0	114	M431 I458 I459 N467 T1532 I1772 F1776	M431-F463 HydrophobicContact SD-CD2 4.48Å; M431-F463 HydrophobicContact SD-CE2 3.9Å; I458-F463 HydrophobicContact CG2-CD2 3.93Å; I458-F463 HydrophobicContact CG2-CE2 3.75Å; I458-F463 PolarHBondContact O-N 2.78Å; I459-F463 WeakPolarHBondContact O-CB 3.17Å; F463-N467 PolarHBondContact O-ND2 3.36Å; F463-T1532 HydrophobicContact CE2-CG2 4.3Å; F463-I1772 HydrophobicContact CE1-CD1 4.25Å; F463-I1772 HydrophobicContact CE1-CG2 4.21Å; F463-F1776 AromaticContact CD1-CE1 3.72Å; F463-F1776 HydrophobicContact CD1-CE1 3.72Å; F463-F1776 AromaticContact CD1-CZ 3.63Å; F463-F1776 HydrophobicContact CD1-CZ 3.63Å; F463-F1776 HydrophobicContact CE1-CE1 4.37Å; F463-F1776 HydrophobicContact CE1-CZ 4.04Å; F463-F1776 HydrophobicContact CG-CZ 4.41Å
464	F	68.9	Low	74.6	Confident	73 Å²	73	20.6 Å²	20.6	32%	0.32	11%	0.109	S	C	.	.	I	π-helix	trans	-95.6	-45	176.7	-55.3	-17.1	0	0	0	113.4	I459 I460 S462 L468 F1474	I459-F464 HydrophobicContact CG2-CE1 3.87Å; I459-F464 HydrophobicContact CG2-CE2 4.04Å; I459-F464 HydrophobicContact CG2-CZ 3.47Å; I459-F464 VanDerWaalsContact CG2-CZ 3.47Å; I459-F464 VanDerWaalsContact O-CD1 3.28Å; I459-F464 WeakPolarHBondContact O-CD1 3.35Å; I459-F464 VanDerWaalsContact O-CG 3.27Å; I459-F464 WeakPolarHBondContact O-CG 3.48Å; I459-F464 PolarHBondContact O-N 3.42Å; I460-F464 HydrophobicContact CB-CD2 4.32Å; I460-F464 HydrophobicContact CG1-CD2 4.02Å; I460-F464 HydrophobicContact CG1-CE2 3.94Å; I460-F464 WeakPolarHBondContact O-CB 3.5Å; S462-F464 VanDerWaalsContact C-N 3.3Å; S462-F464 PolarHBondContact O-N 3.29Å; S462-F464 VanDerWaalsContact O-N 3.09Å; F464-L468 VanDerWaalsContact O-CB 3.28Å; F464-L468 WeakPolarHBondContact O-CB 3.07Å; F464-L468 PolarHBondContact O-N 2.75Å; F464-F1474 HydrophobicContact CD1-CE1 4.46Å; F464-F1474 HydrophobicContact CD1-CE2 4.16Å; F464-F1474 AromaticContact CD1-CZ 3.54Å; F464-F1474 HydrophobicContact CD1-CZ 3.54Å; F464-F1474 AromaticContact CE1-CE1 3.77Å; F464-F1474 HydrophobicContact CE1-CE1 3.77Å; F464-F1474 HydrophobicContact CE1-CE2 4.09Å; F464-F1474 AromaticContact CE1-CZ 3.24Å; F464-F1474 HydrophobicContact CE1-CZ 3.24Å; F464-F1474 HydrophobicContact CE2-CE2 4.45Å; F464-F1474 HydrophobicContact CE2-CZ 4.31Å; F464-F1474 HydrophobicContact CG-CE2 4.4Å; F464-F1474 HydrophobicContact CG-CZ 4.22Å; F464-F1474 HydrophobicContact CZ-CE1 4.06Å; F464-F1474 HydrophobicContact CZ-CE2 4.23Å; F464-F1474 AromaticContact CZ-CZ 3.67Å; F464-F1474 HydrophobicContact CZ-CZ 3.67Å
465	V	66.8	Low	73.3	Confident	3 Å²	3	20.6 Å²	20.6	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-56.7	-58.5	176.9	160.5	0	0	0	0	109.7	L314 V315 I460 G461 S462 N467 L468 V469	L314-V465 HydrophobicContact CD2-CG2 4.35Å; V315-V465 HydrophobicContact CB-CG1 4.25Å; V315-V465 HydrophobicContact CG1-CG1 3.91Å; V315-V465 HydrophobicContact CG1-CG2 4.39Å; V315-V465 HydrophobicContact CG2-CB 4.35Å; V315-V465 HydrophobicContact CG2-CG1 3.34Å; V315-V465 HydrophobicContact CG2-CG2 4.09Å; I460-V465 PolarHBondContact O-N 2.67Å; G461-V465 VanDerWaalsContact O-CB 3.26Å; G461-V465 WeakPolarHBondContact O-CB 3.19Å; S462-V465 PolarHBondContact O-N 2.64Å; V465-N467 PolarHBondContact O-N 3.19Å; V465-L468 WeakPolarHBondContact O-CB 3.48Å; V465-L468 PolarHBondContact O-N 3.02Å; V465-V469 HydrophobicContact CG1-CG2 3.97Å; V465-V469 WeakPolarHBondContact O-CG2 3.49Å; V465-V469 PolarHBondContact O-N 3.33Å
466	M	63.6	Low	72.2	Confident	52 Å²	52	20.7 Å²	20.7	26%	0.256	11%	0.108	S	C	.	.	H	α-helix	trans	-47.6	-65	-177.1	-69.3	-61	-85.2	0	0	108.8	S462 L468 V469 L470 Y826	S462-M466 VanDerWaalsContact O-CB 3.22Å; S462-M466 WeakPolarHBondContact O-CB 3.49Å; S462-M466 VanDerWaalsContact O-CG 3.27Å; S462-M466 WeakPolarHBondContact O-CG 3.4Å; S462-M466 PolarHBondContact O-N 2.95Å; M466-L468 VanDerWaalsContact C-N 3.25Å; M466-L468 PolarHBondContact O-N 3Å; M466-L468 VanDerWaalsContact O-N 3.09Å; M466-V469 CarbonylContact O-C 3.2Å; M466-V469 VanDerWaalsContact O-CA 3.31Å; M466-V469 WeakPolarHBondContact O-CA 3.36Å; M466-V469 WeakPolarHBondContact O-CB 3.28Å; M466-V469 WeakPolarHBondContact O-CG2 3.27Å; M466-V469 PolarHBondContact O-N 3.06Å; M466-L470 VanDerWaalsContact C-CG 3.45Å; M466-L470 HydrophobicContact CB-CD2 4.32Å; M466-L470 WeakPolarHBondContact O-CD2 3.48Å; M466-L470 WeakPolarHBondContact O-CG 3.25Å; M466-L470 PolarHBondContact O-N 3.16Å; M466-Y826 HydrophobicContact CE-CE1 4.27Å; M466-Y826 HydrophobicContact CE-CE2 4.22Å; M466-Y826 HydrophobicContact SD-CE1 3.55Å; M466-Y826 VanDerWaalsContact SD-CE1 3.55Å; M466-Y826 HydrophobicContact SD-CE2 4.16Å; M466-Y826 PolarHBondContact SD-OH 2.7Å
467	N	65.6	Low	71	Confident	3 Å²	3	19.9 Å²	19.9	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-46.3	-39.9	178.7	-84.1	-66.2	0	0	0	115.9	F463 V465 L470 G471 F1776	F463-N467 PolarHBondContact O-ND2 3.36Å; V465-N467 PolarHBondContact O-N 3.19Å; N467-L470 HydrophobicContact CB-CD1 4.4Å; N467-L470 PolarHBondContact O-N 3.46Å; N467-L470 WeakPolarHBondContact OD1-CD1 3.13Å; N467-G471 PolarHBondContact O-N 3.07Å; N467-F1776 WeakPolarHBondContact ND2-CD1 3.44Å; N467-F1776 WeakPolarHBondContact ND2-CE1 2.87Å; N467-F1776 VanDerWaalsContact ND2-CG 3.29Å; N467-F1776 WeakPolarHBondContact ND2-CG 3.47Å; N467-F1776 VanDerWaalsContact ND2-CZ 3.28Å; N467-F1776 WeakPolarHBondContact ND2-CZ 3.33Å; N467-F1776 WeakPolarHBondContact OD1-CB 3.43Å; N467-F1776 WeakPolarHBondContact OD1-CG 3.47Å
468	L	68.7	Low	69.7	Low	11 Å²	11	21.3 Å²	21.3	6%	0.058	11%	0.11	C	C	.	.	H	α-helix	trans	-67.6	-42.9	177.9	-170	148.6	0	0	0	111.3	I311 F464 V465 M466 L470 V472 L1466 F1470	I311-L468 HydrophobicContact CB-CD2 4.04Å; I311-L468 HydrophobicContact CD1-CD2 3.98Å; I311-L468 HydrophobicContact CG1-CD2 3.64Å; I311-L468 HydrophobicContact CG2-CD2 3.46Å; I311-L468 VanDerWaalsContact CG2-CD2 3.46Å; F464-L468 VanDerWaalsContact O-CB 3.28Å; F464-L468 WeakPolarHBondContact O-CB 3.07Å; F464-L468 PolarHBondContact O-N 2.75Å; V465-L468 WeakPolarHBondContact O-CB 3.48Å; V465-L468 PolarHBondContact O-N 3.02Å; M466-L468 VanDerWaalsContact C-N 3.25Å; M466-L468 PolarHBondContact O-N 3Å; M466-L468 VanDerWaalsContact O-N 3.09Å; L468-L470 VanDerWaalsContact C-N 3.31Å; L468-V472 PolarHBondContact O-N 3.27Å; L468-L1466 HydrophobicContact CD1-CD2 3.57Å; L468-L1466 HydrophobicContact CD1-CG 4.15Å; L468-L1466 HydrophobicContact CD2-CD1 4.17Å; L468-L1466 HydrophobicContact CD2-CD2 4.16Å; L468-L1466 HydrophobicContact CD2-CG 4.37Å; L468-L1466 HydrophobicContact CG-CD2 4.44Å; L468-F1470 HydrophobicContact CB-CD1 4.49Å; L468-F1470 HydrophobicContact CB-CE1 3.93Å; L468-F1470 HydrophobicContact CB-CE2 4.3Å; L468-F1470 HydrophobicContact CB-CZ 3.84Å; L468-F1470 HydrophobicContact CD1-CD1 4.07Å; L468-F1470 HydrophobicContact CD1-CD2 3.36Å; L468-F1470 HydrophobicContact CD1-CE1 4.1Å; L468-F1470 HydrophobicContact CD1-CE2 3.43Å; L468-F1470 VanDerWaalsContact CD1-CE2 3.43Å; L468-F1470 HydrophobicContact CD1-CG 3.72Å; L468-F1470 HydrophobicContact CD1-CZ 3.82Å; L468-F1470 HydrophobicContact CG-CD1 4.45Å; L468-F1470 HydrophobicContact CG-CD2 3.96Å; L468-F1470 HydrophobicContact CG-CE1 3.98Å; L468-F1470 HydrophobicContact CG-CE2 3.45Å; L468-F1470 VanDerWaalsContact CG-CE2 3.45Å; L468-F1470 HydrophobicContact CG-CG 4.45Å; L468-F1470 HydrophobicContact CG-CZ 3.47Å; L468-F1470 VanDerWaalsContact CG-CZ 3.47Å
469	V	67.8	Low	68.7	Low	5 Å²	5	23.1 Å²	23.1	3%	0.03	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-42.1	171.9	-144.9	0	0	0	0	111.1	L308 I311 V465 M466 G471 V472 R2472 H2473	L308-V469 HydrophobicContact CD2-CG1 3.59Å; I311-V469 HydrophobicContact CD1-CB 4.5Å; I311-V469 HydrophobicContact CD1-CG1 4.02Å; I311-V469 HydrophobicContact CG2-CB 4.29Å; I311-V469 HydrophobicContact CG2-CG1 4.15Å; I311-V469 HydrophobicContact CG2-CG2 3.73Å; V465-V469 HydrophobicContact CG1-CG2 3.97Å; V465-V469 WeakPolarHBondContact O-CG2 3.49Å; V465-V469 PolarHBondContact O-N 3.33Å; M466-V469 CarbonylContact O-C 3.2Å; M466-V469 VanDerWaalsContact O-CA 3.31Å; M466-V469 WeakPolarHBondContact O-CA 3.36Å; M466-V469 WeakPolarHBondContact O-CB 3.28Å; M466-V469 WeakPolarHBondContact O-CG2 3.27Å; M466-V469 PolarHBondContact O-N 3.06Å; V469-G471 PolarHBondContact O-N 2.72Å; V469-V472 PolarHBondContact O-N 2.95Å; V469-R2472 WeakPolarHBondContact CB-O 3.33Å; V469-R2472 WeakPolarHBondContact CG1-O 3.27Å; V469-H2473 WeakPolarHBondContact CG1-O 3.27Å
470	L	64	Low	67.7	Low	3 Å²	3	22.1 Å²	22.1	2%	0.016	11%	0.111	C	C	.	.	H	α-helix	trans	-62.5	-48	-176.9	-34	171.9	0	0	0	111.8	M466 N467 L468 V472 S474 I1780 S2470 P2471	M466-L470 VanDerWaalsContact C-CG 3.45Å; M466-L470 HydrophobicContact CB-CD2 4.32Å; M466-L470 WeakPolarHBondContact O-CD2 3.48Å; M466-L470 WeakPolarHBondContact O-CG 3.25Å; M466-L470 PolarHBondContact O-N 3.16Å; N467-L470 HydrophobicContact CB-CD1 4.4Å; N467-L470 PolarHBondContact O-N 3.46Å; N467-L470 WeakPolarHBondContact OD1-CD1 3.13Å; L468-L470 VanDerWaalsContact C-N 3.31Å; L470-V472 PolarHBondContact O-N 2.84Å; L470-S474 WeakPolarHBondContact O-CB 3.47Å; L470-S474 PolarHBondContact O-N 2.7Å; L470-S474 VanDerWaalsContact O-N 3.1Å; L470-I1780 HydrophobicContact CB-CD1 4.19Å; L470-S2470 WeakPolarHBondContact CD1-O 3.4Å; L470-S2470 WeakPolarHBondContact CD2-O 3.18Å; L470-P2471 CarbonylContact C-O 3.58Å; L470-P2471 VanDerWaalsContact CA-C 3.44Å; L470-P2471 WeakPolarHBondContact CA-O 3.23Å; L470-P2471 VanDerWaalsContact CB-C 3.46Å; L470-P2471 WeakPolarHBondContact CB-O 3.37Å
471	G	66.8	Low	66.8	Low	1 Å²	1	20.8 Å²	20.8	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-63.5	-41	-177.8	0	0	0	0	0	113.4	N467 V469 L473 S474 G475	N467-G471 PolarHBondContact O-N 3.07Å; V469-G471 PolarHBondContact O-N 2.72Å; G471-L473 PolarHBondContact O-N 3.26Å; G471-S474 WeakPolarHBondContact O-CB 3.36Å; G471-S474 PolarHBondContact O-N 3.14Å; G471-G475 PolarHBondContact O-N 3.41Å
472	V	67	Low	66.3	Low	13 Å²	13	25.3 Å²	25.3	8%	0.079	12%	0.123	C	C	.	.	H	α-helix	trans	-58.9	-51.8	-175.5	160.7	0	0	0	0	111	P307 I311 L468 V469 L470 G475 E476 L1787	P307-V472 HydrophobicContact CB-CG1 3.83Å; P307-V472 HydrophobicContact CG-CG1 3.97Å; I311-V472 HydrophobicContact CD1-CB 3.65Å; I311-V472 HydrophobicContact CD1-CG1 3.92Å; I311-V472 HydrophobicContact CD1-CG2 3.5Å; I311-V472 HydrophobicContact CG1-CG2 4.27Å; L468-V472 PolarHBondContact O-N 3.27Å; V469-V472 PolarHBondContact O-N 2.95Å; L470-V472 PolarHBondContact O-N 2.84Å; V472-G475 WeakPolarHBondContact O-CA 3.48Å; V472-G475 PolarHBondContact O-N 3.44Å; V472-E476 PolarHBondContact O-N 2.68Å; V472-E476 VanDerWaalsContact O-N 3.08Å; V472-L1787 HydrophobicContact CB-CD2 4.47Å; V472-L1787 HydrophobicContact CG2-CD2 3.5Å; V472-L1787 VanDerWaalsContact CG2-CD2 3.5Å
473	L	64.3	Low	65.9	Low	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-79.9	-25	-178.4	-107.6	109.6	0	0	0	113.5	A304 L308 G471 G475 E476 F477 R2472 H2473	A304-L473 HydrophobicContact CB-CD1 4.24Å; A304-L473 HydrophobicContact CB-CD2 3.28Å; A304-L473 HydrophobicContact CB-CG 3.67Å; A304-L473 WeakPolarHBondContact O-CD1 3.3Å; L308-L473 HydrophobicContact CD1-CD1 3.58Å; L308-L473 HydrophobicContact CD2-CD1 3.23Å; L308-L473 HydrophobicContact CG-CD1 3.34Å; G471-L473 PolarHBondContact O-N 3.26Å; L473-G475 PolarHBondContact O-N 3.44Å; L473-E476 PolarHBondContact O-N 2.74Å; L473-F477 HydrophobicContact CD2-CE1 4.38Å; L473-F477 PolarHBondContact O-N 3.34Å; L473-R2472 VanDerWaalsContact C-CZ 3.44Å; L473-R2472 HydrophobicContact CB-CB 3.76Å; L473-R2472 HydrophobicContact CB-CG 3.35Å; L473-R2472 HydrophobicContact CD1-CB 4.43Å; L473-R2472 HydrophobicContact CD1-CG 4.39Å; L473-R2472 HydrophobicContact CD2-CG 3.98Å; L473-R2472 VanDerWaalsContact CD2-NH1 3.31Å; L473-R2472 HydrophobicContact CG-CG 4.08Å; L473-R2472 PolarHBondContact O-NH1 2.9Å; L473-R2472 PolarHBondContact O-NH2 3.26Å; L473-H2473 HydrophobicContact CD1-CB 3.96Å; L473-H2473 HydrophobicContact CD2-CB 4.47Å; L473-H2473 WeakPolarHBondContact CD2-ND1 3.26Å
474	S	63.1	Low	65.6	Low	19 Å²	19	29 Å²	29	13%	0.133	15%	0.145	C	C	.	.	H	α-helix	trans	-51.9	-44	163.7	-169.8	0	0	0	0	109.9	L470 G471 S478 R2472	L470-S474 WeakPolarHBondContact O-CB 3.47Å; L470-S474 PolarHBondContact O-N 2.7Å; L470-S474 VanDerWaalsContact O-N 3.1Å; G471-S474 WeakPolarHBondContact O-CB 3.36Å; G471-S474 PolarHBondContact O-N 3.14Å; S474-S478 VanDerWaalsContact O-CB 3.24Å; S474-S478 WeakPolarHBondContact O-CB 3.41Å; S474-S478 PolarHBondContact O-N 3.24Å; S474-S478 VanDerWaalsContact O-N 3.09Å; S474-S478 PolarHBondContact O-OG 3.44Å; S474-R2472 VanDerWaalsContact CA-NH2 3.3Å; S474-R2472 VanDerWaalsContact N-NH2 3.18Å
475	G	65.2	Low	65.3	Low	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.5	-53.4	169.4	0	0	0	0	0	114.3	G471 V472 L473 S478 K479	G471-G475 PolarHBondContact O-N 3.41Å; V472-G475 WeakPolarHBondContact O-CA 3.48Å; V472-G475 PolarHBondContact O-N 3.44Å; L473-G475 PolarHBondContact O-N 3.44Å; G475-S478 WeakPolarHBondContact O-CB 3.27Å; G475-S478 PolarHBondContact O-N 2.62Å; G475-K479 VanDerWaalsContact O-CB 3.25Å; G475-K479 WeakPolarHBondContact O-CB 3.39Å; G475-K479 PolarHBondContact O-N 3.12Å
476	E	67.6	Low	65.3	Low	36 Å²	36	35.9 Å²	35.9	17%	0.168	17%	0.174	C	C	.	.	H	α-helix	trans	-68.3	-35.5	-174.4	-75	-59.7	149.4	0	0	114.8	A304 P307 V472 L473 K479 E480	A304-E476 HydrophobicContact CB-CB 4.11Å; P307-E476 HydrophobicContact CG-CG 3.93Å; V472-E476 PolarHBondContact O-N 2.68Å; V472-E476 VanDerWaalsContact O-N 3.08Å; L473-E476 PolarHBondContact O-N 2.74Å; E476-K479 PolarHBondContact O-N 3.31Å; E476-K479 IonicContact OE1-NZ 3.71Å; E476-K479 PolarHBondContact OE1-NZ 3.4Å; E476-K479 WeakPolarHBondContact OE2-CE 3.41Å; E476-K479 IonicContact OE2-NZ 2.71Å; E476-K479 PolarHBondContact OE2-NZ 2.73Å; E476-E480 PolarHBondContact O-N 2.55Å
477	F	64.2	Low	65.6	Low	24 Å²	24	41.1 Å²	41.1	11%	0.105	19%	0.191	C	C	.	.	H	α-helix	trans	-72.8	-36.7	170	-84	15.4	0	0	0	112.1	I301 A304 L473 K479 E480 R481 V831 A834 R2472	I301-F477 HydrophobicContact CG1-CZ 4.46Å; A304-F477 HydrophobicContact CB-CE1 4.44Å; L473-F477 HydrophobicContact CD2-CE1 4.38Å; L473-F477 PolarHBondContact O-N 3.34Å; F477-K479 PolarHBondContact O-N 2.65Å; F477-E480 PolarHBondContact O-N 3.22Å; F477-R481 WeakPolarHBondContact O-CB 3.09Å; F477-R481 PolarHBondContact O-N 2.78Å; F477-V831 HydrophobicContact CE2-CB 4.24Å; F477-V831 HydrophobicContact CE2-CG1 3.87Å; F477-V831 HydrophobicContact CE2-CG2 4.13Å; F477-V831 HydrophobicContact CZ-CG1 4.29Å; F477-V831 HydrophobicContact CZ-CG2 4.04Å; F477-A834 HydrophobicContact CD2-CB 3.63Å; F477-A834 HydrophobicContact CE2-CB 4.21Å; F477-R2472 VanDerWaalsContact CE2-NH1 3.28Å
478	S	63.5	Low	65.5	Low	30 Å²	30	42.7 Å²	42.7	21%	0.21	21%	0.208	C	C	.	.	H	α-helix	trans	-56.7	-39.9	171.6	-63.1	0	0	0	0	111.1	S474 G475 E482	S474-S478 VanDerWaalsContact O-CB 3.24Å; S474-S478 WeakPolarHBondContact O-CB 3.41Å; S474-S478 PolarHBondContact O-N 3.24Å; S474-S478 VanDerWaalsContact O-N 3.09Å; S474-S478 PolarHBondContact O-OG 3.44Å; G475-S478 WeakPolarHBondContact O-CB 3.27Å; G475-S478 PolarHBondContact O-N 2.62Å; S478-E482 WeakPolarHBondContact O-CB 3.49Å; S478-E482 PolarHBondContact O-N 2.76Å
479	K	67.4	Low	65.2	Low	38 Å²	38	49.2 Å²	49.2	17%	0.165	24%	0.236	C	C	.	.	H	α-helix	trans	-71.1	-39.8	178.2	174	169.2	159	-170.9	0	113.8	G475 E476 F477 E482 K483 D1790	G475-K479 VanDerWaalsContact O-CB 3.25Å; G475-K479 WeakPolarHBondContact O-CB 3.39Å; G475-K479 PolarHBondContact O-N 3.12Å; E476-K479 PolarHBondContact O-N 3.31Å; E476-K479 IonicContact OE1-NZ 3.71Å; E476-K479 PolarHBondContact OE1-NZ 3.4Å; E476-K479 WeakPolarHBondContact OE2-CE 3.41Å; E476-K479 IonicContact OE2-NZ 2.71Å; E476-K479 PolarHBondContact OE2-NZ 2.73Å; F477-K479 PolarHBondContact O-N 2.65Å; K479-E482 PolarHBondContact O-N 3.35Å; K479-K483 WeakPolarHBondContact O-CE 3.29Å; K479-K483 WeakPolarHBondContact O-CG 3.42Å; K479-K483 PolarHBondContact O-N 3.48Å; K479-K483 VanDerWaalsContact O-N 3.14Å; K479-D1790 WeakPolarHBondContact CE-OD1 3.38Å; K479-D1790 IonicContact NZ-OD1 3.35Å; K479-D1790 PolarHBondContact NZ-OD1 3Å
480	E	65	Low	64.8	Low	43 Å²	43	52.9 Å²	52.9	20%	0.201	25%	0.25	C	C	.	.	H	α-helix	trans	-71.6	-36.8	173	-159.7	71.4	176.2	0	0	111.5	R303 E476 F477 K483 A484	R303-E480 IonicContact CZ-OE1 2.74Å; R303-E480 IonicContact NH1-OE1 2.77Å; R303-E480 PolarHBondContact NH1-OE1 3Å; E476-E480 PolarHBondContact O-N 2.55Å; F477-E480 PolarHBondContact O-N 3.22Å; E480-K483 WeakPolarHBondContact O-CB 3.37Å; E480-K483 PolarHBondContact O-N 3.22Å; E480-K483 WeakPolarHBondContact OE2-CD 3.47Å; E480-K483 WeakPolarHBondContact OE2-CE 3.32Å; E480-K483 IonicContact OE2-NZ 2.97Å; E480-K483 PolarHBondContact OE2-NZ 3.07Å; E480-A484 PolarHBondContact O-N 3.37Å
481	R	62	Low	65	Low	37 Å²	37	58.9 Å²	58.9	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-35	170.8	179.1	170.3	171.8	-132.7	6.8	112.2	F477 A484 K485 Y490 D838 D842	F477-R481 WeakPolarHBondContact O-CB 3.09Å; F477-R481 PolarHBondContact O-N 2.78Å; R481-A484 CarbonylContact O-C 3.56Å; R481-A484 WeakPolarHBondContact O-CA 3.16Å; R481-A484 WeakPolarHBondContact O-CB 3.27Å; R481-A484 PolarHBondContact O-N 3.27Å; R481-A484 VanDerWaalsContact O-N 3.16Å; R481-K485 HydrophobicContact CG-CD 4.46Å; R481-K485 WeakPolarHBondContact O-CB 3.41Å; R481-K485 PolarHBondContact O-N 2.94Å; R481-Y490 PolarHBondContact NE-OH 2.57Å; R481-Y490 PolarHBondContact NH2-OH 3.38Å; R481-D838 WeakPolarHBondContact CD-OD1 3.28Å; R481-D838 VanDerWaalsContact CD-OD2 3.26Å; R481-D838 WeakPolarHBondContact CD-OD2 3.14Å; R481-D838 IonicContact CZ-OD1 3.67Å; R481-D838 VanDerWaalsContact CZ-OD1 3.3Å; R481-D838 IonicContact NE-OD1 3.17Å; R481-D838 IonicContact NH1-OD1 3.57Å; R481-D838 PolarHBondContact NH1-OD1 3.36Å; R481-D838 PolarHBondContact NH2-O 3.11Å; R481-D842 IonicContact CZ-OD2 3.41Å; R481-D842 IonicContact NH2-OD1 3.2Å; R481-D842 PolarHBondContact NH2-OD1 3.05Å; R481-D842 IonicContact NH2-OD2 3.91Å; R481-D842 PolarHBondContact NH2-OD2 2.99Å
482	E	65.3	Low	65.3	Low	97 Å²	97	65.4 Å²	65.4	45%	0.453	31%	0.306	S	S	.	.	H	α-helix	trans	-62.3	-43.7	171.3	-98.3	-160	-135.9	0	0	111.5	S478 K479 A484 K485 K486	S478-E482 WeakPolarHBondContact O-CB 3.49Å; S478-E482 PolarHBondContact O-N 2.76Å; K479-E482 PolarHBondContact O-N 3.35Å; E482-A484 VanDerWaalsContact C-N 3.27Å; E482-A484 PolarHBondContact O-N 2.99Å; E482-K485 PolarHBondContact O-N 3Å; E482-K486 WeakPolarHBondContact O-CB 3.42Å; E482-K486 WeakPolarHBondContact O-CD 3.21Å; E482-K486 VanDerWaalsContact O-CG 3.27Å; E482-K486 WeakPolarHBondContact O-CG 3.4Å; E482-K486 PolarHBondContact O-N 2.87Å; E482-K486 IonicContact OE2-NZ 2.83Å; E482-K486 PolarHBondContact OE2-NZ 2.79Å
483	K	68	Low	65	Low	85 Å²	85	66.8 Å²	66.8	37%	0.37	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-38.6	172.1	-63.2	166.7	-147.7	164.7	0	110.6	K479 E480 K486 R487	K479-K483 WeakPolarHBondContact O-CE 3.29Å; K479-K483 WeakPolarHBondContact O-CG 3.42Å; K479-K483 PolarHBondContact O-N 3.48Å; K479-K483 VanDerWaalsContact O-N 3.14Å; E480-K483 WeakPolarHBondContact O-CB 3.37Å; E480-K483 PolarHBondContact O-N 3.22Å; E480-K483 WeakPolarHBondContact OE2-CD 3.47Å; E480-K483 WeakPolarHBondContact OE2-CE 3.32Å; E480-K483 IonicContact OE2-NZ 2.97Å; E480-K483 PolarHBondContact OE2-NZ 3.07Å; K483-K486 PolarHBondContact O-N 3.26Å; K483-R487 WeakPolarHBondContact O-CG 3.18Å; K483-R487 PolarHBondContact O-N 3.45Å; K483-R487 VanDerWaalsContact O-N 3.09Å
484	A	63.8	Low	65	Low	35 Å²	35	73.8 Å²	73.8	29%	0.289	35%	0.345	S	S	.	.	H	α-helix	trans	-69.2	-36.3	175.1	0	0	0	0	0	113.7	E480 R481 E482 R487	E480-A484 PolarHBondContact O-N 3.37Å; R481-A484 CarbonylContact O-C 3.56Å; R481-A484 WeakPolarHBondContact O-CA 3.16Å; R481-A484 WeakPolarHBondContact O-CB 3.27Å; R481-A484 PolarHBondContact O-N 3.27Å; R481-A484 VanDerWaalsContact O-N 3.16Å; E482-A484 VanDerWaalsContact C-N 3.27Å; E482-A484 PolarHBondContact O-N 2.99Å; A484-R487 PolarHBondContact O-N 3.29Å
485	K	62.1	Low	65.4	Low	68 Å²	68	77.8 Å²	77.8	30%	0.296	36%	0.362	S	S	.	.	H	α-helix	trans	-62.9	-44.9	171	-80.5	-179.9	173.1	-169	0	110.5	R481 E482 R487 G488 Y490 D842	R481-K485 HydrophobicContact CG-CD 4.46Å; R481-K485 WeakPolarHBondContact O-CB 3.41Å; R481-K485 PolarHBondContact O-N 2.94Å; E482-K485 PolarHBondContact O-N 3Å; K485-R487 PolarHBondContact O-N 2.76Å; K485-G488 PolarHBondContact O-N 2.64Å; K485-G488 VanDerWaalsContact O-N 3.1Å; K485-Y490 HydrophobicContact CB-CD2 4.26Å; K485-Y490 HydrophobicContact CD-CD2 4.3Å; K485-Y490 HydrophobicContact CD-CE2 4.08Å; K485-Y490 HydrophobicContact CG-CD2 3.32Å; K485-Y490 HydrophobicContact CG-CE2 3.39Å; K485-Y490 HydrophobicContact CG-CG 4.07Å; K485-D842 IonicContact NZ-OD1 2.73Å; K485-D842 PolarHBondContact NZ-OD1 3.32Å
486	K	65.7	Low	65.9	Low	153 Å²	153	83.2 Å²	83.2	67%	0.665	39%	0.387	S	S	*	.	H	α-helix	trans	-64.5	-17.8	174.1	-70.8	159.2	178	161.2	0	113.8	E482 K483	E482-K486 WeakPolarHBondContact O-CB 3.42Å; E482-K486 WeakPolarHBondContact O-CD 3.21Å; E482-K486 VanDerWaalsContact O-CG 3.27Å; E482-K486 WeakPolarHBondContact O-CG 3.4Å; E482-K486 PolarHBondContact O-N 2.87Å; E482-K486 IonicContact OE2-NZ 2.83Å; E482-K486 PolarHBondContact OE2-NZ 2.79Å; K483-K486 PolarHBondContact O-N 3.26Å
487	R	69.5	Low	65.8	Low	163 Å²	163	85.9 Å²	85.9	62%	0.615	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	12.5	171.4	-70.8	176.6	-171	-148.9	5.2	114.4	K483 A484 K485 K489	K483-R487 WeakPolarHBondContact O-CG 3.18Å; K483-R487 PolarHBondContact O-N 3.45Å; K483-R487 VanDerWaalsContact O-N 3.09Å; A484-R487 PolarHBondContact O-N 3.29Å; K485-R487 PolarHBondContact O-N 2.76Å; R487-K489 PolarHBondContact O-N 2.81Å
488	G	64.8	Low	66.3	Low	36 Å²	36	89.4 Å²	89.4	37%	0.371	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	-5.5	169.4	0	0	0	0	0	117.3	K485 Y490 Q491 K492	K485-G488 PolarHBondContact O-N 2.64Å; K485-G488 VanDerWaalsContact O-N 3.1Å; G488-Y490 PolarHBondContact O-N 2.9Å; G488-Q491 PolarHBondContact O-N 3.49Å; G488-K492 PolarHBondContact O-N 3.07Å
489	K	62.8	Low	66.9	Low	147 Å²	147	94.5 Å²	94.5	64%	0.639	44%	0.436	S	S	*	.	H	α-helix	trans	-52.4	-34.1	179.8	-70.1	-171.9	176.4	-176.8	0	113.4	R487 A493	R487-K489 PolarHBondContact O-N 2.81Å; K489-A493 WeakPolarHBondContact O-CB 3.36Å; K489-A493 PolarHBondContact O-N 3.38Å
490	Y	57.7	Low	67.3	Low	82 Å²	82	99.3 Å²	99.3	32%	0.322	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-37.1	177.2	-92.5	-84.5	0	0	0	114.4	R481 K485 G488 R494 D842	R481-Y490 PolarHBondContact NE-OH 2.57Å; R481-Y490 PolarHBondContact NH2-OH 3.38Å; K485-Y490 HydrophobicContact CB-CD2 4.26Å; K485-Y490 HydrophobicContact CD-CD2 4.3Å; K485-Y490 HydrophobicContact CD-CE2 4.08Å; K485-Y490 HydrophobicContact CG-CD2 3.32Å; K485-Y490 HydrophobicContact CG-CE2 3.39Å; K485-Y490 HydrophobicContact CG-CG 4.07Å; G488-Y490 PolarHBondContact O-N 2.9Å; Y490-R494 WeakPolarHBondContact O-CB 3.34Å; Y490-R494 PolarHBondContact O-N 3.1Å; Y490-D842 HydrophobicContact CE1-CB 4.37Å; Y490-D842 WeakPolarHBondContact CE1-OD1 3.28Å; Y490-D842 WeakPolarHBondContact CE1-OD2 3.43Å; Y490-D842 VanDerWaalsContact CZ-OD2 3.25Å; Y490-D842 PolarHBondContact OH-OD2 2.99Å
491	Q	69.1	Low	67.7	Low	130 Å²	130	102.8 Å²	102.8	61%	0.607	48%	0.476	S	S	*	.	H	α-helix	trans	-68	-45.9	177.9	174.1	158.2	-13.3	0	0	109.7	G488 A493 R494 E495	G488-Q491 PolarHBondContact O-N 3.49Å; Q491-A493 PolarHBondContact O-N 3.32Å; Q491-R494 PolarHBondContact O-N 2.82Å; Q491-R494 VanDerWaalsContact O-N 3.15Å; Q491-E495 HydrophobicContact CG-CG 4.45Å; Q491-E495 WeakPolarHBondContact CG-OE1 3.13Å; Q491-E495 PolarHBondContact NE2-OE1 2.6Å; Q491-E495 VanDerWaalsContact O-CG 3.3Å; Q491-E495 WeakPolarHBondContact O-CG 3.47Å; Q491-E495 PolarHBondContact O-N 2.77Å
492	K	72.6	Confident	68.6	Low	137 Å²	137	104.6 Å²	104.6	60%	0.596	49%	0.488	S	S	*	.	H	α-helix	trans	-59.5	-41.5	174.1	-173.7	167	-174.6	164.2	0	113.7	G488 R494 E495 Q496	G488-K492 PolarHBondContact O-N 3.07Å; K492-R494 VanDerWaalsContact C-N 3.35Å; K492-E495 WeakPolarHBondContact CA-OE2 3.41Å; K492-E495 PolarHBondContact O-N 3.46Å; K492-Q496 WeakPolarHBondContact O-CG 3.34Å; K492-Q496 PolarHBondContact O-N 2.99Å
493	A	62.2	Low	69.3	Low	43 Å²	43	102.7 Å²	102.7	36%	0.355	48%	0.483	S	S	.	.	H	α-helix	trans	-66.1	-37	176.3	0	0	0	0	0	112.3	K489 Q491 Q496 M497	K489-A493 WeakPolarHBondContact O-CB 3.36Å; K489-A493 PolarHBondContact O-N 3.38Å; Q491-A493 PolarHBondContact O-N 3.32Å; A493-Q496 PolarHBondContact O-N 2.94Å; A493-M497 PolarHBondContact O-N 3.26Å
494	R	63.2	Low	69.6	Low	147 Å²	147	102.2 Å²	102.2	56%	0.555	48%	0.482	S	S	*	.	H	α-helix	trans	-68.9	-41.1	174.6	-175.8	-179.5	176.7	-154.5	-4.6	112.1	Y490 Q491 K492 Q496 M497 Q498	Y490-R494 WeakPolarHBondContact O-CB 3.34Å; Y490-R494 PolarHBondContact O-N 3.1Å; Q491-R494 PolarHBondContact O-N 2.82Å; Q491-R494 VanDerWaalsContact O-N 3.15Å; K492-R494 VanDerWaalsContact C-N 3.35Å; R494-Q496 VanDerWaalsContact C-N 3.27Å; R494-Q496 PolarHBondContact O-N 3.28Å; R494-M497 PolarHBondContact O-N 3.14Å; R494-Q498 WeakPolarHBondContact O-CB 3.29Å; R494-Q498 PolarHBondContact O-N 2.8Å
495	E	72.7	Confident	70.3	Confident	102 Å²	102	102.5 Å²	102.5	48%	0.477	49%	0.488	S	S	.	.	H	α-helix	trans	-59.8	-38.2	173.9	-72.7	159.1	-179.1	0	0	111	Q491 K492 F499	Q491-E495 HydrophobicContact CG-CG 4.45Å; Q491-E495 WeakPolarHBondContact CG-OE1 3.13Å; Q491-E495 PolarHBondContact NE2-OE1 2.6Å; Q491-E495 VanDerWaalsContact O-CG 3.3Å; Q491-E495 WeakPolarHBondContact O-CG 3.47Å; Q491-E495 PolarHBondContact O-N 2.77Å; K492-E495 WeakPolarHBondContact CA-OE2 3.41Å; K492-E495 PolarHBondContact O-N 3.46Å; E495-F499 VanDerWaalsContact O-CB 3.27Å; E495-F499 WeakPolarHBondContact O-CB 3.36Å; E495-F499 PolarHBondContact O-N 2.94Å
496	Q	74.7	Confident	71.2	Confident	115 Å²	115	106.1 Å²	106.1	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-67.8	-47	173.4	-71.3	-179.5	-59.7	0	0	113	K492 A493 R494 Q498 F499 E500	K492-Q496 WeakPolarHBondContact O-CG 3.34Å; K492-Q496 PolarHBondContact O-N 2.99Å; A493-Q496 PolarHBondContact O-N 2.94Å; R494-Q496 VanDerWaalsContact C-N 3.27Å; R494-Q496 PolarHBondContact O-N 3.28Å; Q496-Q498 VanDerWaalsContact C-N 3.33Å; Q496-Q498 PolarHBondContact O-N 3.29Å; Q496-F499 PolarHBondContact O-N 2.85Å; Q496-E500 PolarHBondContact O-N 2.95Å
497	M	65.8	Low	71.7	Confident	92 Å²	92	103.4 Å²	103.4	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-62.5	-39.9	176.3	-74.9	-179.7	170	0	0	112.3	A493 R494 E500 E501 A731	A493-M497 PolarHBondContact O-N 3.26Å; R494-M497 PolarHBondContact O-N 3.14Å; M497-E500 PolarHBondContact O-N 2.82Å; M497-E501 PolarHBondContact O-N 2.82Å; M497-A731 HydrophobicContact CE-CB 4.11Å
498	Q	74.4	Confident	71.8	Confident	97 Å²	97	99.1 Å²	99.1	45%	0.453	48%	0.483	S	S	.	.	H	α-helix	trans	-66.7	-42.1	176.6	-174.2	173.2	-25.8	0	0	111	R494 Q496 E500 E501 D502	R494-Q498 WeakPolarHBondContact O-CB 3.29Å; R494-Q498 PolarHBondContact O-N 2.8Å; Q496-Q498 VanDerWaalsContact C-N 3.33Å; Q496-Q498 PolarHBondContact O-N 3.29Å; Q498-E500 VanDerWaalsContact C-N 3.28Å; Q498-E500 PolarHBondContact O-N 3.29Å; Q498-E501 PolarHBondContact O-N 2.91Å; Q498-D502 WeakPolarHBondContact O-CB 3.29Å; Q498-D502 PolarHBondContact O-N 3.25Å
499	F	76.8	Confident	72.3	Confident	138 Å²	138	106 Å²	106	61%	0.605	50%	0.497	S	S	*	.	H	α-helix	trans	-60.4	-35.3	173.4	-178.4	-97.8	0	0	0	112.7	E495 Q496 V503	E495-F499 VanDerWaalsContact O-CB 3.27Å; E495-F499 WeakPolarHBondContact O-CB 3.36Å; E495-F499 PolarHBondContact O-N 2.94Å; Q496-F499 PolarHBondContact O-N 2.85Å; F499-V503 HydrophobicContact CD1-CG2 4.13Å; F499-V503 HydrophobicContact CD2-CG2 4.4Å; F499-V503 HydrophobicContact CE1-CG2 3.78Å; F499-V503 HydrophobicContact CE2-CG2 4.06Å; F499-V503 HydrophobicContact CG-CG2 4.44Å; F499-V503 HydrophobicContact CZ-CG2 3.74Å; F499-V503 VanDerWaalsContact O-CB 3.3Å; F499-V503 WeakPolarHBondContact O-CB 3.42Å; F499-V503 WeakPolarHBondContact O-CG2 3.49Å; F499-V503 PolarHBondContact O-N 3.26Å
500	E	74.4	Confident	73	Confident	139 Å²	139	103.2 Å²	103.2	65%	0.65	49%	0.489	S	S	*	.	H	α-helix	trans	-69.6	-40.6	173.3	-73.3	176.7	-172.8	0	0	112.6	Q496 M497 Q498 Q504	Q496-E500 PolarHBondContact O-N 2.95Å; M497-E500 PolarHBondContact O-N 2.82Å; Q498-E500 VanDerWaalsContact C-N 3.28Å; Q498-E500 PolarHBondContact O-N 3.29Å; E500-Q504 PolarHBondContact O-N 3.19Å; E500-Q504 VanDerWaalsContact O-N 3.07Å
501	E	74.5	Confident	73.6	Confident	116 Å²	116	100.7 Å²	100.7	54%	0.542	48%	0.483	S	S	.	.	H	α-helix	trans	-64.8	-41.6	172.5	-66.5	-161.9	131.9	0	0	111.5	M497 Q498 G505 K850	M497-E501 PolarHBondContact O-N 2.82Å; Q498-E501 PolarHBondContact O-N 2.91Å; E501-G505 PolarHBondContact O-N 3.41Å; E501-K850 IonicContact OE1-NZ 3.64Å; E501-K850 PolarHBondContact OE1-NZ 3.44Å; E501-K850 IonicContact OE2-NZ 2.64Å; E501-K850 PolarHBondContact OE2-NZ 2.84Å
502	D	80.4	Confident	73.6	Confident	74 Å²	74	96.4 Å²	96.4	40%	0.396	47%	0.47	S	S	.	.	H	α-helix	trans	-64.6	-47.5	177.2	-69.2	-25.6	0	0	0	111.5	Q498 Q504 G505 Y506	Q498-D502 WeakPolarHBondContact O-CB 3.29Å; Q498-D502 PolarHBondContact O-N 3.25Å; D502-Q504 PolarHBondContact O-N 3Å; D502-G505 CarbonylContact O-C 3.57Å; D502-G505 WeakPolarHBondContact O-CA 3.32Å; D502-G505 PolarHBondContact O-N 3.45Å; D502-G505 VanDerWaalsContact O-N 3.1Å; D502-Y506 HydrophobicContact CB-CE2 4.32Å; D502-Y506 WeakPolarHBondContact O-CD2 3.45Å; D502-Y506 PolarHBondContact O-N 3.42Å
503	V	80.7	Confident	73.6	Confident	57 Å²	57	92.1 Å²	92.1	35%	0.345	46%	0.46	S	S	.	.	H	α-helix	trans	-63.3	-40.4	178.3	166.6	0	0	0	0	111.8	F499 G505 Y506 L507	F499-V503 HydrophobicContact CD1-CG2 4.13Å; F499-V503 HydrophobicContact CD2-CG2 4.4Å; F499-V503 HydrophobicContact CE1-CG2 3.78Å; F499-V503 HydrophobicContact CE2-CG2 4.06Å; F499-V503 HydrophobicContact CG-CG2 4.44Å; F499-V503 HydrophobicContact CZ-CG2 3.74Å; F499-V503 VanDerWaalsContact O-CB 3.3Å; F499-V503 WeakPolarHBondContact O-CB 3.42Å; F499-V503 WeakPolarHBondContact O-CG2 3.49Å; F499-V503 PolarHBondContact O-N 3.26Å; V503-G505 VanDerWaalsContact C-N 3.31Å; V503-Y506 PolarHBondContact O-N 2.92Å; V503-L507 HydrophobicContact CG1-CD1 4.29Å; V503-L507 WeakPolarHBondContact O-CG 3.46Å; V503-L507 PolarHBondContact O-N 2.66Å
504	Q	74.4	Confident	73.8	Confident	75 Å²	75	96.2 Å²	96.2	35%	0.35	47%	0.472	S	S	.	.	H	α-helix	trans	-64.5	-38.4	172.4	-175.4	63.2	49.3	0	0	111.3	E500 D502 L507 D508	E500-Q504 PolarHBondContact O-N 3.19Å; E500-Q504 VanDerWaalsContact O-N 3.07Å; D502-Q504 PolarHBondContact O-N 3Å; Q504-L507 PolarHBondContact O-N 3.33Å; Q504-D508 PolarHBondContact NE2-OD1 3.19Å; Q504-D508 WeakPolarHBondContact O-CB 3.48Å; Q504-D508 PolarHBondContact O-N 3.5Å
505	G	78.3	Confident	73.7	Confident	41 Å²	41	90.3 Å²	90.3	42%	0.423	45%	0.452	S	S	.	.	H	α-helix	trans	-59.2	-44.4	173.5	0	0	0	0	0	113	E501 D502 V503 D508 W509	E501-G505 PolarHBondContact O-N 3.41Å; D502-G505 CarbonylContact O-C 3.57Å; D502-G505 WeakPolarHBondContact O-CA 3.32Å; D502-G505 PolarHBondContact O-N 3.45Å; D502-G505 VanDerWaalsContact O-N 3.1Å; V503-G505 VanDerWaalsContact C-N 3.31Å; G505-D508 PolarHBondContact O-N 2.83Å; G505-W509 WeakPolarHBondContact O-CB 3.47Å; G505-W509 PolarHBondContact O-N 3.1Å
506	Y	81.1	Confident	73.3	Confident	144 Å²	144	90.5 Å²	90.5	57%	0.565	45%	0.454	S	S	*	.	H	α-helix	trans	-64.2	-40.7	174	-70.7	-63.9	0	0	0	112.3	D502 V503 W509 I510	D502-Y506 HydrophobicContact CB-CE2 4.32Å; D502-Y506 WeakPolarHBondContact O-CD2 3.45Å; D502-Y506 PolarHBondContact O-N 3.42Å; V503-Y506 PolarHBondContact O-N 2.92Å; Y506-W509 HydrophobicContact CD1-CE3 4.26Å; Y506-W509 PolarHBondContact O-N 2.85Å; Y506-I510 WeakPolarHBondContact O-CB 3.4Å; Y506-I510 WeakPolarHBondContact O-CD1 3.37Å; Y506-I510 WeakPolarHBondContact O-CG1 3.28Å; Y506-I510 PolarHBondContact O-N 3Å
507	L	75.8	Confident	72.6	Confident	96 Å²	96	87.9 Å²	87.9	50%	0.503	45%	0.449	S	S	.	.	H	α-helix	trans	-66.9	-41.4	177.1	-71.9	172.7	0	0	0	112.7	V503 Q504 W509 I510 S511	V503-L507 HydrophobicContact CG1-CD1 4.29Å; V503-L507 WeakPolarHBondContact O-CG 3.46Å; V503-L507 PolarHBondContact O-N 2.66Å; Q504-L507 PolarHBondContact O-N 3.33Å; L507-W509 VanDerWaalsContact C-N 3.33Å; L507-I510 PolarHBondContact O-N 3.4Å; L507-S511 VanDerWaalsContact O-CB 3.26Å; L507-S511 WeakPolarHBondContact O-CB 3.2Å; L507-S511 PolarHBondContact O-N 3.31Å
508	D	70.6	Confident	72.2	Confident	74 Å²	74	84.7 Å²	84.7	40%	0.396	43%	0.434	S	S	.	.	H	α-helix	trans	-65.8	-36.3	174.6	-81	3.8	0	0	0	111.1	Q504 G505 A512	Q504-D508 PolarHBondContact NE2-OD1 3.19Å; Q504-D508 WeakPolarHBondContact O-CB 3.48Å; Q504-D508 PolarHBondContact O-N 3.5Å; G505-D508 PolarHBondContact O-N 2.83Å; D508-A512 WeakPolarHBondContact O-CB 3.36Å; D508-A512 PolarHBondContact O-N 3.47Å
509	W	77.1	Confident	71.2	Confident	179 Å²	179	83.6 Å²	83.6	68%	0.678	43%	0.431	S	S	*	.	H	α-helix	trans	-69.1	-43.4	174.2	-177.9	45.2	0	0	0	112.7	G505 Y506 L507 S511 A512 A513	G505-W509 WeakPolarHBondContact O-CB 3.47Å; G505-W509 PolarHBondContact O-N 3.1Å; Y506-W509 HydrophobicContact CD1-CE3 4.26Å; Y506-W509 PolarHBondContact O-N 2.85Å; L507-W509 VanDerWaalsContact C-N 3.33Å; W509-S511 VanDerWaalsContact C-N 3.34Å; W509-S511 PolarHBondContact O-N 3.48Å; W509-A512 CarbonylContact O-C 3.4Å; W509-A512 PolarHBondContact O-N 3.13Å; W509-A513 WeakPolarHBondContact O-CB 3.37Å; W509-A513 PolarHBondContact O-N 3.36Å
510	I	77.2	Confident	70.2	Confident	89 Å²	89	82.5 Å²	82.5	46%	0.456	43%	0.428	S	S	.	.	H	α-helix	trans	-61	-44.6	174.1	-70.7	162.1	0	0	0	110.2	Y506 L507 A512 A513 E514	Y506-I510 WeakPolarHBondContact O-CB 3.4Å; Y506-I510 WeakPolarHBondContact O-CD1 3.37Å; Y506-I510 WeakPolarHBondContact O-CG1 3.28Å; Y506-I510 PolarHBondContact O-N 3Å; L507-I510 PolarHBondContact O-N 3.4Å; I510-A512 VanDerWaalsContact C-N 3.33Å; I510-A512 PolarHBondContact O-N 3.27Å; I510-A513 PolarHBondContact O-N 2.93Å; I510-A513 VanDerWaalsContact O-N 3.16Å; I510-E514 PolarHBondContact O-N 2.86Å
511	S	69.1	Low	69.1	Low	29 Å²	29	79.2 Å²	79.2	20%	0.203	41%	0.413	C	S	.	.	H	α-helix	trans	-61.4	-40	175.1	-172.6	0	0	0	0	111.9	L507 W509 D515	L507-S511 VanDerWaalsContact O-CB 3.26Å; L507-S511 WeakPolarHBondContact O-CB 3.2Å; L507-S511 PolarHBondContact O-N 3.31Å; W509-S511 VanDerWaalsContact C-N 3.34Å; W509-S511 PolarHBondContact O-N 3.48Å; S511-D515 WeakPolarHBondContact O-CB 3.42Å; S511-D515 PolarHBondContact O-N 3.14Å; S511-D515 VanDerWaalsContact O-OD1 3.07Å
512	A	69.2	Low	67.9	Low	40 Å²	40	74.7 Å²	74.7	33%	0.331	39%	0.393	S	S	.	.	H	α-helix	trans	-68.5	-33.8	173.4	0	0	0	0	0	113.2	D508 W509 I510 D515 I516	D508-A512 WeakPolarHBondContact O-CB 3.36Å; D508-A512 PolarHBondContact O-N 3.47Å; W509-A512 CarbonylContact O-C 3.4Å; W509-A512 PolarHBondContact O-N 3.13Å; I510-A512 VanDerWaalsContact C-N 3.33Å; I510-A512 PolarHBondContact O-N 3.27Å; A512-D515 WeakPolarHBondContact O-CB 3.34Å; A512-D515 PolarHBondContact O-N 2.89Å; A512-I516 WeakPolarHBondContact O-CD1 3.35Å; A512-I516 VanDerWaalsContact O-CG1 3.27Å; A512-I516 WeakPolarHBondContact O-CG1 3.48Å; A512-I516 PolarHBondContact O-N 2.9Å
513	A	72.3	Confident	66.5	Low	47 Å²	47	75 Å²	75	39%	0.388	40%	0.398	S	S	.	.	H	α-helix	trans	-71.1	-41.7	174.9	0	0	0	0	0	111.7	W509 I510 D515 I516 S517	W509-A513 WeakPolarHBondContact O-CB 3.37Å; W509-A513 PolarHBondContact O-N 3.36Å; I510-A513 PolarHBondContact O-N 2.93Å; I510-A513 VanDerWaalsContact O-N 3.16Å; A513-D515 VanDerWaalsContact C-N 3.32Å; A513-D515 PolarHBondContact O-N 3.43Å; A513-I516 PolarHBondContact O-N 3.23Å; A513-S517 WeakPolarHBondContact O-CB 3.36Å; A513-S517 PolarHBondContact O-N 2.94Å; A513-S517 PolarHBondContact O-OG 3.1Å
514	E	67.2	Low	65	Low	129 Å²	129	76.6 Å²	76.6	60%	0.603	40%	0.404	S	S	*	.	H	α-helix	trans	-58.1	-45	169.4	-75.1	-166.9	174.1	0	0	110.8	I510 I516 S517 D518	I510-E514 PolarHBondContact O-N 2.86Å; E514-I516 PolarHBondContact O-N 3.41Å; E514-S517 WeakPolarHBondContact CA-OG 3.41Å; E514-S517 PolarHBondContact O-N 3.22Å; E514-S517 PolarHBondContact O-OG 3.07Å; E514-D518 PolarHBondContact O-N 3.12Å
515	D	61	Low	63.9	Low	24 Å²	24	76.5 Å²	76.5	13%	0.128	40%	0.402	C	S	.	.	H	α-helix	trans	-57.1	-46.9	176.6	-77.3	9.3	0	0	0	112.7	S511 A512 A513 D519 R603 K607	S511-D515 WeakPolarHBondContact O-CB 3.42Å; S511-D515 PolarHBondContact O-N 3.14Å; S511-D515 VanDerWaalsContact O-OD1 3.07Å; A512-D515 WeakPolarHBondContact O-CB 3.34Å; A512-D515 PolarHBondContact O-N 2.89Å; A513-D515 VanDerWaalsContact C-N 3.32Å; A513-D515 PolarHBondContact O-N 3.43Å; D515-D519 PolarHBondContact O-N 3.29Å; D515-R603 VanDerWaalsContact CG-NH2 3.27Å; D515-R603 IonicContact OD1-CZ 2.7Å; D515-R603 IonicContact OD1-NH1 3.68Å; D515-R603 PolarHBondContact OD1-NH1 2.78Å; D515-R603 IonicContact OD1-NH2 3.16Å; D515-R603 PolarHBondContact OD1-NH2 3.2Å; D515-R603 IonicContact OD2-CZ 3.64Å; D515-R603 IonicContact OD2-NE 3.58Å; D515-R603 PolarHBondContact OD2-NE 2.89Å; D515-R603 IonicContact OD2-NH1 3.38Å; D515-R603 PolarHBondContact OD2-NH1 3.45Å; D515-R603 IonicContact OD2-NH2 3.29Å; D515-R603 PolarHBondContact OD2-NH2 3.49Å; D515-R603 VanDerWaalsContact OD2-NH2 3.12Å; D515-K607 IonicContact OD2-NZ 2.67Å; D515-K607 PolarHBondContact OD2-NZ 3.46Å
516	I	64.2	Low	62.5	Low	105 Å²	105	79.9 Å²	79.9	54%	0.538	41%	0.407	S	S	.	.	H	α-helix	trans	-68.4	-41.2	178.6	-68.3	163.4	0	0	0	110.1	A512 A513 E514 D518 D519 E520	A512-I516 WeakPolarHBondContact O-CD1 3.35Å; A512-I516 VanDerWaalsContact O-CG1 3.27Å; A512-I516 WeakPolarHBondContact O-CG1 3.48Å; A512-I516 PolarHBondContact O-N 2.9Å; A513-I516 PolarHBondContact O-N 3.23Å; E514-I516 PolarHBondContact O-N 3.41Å; I516-D518 PolarHBondContact O-N 2.99Å; I516-D519 CarbonylContact O-C 3.54Å; I516-D519 WeakPolarHBondContact O-CA 3.39Å; I516-D519 WeakPolarHBondContact O-CB 3.5Å; I516-D519 PolarHBondContact O-N 3.44Å; I516-D519 VanDerWaalsContact O-N 3.08Å; I516-E520 HydrophobicContact CG2-CG 4.36Å; I516-E520 PolarHBondContact O-N 3Å
517	S	60.5	Low	60.9	Low	60 Å²	60	78.5 Å²	78.5	42%	0.42	41%	0.41	S	S	.	.	H	α-helix	trans	-65.1	-34.1	178.9	77.5	0	0	0	0	113.4	A513 E514 D519 E521	A513-S517 WeakPolarHBondContact O-CB 3.36Å; A513-S517 PolarHBondContact O-N 2.94Å; A513-S517 PolarHBondContact O-OG 3.1Å; E514-S517 WeakPolarHBondContact CA-OG 3.41Å; E514-S517 PolarHBondContact O-N 3.22Å; E514-S517 PolarHBondContact O-OG 3.07Å; S517-D519 VanDerWaalsContact C-N 3.28Å; S517-D519 PolarHBondContact O-N 3.4Å; S517-E521 WeakPolarHBondContact O-CB 3.39Å; S517-E521 WeakPolarHBondContact O-CG 3.42Å; S517-E521 PolarHBondContact O-N 2.83Å
518	D	56.5	Low	59.5	Low	26 Å²	26	79.7 Å²	79.7	14%	0.139	41%	0.413	C	S	.	.	H	α-helix	trans	-70.9	-26.8	174.8	-159.4	29	0	0	0	110.7	E514 I516 E521 T522 R596 R599 R600	E514-D518 PolarHBondContact O-N 3.12Å; I516-D518 PolarHBondContact O-N 2.99Å; D518-E521 WeakPolarHBondContact O-CB 3.34Å; D518-T522 WeakPolarHBondContact O-CG2 3.46Å; D518-T522 PolarHBondContact O-OG1 3.28Å; D518-R596 IonicContact OD1-CZ 2.74Å; D518-R596 VanDerWaalsContact OD1-CZ 3.3Å; D518-R596 IonicContact OD1-NE 3.03Å; D518-R596 PolarHBondContact OD1-NE 3.49Å; D518-R596 IonicContact OD1-NH2 3.92Å; D518-R596 PolarHBondContact OD1-NH2 2.71Å; D518-R599 IonicContact OD2-CZ 2.67Å; D518-R599 IonicContact OD2-NE 3.22Å; D518-R599 IonicContact OD2-NH2 3.16Å; D518-R599 PolarHBondContact OD2-NH2 3.2Å; D518-R600 VanDerWaalsContact C-NH2 3.28Å; D518-R600 PolarHBondContact O-NH2 2.88Å
519	D	54.2	Low	58.3	Low	74 Å²	74	81.8 Å²	81.8	40%	0.396	42%	0.418	S	S	.	.	H	α-helix	trans	-77.6	-48.2	173.7	-79.7	28.8	0	0	0	111.9	D515 I516 S517 E521 T522 T523 R600	D515-D519 PolarHBondContact O-N 3.29Å; I516-D519 CarbonylContact O-C 3.54Å; I516-D519 WeakPolarHBondContact O-CA 3.39Å; I516-D519 WeakPolarHBondContact O-CB 3.5Å; I516-D519 PolarHBondContact O-N 3.44Å; I516-D519 VanDerWaalsContact O-N 3.08Å; S517-D519 VanDerWaalsContact C-N 3.28Å; S517-D519 PolarHBondContact O-N 3.4Å; D519-E521 VanDerWaalsContact C-N 3.34Å; D519-E521 PolarHBondContact O-N 2.98Å; D519-T522 PolarHBondContact O-N 3.44Å; D519-T522 PolarHBondContact O-OG1 3.46Å; D519-T523 PolarHBondContact O-N 2.95Å; D519-T523 VanDerWaalsContact O-N 3.07Å; D519-R600 VanDerWaalsContact CA-NH2 3.33Å; D519-R600 VanDerWaalsContact CG-NE 3.32Å; D519-R600 IonicContact OD1-CZ 2.87Å; D519-R600 IonicContact OD1-NE 2.67Å; D519-R600 PolarHBondContact OD1-NE 2.66Å; D519-R600 IonicContact OD1-NH2 3.35Å; D519-R600 PolarHBondContact OD1-NH2 2.66Å; D519-R600 IonicContact OD2-NE 2.84Å; D519-R600 PolarHBondContact OD2-NE 2.76Å
520	E	55.6	Low	56.5	Low	115 Å²	115	82.1 Å²	82.1	54%	0.537	43%	0.427	S	S	.	.	H	α-helix	trans	-60.6	-39.1	170.1	-70.2	-171.6	167	0	0	112.5	I516 T522 T523 N524	I516-E520 HydrophobicContact CG2-CG 4.36Å; I516-E520 PolarHBondContact O-N 3Å; E520-T522 PolarHBondContact O-N 3.13Å; E520-T523 PolarHBondContact O-N 3.18Å; E520-T523 PolarHBondContact O-OG1 2.78Å; E520-T523 VanDerWaalsContact O-OG1 3.09Å; E520-N524 VanDerWaalsContact O-CB 3.26Å; E520-N524 WeakPolarHBondContact O-CB 3.35Å; E520-N524 PolarHBondContact O-N 3.42Å; E520-N524 PolarHBondContact O-ND2 3.37Å
521	E	51	Low	54.6	Low	70 Å²	70	86.5 Å²	86.5	33%	0.327	44%	0.443	S	S	.	.	H	α-helix	trans	-52.2	-27.6	170.3	-106	-118	159.3	0	0	112.2	S517 D518 D519 K525 R596	S517-E521 WeakPolarHBondContact O-CB 3.39Å; S517-E521 WeakPolarHBondContact O-CG 3.42Å; S517-E521 PolarHBondContact O-N 2.83Å; D518-E521 WeakPolarHBondContact O-CB 3.34Å; D519-E521 VanDerWaalsContact C-N 3.34Å; D519-E521 PolarHBondContact O-N 2.98Å; E521-K525 WeakPolarHBondContact O-CB 3.44Å; E521-K525 VanDerWaalsContact O-CD 3.23Å; E521-K525 WeakPolarHBondContact O-CD 3.38Å; E521-K525 WeakPolarHBondContact O-CG 3.38Å; E521-K525 PolarHBondContact O-N 2.97Å; E521-K525 VanDerWaalsContact O-N 3.13Å; E521-K525 IonicContact OE1-NZ 3.74Å; E521-K525 PolarHBondContact OE1-NZ 3.37Å; E521-K525 IonicContact OE2-NZ 3.2Å; E521-K525 PolarHBondContact OE2-NZ 2.61Å; E521-R596 IonicContact OE2-CZ 2.79Å; E521-R596 IonicContact OE2-NH1 3.68Å; E521-R596 PolarHBondContact OE2-NH1 2.84Å; E521-R596 IonicContact OE2-NH2 2.71Å; E521-R596 PolarHBondContact OE2-NH2 3.09Å
522	T	49.7	Very low	52.8	Low	21 Å²	21	93.8 Å²	93.8	13%	0.129	47%	0.471	C	S	.	.	H	α-helix	trans	-105.2	-24.1	-173.6	54	0	0	0	0	115.1	D518 D519 E520 E526 R600	D518-T522 WeakPolarHBondContact O-CG2 3.46Å; D518-T522 PolarHBondContact O-OG1 3.28Å; D519-T522 PolarHBondContact O-N 3.44Å; D519-T522 PolarHBondContact O-OG1 3.46Å; E520-T522 PolarHBondContact O-N 3.13Å; T522-E526 WeakPolarHBondContact O-CG 3.34Å; T522-E526 PolarHBondContact O-N 3.15Å; T522-R600 PolarHBondContact OG1-NH1 3.22Å; T522-R600 PolarHBondContact OG1-NH2 2.85Å
523	T	50.4	Low	50.8	Low	81 Å²	81	100.4 Å²	100.4	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-55.4	160.5	44.2	0	0	0	0	108.1	D519 E520 K525 E526 D527	D519-T523 PolarHBondContact O-N 2.95Å; D519-T523 VanDerWaalsContact O-N 3.07Å; E520-T523 PolarHBondContact O-N 3.18Å; E520-T523 PolarHBondContact O-OG1 2.78Å; E520-T523 VanDerWaalsContact O-OG1 3.09Å; T523-K525 VanDerWaalsContact C-N 3.26Å; T523-K525 PolarHBondContact O-N 2.77Å; T523-K525 VanDerWaalsContact O-N 3.12Å; T523-E526 PolarHBondContact O-N 2.82Å; T523-D527 PolarHBondContact O-N 3.39Å; T523-D527 VanDerWaalsContact O-OD2 3.13Å
524	N	49.7	Very low	49	Very low	90 Å²	90	105.2 Å²	105.2	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-57.2	-33.9	177.3	-67.4	-40.4	0	0	0	113.1	E520 D527 E528	E520-N524 VanDerWaalsContact O-CB 3.26Å; E520-N524 WeakPolarHBondContact O-CB 3.35Å; E520-N524 PolarHBondContact O-N 3.42Å; E520-N524 PolarHBondContact O-ND2 3.37Å; N524-D527 PolarHBondContact O-N 3.29Å; N524-E528 VanDerWaalsContact O-CB 3.31Å; N524-E528 WeakPolarHBondContact O-CB 3.41Å; N524-E528 WeakPolarHBondContact O-CG 3.12Å; N524-E528 PolarHBondContact O-N 3.46Å
525	K	50.2	Low	47.3	Very low	72 Å²	72	110.4 Å²	110.4	31%	0.313	52%	0.521	S	S	.	.	H	α-helix	trans	-91.5	7.4	175	-64.7	171.9	-167.5	-178.9	0	115	E521 T523 K529	E521-K525 WeakPolarHBondContact O-CB 3.44Å; E521-K525 VanDerWaalsContact O-CD 3.23Å; E521-K525 WeakPolarHBondContact O-CD 3.38Å; E521-K525 WeakPolarHBondContact O-CG 3.38Å; E521-K525 PolarHBondContact O-N 2.97Å; E521-K525 VanDerWaalsContact O-N 3.13Å; E521-K525 IonicContact OE1-NZ 3.74Å; E521-K525 PolarHBondContact OE1-NZ 3.37Å; E521-K525 IonicContact OE2-NZ 3.2Å; E521-K525 PolarHBondContact OE2-NZ 2.61Å; T523-K525 VanDerWaalsContact C-N 3.26Å; T523-K525 PolarHBondContact O-N 2.77Å; T523-K525 VanDerWaalsContact O-N 3.12Å; K525-K529 WeakPolarHBondContact O-CD 3.42Å; K525-K529 PolarHBondContact O-NZ 2.76Å
526	E	48.9	Very low	46.2	Very low	112 Å²	112	115.6 Å²	115.6	52%	0.523	56%	0.558	S	S	.	*	H	α-helix	trans	-95.1	-34.2	155.6	-64.4	-156.3	134.9	0	0	110.3	T522 T523 K529 R593	T522-E526 WeakPolarHBondContact O-CG 3.34Å; T522-E526 PolarHBondContact O-N 3.15Å; T523-E526 PolarHBondContact O-N 2.82Å; E526-K529 PolarHBondContact O-N 3.16Å; E526-R593 IonicContact OE1-CZ 3.98Å; E526-R593 IonicContact OE1-NE 2.57Å; E526-R593 PolarHBondContact OE1-NE 2.9Å; E526-R593 IonicContact OE1-NH2 3.01Å; E526-R593 PolarHBondContact OE1-NH2 3.19Å
527	D	49.2	Very low	45	Very low	115 Å²	115	113.6 Å²	113.6	62%	0.615	56%	0.557	S	S	*	*	H	α-helix	trans	-69.8	-46.4	173.9	-58.4	-39.4	0	0	0	113.5	T523 N524 K529 E530	T523-D527 PolarHBondContact O-N 3.39Å; T523-D527 VanDerWaalsContact O-OD2 3.13Å; N524-D527 PolarHBondContact O-N 3.29Å; D527-K529 PolarHBondContact O-N 3.39Å; D527-E530 PolarHBondContact O-N 2.85Å
528	E	45.1	Very low	43.5	Very low	121 Å²	121	114.6 Å²	114.6	57%	0.565	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-11	176.1	-82.7	-161.5	131.9	0	0	113.8	N524 E530 K531	N524-E528 VanDerWaalsContact O-CB 3.31Å; N524-E528 WeakPolarHBondContact O-CB 3.41Å; N524-E528 WeakPolarHBondContact O-CG 3.12Å; N524-E528 PolarHBondContact O-N 3.46Å; E528-E530 VanDerWaalsContact C-N 3.26Å; E528-E530 PolarHBondContact O-N 2.89Å; E528-K531 CarbonylContact O-C 3.56Å; E528-K531 WeakPolarHBondContact O-CA 3.42Å; E528-K531 PolarHBondContact O-N 3.38Å
529	K	46.6	Very low	42.1	Very low	119 Å²	119	119.2 Å²	119.2	52%	0.517	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	-4.2	-180	-80.3	177.2	-175.5	59.3	0	114.8	K525 E526 D527	K525-K529 WeakPolarHBondContact O-CD 3.42Å; K525-K529 PolarHBondContact O-NZ 2.76Å; E526-K529 PolarHBondContact O-N 3.16Å; D527-K529 PolarHBondContact O-N 3.39Å
530	E	38.8	Very low	40.9	Very low	185 Å²	185	127.3 Å²	127.3	86%	0.864	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-28.8	158.6	-166.6	151.6	-124.5	0	0	111.9	D527 E528 K532	D527-E530 PolarHBondContact O-N 2.85Å; E528-E530 VanDerWaalsContact C-N 3.26Å; E528-E530 PolarHBondContact O-N 2.89Å; E530-K532 PolarHBondContact O-N 3.04Å
531	K	36.5	Very low	39.6	Very low	181 Å²	181	127.4 Å²	127.4	79%	0.787	64%	0.635	S	S	*	*	S	Bend	trans	-100.8	71.5	174.4	-69.2	-178.7	-178.1	173.3	0	111.8	E528 F533	E528-K531 CarbonylContact O-C 3.56Å; E528-K531 WeakPolarHBondContact O-CA 3.42Å; E528-K531 PolarHBondContact O-N 3.38Å; K531-F533 PolarHBondContact O-N 3.02Å
532	K	32.1	Very low	38.5	Very low	183 Å²	183	130.1 Å²	130.1	80%	0.796	66%	0.657	S	S	*	*			trans	-37.5	135.5	169.1	-68.5	172	179.8	167	0	112	E530	E530-K532 PolarHBondContact O-N 3.04Å
533	F	26.4	Very low	37.3	Very low	179 Å²	179	134.2 Å²	134.2	79%	0.785	69%	0.686	S	S	*	*			trans	32.1	114.4	148	-80.1	-106.7	0	0	0	117	K531	K531-F533 PolarHBondContact O-N 3.02Å
534	H	36.2	Very low	36.2	Very low	148 Å²	148	135.3 Å²	135.3	69%	0.685	70%	0.697	S	S	*	*				174.7	93.3	104.2	-175.2	-90.6	0	0	0	113.4
535	W	30.4	Very low	35.1	Very low	238 Å²	238	136.6 Å²	136.6	90%	0.902	71%	0.713	S	S	*	*			trans	-144.7	27	152.7	-131.9	77.3	0	0	0	113.6	A537	W535-A537 VanDerWaalsContact C-N 3.31Å; W535-A537 PolarHBondContact O-N 2.87Å
536	C	37.4	Very low	34.4	Very low	133 Å²	133	136.9 Å²	136.9	90%	0.899	73%	0.729	S	S	*	*			trans	-92.8	67.2	170.6	-166.8	0	0	0	0	108.5
537	A	38.9	Very low	33.6	Very low	63 Å²	63	136.7 Å²	136.7	52%	0.521	74%	0.736	S	S	.	*			trans	-150.9	43.4	-161.2	0	0	0	0	0	114.4	W535	W535-A537 VanDerWaalsContact C-N 3.31Å; W535-A537 PolarHBondContact O-N 2.87Å
538	A	29.7	Very low	32.5	Very low	81 Å²	81	138 Å²	138	67%	0.669	74%	0.742	S	S	*	*	S	Bend	trans	-107.5	-90.4	173.3	0	0	0	0	0	112.1
539	C	28	Very low	31.8	Very low	122 Å²	122	138.4 Å²	138.4	82%	0.824	75%	0.749	S	S	*	*	S	Bend	trans	-122.6	48.6	-158.3	-55.1	0	0	0	0	116.2
540	R	27.2	Very low	30.9	Very low	245 Å²	245	140.3 Å²	140.3	93%	0.925	76%	0.757	S	S	*	*			trans	-155.2	60.3	158.3	-143.1	170.5	-71.7	-151.1	0.9	116
541	T	29.1	Very low	30.4	Very low	117 Å²	117	137.6 Å²	137.6	72%	0.718	75%	0.745	S	S	*	*			trans	-121.8	108.8	159.6	41.2	0	0	0	0	110.4
542	T	27.1	Very low	29.8	Very low	126 Å²	126	133.4 Å²	133.4	77%	0.773	73%	0.728	S	S	*	*			trans	54.7	143.8	139.4	53.3	0	0	0	0	122.5
543	S	26.1	Very low	29.3	Very low	108 Å²	108	129.3 Å²	129.3	76%	0.755	71%	0.712	S	S	*	*			trans	76.4	139.6	159.6	25.1	0	0	0	0	119.6
544	S	26.2	Very low	29.3	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	70%	0.7	S	S	*	*			trans	56.6	118.8	161	50.2	0	0	0	0	119.8
545	S	28	Very low	28.9	Very low	117 Å²	117	127.4 Å²	127.4	82%	0.818	71%	0.705	S	S	*	*			trans	55.7	131.4	143.5	53	0	0	0	0	119.7
546	A	34	Very low	29.2	Very low	78 Å²	78	119.7 Å²	119.7	65%	0.645	68%	0.682	S	S	*	*			cis	-161.6	-174.6	-6.5	0	0	0	0	0	108.9
547	T	33.6	Very low	29.3	Very low	108 Å²	108	117.7 Å²	117.7	66%	0.663	67%	0.667	S	S	*	*			trans	42.8	104.6	148.2	48.4	0	0	0	0	115.8
548	D	25.3	Very low	29.2	Very low	142 Å²	142	117.2 Å²	117.2	76%	0.759	66%	0.66	S	S	*	*			cis	46.5	165.8	43.8	-69.1	-44.4	0	0	0	113
549	D	30.6	Very low	29.6	Very low	131 Å²	131	120 Å²	120	70%	0.701	66%	0.659	S	S	*	*			trans	70	105.3	-177.6	-45.4	-34.3	0	0	0	114.5
550	F	28.3	Very low	29.8	Very low	159 Å²	159	121.4 Å²	121.4	70%	0.697	65%	0.653	S	S	*	*			cis	101.8	151.5	36.6	-82	-127.5	0	0	0	113.7
551	E	26.9	Very low	29.8	Very low	128 Å²	128	112.2 Å²	112.2	60%	0.598	64%	0.635	S	S	*	*			trans	67.2	-167.5	149.3	-74.9	160.5	-166.1	0	0	119.3	H569	E551-H569 PolarHBondContact O-CE1 3.32Å; E551-H569 PolarHBondContact O-ND1 3.48Å
552	E	24.1	Very low	30.2	Very low	92 Å²	92	114.8 Å²	114.8	43%	0.43	64%	0.643	S	S	.	*			trans	41.7	-159	171.7	-53.2	-39.6	88.5	0	0	122.3	H569 R570	E552-H569 VanDerWaalsContact O-CB 3.28Å; E552-H569 WeakPolarHBondContact O-CB 3.42Å; E552-H569 PolarHBondContact O-ND1 3.03Å; E552-R570 VanDerWaalsContact O-CA 3.3Å; E552-R570 WeakPolarHBondContact O-CA 3.37Å; E552-R570 WeakPolarHBondContact O-CB 3.46Å; E552-R570 VanDerWaalsContact O-CD 3.23Å; E552-R570 WeakPolarHBondContact O-CD 3.36Å; E552-R570 WeakPolarHBondContact O-CG 3.2Å; E552-R570 PolarHBondContact O-N 2.82Å; E552-R570 IonicContact OE1-NH1 3.58Å; E552-R570 PolarHBondContact OE1-NH1 3.06Å; E552-R570 IonicContact OE2-CZ 2.62Å; E552-R570 IonicContact OE2-NH1 2.73Å; E552-R570 PolarHBondContact OE2-NH1 2.6Å; E552-R570 IonicContact OE2-NH2 2.76Å; E552-R570 PolarHBondContact OE2-NH2 3.06Å
553	E	22.1	Very low	30.8	Very low	98 Å²	98	114.1 Å²	114.1	46%	0.458	64%	0.635	S	S	.	*				-137.7	108.9	-128.6	-170.8	91.6	-78.3	0	0	114.3	H569 R570	E553-H569 PolarHBondContact N-CD2 2.77Å; E553-H569 PolarHBondContact N-ND1 2.82Å; E553-R570 VanDerWaalsContact CD-NH2 3.34Å; E553-R570 WeakPolarHBondContact OE1-CD 3.07Å; E553-R570 IonicContact OE1-CZ 2.66Å; E553-R570 IonicContact OE1-NE 2.75Å; E553-R570 PolarHBondContact OE1-NE 3.06Å; E553-R570 IonicContact OE1-NH2 2.79Å; E553-R570 IonicContact OE2-CZ 3.45Å; E553-R570 VanDerWaalsContact OE2-CZ 3.28Å; E553-R570 IonicContact OE2-NE 3.21Å; E553-R570 PolarHBondContact OE2-NE 3.48Å; E553-R570 IonicContact OE2-NH2 3.57Å; E553-R570 PolarHBondContact OE2-NH2 3.29Å
554	E	26.7	Very low	31.2	Very low	115 Å²	115	112.2 Å²	112.2	54%	0.537	62%	0.616	S	S	.	*			trans	59.1	-176.5	160.2	-52.5	-168.5	106.9	0	0	121
555	E	28.2	Very low	31.4	Very low	171 Å²	171	109.8 Å²	109.8	80%	0.799	61%	0.607	S	S	*	*			trans	64	155.8	159.9	-57.4	-166.9	131.8	0	0	125.6
556	D	36.3	Very low	31.6	Very low	76 Å²	76	107.5 Å²	107.5	41%	0.406	60%	0.603	S	S	.	*			trans	-56.8	171.8	152.2	-77.4	-36.4	0	0	0	110.8	S93 V94	S93-D556 VanDerWaalsContact CB-CG 3.48Å; S93-D556 WeakPolarHBondContact CB-OD1 3.47Å; S93-D556 WeakPolarHBondContact CB-OD2 3.24Å; S93-D556 PolarHBondContact OG-OD1 2.82Å; S93-D556 PolarHBondContact OG-OD2 3.12Å; V94-D556 WeakPolarHBondContact CG2-OD1 3.2Å
557	P	39.9	Very low	31.4	Very low	91 Å²	91	106.7 Å²	106.7	59%	0.591	60%	0.602	S	S	*	*			cis	-149.4	178.1	22.3	45.8	-25.9	0	0	0	118.7
558	S	36.9	Very low	31.2	Very low	53 Å²	53	104.4 Å²	104.4	37%	0.371	60%	0.6	S	S	.	*			trans	30.2	137.4	139.3	69.3	0	0	0	0	124
559	E	36.7	Very low	31.3	Very low	139 Å²	139	102.2 Å²	102.2	65%	0.65	59%	0.585	S	S	*	*			trans	59.8	129	138.6	-64.8	-178.8	146.6	0	0	116.9	D564	E559-D564 VanDerWaalsContact CA-OD1 3.26Å; E559-D564 WeakPolarHBondContact CA-OD1 3.44Å; E559-D564 PolarHBondContact N-OD1 3.31Å; E559-D564 VanDerWaalsContact N-OD1 3.15Å; E559-D564 PolarHBondContact N-OD2 3.49Å; E559-D564 VanDerWaalsContact N-OD2 3.16Å
560	H	32	Very low	31	Very low	152 Å²	152	101.3 Å²	101.3	70%	0.704	57%	0.571	S	S	*	*			cis	-178.1	134.2	40	-147.5	-38.5	0	0	0	111	D563	H560-D563 IonicContact ND1-OD1 3.83Å
561	G	28.2	Very low	30.9	Very low	52 Å²	52	97.6 Å²	97.6	54%	0.536	57%	0.565	S	S	.	*	S	Bend	trans	90.3	100.6	157.3	0	0	0	0	0	116.9	D563	G561-D563 VanDerWaalsContact CA-OD1 3.24Å; G561-D563 WeakPolarHBondContact CA-OD1 3.34Å; G561-D563 PolarHBondContact N-OD1 3.42Å
562	L	36.4	Very low	31	Very low	172 Å²	172	99.6 Å²	99.6	90%	0.901	58%	0.575	S	S	*	*	S	Bend	cis	-144.6	98.1	5	-75.3	161.3	0	0	0	110.6
563	D	40	Very low	31	Very low	112 Å²	112	100.5 Å²	100.5	60%	0.599	59%	0.591	S	S	*	*	S	Bend	cis	-146.8	145.3	-24.2	-67.7	-74.7	0	0	0	103.8	H560 G561	H560-D563 IonicContact ND1-OD1 3.83Å; G561-D563 VanDerWaalsContact CA-OD1 3.24Å; G561-D563 WeakPolarHBondContact CA-OD1 3.34Å; G561-D563 PolarHBondContact N-OD1 3.42Å
564	D	34.4	Very low	31.2	Very low	67 Å²	67	100.5 Å²	100.5	36%	0.358	60%	0.602	S	S	.	*			cis	-139.7	-174.7	4.3	-159.1	-1.3	0	0	0	108.8	N96 E559	N96-D564 PolarHBondContact ND2-OD2 3.48Å; E559-D564 VanDerWaalsContact CA-OD1 3.26Å; E559-D564 WeakPolarHBondContact CA-OD1 3.44Å; E559-D564 PolarHBondContact N-OD1 3.31Å; E559-D564 VanDerWaalsContact N-OD1 3.15Å; E559-D564 PolarHBondContact N-OD2 3.49Å; E559-D564 VanDerWaalsContact N-OD2 3.16Å
565	G	31.1	Very low	31.2	Very low	52 Å²	52	99.2 Å²	99.2	54%	0.536	61%	0.605	S	S	.	*			trans	-149.4	179.4	-176.1	0	0	0	0	0	118.1
566	G	31.2	Very low	31.4	Very low	70 Å²	70	98.2 Å²	98.2	72%	0.722	60%	0.601	S	S	*	*			trans	85.6	151.9	178.7	0	0	0	0	0	115.2
567	G	30	Very low	30.9	Very low	61 Å²	61	101.8 Å²	101.8	63%	0.629	62%	0.615	S	S	*	*			cis	-177	155.8	-8.6	0	0	0	0	0	112.8
568	G	29	Very low	30.3	Very low	59 Å²	59	105 Å²	105	61%	0.608	62%	0.622	S	S	*	*			trans	67.3	173.8	158.5	0	0	0	0	0	122.1
569	H	28	Very low	29.9	Very low	97 Å²	97	110.2 Å²	110.2	45%	0.449	64%	0.64	S	S	.	*			cis	-171	153.5	-22.8	-102.8	-36.2	0	0	0	114	E551 E552 E553	E551-H569 PolarHBondContact O-CE1 3.32Å; E551-H569 PolarHBondContact O-ND1 3.48Å; E552-H569 VanDerWaalsContact O-CB 3.28Å; E552-H569 WeakPolarHBondContact O-CB 3.42Å; E552-H569 PolarHBondContact O-ND1 3.03Å; E553-H569 PolarHBondContact N-CD2 2.77Å; E553-H569 PolarHBondContact N-ND1 2.82Å
570	R	25.1	Very low	29.5	Very low	111 Å²	111	114.2 Å²	114.2	42%	0.419	65%	0.651	S	S	.	*			trans	71.9	108.9	163.8	-126.8	152.7	171.8	92.4	-38.2	124.1	E552 E553	E552-R570 VanDerWaalsContact O-CA 3.3Å; E552-R570 WeakPolarHBondContact O-CA 3.37Å; E552-R570 WeakPolarHBondContact O-CB 3.46Å; E552-R570 VanDerWaalsContact O-CD 3.23Å; E552-R570 WeakPolarHBondContact O-CD 3.36Å; E552-R570 WeakPolarHBondContact O-CG 3.2Å; E552-R570 PolarHBondContact O-N 2.82Å; E552-R570 IonicContact OE1-NH1 3.58Å; E552-R570 PolarHBondContact OE1-NH1 3.06Å; E552-R570 IonicContact OE2-CZ 2.62Å; E552-R570 IonicContact OE2-NH1 2.73Å; E552-R570 PolarHBondContact OE2-NH1 2.6Å; E552-R570 IonicContact OE2-NH2 2.76Å; E552-R570 PolarHBondContact OE2-NH2 3.06Å; E553-R570 VanDerWaalsContact CD-NH2 3.34Å; E553-R570 WeakPolarHBondContact OE1-CD 3.07Å; E553-R570 IonicContact OE1-CZ 2.66Å; E553-R570 IonicContact OE1-NE 2.75Å; E553-R570 PolarHBondContact OE1-NE 3.06Å; E553-R570 IonicContact OE1-NH2 2.79Å; E553-R570 IonicContact OE2-CZ 3.45Å; E553-R570 VanDerWaalsContact OE2-CZ 3.28Å; E553-R570 IonicContact OE2-NE 3.21Å; E553-R570 PolarHBondContact OE2-NE 3.48Å; E553-R570 IonicContact OE2-NH2 3.57Å; E553-R570 PolarHBondContact OE2-NH2 3.29Å
571	S	26.6	Very low	29.2	Very low	81 Å²	81	114.3 Å²	114.3	57%	0.566	65%	0.65	S	S	*	*				37.7	161	113.2	-40.5	0	0	0	0	122.3
572	Q	27.3	Very low	29.2	Very low	171 Å²	171	120.2 Å²	120.2	80%	0.799	66%	0.661	S	S	*	*			cis	-162	149.1	14.5	-150.9	169.2	45.9	0	0	113.1
573	S	25.3	Very low	28.8	Very low	111 Å²	111	116.4 Å²	116.4	78%	0.776	65%	0.647	S	S	*	*			trans	65.1	145.5	161.4	76.5	0	0	0	0	118.7
574	S	25.5	Very low	28.3	Very low	98 Å²	98	116 Å²	116	69%	0.685	64%	0.644	S	S	*	*			cis	-159.3	142.9	-6.1	49.5	0	0	0	0	112.1
575	S	28.3	Very low	28.5	Very low	87 Å²	87	117.6 Å²	117.6	61%	0.608	66%	0.658	S	S	*	*			trans	57.2	146.1	154.9	58.2	0	0	0	0	120.3
576	Q	30.4	Very low	28.8	Very low	150 Å²	150	121.8 Å²	121.8	70%	0.701	67%	0.668	S	S	*	*			cis	-158.7	128.7	-13.2	-105.5	168.5	0.8	0	0	104.2
577	Q	26.8	Very low	29.1	Very low	151 Å²	151	128.7 Å²	128.7	71%	0.706	68%	0.678	S	S	*	*				97.9	122.5	53.7	-95.5	-172.6	-39.4	0	0	114.1
578	H	27.5	Very low	29.7	Very low	159 Å²	159	127 Å²	127	74%	0.736	66%	0.66	S	S	*	*			trans	66.3	159.1	160.1	-63.1	-65	0	0	0	117.1
579	Q	27.7	Very low	30.8	Very low	162 Å²	162	134.8 Å²	134.8	76%	0.757	67%	0.671	S	S	*	*			cis	-147.2	97.2	17.6	-160.4	168.8	9.5	0	0	115.1	F581	Q579-F581 VanDerWaalsContact C-N 3.32Å; Q579-F581 HydrophobicContact CG-CB 4.35Å; Q579-F581 PolarHBondContact O-N 3.34Å; Q579-F581 VanDerWaalsContact O-N 3.15Å
580	Y	28	Very low	32	Very low	224 Å²	224	141.4 Å²	141.4	88%	0.878	69%	0.692	S	S	*	*			trans	-80.3	72.9	158.9	-75.5	-77.9	0	0	0	110.7
581	F	27.6	Very low	33.3	Very low	153 Å²	153	139.4 Å²	139.4	67%	0.671	70%	0.695	S	S	*	*			trans	-156.7	103	171	-138.6	-90.1	0	0	0	115.7	Q579 C583	Q579-F581 VanDerWaalsContact C-N 3.32Å; Q579-F581 HydrophobicContact CG-CB 4.35Å; Q579-F581 PolarHBondContact O-N 3.34Å; Q579-F581 VanDerWaalsContact O-N 3.15Å; F581-C583 HydrophobicContact CE1-CB 4.15Å; F581-C583 HydrophobicContact CZ-CB 4.29Å
582	F	27	Very low	34.7	Very low	177 Å²	177	144.7 Å²	144.7	78%	0.776	70%	0.703	S	S	*	*			trans	-145.5	79.2	138.2	-161.6	-129	0	0	0	111.7	I584	F582-I584 HydrophobicContact CD1-CD1 4.22Å; F582-I584 HydrophobicContact CD1-CG1 4.11Å; F582-I584 HydrophobicContact CE1-CD1 3.36Å; F582-I584 HydrophobicContact CE1-CG1 3.58Å; F582-I584 HydrophobicContact CZ-CD1 3.73Å; F582-I584 HydrophobicContact CZ-CG1 3.8Å; F582-I584 PolarHBondContact O-N 3.02Å
583	C	28.6	Very low	36.2	Very low	91 Å²	91	143 Å²	143	62%	0.615	69%	0.689	S	S	*	*			trans	-70.8	105.7	169	-100.1	0	0	0	0	110.4	F581 P585	F581-C583 HydrophobicContact CE1-CB 4.15Å; F581-C583 HydrophobicContact CZ-CB 4.29Å; C583-P585 WeakPolarHBondContact O-CD 3.24Å
584	I	28.4	Very low	37.8	Very low	104 Å²	104	147.4 Å²	147.4	53%	0.533	69%	0.689	S	S	.	*			trans	-96.7	96.5	153.6	-72.5	-173.3	0	0	0	109.2	F582 L586	F582-I584 HydrophobicContact CD1-CD1 4.22Å; F582-I584 HydrophobicContact CD1-CG1 4.11Å; F582-I584 HydrophobicContact CE1-CD1 3.36Å; F582-I584 HydrophobicContact CE1-CG1 3.58Å; F582-I584 HydrophobicContact CZ-CD1 3.73Å; F582-I584 HydrophobicContact CZ-CG1 3.8Å; F582-I584 PolarHBondContact O-N 3.02Å; I584-L586 HydrophobicContact CG2-CB 3.61Å; I584-L586 HydrophobicContact CG2-CD1 3.81Å; I584-L586 HydrophobicContact CG2-CG 3.78Å; I584-L586 PolarHBondContact O-N 3.46Å
585	P	38.6	Very low	39.9	Very low	100 Å²	100	146.6 Å²	146.6	65%	0.649	68%	0.677	S	S	*	*			trans	-90	33.8	164.4	37.3	-35.9	0	0	0	111.6	C583 K587	C583-P585 WeakPolarHBondContact O-CD 3.24Å; P585-K587 PolarHBondContact O-N 3.13Å
586	L	38	Very low	41.8	Very low	140 Å²	140	146.6 Å²	146.6	73%	0.733	66%	0.664	S	S	*	*			trans	-65.2	99.3	-178.2	-80.5	170.8	0	0	0	112.1	I584 G588	I584-L586 HydrophobicContact CG2-CB 3.61Å; I584-L586 HydrophobicContact CG2-CD1 3.81Å; I584-L586 HydrophobicContact CG2-CG 3.78Å; I584-L586 PolarHBondContact O-N 3.46Å; L586-G588 PolarHBondContact O-N 2.9Å
587	K	36.8	Very low	43.8	Very low	216 Å²	216	148.8 Å²	148.8	94%	0.939	67%	0.666	S	S	*	*	S	Bend	trans	51.5	43.6	140.4	-117.8	171.7	-177.6	175.3	0	116.7	P585	P585-K587 PolarHBondContact O-N 3.13Å
588	G	44.2	Very low	45.9	Very low	25 Å²	25	144.2 Å²	144.2	26%	0.258	65%	0.649	S	S	.	*			trans	-139.9	50.4	-171.7	0	0	0	0	0	117.4	L586 R590 S591 R592	L586-G588 PolarHBondContact O-N 2.9Å; G588-R590 PolarHBondContact O-N 3.15Å; G588-S591 CarbonylContact O-C 2.96Å; G588-S591 WeakPolarHBondContact O-CA 3.35Å; G588-S591 WeakPolarHBondContact O-CB 3.19Å; G588-S591 PolarHBondContact O-N 3.21Å; G588-R592 PolarHBondContact O-N 2.89Å
589	R	51.7	Low	48.3	Very low	222 Å²	222	139.8 Å²	139.8	84%	0.838	63%	0.626	S	S	*	*	H	α-helix	trans	-59.8	-32.4	174.4	-106.3	-178.3	177.3	163.7	0.1	113.2
590	R	53.8	Low	50.4	Low	237 Å²	237	134.7 Å²	134.7	89%	0.894	60%	0.6	S	S	*	*	H	α-helix	trans	-70.6	-40.5	170	-138.2	174.3	-170.7	169.9	1.9	111.3	G588 R593 W594	G588-R590 PolarHBondContact O-N 3.15Å; R590-R593 PolarHBondContact O-N 3.35Å; R590-W594 PolarHBondContact O-N 2.93Å
591	S	52.4	Low	52.8	Low	69 Å²	69	127.7 Å²	127.7	48%	0.483	58%	0.584	S	S	.	*	H	α-helix	trans	-60.4	-44	177.9	-171.8	0	0	0	0	112.8	G588 R593 W594 N595	G588-S591 CarbonylContact O-C 2.96Å; G588-S591 WeakPolarHBondContact O-CA 3.35Å; G588-S591 WeakPolarHBondContact O-CB 3.19Å; G588-S591 PolarHBondContact O-N 3.21Å; S591-R593 VanDerWaalsContact C-N 3.28Å; S591-R593 PolarHBondContact O-N 3.46Å; S591-W594 CarbonylContact O-C 2.89Å; S591-W594 WeakPolarHBondContact O-CA 3.3Å; S591-W594 WeakPolarHBondContact O-CB 3.12Å; S591-W594 PolarHBondContact O-N 2.87Å; S591-N595 WeakPolarHBondContact O-CB 3.15Å; S591-N595 PolarHBondContact O-N 2.99Å
592	R	54.9	Low	55.3	Low	191 Å²	191	121.4 Å²	121.4	72%	0.721	56%	0.559	S	S	*	*	H	α-helix	trans	-56.4	-37	178.6	-73.5	-169.1	-179.5	-176.6	0.2	114	G588 N595 R596	G588-R592 PolarHBondContact O-N 2.89Å; R592-N595 PolarHBondContact O-N 3.21Å; R592-R596 PolarHBondContact O-N 2.93Å; R592-R596 VanDerWaalsContact O-N 3.07Å
593	R	58.4	Low	57.8	Low	137 Å²	137	114.4 Å²	114.4	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-71.6	-37.8	177.5	-143.7	173.2	180	169	-2.4	111.1	E526 R590 S591 R597	E526-R593 IonicContact OE1-CZ 3.98Å; E526-R593 IonicContact OE1-NE 2.57Å; E526-R593 PolarHBondContact OE1-NE 2.9Å; E526-R593 IonicContact OE1-NH2 3.01Å; E526-R593 PolarHBondContact OE1-NH2 3.19Å; R590-R593 PolarHBondContact O-N 3.35Å; S591-R593 VanDerWaalsContact C-N 3.28Å; S591-R593 PolarHBondContact O-N 3.46Å; R593-R597 PolarHBondContact O-N 2.89Å; R593-R597 VanDerWaalsContact O-N 3.16Å
594	W	60.4	Low	60.4	Low	202 Å²	202	119 Å²	119	77%	0.765	53%	0.531	S	S	*	.	H	α-helix	trans	-67.8	-38.1	172.9	-151	44.8	0	0	0	111.8	R590 S591 R597 C598	R590-W594 PolarHBondContact O-N 2.93Å; S591-W594 CarbonylContact O-C 2.89Å; S591-W594 WeakPolarHBondContact O-CA 3.3Å; S591-W594 WeakPolarHBondContact O-CB 3.12Å; S591-W594 PolarHBondContact O-N 2.87Å; W594-R597 PolarHBondContact O-N 3.28Å; W594-C598 WeakPolarHBondContact O-CB 3.5Å; W594-C598 PolarHBondContact O-N 2.68Å
595	N	69.2	Low	63.1	Low	82 Å²	82	118 Å²	118	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-61.9	-48.7	175.7	-160.9	81.6	0	0	0	111.7	S591 R592 R597 C598 R599 Y661	S591-N595 WeakPolarHBondContact O-CB 3.15Å; S591-N595 PolarHBondContact O-N 2.99Å; R592-N595 PolarHBondContact O-N 3.21Å; N595-R597 PolarHBondContact O-N 3.32Å; N595-C598 PolarHBondContact O-N 3.16Å; N595-R599 WeakPolarHBondContact O-CB 2.95Å; N595-R599 PolarHBondContact O-N 2.84Å; N595-Y661 PolarHBondContact O-OH 3.45Å; N595-Y661 PolarHBondContact OD1-OH 3.02Å
596	R	67.3	Low	65.2	Low	87 Å²	87	114.5 Å²	114.5	33%	0.328	50%	0.504	S	S	.	.	H	α-helix	trans	-59	-45.9	172.7	-90.5	-170.2	161.9	177.8	-2.3	111.9	D518 E521 R592 C598 R599 R600	D518-R596 IonicContact OD1-CZ 2.74Å; D518-R596 VanDerWaalsContact OD1-CZ 3.3Å; D518-R596 IonicContact OD1-NE 3.03Å; D518-R596 PolarHBondContact OD1-NE 3.49Å; D518-R596 IonicContact OD1-NH2 3.92Å; D518-R596 PolarHBondContact OD1-NH2 2.71Å; E521-R596 IonicContact OE2-CZ 2.79Å; E521-R596 IonicContact OE2-NH1 3.68Å; E521-R596 PolarHBondContact OE2-NH1 2.84Å; E521-R596 IonicContact OE2-NH2 2.71Å; E521-R596 PolarHBondContact OE2-NH2 3.09Å; R592-R596 PolarHBondContact O-N 2.93Å; R592-R596 VanDerWaalsContact O-N 3.07Å; R596-C598 VanDerWaalsContact C-N 3.34Å; R596-C598 PolarHBondContact O-N 2.87Å; R596-R599 PolarHBondContact O-N 3.27Å; R596-R600 PolarHBondContact O-N 2.77Å; R596-R600 VanDerWaalsContact O-N 3.14Å
597	R	72	Confident	67.3	Low	196 Å²	196	114.7 Å²	114.7	74%	0.74	50%	0.498	S	S	*	.	H	α-helix	trans	-65.5	-36.4	179.2	-150	174.8	-153.7	170.7	10.5	112.6	R593 W594 N595 S601	R593-R597 PolarHBondContact O-N 2.89Å; R593-R597 VanDerWaalsContact O-N 3.16Å; W594-R597 PolarHBondContact O-N 3.28Å; N595-R597 PolarHBondContact O-N 3.32Å; R597-S601 PolarHBondContact O-N 3.13Å
598	C	71.7	Confident	69.6	Low	54 Å²	54	106 Å²	106	37%	0.365	47%	0.465	S	S	.	.	H	α-helix	trans	-70.7	-45.6	176	-174.7	0	0	0	0	111.5	W594 N595 R596 R600 S601 C602 Y661	W594-C598 WeakPolarHBondContact O-CB 3.5Å; W594-C598 PolarHBondContact O-N 2.68Å; N595-C598 PolarHBondContact O-N 3.16Å; R596-C598 VanDerWaalsContact C-N 3.34Å; R596-C598 PolarHBondContact O-N 2.87Å; C598-R600 VanDerWaalsContact C-N 3.28Å; C598-R600 PolarHBondContact O-N 2.77Å; C598-S601 PolarHBondContact O-N 3.28Å; C598-C602 WeakPolarHBondContact O-CB 3.43Å; C598-C602 PolarHBondContact O-N 3.38Å; C598-C602 PolarHBondContact O-SG 3.32Å; C598-C602 VanDerWaalsContact O-SG 3.32Å; C598-Y661 HydrophobicContact CB-CE1 4.42Å
599	R	76.7	Confident	71.5	Confident	67 Å²	67	110.9 Å²	110.9	25%	0.253	48%	0.481	S	S	.	.	H	α-helix	trans	-52.2	-46.3	173.1	-179.4	167.8	116.3	115.9	-9.4	111.1	D518 N595 R596 R603 Y661	D518-R599 IonicContact OD2-CZ 2.67Å; D518-R599 IonicContact OD2-NE 3.22Å; D518-R599 IonicContact OD2-NH2 3.16Å; D518-R599 PolarHBondContact OD2-NH2 3.2Å; N595-R599 WeakPolarHBondContact O-CB 2.95Å; N595-R599 PolarHBondContact O-N 2.84Å; R596-R599 PolarHBondContact O-N 3.27Å; R599-R603 WeakPolarHBondContact O-CB 3.37Å; R599-R603 PolarHBondContact O-N 3.09Å; R599-Y661 HydrophobicContact CB-CE1 4.23Å; R599-Y661 PolarHBondContact N-OH 3.3Å
600	R	73.4	Confident	73.1	Confident	54 Å²	54	104.9 Å²	104.9	20%	0.204	47%	0.469	C	S	.	.	H	α-helix	trans	-61.7	-47.9	173	-75.7	-168.2	175.4	112.5	29.9	114	D518 D519 T522 R596 C598 C602 R603 R604	D518-R600 VanDerWaalsContact C-NH2 3.28Å; D518-R600 PolarHBondContact O-NH2 2.88Å; D519-R600 VanDerWaalsContact CA-NH2 3.33Å; D519-R600 VanDerWaalsContact CG-NE 3.32Å; D519-R600 IonicContact OD1-CZ 2.87Å; D519-R600 IonicContact OD1-NE 2.67Å; D519-R600 PolarHBondContact OD1-NE 2.66Å; D519-R600 IonicContact OD1-NH2 3.35Å; D519-R600 PolarHBondContact OD1-NH2 2.66Å; D519-R600 IonicContact OD2-NE 2.84Å; D519-R600 PolarHBondContact OD2-NE 2.76Å; T522-R600 PolarHBondContact OG1-NH1 3.22Å; T522-R600 PolarHBondContact OG1-NH2 2.85Å; R596-R600 PolarHBondContact O-N 2.77Å; R596-R600 VanDerWaalsContact O-N 3.14Å; C598-R600 VanDerWaalsContact C-N 3.28Å; C598-R600 PolarHBondContact O-N 2.77Å; R600-C602 VanDerWaalsContact C-N 3.33Å; R600-C602 PolarHBondContact O-N 3.3Å; R600-R603 PolarHBondContact O-N 3.07Å; R600-R603 VanDerWaalsContact O-N 3.13Å; R600-R604 WeakPolarHBondContact O-CG 3.35Å; R600-R604 PolarHBondContact O-N 2.74Å
601	S	78.3	Confident	74.7	Confident	77 Å²	77	95 Å²	95	54%	0.538	43%	0.433	S	S	.	.	H	α-helix	trans	-61	-44	-180	-159	0	0	0	0	111.2	R597 C598 L605	R597-S601 PolarHBondContact O-N 3.13Å; C598-S601 PolarHBondContact O-N 3.28Å; S601-L605 VanDerWaalsContact O-CB 3.3Å; S601-L605 WeakPolarHBondContact O-CB 3.4Å; S601-L605 PolarHBondContact O-N 3.35Å
602	C	79.4	Confident	76	Confident	21 Å²	21	94.9 Å²	94.9	14%	0.142	42%	0.422	C	S	.	.	H	α-helix	trans	-61.7	-39.8	172.5	-66.9	0	0	0	0	112	C598 R600 L605 V606 I658 Y661	C598-C602 WeakPolarHBondContact O-CB 3.43Å; C598-C602 PolarHBondContact O-N 3.38Å; C598-C602 PolarHBondContact O-SG 3.32Å; C598-C602 VanDerWaalsContact O-SG 3.32Å; R600-C602 VanDerWaalsContact C-N 3.33Å; R600-C602 PolarHBondContact O-N 3.3Å; C602-L605 WeakPolarHBondContact O-CB 3.49Å; C602-L605 PolarHBondContact O-N 2.88Å; C602-V606 WeakPolarHBondContact O-CB 3.29Å; C602-V606 VanDerWaalsContact O-CG2 3.31Å; C602-V606 WeakPolarHBondContact O-CG2 3.39Å; C602-V606 PolarHBondContact O-N 3.41Å; C602-I658 HydrophobicContact CB-CG2 4.04Å; C602-Y661 HydrophobicContact CB-CD1 4.18Å; C602-Y661 HydrophobicContact CB-CE1 4.41Å
603	R	79.4	Confident	77.5	Confident	31 Å²	31	92.7 Å²	92.7	12%	0.117	41%	0.414	C	S	.	.	H	α-helix	trans	-70.4	-40.5	-180	-157.9	175.9	-145.9	169.3	-0.6	113.4	D515 R599 R600 L605 V606 K607 S662	D515-R603 VanDerWaalsContact CG-NH2 3.27Å; D515-R603 IonicContact OD1-CZ 2.7Å; D515-R603 IonicContact OD1-NH1 3.68Å; D515-R603 PolarHBondContact OD1-NH1 2.78Å; D515-R603 IonicContact OD1-NH2 3.16Å; D515-R603 PolarHBondContact OD1-NH2 3.2Å; D515-R603 IonicContact OD2-CZ 3.64Å; D515-R603 IonicContact OD2-NE 3.58Å; D515-R603 PolarHBondContact OD2-NE 2.89Å; D515-R603 IonicContact OD2-NH1 3.38Å; D515-R603 PolarHBondContact OD2-NH1 3.45Å; D515-R603 IonicContact OD2-NH2 3.29Å; D515-R603 PolarHBondContact OD2-NH2 3.49Å; D515-R603 VanDerWaalsContact OD2-NH2 3.12Å; R599-R603 WeakPolarHBondContact O-CB 3.37Å; R599-R603 PolarHBondContact O-N 3.09Å; R600-R603 PolarHBondContact O-N 3.07Å; R600-R603 VanDerWaalsContact O-N 3.13Å; R603-L605 VanDerWaalsContact C-N 3.3Å; R603-V606 PolarHBondContact O-N 3.45Å; R603-K607 WeakPolarHBondContact O-CB 3.43Å; R603-K607 PolarHBondContact O-N 3.02Å; R603-S662 PolarHBondContact NE-O 3.35Å
604	R	82.9	Confident	78.8	Confident	187 Å²	187	90.5 Å²	90.5	71%	0.706	41%	0.412	S	S	*	.	H	α-helix	trans	-61	-41.1	170.5	-68.3	-178.6	-168.5	174.8	0.5	111.1	R600 S608	R600-R604 WeakPolarHBondContact O-CG 3.35Å; R600-R604 PolarHBondContact O-N 2.74Å; R604-S608 WeakPolarHBondContact O-CB 3.34Å; R604-S608 PolarHBondContact O-N 2.86Å
605	L	84.9	Confident	79.9	Confident	83 Å²	83	81.2 Å²	81.2	44%	0.435	38%	0.377	S	S	.	.	H	α-helix	trans	-63.8	-49.1	175.9	-169.2	159	0	0	0	110.8	S601 C602 R603 K607 S608 F611	S601-L605 VanDerWaalsContact O-CB 3.3Å; S601-L605 WeakPolarHBondContact O-CB 3.4Å; S601-L605 PolarHBondContact O-N 3.35Å; C602-L605 WeakPolarHBondContact O-CB 3.49Å; C602-L605 PolarHBondContact O-N 2.88Å; R603-L605 VanDerWaalsContact C-N 3.3Å; L605-K607 PolarHBondContact O-N 2.74Å; L605-S608 VanDerWaalsContact O-CB 3.27Å; L605-S608 WeakPolarHBondContact O-CB 3.46Å; L605-S608 PolarHBondContact O-N 3.46Å; L605-S608 PolarHBondContact O-OG 2.92Å; L605-F611 HydrophobicContact CD2-CB 4.09Å; L605-F611 HydrophobicContact CD2-CD2 3.37Å; L605-F611 HydrophobicContact CD2-CE2 3.92Å; L605-F611 HydrophobicContact CD2-CG 3.88Å; L605-F611 WeakPolarHBondContact O-CB 3.29Å
606	V	83	Confident	80.5	Confident	27 Å²	27	78.2 Å²	78.2	16%	0.164	36%	0.361	C	S	.	.	H	α-helix	trans	-65.9	-36.3	179.9	168.1	0	0	0	0	113.2	C602 R603 S608 F611 I658 K659	C602-V606 WeakPolarHBondContact O-CB 3.29Å; C602-V606 VanDerWaalsContact O-CG2 3.31Å; C602-V606 WeakPolarHBondContact O-CG2 3.39Å; C602-V606 PolarHBondContact O-N 3.41Å; R603-V606 PolarHBondContact O-N 3.45Å; V606-S608 PolarHBondContact O-N 3Å; V606-F611 HydrophobicContact CB-CD1 4.42Å; V606-F611 HydrophobicContact CB-CE1 4.26Å; V606-F611 HydrophobicContact CG1-CE1 4.2Å; V606-F611 HydrophobicContact CG2-CD1 4.42Å; V606-F611 HydrophobicContact CG2-CE1 3.93Å; V606-F611 HydrophobicContact CG2-CZ 4.04Å; V606-I658 HydrophobicContact CG2-CG2 3.6Å; V606-K659 HydrophobicContact CG1-CG 4.22Å; V606-K659 HydrophobicContact CG2-CG 4.48Å
607	K	81.8	Confident	81.4	Confident	143 Å²	143	77.8 Å²	77.8	62%	0.622	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	4.4	172.5	-70	-173.9	175.8	176.8	0	113.1	D515 R603 L605	D515-K607 IonicContact OD2-NZ 2.67Å; D515-K607 PolarHBondContact OD2-NZ 3.46Å; R603-K607 WeakPolarHBondContact O-CB 3.43Å; R603-K607 PolarHBondContact O-N 3.02Å; L605-K607 PolarHBondContact O-N 2.74Å
608	S	85.7	Confident	82.2	Confident	35 Å²	35	70.2 Å²	70.2	25%	0.245	34%	0.342	C	S	.	.	S	Bend	trans	-87.5	144.4	-179	77.6	0	0	0	0	114.2	R604 L605 V606 T610 F611 Y612	R604-S608 WeakPolarHBondContact O-CB 3.34Å; R604-S608 PolarHBondContact O-N 2.86Å; L605-S608 VanDerWaalsContact O-CB 3.27Å; L605-S608 WeakPolarHBondContact O-CB 3.46Å; L605-S608 PolarHBondContact O-N 3.46Å; L605-S608 PolarHBondContact O-OG 2.92Å; V606-S608 PolarHBondContact O-N 3Å; S608-T610 PolarHBondContact O-N 3.39Å; S608-F611 PolarHBondContact O-N 3.38Å; S608-F611 WeakPolarHBondContact OG-CB 3.42Å; S608-F611 PolarHBondContact OG-N 3.16Å; S608-F611 VanDerWaalsContact OG-N 3.15Å; S608-Y612 PolarHBondContact O-N 2.81Å
609	Q	85.1	Confident	82.7	Confident	126 Å²	126	67.8 Å²	67.8	59%	0.589	33%	0.326	S	S	*	.	H	α-helix	trans	-62.3	-25.8	173.4	-162.1	68.7	-10	0	0	112.7	Y612 W613	Q609-Y612 WeakPolarHBondContact O-CB 3.28Å; Q609-W613 VanDerWaalsContact O-CD1 3.23Å; Q609-W613 PolarHBondContact O-N 3.1Å; Q609-W613 VanDerWaalsContact O-N 3.15Å
610	T	85	Confident	83	Confident	97 Å²	97	70.9 Å²	70.9	60%	0.595	34%	0.341	S	S	*	.	H	α-helix	trans	-69.6	-44.3	175.8	-44.6	0	0	0	0	111.6	S608 W613 I614	S608-T610 PolarHBondContact O-N 3.39Å; T610-W613 PolarHBondContact O-N 3.02Å; T610-I614 HydrophobicContact CG2-CD1 4.03Å; T610-I614 VanDerWaalsContact O-CG1 3.28Å; T610-I614 WeakPolarHBondContact O-CG1 3.49Å; T610-I614 PolarHBondContact O-N 2.76Å
611	F	86.2	Confident	83.7	Confident	28 Å²	28	73 Å²	73	12%	0.123	36%	0.356	C	S	.	.	H	α-helix	trans	-64.4	-40.6	176	180	-106.5	0	0	0	111.8	L605 V606 S608 W613 I614 V615 E655	L605-F611 HydrophobicContact CD2-CB 4.09Å; L605-F611 HydrophobicContact CD2-CD2 3.37Å; L605-F611 HydrophobicContact CD2-CE2 3.92Å; L605-F611 HydrophobicContact CD2-CG 3.88Å; L605-F611 WeakPolarHBondContact O-CB 3.29Å; V606-F611 HydrophobicContact CB-CD1 4.42Å; V606-F611 HydrophobicContact CB-CE1 4.26Å; V606-F611 HydrophobicContact CG1-CE1 4.2Å; V606-F611 HydrophobicContact CG2-CD1 4.42Å; V606-F611 HydrophobicContact CG2-CE1 3.93Å; V606-F611 HydrophobicContact CG2-CZ 4.04Å; S608-F611 PolarHBondContact O-N 3.38Å; S608-F611 WeakPolarHBondContact OG-CB 3.42Å; S608-F611 PolarHBondContact OG-N 3.16Å; S608-F611 VanDerWaalsContact OG-N 3.15Å; F611-W613 PolarHBondContact O-N 3.44Å; F611-I614 PolarHBondContact O-N 2.97Å; F611-V615 HydrophobicContact CD1-CG2 4.39Å; F611-V615 HydrophobicContact CD2-CG2 4.46Å; F611-V615 HydrophobicContact CE1-CG2 4.13Å; F611-V615 HydrophobicContact CE2-CG2 4.21Å; F611-V615 HydrophobicContact CZ-CG2 4.05Å; F611-V615 WeakPolarHBondContact O-CG2 3.2Å; F611-V615 PolarHBondContact O-N 3.15Å; F611-E655 HydrophobicContact CE2-CG 4.43Å; F611-E655 HydrophobicContact CZ-CG 3.74Å
612	Y	80.9	Confident	84.1	Confident	67 Å²	67	69.3 Å²	69.3	26%	0.263	33%	0.33	S	S	.	.	H	α-helix	trans	-51.4	-52.9	170.9	167.6	-82.7	0	0	0	112.1	S608 Q609 V615 I616 Y718	S608-Y612 PolarHBondContact O-N 2.81Å; Q609-Y612 WeakPolarHBondContact O-CB 3.28Å; Y612-V615 PolarHBondContact O-N 3.5Å; Y612-I616 HydrophobicContact CD1-CD1 3.85Å; Y612-I616 HydrophobicContact CD2-CD1 4.42Å; Y612-I616 HydrophobicContact CE1-CD1 3.35Å; Y612-I616 HydrophobicContact CE2-CD1 4.03Å; Y612-I616 HydrophobicContact CG-CD1 4.33Å; Y612-I616 VanDerWaalsContact CZ-CD1 3.45Å; Y612-I616 WeakPolarHBondContact O-CG1 3.47Å; Y612-I616 PolarHBondContact O-N 3.34Å; Y612-I616 VanDerWaalsContact O-N 3.1Å; Y612-Y718 HydrophobicContact CD2-CD1 4.32Å; Y612-Y718 AromaticContact CD2-CE1 3.86Å; Y612-Y718 HydrophobicContact CD2-CE1 3.86Å; Y612-Y718 AromaticContact CE2-CD1 3.4Å; Y612-Y718 HydrophobicContact CE2-CD1 3.4Å; Y612-Y718 VanDerWaalsContact CE2-CD1 3.4Å; Y612-Y718 HydrophobicContact CE2-CD2 4.3Å; Y612-Y718 AromaticContact CE2-CE1 3.38Å; Y612-Y718 HydrophobicContact CE2-CE1 3.38Å; Y612-Y718 HydrophobicContact CE2-CE2 4.3Å; Y612-Y718 AromaticContact CE2-CG 3.88Å; Y612-Y718 HydrophobicContact CE2-CG 3.88Å; Y612-Y718 AromaticContact CE2-CZ 3.86Å
613	W	85.8	Confident	84.3	Confident	146 Å²	146	68.9 Å²	68.9	55%	0.553	33%	0.327	S	S	*	.	H	α-helix	trans	-68.7	-37.1	179.9	-80.6	113.3	0	0	0	112.9	Q609 T610 F611 I616 V617	Q609-W613 VanDerWaalsContact O-CD1 3.23Å; Q609-W613 PolarHBondContact O-N 3.1Å; Q609-W613 VanDerWaalsContact O-N 3.15Å; T610-W613 PolarHBondContact O-N 3.02Å; F611-W613 PolarHBondContact O-N 3.44Å; W613-I616 HydrophobicContact CE3-CG2 4.47Å; W613-I616 PolarHBondContact O-N 2.86Å; W613-V617 WeakPolarHBondContact O-CB 3.44Å; W613-V617 WeakPolarHBondContact O-CG2 3.38Å; W613-V617 PolarHBondContact O-N 3.11Å
614	I	86.9	Confident	84.5	Confident	91 Å²	91	69.2 Å²	69.2	47%	0.467	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-47.6	174.6	-72.1	165.7	0	0	0	110.7	T610 F611 I616 V617 L618	T610-I614 HydrophobicContact CG2-CD1 4.03Å; T610-I614 VanDerWaalsContact O-CG1 3.28Å; T610-I614 WeakPolarHBondContact O-CG1 3.49Å; T610-I614 PolarHBondContact O-N 2.76Å; F611-I614 PolarHBondContact O-N 2.97Å; I614-I616 PolarHBondContact O-N 3.45Å; I614-V617 PolarHBondContact O-N 3.46Å; I614-L618 HydrophobicContact CG2-CD1 3.98Å; I614-L618 HydrophobicContact CG2-CG 4.44Å; I614-L618 WeakPolarHBondContact O-CB 3.45Å; I614-L618 VanDerWaalsContact O-CG 3.31Å; I614-L618 WeakPolarHBondContact O-CG 3.31Å; I614-L618 PolarHBondContact O-N 2.89Å
615	V	83.2	Confident	84.7	Confident	7 Å²	7	61.1 Å²	61.1	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-41.9	178.2	169.4	0	0	0	0	111.4	F611 Y612 L618 V619 E655 K714	F611-V615 HydrophobicContact CD1-CG2 4.39Å; F611-V615 HydrophobicContact CD2-CG2 4.46Å; F611-V615 HydrophobicContact CE1-CG2 4.13Å; F611-V615 HydrophobicContact CE2-CG2 4.21Å; F611-V615 HydrophobicContact CZ-CG2 4.05Å; F611-V615 WeakPolarHBondContact O-CG2 3.2Å; F611-V615 PolarHBondContact O-N 3.15Å; Y612-V615 PolarHBondContact O-N 3.5Å; V615-L618 PolarHBondContact O-N 2.78Å; V615-V619 WeakPolarHBondContact O-CG2 3.31Å; V615-V619 PolarHBondContact O-N 3.44Å; V615-E655 WeakPolarHBondContact CG1-OE1 3.1Å; V615-E655 VanDerWaalsContact CG2-CD 3.49Å; V615-E655 HydrophobicContact CG2-CG 3.84Å; V615-K714 HydrophobicContact CG1-CD 4.23Å
616	I	81.6	Confident	84.6	Confident	18 Å²	18	57.3 Å²	57.3	9%	0.092	29%	0.292	C	S	.	.	H	α-helix	trans	-62.6	-45.7	176.6	-71.5	171.6	0	0	0	111.4	Y612 W613 I614 L618 V619 F620 Y718	Y612-I616 HydrophobicContact CD1-CD1 3.85Å; Y612-I616 HydrophobicContact CD2-CD1 4.42Å; Y612-I616 HydrophobicContact CE1-CD1 3.35Å; Y612-I616 HydrophobicContact CE2-CD1 4.03Å; Y612-I616 HydrophobicContact CG-CD1 4.33Å; Y612-I616 VanDerWaalsContact CZ-CD1 3.45Å; Y612-I616 WeakPolarHBondContact O-CG1 3.47Å; Y612-I616 PolarHBondContact O-N 3.34Å; Y612-I616 VanDerWaalsContact O-N 3.1Å; W613-I616 HydrophobicContact CE3-CG2 4.47Å; W613-I616 PolarHBondContact O-N 2.86Å; I614-I616 PolarHBondContact O-N 3.45Å; I616-L618 VanDerWaalsContact C-N 3.33Å; I616-L618 PolarHBondContact O-N 3.19Å; I616-V619 PolarHBondContact O-N 3.3Å; I616-F620 HydrophobicContact CG2-CD2 3.68Å; I616-F620 HydrophobicContact CG2-CE2 3.72Å; I616-F620 WeakPolarHBondContact O-CD2 3.44Å; I616-F620 PolarHBondContact O-N 3.24Å; I616-Y718 HydrophobicContact CD1-CD2 3.73Å; I616-Y718 HydrophobicContact CD1-CE2 3.53Å; I616-Y718 HydrophobicContact CG1-CD2 4.2Å; I616-Y718 HydrophobicContact CG1-CE2 3.59Å
617	V	86.2	Confident	84.7	Confident	79 Å²	79	58.3 Å²	58.3	48%	0.479	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-38.5	177.8	169.8	0	0	0	0	111.4	W613 I614 F620 L621	W613-V617 WeakPolarHBondContact O-CB 3.44Å; W613-V617 WeakPolarHBondContact O-CG2 3.38Å; W613-V617 PolarHBondContact O-N 3.11Å; I614-V617 PolarHBondContact O-N 3.46Å; V617-F620 PolarHBondContact O-N 3.43Å; V617-L621 HydrophobicContact CG1-CD1 3.88Å; V617-L621 HydrophobicContact CG1-CG 4.42Å; V617-L621 WeakPolarHBondContact O-CB 3.38Å; V617-L621 WeakPolarHBondContact O-CG 3.46Å; V617-L621 PolarHBondContact O-N 2.96Å
618	L	87.8	Confident	85	Confident	36 Å²	36	53 Å²	53	19%	0.188	28%	0.279	C	S	.	.	H	α-helix	trans	-65.1	-38.3	173.9	-72.1	173.8	0	0	0	112.7	I614 V615 I616 N622 F648 L651 F652	I614-L618 HydrophobicContact CG2-CD1 3.98Å; I614-L618 HydrophobicContact CG2-CG 4.44Å; I614-L618 WeakPolarHBondContact O-CB 3.45Å; I614-L618 VanDerWaalsContact O-CG 3.31Å; I614-L618 WeakPolarHBondContact O-CG 3.31Å; I614-L618 PolarHBondContact O-N 2.89Å; V615-L618 PolarHBondContact O-N 2.78Å; I616-L618 VanDerWaalsContact C-N 3.33Å; I616-L618 PolarHBondContact O-N 3.19Å; L618-N622 VanDerWaalsContact O-CB 3.26Å; L618-N622 WeakPolarHBondContact O-CB 3.5Å; L618-N622 PolarHBondContact O-N 2.96Å; L618-F648 HydrophobicContact CD2-CE1 4.38Å; L618-L651 HydrophobicContact CD2-CD1 3.81Å; L618-F652 HydrophobicContact CB-CE1 4.01Å; L618-F652 HydrophobicContact CB-CZ 4.13Å
619	V	83.4	Confident	84.9	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.024	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-49.2	173.9	170.4	0	0	0	0	110.8	V615 I616 L621 N622 T623 F652 R711 K714	V615-V619 WeakPolarHBondContact O-CG2 3.31Å; V615-V619 PolarHBondContact O-N 3.44Å; I616-V619 PolarHBondContact O-N 3.3Å; V619-L621 PolarHBondContact O-N 3.47Å; V619-N622 PolarHBondContact O-N 2.78Å; V619-T623 PolarHBondContact O-N 3.36Å; V619-T623 PolarHBondContact O-OG1 2.92Å; V619-F652 HydrophobicContact CG2-CE1 4.1Å; V619-F652 HydrophobicContact CG2-CZ 4.17Å; V619-R711 HydrophobicContact CG1-CB 4.44Å; V619-R711 WeakPolarHBondContact CG1-O 3.42Å; V619-K714 HydrophobicContact CG2-CB 4.44Å; V619-K714 HydrophobicContact CG2-CD 3.84Å
620	F	83.2	Confident	85.1	Confident	131 Å²	131	49.1 Å²	49.1	58%	0.575	26%	0.257	S	S	*	.	H	α-helix	trans	-62.8	-39.6	178.5	-84.9	-69.1	0	0	0	112.9	I616 V617 T623 G624 V715	I616-F620 HydrophobicContact CG2-CD2 3.68Å; I616-F620 HydrophobicContact CG2-CE2 3.72Å; I616-F620 WeakPolarHBondContact O-CD2 3.44Å; I616-F620 PolarHBondContact O-N 3.24Å; V617-F620 PolarHBondContact O-N 3.43Å; F620-T623 PolarHBondContact O-N 3.05Å; F620-G624 PolarHBondContact O-N 3.09Å; F620-V715 HydrophobicContact CZ-CG2 4.47Å
621	L	87.7	Confident	85.4	Confident	98 Å²	98	48.3 Å²	48.3	51%	0.513	24%	0.243	S	C	.	.	H	α-helix	trans	-64.3	-42.8	174.5	-77.7	168.6	0	0	0	112	V617 V619 G624 V625 F648	V617-L621 HydrophobicContact CG1-CD1 3.88Å; V617-L621 HydrophobicContact CG1-CG 4.42Å; V617-L621 WeakPolarHBondContact O-CB 3.38Å; V617-L621 WeakPolarHBondContact O-CG 3.46Å; V617-L621 PolarHBondContact O-N 2.96Å; V619-L621 PolarHBondContact O-N 3.47Å; L621-G624 PolarHBondContact O-N 3.41Å; L621-V625 PolarHBondContact O-N 3.5Å; L621-F648 HydrophobicContact CB-CE1 4.04Å; L621-F648 HydrophobicContact CB-CZ 3.84Å
622	N	85.1	Confident	85.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-43.3	175.1	174.2	96.4	0	0	0	112	L618 V619 V625 L626 F648 F652 R711	L618-N622 VanDerWaalsContact O-CB 3.26Å; L618-N622 WeakPolarHBondContact O-CB 3.5Å; L618-N622 PolarHBondContact O-N 2.96Å; V619-N622 PolarHBondContact O-N 2.78Å; N622-V625 PolarHBondContact O-N 2.95Å; N622-L626 WeakPolarHBondContact O-CG 3.44Å; N622-L626 PolarHBondContact O-N 2.97Å; N622-L626 VanDerWaalsContact O-N 3.14Å; N622-F648 HydrophobicContact CB-CD1 3.97Å; N622-F648 HydrophobicContact CB-CD2 3.89Å; N622-F648 HydrophobicContact CB-CE1 4.13Å; N622-F648 HydrophobicContact CB-CE2 4.06Å; N622-F648 HydrophobicContact CB-CG 3.88Å; N622-F648 HydrophobicContact CB-CZ 4.19Å; N622-F648 WeakPolarHBondContact OD1-CB 3.31Å; N622-F648 WeakPolarHBondContact OD1-CD2 3.24Å; N622-F652 HydrophobicContact CB-CE2 4.09Å; N622-F652 HydrophobicContact CB-CZ 4.28Å; N622-R711 PolarHBondContact OD1-NH1 3.48Å
623	T	83.9	Confident	85.9	Confident	12 Å²	12	48.9 Å²	48.9	7%	0.074	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-40.3	174.7	-61.6	0	0	0	0	111.5	V619 F620 V625 L626 T627 V712 F1171	V619-T623 PolarHBondContact O-N 3.36Å; V619-T623 PolarHBondContact O-OG1 2.92Å; F620-T623 PolarHBondContact O-N 3.05Å; T623-V625 VanDerWaalsContact C-N 3.3Å; T623-V625 PolarHBondContact O-N 3.29Å; T623-L626 PolarHBondContact O-N 3.21Å; T623-L626 VanDerWaalsContact O-N 3.17Å; T623-T627 PolarHBondContact O-N 3.41Å; T623-T627 PolarHBondContact O-OG1 3.34Å; T623-V712 HydrophobicContact CG2-CG2 3.97Å; T623-V712 WeakPolarHBondContact OG1-CG2 3.38Å; T623-F1171 HydrophobicContact CG2-CE1 3.75Å; T623-F1171 HydrophobicContact CG2-CZ 3.72Å
624	G	85	Confident	86.2	Confident	39 Å²	39	44.5 Å²	44.5	40%	0.402	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-35.7	175.7	0	0	0	0	0	113.8	F620 L621 T627	F620-G624 PolarHBondContact O-N 3.09Å; L621-G624 PolarHBondContact O-N 3.41Å; G624-T627 VanDerWaalsContact CA-OG1 3.31Å; G624-T627 WeakPolarHBondContact CA-OG1 3.24Å; G624-T627 PolarHBondContact O-OG1 3.31Å
625	V	86.8	Confident	86.4	Confident	17 Å²	17	47 Å²	47	10%	0.103	27%	0.27	C	S	.	.	H	α-helix	trans	-69.9	-44.1	172.9	171.5	0	0	0	0	111.3	L621 N622 T623 T627 S628 F640 Q641 A644 F648	L621-V625 PolarHBondContact O-N 3.5Å; N622-V625 PolarHBondContact O-N 2.95Å; T623-V625 VanDerWaalsContact C-N 3.3Å; T623-V625 PolarHBondContact O-N 3.29Å; V625-T627 VanDerWaalsContact C-N 3.27Å; V625-T627 PolarHBondContact O-N 3.06Å; V625-S628 WeakPolarHBondContact O-CB 3.14Å; V625-S628 PolarHBondContact O-N 2.84Å; V625-S628 PolarHBondContact O-OG 3.44Å; V625-F640 HydrophobicContact CG2-CE1 4.12Å; V625-Q641 HydrophobicContact CG1-CB 4.3Å; V625-Q641 HydrophobicContact CG1-CG 4Å; V625-A644 HydrophobicContact CG1-CB 4.09Å; V625-A644 HydrophobicContact CG2-CB 4.21Å; V625-F648 HydrophobicContact CB-CE2 4.3Å; V625-F648 HydrophobicContact CG2-CE2 3.93Å
626	L	81.3	Confident	86.9	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-31.8	176.2	-66.4	168.7	0	0	0	112.6	N622 T623 S628 R705 R708 L709	N622-L626 WeakPolarHBondContact O-CG 3.44Å; N622-L626 PolarHBondContact O-N 2.97Å; N622-L626 VanDerWaalsContact O-N 3.14Å; T623-L626 PolarHBondContact O-N 3.21Å; T623-L626 VanDerWaalsContact O-N 3.17Å; L626-S628 PolarHBondContact O-N 3.26Å; L626-R705 HydrophobicContact CD2-CG 4.48Å; L626-R708 HydrophobicContact CD1-CB 3.83Å; L626-L709 HydrophobicContact CB-CD2 4.26Å; L626-L709 HydrophobicContact CD1-CD2 3.81Å; L626-L709 HydrophobicContact CD1-CG 4.35Å
627	T	86.2	Confident	87.4	Confident	49 Å²	49	54.9 Å²	54.9	30%	0.301	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.6	174.4	49.3	0	0	0	0	115.1	T623 G624 V625 F1171 V1175 V1231	T623-T627 PolarHBondContact O-N 3.41Å; T623-T627 PolarHBondContact O-OG1 3.34Å; G624-T627 VanDerWaalsContact CA-OG1 3.31Å; G624-T627 WeakPolarHBondContact CA-OG1 3.24Å; G624-T627 PolarHBondContact O-OG1 3.31Å; V625-T627 VanDerWaalsContact C-N 3.27Å; V625-T627 PolarHBondContact O-N 3.06Å; T627-F1171 HydrophobicContact CG2-CE2 3.5Å; T627-F1171 VanDerWaalsContact CG2-CE2 3.5Å; T627-F1171 HydrophobicContact CG2-CZ 3.36Å; T627-V1175 HydrophobicContact CG2-CG2 4.03Å; T627-V1231 HydrophobicContact CG2-CG2 4.44Å
628	S	87.9	Confident	87.4	Confident	32 Å²	32	54.7 Å²	54.7	22%	0.224	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-9.2	177.3	72.2	0	0	0	0	113.7	V625 L626 H630 Q641	V625-S628 WeakPolarHBondContact O-CB 3.14Å; V625-S628 PolarHBondContact O-N 2.84Å; V625-S628 PolarHBondContact O-OG 3.44Å; L626-S628 PolarHBondContact O-N 3.26Å; S628-H630 PolarHBondContact O-N 3.37Å; S628-H630 PolarHBondContact O-ND1 3.07Å; S628-Q641 VanDerWaalsContact C-NE2 3.32Å; S628-Q641 PolarHBondContact O-NE2 2.75Å; S628-Q641 PolarHBondContact OG-NE2 3.1Å
629	E	83.7	Confident	87.5	Confident	15 Å²	15	58.6 Å²	58.6	7%	0.07	32%	0.317	C	S	.	.			trans	-63.4	124.3	172.5	-69.6	176.7	149.4	0	0	109.9	R705 Q1179	E629-R705 WeakPolarHBondContact OE1-CD 3.44Å; E629-R705 IonicContact OE1-CZ 2.62Å; E629-R705 IonicContact OE1-NE 3.44Å; E629-R705 IonicContact OE1-NH1 2.73Å; E629-R705 PolarHBondContact OE1-NH1 2.81Å; E629-Q1179 VanDerWaalsContact OE2-CG 3.25Å; E629-Q1179 WeakPolarHBondContact OE2-CG 3.41Å; E629-Q1179 PolarHBondContact OE2-NE2 2.83Å
630	H	90.2	Very high	87.9	Confident	64 Å²	64	63.5 Å²	63.5	30%	0.296	34%	0.338	S	S	.	.			trans	-148.8	156.2	176.5	60	-76.3	0	0	0	111.2	S628 Q633 D1229 N1230	S628-H630 PolarHBondContact O-N 3.37Å; S628-H630 PolarHBondContact O-ND1 3.07Å; H630-Q633 WeakPolarHBondContact O-CB 3.47Å; H630-Q633 PolarHBondContact O-N 3.06Å; H630-D1229 WeakPolarHBondContact CA-O 3.26Å; H630-D1229 WeakPolarHBondContact CB-O 3.02Å; H630-N1230 WeakPolarHBondContact CB-OD1 3.08Å
631	Y	89.7	Confident	88.1	Confident	80 Å²	80	57.4 Å²	57.4	31%	0.314	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	139.1	173.3	165.4	-112.4	0	0	0	110.9	Q633 H1186 D1229 D1261	Y631-Q633 VanDerWaalsContact C-N 3.31Å; Y631-Q633 PolarHBondContact O-N 2.84Å; Y631-H1186 AromaticContact CE1-CE1 3.42Å; Y631-H1186 VanDerWaalsContact CE1-CE1 3.42Å; Y631-H1186 WeakPolarHBondContact CE1-CE1 3.45Å; Y631-H1186 AromaticContact CE1-NE2 3.93Å; Y631-H1186 AromaticContact CZ-CE1 3.66Å; Y631-D1229 PolarHBondContact N-O 2.69Å; Y631-D1261 WeakPolarHBondContact CE2-OD1 3.35Å; Y631-D1261 PolarHBondContact OH-OD1 3.01Å; Y631-D1261 VanDerWaalsContact OH-OD1 3.04Å
632	G	88.1	Confident	87.9	Confident	66 Å²	66	55.8 Å²	55.8	68%	0.68	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	15.9	-176.7	0	0	0	0	0	115.1
633	Q	89.3	Confident	88	Confident	40 Å²	40	61.3 Å²	61.3	19%	0.187	33%	0.331	C	S	.	.			trans	-59.3	140.3	-175.9	69	174.8	13.8	0	0	113.4	H630 Y631 L637 D638	H630-Q633 WeakPolarHBondContact O-CB 3.47Å; H630-Q633 PolarHBondContact O-N 3.06Å; Y631-Q633 VanDerWaalsContact C-N 3.31Å; Y631-Q633 PolarHBondContact O-N 2.84Å; Q633-L637 HydrophobicContact CB-CD2 4.32Å; Q633-D638 PolarHBondContact NE2-OD1 3.41Å
634	P	93.1	Very high	88.3	Confident	54 Å²	54	61.3 Å²	61.3	35%	0.351	33%	0.332	S	S	.	.			trans	-71.4	141.3	-179.2	30.1	-35.7	0	0	0	111.1	W636 L637	P634-W636 HydrophobicContact CG-CZ2 4.44Å; P634-W636 PolarHBondContact O-N 2.74Å; P634-L637 HydrophobicContact CG-CB 4.22Å; P634-L637 WeakPolarHBondContact O-CB 3.42Å; P634-L637 PolarHBondContact O-N 3.4Å
635	L	90.5	Very high	88.2	Confident	143 Å²	143	59.5 Å²	59.5	75%	0.749	31%	0.313	S	S	*	.	H	α-helix	trans	-48.3	-36.4	-174.9	-71.6	135.4	0	0	0	115	L637 D638 D639	L635-L637 PolarHBondContact O-N 3.15Å; L635-D638 WeakPolarHBondContact O-CB 3.46Å; L635-D638 PolarHBondContact O-N 2.74Å; L635-D639 PolarHBondContact O-N 2.89Å
636	W	94.2	Very high	88.2	Confident	173 Å²	173	62.3 Å²	62.3	66%	0.655	33%	0.326	S	S	*	.	H	α-helix	trans	-63	-27.6	178.2	74.4	-98.3	0	0	0	113.3	P634 F640	P634-W636 HydrophobicContact CG-CZ2 4.44Å; P634-W636 PolarHBondContact O-N 2.74Å; W636-F640 WeakPolarHBondContact O-CB 3.48Å; W636-F640 PolarHBondContact O-N 2.9Å; W636-F640 VanDerWaalsContact O-N 3.08Å
637	L	91.9	Very high	88.7	Confident	18 Å²	18	64.9 Å²	64.9	9%	0.094	34%	0.342	C	S	.	.	H	α-helix	trans	-79.5	-35.2	177.8	-175.2	63.7	0	0	0	111	Q633 P634 L635 F640 Q641	Q633-L637 HydrophobicContact CB-CD2 4.32Å; P634-L637 HydrophobicContact CG-CB 4.22Å; P634-L637 WeakPolarHBondContact O-CB 3.42Å; P634-L637 PolarHBondContact O-N 3.4Å; L635-L637 PolarHBondContact O-N 3.15Å; L637-F640 HydrophobicContact CD1-CD1 4.14Å; L637-F640 PolarHBondContact O-N 2.99Å; L637-Q641 WeakPolarHBondContact O-CB 3.4Å; L637-Q641 WeakPolarHBondContact O-CG 3.26Å; L637-Q641 PolarHBondContact O-N 3.35Å
638	D	86.1	Confident	88.8	Confident	76 Å²	76	63.3 Å²	63.3	41%	0.406	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-50.9	173.7	-160	54.6	0	0	0	110.4	Q633 L635 F640 Q641 D642	Q633-D638 PolarHBondContact NE2-OD1 3.41Å; L635-D638 WeakPolarHBondContact O-CB 3.46Å; L635-D638 PolarHBondContact O-N 2.74Å; D638-F640 VanDerWaalsContact C-N 3.27Å; D638-F640 PolarHBondContact O-N 2.73Å; D638-Q641 PolarHBondContact O-N 3.42Å; D638-D642 PolarHBondContact O-N 2.94Å
639	D	89.6	Confident	88.8	Confident	118 Å²	118	62.3 Å²	62.3	63%	0.631	32%	0.324	S	S	*	.	H	α-helix	trans	-53.1	-43.4	170.6	-81.4	-36	0	0	0	111.8	L635 M643	L635-D639 PolarHBondContact O-N 2.89Å; D639-M643 WeakPolarHBondContact O-CB 3.31Å; D639-M643 PolarHBondContact O-N 3.11Å; D639-M643 VanDerWaalsContact O-N 3.08Å
640	F	91.7	Very high	89.1	Confident	107 Å²	107	65.4 Å²	65.4	47%	0.469	34%	0.343	S	S	.	.	H	α-helix	trans	-68.7	-43.9	179.2	172.6	-97.5	0	0	0	112.5	V625 W636 L637 D638 A644	V625-F640 HydrophobicContact CG2-CE1 4.12Å; W636-F640 WeakPolarHBondContact O-CB 3.48Å; W636-F640 PolarHBondContact O-N 2.9Å; W636-F640 VanDerWaalsContact O-N 3.08Å; L637-F640 HydrophobicContact CD1-CD1 4.14Å; L637-F640 PolarHBondContact O-N 2.99Å; D638-F640 VanDerWaalsContact C-N 3.27Å; D638-F640 PolarHBondContact O-N 2.73Å; F640-A644 WeakPolarHBondContact O-CB 3.04Å; F640-A644 PolarHBondContact O-N 3.04Å
641	Q	88.2	Confident	89.2	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.009	35%	0.345	C	S	.	.	H	α-helix	trans	-58.6	-49.7	176.4	-78.5	163.1	5.2	0	0	109.7	V625 S628 L637 D638 A644 N645	V625-Q641 HydrophobicContact CG1-CB 4.3Å; V625-Q641 HydrophobicContact CG1-CG 4Å; S628-Q641 VanDerWaalsContact C-NE2 3.32Å; S628-Q641 PolarHBondContact O-NE2 2.75Å; S628-Q641 PolarHBondContact OG-NE2 3.1Å; L637-Q641 WeakPolarHBondContact O-CB 3.4Å; L637-Q641 WeakPolarHBondContact O-CG 3.26Å; L637-Q641 PolarHBondContact O-N 3.35Å; D638-Q641 PolarHBondContact O-N 3.42Å; Q641-A644 PolarHBondContact O-N 3.38Å; Q641-N645 VanDerWaalsContact O-CB 3.26Å; Q641-N645 WeakPolarHBondContact O-CB 3.23Å; Q641-N645 PolarHBondContact O-N 2.83Å; Q641-N645 PolarHBondContact O-ND2 3.25Å
642	D	82.9	Confident	89.2	Confident	64 Å²	64	61.7 Å²	61.7	34%	0.342	33%	0.33	S	S	.	.	H	α-helix	trans	-68.5	-37.3	-177.4	-112.7	15.5	0	0	0	113.4	D638 N645 I646	D638-D642 PolarHBondContact O-N 2.94Å; D642-N645 WeakPolarHBondContact O-CB 3.1Å; D642-N645 PolarHBondContact O-N 3.2Å; D642-N645 PolarHBondContact OD1-ND2 3.43Å; D642-I646 WeakPolarHBondContact O-CG1 3.5Å; D642-I646 PolarHBondContact O-N 3.21Å; D642-I646 VanDerWaalsContact O-N 3.09Å
643	M	89	Confident	89.3	Confident	117 Å²	117	59.5 Å²	59.5	58%	0.576	31%	0.305	S	S	*	.	H	α-helix	trans	-66.5	-43.2	172.6	-138.1	-60.6	-63.1	0	0	111.6	D639 N645 I646 V647	D639-M643 WeakPolarHBondContact O-CB 3.31Å; D639-M643 PolarHBondContact O-N 3.11Å; D639-M643 VanDerWaalsContact O-N 3.08Å; M643-N645 VanDerWaalsContact C-N 3.34Å; M643-N645 PolarHBondContact O-N 3.26Å; M643-I646 PolarHBondContact O-N 3.32Å; M643-V647 HydrophobicContact CE-CG2 3.56Å; M643-V647 WeakPolarHBondContact O-CG2 3.16Å; M643-V647 PolarHBondContact O-N 3.25Å; M643-V647 HydrophobicContact SD-CG2 3.91Å
644	A	88.8	Confident	89.3	Confident	11 Å²	11	61.5 Å²	61.5	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-63	-40.5	175.7	0	0	0	0	0	111.7	V625 F640 Q641 I646 V647 F648	V625-A644 HydrophobicContact CG1-CB 4.09Å; V625-A644 HydrophobicContact CG2-CB 4.21Å; F640-A644 WeakPolarHBondContact O-CB 3.04Å; F640-A644 PolarHBondContact O-N 3.04Å; Q641-A644 PolarHBondContact O-N 3.38Å; A644-I646 PolarHBondContact O-N 3.38Å; A644-V647 PolarHBondContact O-N 3.26Å; A644-F648 HydrophobicContact CB-CD2 4.4Å; A644-F648 HydrophobicContact CB-CE2 4.06Å; A644-F648 WeakPolarHBondContact O-CD2 3.27Å; A644-F648 WeakPolarHBondContact O-CG 3.22Å; A644-F648 PolarHBondContact O-N 3.34Å
645	N	83.5	Confident	89.2	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.011	30%	0.302	C	S	.	.	H	α-helix	trans	-57	-48.5	175.3	-73.2	-35.4	0	0	0	111.3	Q641 D642 M643 F648 V649 R708	Q641-N645 VanDerWaalsContact O-CB 3.26Å; Q641-N645 WeakPolarHBondContact O-CB 3.23Å; Q641-N645 PolarHBondContact O-N 2.83Å; Q641-N645 PolarHBondContact O-ND2 3.25Å; D642-N645 WeakPolarHBondContact O-CB 3.1Å; D642-N645 PolarHBondContact O-N 3.2Å; D642-N645 PolarHBondContact OD1-ND2 3.43Å; M643-N645 VanDerWaalsContact C-N 3.34Å; M643-N645 PolarHBondContact O-N 3.26Å; N645-F648 PolarHBondContact O-N 2.72Å; N645-V649 WeakPolarHBondContact O-CG2 3.47Å; N645-V649 PolarHBondContact O-N 3.16Å; N645-R708 PolarHBondContact ND2-NH1 3.42Å; N645-R708 PolarHBondContact OD1-NH1 2.97Å
646	I	87.4	Confident	89.1	Confident	75 Å²	75	53.2 Å²	53.2	39%	0.385	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-46	175.8	-68	168	0	0	0	110.7	D642 M643 A644 F648 V649 V650	D642-I646 WeakPolarHBondContact O-CG1 3.5Å; D642-I646 PolarHBondContact O-N 3.21Å; D642-I646 VanDerWaalsContact O-N 3.09Å; M643-I646 PolarHBondContact O-N 3.32Å; A644-I646 PolarHBondContact O-N 3.38Å; I646-F648 PolarHBondContact O-N 2.66Å; I646-V649 PolarHBondContact O-N 2.88Å; I646-V650 WeakPolarHBondContact O-CG2 3.34Å; I646-V650 PolarHBondContact O-N 3.21Å
647	V	90.5	Very high	88.8	Confident	56 Å²	56	49.8 Å²	49.8	34%	0.339	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-45.7	176.9	168.1	0	0	0	0	111.6	M643 A644 V650 L651	M643-V647 HydrophobicContact CE-CG2 3.56Å; M643-V647 WeakPolarHBondContact O-CG2 3.16Å; M643-V647 PolarHBondContact O-N 3.25Å; M643-V647 HydrophobicContact SD-CG2 3.91Å; A644-V647 PolarHBondContact O-N 3.26Å; V647-V650 PolarHBondContact O-N 2.72Å; V647-L651 HydrophobicContact CG1-CD1 3.77Å; V647-L651 HydrophobicContact CG1-CG 4.29Å; V647-L651 WeakPolarHBondContact O-CB 3.37Å; V647-L651 VanDerWaalsContact O-CG 3.31Å; V647-L651 WeakPolarHBondContact O-CG 3.38Å; V647-L651 PolarHBondContact O-N 2.85Å
648	F	89.6	Confident	88.7	Confident	17 Å²	17	51.1 Å²	51.1	8%	0.075	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-41	177.4	-71.2	-54.6	0	0	0	112.1	L618 L621 N622 V625 A644 N645 I646 V650 L651 F652	L618-F648 HydrophobicContact CD2-CE1 4.38Å; L621-F648 HydrophobicContact CB-CE1 4.04Å; L621-F648 HydrophobicContact CB-CZ 3.84Å; N622-F648 HydrophobicContact CB-CD1 3.97Å; N622-F648 HydrophobicContact CB-CD2 3.89Å; N622-F648 HydrophobicContact CB-CE1 4.13Å; N622-F648 HydrophobicContact CB-CE2 4.06Å; N622-F648 HydrophobicContact CB-CG 3.88Å; N622-F648 HydrophobicContact CB-CZ 4.19Å; N622-F648 WeakPolarHBondContact OD1-CB 3.31Å; N622-F648 WeakPolarHBondContact OD1-CD2 3.24Å; V625-F648 HydrophobicContact CB-CE2 4.3Å; V625-F648 HydrophobicContact CG2-CE2 3.93Å; A644-F648 HydrophobicContact CB-CD2 4.4Å; A644-F648 HydrophobicContact CB-CE2 4.06Å; A644-F648 WeakPolarHBondContact O-CD2 3.27Å; A644-F648 WeakPolarHBondContact O-CG 3.22Å; A644-F648 PolarHBondContact O-N 3.34Å; N645-F648 PolarHBondContact O-N 2.72Å; I646-F648 PolarHBondContact O-N 2.66Å; F648-V650 VanDerWaalsContact C-N 3.32Å; F648-V650 PolarHBondContact O-N 2.93Å; F648-L651 PolarHBondContact O-N 3.29Å; F648-F652 HydrophobicContact CB-CD2 4.1Å; F648-F652 HydrophobicContact CB-CE2 3.87Å; F648-F652 HydrophobicContact CD1-CE2 4.29Å; F648-F652 HydrophobicContact CG-CE2 4.37Å; F648-F652 WeakPolarHBondContact O-CB 3.3Å; F648-F652 WeakPolarHBondContact O-CD2 3.45Å; F648-F652 WeakPolarHBondContact O-CG 3.41Å; F648-F652 PolarHBondContact O-N 2.82Å
649	V	87	Confident	88.8	Confident	11 Å²	11	48.3 Å²	48.3	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-61.1	-41	175.1	172.4	0	0	0	0	111.3	N645 I646 S653 I685 V688	N645-V649 WeakPolarHBondContact O-CG2 3.47Å; N645-V649 PolarHBondContact O-N 3.16Å; I646-V649 PolarHBondContact O-N 2.88Å; V649-S653 VanDerWaalsContact O-CB 3.27Å; V649-S653 WeakPolarHBondContact O-CB 3.39Å; V649-S653 PolarHBondContact O-N 2.87Å; V649-S653 PolarHBondContact O-OG 2.69Å; V649-I685 HydrophobicContact CG1-CG1 3.88Å; V649-V688 HydrophobicContact CG2-CG2 4.41Å
650	V	90.5	Very high	88.7	Confident	79 Å²	79	44.5 Å²	44.5	48%	0.479	23%	0.233	S	C	.	.	H	α-helix	trans	-64.6	-46.3	174.3	172.2	0	0	0	0	111.5	I646 V647 F648 S653 I654	I646-V650 WeakPolarHBondContact O-CG2 3.34Å; I646-V650 PolarHBondContact O-N 3.21Å; V647-V650 PolarHBondContact O-N 2.72Å; F648-V650 VanDerWaalsContact C-N 3.32Å; F648-V650 PolarHBondContact O-N 2.93Å; V650-S653 WeakPolarHBondContact O-CB 3.43Å; V650-S653 PolarHBondContact O-N 3.27Å; V650-I654 HydrophobicContact CG1-CD1 3.9Å; V650-I654 VanDerWaalsContact O-CG1 3.32Å; V650-I654 WeakPolarHBondContact O-CG1 3.38Å; V650-I654 PolarHBondContact O-N 3.25Å
651	L	91.2	Very high	88.5	Confident	64 Å²	64	43 Å²	43	34%	0.335	23%	0.225	S	C	.	.	H	α-helix	trans	-64.8	-42	-179.9	-70.6	173.2	0	0	0	112.7	L618 V647 F648 I654 E655	L618-L651 HydrophobicContact CD2-CD1 3.81Å; V647-L651 HydrophobicContact CG1-CD1 3.77Å; V647-L651 HydrophobicContact CG1-CG 4.29Å; V647-L651 WeakPolarHBondContact O-CB 3.37Å; V647-L651 VanDerWaalsContact O-CG 3.31Å; V647-L651 WeakPolarHBondContact O-CG 3.38Å; V647-L651 PolarHBondContact O-N 2.85Å; F648-L651 PolarHBondContact O-N 3.29Å; L651-I654 PolarHBondContact O-N 3.09Å; L651-E655 PolarHBondContact O-N 2.71Å
652	F	89.6	Confident	88.2	Confident	2 Å²	2	43 Å²	43	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-72	-30.4	175.6	-64.7	-52.4	0	0	0	112.4	L618 V619 N622 F648 I654 E655 M656 V681	L618-F652 HydrophobicContact CB-CE1 4.01Å; L618-F652 HydrophobicContact CB-CZ 4.13Å; V619-F652 HydrophobicContact CG2-CE1 4.1Å; V619-F652 HydrophobicContact CG2-CZ 4.17Å; N622-F652 HydrophobicContact CB-CE2 4.09Å; N622-F652 HydrophobicContact CB-CZ 4.28Å; F648-F652 HydrophobicContact CB-CD2 4.1Å; F648-F652 HydrophobicContact CB-CE2 3.87Å; F648-F652 HydrophobicContact CD1-CE2 4.29Å; F648-F652 HydrophobicContact CG-CE2 4.37Å; F648-F652 WeakPolarHBondContact O-CB 3.3Å; F648-F652 WeakPolarHBondContact O-CD2 3.45Å; F648-F652 WeakPolarHBondContact O-CG 3.41Å; F648-F652 PolarHBondContact O-N 2.82Å; F652-I654 VanDerWaalsContact C-N 3.33Å; F652-E655 VanDerWaalsContact CD1-OE2 3.31Å; F652-E655 WeakPolarHBondContact CD1-OE2 3.37Å; F652-E655 WeakPolarHBondContact O-CB 3.47Å; F652-E655 PolarHBondContact O-N 3.13Å; F652-M656 WeakPolarHBondContact O-CB 3.44Å; F652-M656 PolarHBondContact O-N 2.88Å; F652-V681 HydrophobicContact CB-CG2 3.86Å
653	S	90	Very high	87.9	Confident	20 Å²	20	41.1 Å²	41.1	14%	0.14	21%	0.214	C	C	.	.	H	α-helix	trans	-63.3	-39.8	168.6	-60.5	0	0	0	0	111.7	V649 V650 M656 L657	V649-S653 VanDerWaalsContact O-CB 3.27Å; V649-S653 WeakPolarHBondContact O-CB 3.39Å; V649-S653 PolarHBondContact O-N 2.87Å; V649-S653 PolarHBondContact O-OG 2.69Å; V650-S653 WeakPolarHBondContact O-CB 3.43Å; V650-S653 PolarHBondContact O-N 3.27Å; S653-M656 PolarHBondContact O-N 3.43Å; S653-L657 WeakPolarHBondContact O-CB 3.36Å; S653-L657 WeakPolarHBondContact O-CG 3.42Å; S653-L657 PolarHBondContact O-N 3.48Å
654	I	90.7	Very high	87.3	Confident	82 Å²	82	36.6 Å²	36.6	42%	0.421	20%	0.198	S	C	.	.	H	α-helix	trans	-67.4	-42.3	174.3	-68.4	164.8	0	0	0	110.9	V650 L651 F652 M656 L657 I658	V650-I654 HydrophobicContact CG1-CD1 3.9Å; V650-I654 VanDerWaalsContact O-CG1 3.32Å; V650-I654 WeakPolarHBondContact O-CG1 3.38Å; V650-I654 PolarHBondContact O-N 3.25Å; L651-I654 PolarHBondContact O-N 3.09Å; F652-I654 VanDerWaalsContact C-N 3.33Å; I654-M656 PolarHBondContact O-N 2.93Å; I654-L657 PolarHBondContact O-N 3.22Å; I654-I658 HydrophobicContact CG2-CD1 3.57Å; I654-I658 HydrophobicContact CG2-CG1 4.25Å; I654-I658 WeakPolarHBondContact O-CB 3.47Å; I654-I658 WeakPolarHBondContact O-CG1 3.23Å; I654-I658 PolarHBondContact O-N 2.81Å
655	E	89.7	Confident	86.9	Confident	11 Å²	11	41 Å²	41	5%	0.051	22%	0.219	C	C	.	.	H	α-helix	trans	-55.1	-51.1	172.8	-170.4	-163.5	151.5	0	0	111.1	F611 V615 L651 F652 I658 K659 K714	F611-E655 HydrophobicContact CE2-CG 4.43Å; F611-E655 HydrophobicContact CZ-CG 3.74Å; V615-E655 WeakPolarHBondContact CG1-OE1 3.1Å; V615-E655 VanDerWaalsContact CG2-CD 3.49Å; V615-E655 HydrophobicContact CG2-CG 3.84Å; L651-E655 PolarHBondContact O-N 2.71Å; F652-E655 VanDerWaalsContact CD1-OE2 3.31Å; F652-E655 WeakPolarHBondContact CD1-OE2 3.37Å; F652-E655 WeakPolarHBondContact O-CB 3.47Å; F652-E655 PolarHBondContact O-N 3.13Å; E655-I658 PolarHBondContact O-N 3.5Å; E655-K659 WeakPolarHBondContact O-CG 3.2Å; E655-K659 PolarHBondContact O-N 2.94Å; E655-K659 WeakPolarHBondContact OE1-CE 3.49Å; E655-K659 IonicContact OE1-NZ 3.98Å; E655-K659 PolarHBondContact OE1-NZ 3.13Å; E655-K714 IonicContact OE1-NZ 3.86Å; E655-K714 PolarHBondContact OE1-NZ 3.48Å; E655-K714 IonicContact OE2-NZ 3.74Å; E655-K714 PolarHBondContact OE2-NZ 3.41Å
656	M	88.6	Confident	86.8	Confident	13 Å²	13	50.1 Å²	50.1	6%	0.064	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-50.2	178.2	177.7	-175.8	73.1	0	0	111.9	F652 S653 I654 I658 K659 M660 F678 V681	F652-M656 WeakPolarHBondContact O-CB 3.44Å; F652-M656 PolarHBondContact O-N 2.88Å; S653-M656 PolarHBondContact O-N 3.43Å; I654-M656 PolarHBondContact O-N 2.93Å; M656-I658 PolarHBondContact O-N 3.38Å; M656-K659 PolarHBondContact O-N 3.23Å; M656-M660 HydrophobicContact CG-CE 4.35Å; M656-M660 WeakPolarHBondContact O-CB 3.31Å; M656-M660 PolarHBondContact O-N 3.05Å; M656-F678 HydrophobicContact SD-CB 4.45Å; M656-F678 HydrophobicContact SD-CD2 3.65Å; M656-F678 HydrophobicContact SD-CE2 4.38Å; M656-F678 HydrophobicContact SD-CG 4.42Å; M656-V681 HydrophobicContact CE-CG1 3.78Å; M656-V681 HydrophobicContact SD-CB 3.97Å; M656-V681 HydrophobicContact SD-CG1 3.77Å
657	L	89.4	Confident	86.1	Confident	101 Å²	101	47.5 Å²	47.5	53%	0.529	24%	0.241	S	C	.	.	H	α-helix	trans	-64.8	-39.8	-178.3	-72.6	169	0	0	0	112.1	S653 I654 M660 Y661	S653-L657 WeakPolarHBondContact O-CB 3.36Å; S653-L657 WeakPolarHBondContact O-CG 3.42Å; S653-L657 PolarHBondContact O-N 3.48Å; I654-L657 PolarHBondContact O-N 3.22Å; L657-M660 PolarHBondContact O-N 3.26Å; L657-Y661 WeakPolarHBondContact O-CB 3.49Å; L657-Y661 PolarHBondContact O-N 3.07Å
658	I	88.4	Confident	85.7	Confident	46 Å²	46	44.9 Å²	44.9	24%	0.236	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-40.2	176.6	-66	171.6	0	0	0	110.7	C602 V606 I654 E655 M656 S662	C602-I658 HydrophobicContact CB-CG2 4.04Å; V606-I658 HydrophobicContact CG2-CG2 3.6Å; I654-I658 HydrophobicContact CG2-CD1 3.57Å; I654-I658 HydrophobicContact CG2-CG1 4.25Å; I654-I658 WeakPolarHBondContact O-CB 3.47Å; I654-I658 WeakPolarHBondContact O-CG1 3.23Å; I654-I658 PolarHBondContact O-N 2.81Å; E655-I658 PolarHBondContact O-N 3.5Å; M656-I658 PolarHBondContact O-N 3.38Å; I658-S662 VanDerWaalsContact O-CB 3.24Å; I658-S662 WeakPolarHBondContact O-CB 3.38Å; I658-S662 PolarHBondContact O-N 2.97Å; I658-S662 PolarHBondContact O-OG 2.95Å
659	K	88.2	Confident	85.6	Confident	16 Å²	16	47.4 Å²	47.4	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-51.2	172.7	-72.9	175.3	-175.4	172.8	0	111.8	V606 E655 M656 Y661 S662 L663 Y668 D677	V606-K659 HydrophobicContact CG1-CG 4.22Å; V606-K659 HydrophobicContact CG2-CG 4.48Å; E655-K659 WeakPolarHBondContact O-CG 3.2Å; E655-K659 PolarHBondContact O-N 2.94Å; E655-K659 WeakPolarHBondContact OE1-CE 3.49Å; E655-K659 IonicContact OE1-NZ 3.98Å; E655-K659 PolarHBondContact OE1-NZ 3.13Å; M656-K659 PolarHBondContact O-N 3.23Å; K659-Y661 VanDerWaalsContact C-N 3.3Å; K659-Y661 PolarHBondContact O-N 3.03Å; K659-S662 PolarHBondContact O-N 3.48Å; K659-S662 PolarHBondContact O-OG 3.17Å; K659-L663 WeakPolarHBondContact O-CB 3.43Å; K659-L663 PolarHBondContact O-N 3.36Å; K659-Y668 HydrophobicContact CB-CD2 3.75Å; K659-Y668 HydrophobicContact CB-CE2 3.63Å; K659-Y668 HydrophobicContact CD-CE2 3.98Å; K659-Y668 HydrophobicContact CG-CE2 4.5Å; K659-D677 IonicContact NZ-OD2 3.59Å; K659-D677 PolarHBondContact NZ-OD2 2.88Å
660	M	88.4	Confident	85	Confident	38 Å²	38	52.1 Å²	52.1	19%	0.187	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-38.4	-177.7	-169.9	-175.2	-65.5	0	0	112	M656 L657 G664 I665 Y668 F678	M656-M660 HydrophobicContact CG-CE 4.35Å; M656-M660 WeakPolarHBondContact O-CB 3.31Å; M656-M660 PolarHBondContact O-N 3.05Å; L657-M660 PolarHBondContact O-N 3.26Å; M660-G664 CarbonylContact O-C 3.46Å; M660-G664 VanDerWaalsContact O-CA 3.25Å; M660-G664 WeakPolarHBondContact O-CA 2.91Å; M660-G664 PolarHBondContact O-N 3.18Å; M660-I665 HydrophobicContact CG-CB 4.32Å; M660-I665 HydrophobicContact CG-CD1 4.4Å; M660-I665 HydrophobicContact CG-CG1 4.08Å; M660-I665 HydrophobicContact SD-CD1 3.91Å; M660-I665 HydrophobicContact SD-CG1 4.18Å; M660-Y668 HydrophobicContact CB-CD1 4.45Å; M660-Y668 HydrophobicContact CB-CD2 4.41Å; M660-Y668 HydrophobicContact CB-CG 4.24Å; M660-Y668 HydrophobicContact CE-CD1 4.13Å; M660-Y668 HydrophobicContact CE-CE1 3.99Å; M660-Y668 HydrophobicContact CG-CD1 4.38Å; M660-Y668 HydrophobicContact CG-CG 4.43Å; M660-F678 HydrophobicContact CE-CD2 4.06Å; M660-F678 HydrophobicContact CE-CE2 4.2Å
661	Y	86.1	Confident	84.1	Confident	77 Å²	77	51.7 Å²	51.7	30%	0.302	25%	0.253	S	S	.	.	H	α-helix	trans	-73.3	-35.8	175.9	175	-108.7	0	0	0	113.8	N595 C598 R599 C602 L657 K659	N595-Y661 PolarHBondContact O-OH 3.45Å; N595-Y661 PolarHBondContact OD1-OH 3.02Å; C598-Y661 HydrophobicContact CB-CE1 4.42Å; R599-Y661 HydrophobicContact CB-CE1 4.23Å; R599-Y661 PolarHBondContact N-OH 3.3Å; C602-Y661 HydrophobicContact CB-CD1 4.18Å; C602-Y661 HydrophobicContact CB-CE1 4.41Å; L657-Y661 WeakPolarHBondContact O-CB 3.49Å; L657-Y661 PolarHBondContact O-N 3.07Å; K659-Y661 VanDerWaalsContact C-N 3.3Å; K659-Y661 PolarHBondContact O-N 3.03Å
662	S	82.4	Confident	83.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-83.6	-36.3	-177.1	57.7	0	0	0	0	114.3	R603 I658 K659	R603-S662 PolarHBondContact NE-O 3.35Å; I658-S662 VanDerWaalsContact O-CB 3.24Å; I658-S662 WeakPolarHBondContact O-CB 3.38Å; I658-S662 PolarHBondContact O-N 2.97Å; I658-S662 PolarHBondContact O-OG 2.95Å; K659-S662 PolarHBondContact O-N 3.48Å; K659-S662 PolarHBondContact O-OG 3.17Å
663	L	76.3	Confident	82.4	Confident	25 Å²	25	59.4 Å²	59.4	13%	0.131	29%	0.288	C	S	.	.	H	α-helix	trans	-86.4	-28	175.6	-61	176.8	0	0	0	112.5	K659 C667	K659-L663 WeakPolarHBondContact O-CB 3.43Å; K659-L663 PolarHBondContact O-N 3.36Å; L663-C667 HydrophobicContact CB-CB 4.44Å
664	G	76.7	Confident	82	Confident	23 Å²	23	58.9 Å²	58.9	24%	0.237	28%	0.284	C	S	.	.			trans	84.9	152.2	-165.6	0	0	0	0	0	111.5	M660 R666 Y668	M660-G664 CarbonylContact O-C 3.46Å; M660-G664 VanDerWaalsContact O-CA 3.25Å; M660-G664 WeakPolarHBondContact O-CA 2.91Å; M660-G664 PolarHBondContact O-N 3.18Å; G664-R666 PolarHBondContact O-N 3.24Å; G664-Y668 VanDerWaalsContact O-CB 3.28Å; G664-Y668 WeakPolarHBondContact O-CB 3.32Å; G664-Y668 PolarHBondContact O-N 3.46Å
665	I	80.9	Confident	81.7	Confident	102 Å²	102	63.4 Å²	63.4	52%	0.523	30%	0.296	S	S	.	.	H	α-helix	trans	-70.2	-29.7	-163.6	-162.2	163	0	0	0	114.6	M660 F669	M660-I665 HydrophobicContact CG-CB 4.32Å; M660-I665 HydrophobicContact CG-CD1 4.4Å; M660-I665 HydrophobicContact CG-CG1 4.08Å; M660-I665 HydrophobicContact SD-CD1 3.91Å; M660-I665 HydrophobicContact SD-CG1 4.18Å; I665-F669 HydrophobicContact CD1-CE2 4.22Å; I665-F669 HydrophobicContact CG1-CD2 3.91Å; I665-F669 HydrophobicContact CG1-CE2 3.77Å; I665-F669 VanDerWaalsContact O-CD2 3.25Å; I665-F669 WeakPolarHBondContact O-CD2 3.35Å; I665-F669 PolarHBondContact O-N 3.08Å
666	R	80.3	Confident	81.3	Confident	194 Å²	194	65.6 Å²	65.6	73%	0.732	31%	0.305	S	S	*	.	H	α-helix	trans	-66	-66.8	174.3	-70.1	-179.2	177.7	168.9	-3.9	110.4	G664 Y668 F669 D670	G664-R666 PolarHBondContact O-N 3.24Å; R666-Y668 CarbonylContact O-C 3.48Å; R666-Y668 PolarHBondContact O-N 3.5Å; R666-F669 WeakPolarHBondContact O-CA 3.14Å; R666-F669 PolarHBondContact O-N 2.96Å; R666-D670 PolarHBondContact O-N 3.09Å
667	C	73.1	Confident	81	Confident	21 Å²	21	65.1 Å²	65.1	14%	0.142	30%	0.303	C	S	.	.	H	α-helix	trans	-50.1	-32.8	175.9	179.5	0	0	0	0	113.3	L663 D670 F671	L663-C667 HydrophobicContact CB-CB 4.44Å; C667-D670 VanDerWaalsContact CA-OD2 3.23Å; C667-D670 WeakPolarHBondContact CA-OD2 3.47Å; C667-D670 PolarHBondContact N-OD2 3.42Å; C667-D670 VanDerWaalsContact N-OD2 3.15Å; C667-F671 WeakPolarHBondContact O-CD2 3.39Å
668	Y	83.5	Confident	80.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-46.5	171	178.9	-97.9	0	0	0	113.3	K659 M660 G664 R666 N674 F678	K659-Y668 HydrophobicContact CB-CD2 3.75Å; K659-Y668 HydrophobicContact CB-CE2 3.63Å; K659-Y668 HydrophobicContact CD-CE2 3.98Å; K659-Y668 HydrophobicContact CG-CE2 4.5Å; M660-Y668 HydrophobicContact CB-CD1 4.45Å; M660-Y668 HydrophobicContact CB-CD2 4.41Å; M660-Y668 HydrophobicContact CB-CG 4.24Å; M660-Y668 HydrophobicContact CE-CD1 4.13Å; M660-Y668 HydrophobicContact CE-CE1 3.99Å; M660-Y668 HydrophobicContact CG-CD1 4.38Å; M660-Y668 HydrophobicContact CG-CG 4.43Å; G664-Y668 VanDerWaalsContact O-CB 3.28Å; G664-Y668 WeakPolarHBondContact O-CB 3.32Å; G664-Y668 PolarHBondContact O-N 3.46Å; R666-Y668 CarbonylContact O-C 3.48Å; R666-Y668 PolarHBondContact O-N 3.5Å; Y668-N674 HydrophobicContact CD2-CB 3.91Å; Y668-N674 HydrophobicContact CE1-CB 4.39Å; Y668-N674 HydrophobicContact CE2-CB 3.63Å; Y668-N674 HydrophobicContact CG-CB 4.39Å; Y668-N674 WeakPolarHBondContact O-CB 3.25Å; Y668-N674 PolarHBondContact O-ND2 3.47Å; Y668-N674 PolarHBondContact OH-O 3.31Å; Y668-N674 VanDerWaalsContact OH-O 3.06Å; Y668-F678 HydrophobicContact CE1-CB 4.03Å; Y668-F678 HydrophobicContact CE1-CD2 4.43Å
669	F	86.6	Confident	80.8	Confident	70 Å²	70	66.5 Å²	66.5	31%	0.307	30%	0.303	S	S	.	.	H	α-helix	trans	-78.7	-24	-179.8	-81.8	-62.7	0	0	0	114.9	I665 R666 F671 R675 F678	I665-F669 HydrophobicContact CD1-CE2 4.22Å; I665-F669 HydrophobicContact CG1-CD2 3.91Å; I665-F669 HydrophobicContact CG1-CE2 3.77Å; I665-F669 VanDerWaalsContact O-CD2 3.25Å; I665-F669 WeakPolarHBondContact O-CD2 3.35Å; I665-F669 PolarHBondContact O-N 3.08Å; R666-F669 WeakPolarHBondContact O-CA 3.14Å; R666-F669 PolarHBondContact O-N 2.96Å; F669-F671 VanDerWaalsContact C-N 3.32Å; F669-F671 PolarHBondContact O-N 3.29Å; F669-R675 HydrophobicContact CD1-CB 4.45Å; F669-F678 HydrophobicContact CE1-CB 4.08Å; F669-F678 AromaticContact CE1-CD1 3.67Å; F669-F678 HydrophobicContact CE1-CD1 3.67Å; F669-F678 HydrophobicContact CE1-CD2 4.06Å; F669-F678 HydrophobicContact CE1-CE1 4.07Å; F669-F678 HydrophobicContact CE1-CE2 4.43Å; F669-F678 AromaticContact CE1-CG 3.66Å; F669-F678 HydrophobicContact CE1-CG 3.66Å; F669-F678 HydrophobicContact CE1-CZ 4.43Å; F669-F678 AromaticContact CZ-CD1 4Å; F669-F678 HydrophobicContact CZ-CD1 4Å; F669-F678 AromaticContact CZ-CD2 3.79Å; F669-F678 HydrophobicContact CZ-CD2 3.79Å; F669-F678 HydrophobicContact CZ-CE1 4.01Å; F669-F678 AromaticContact CZ-CE2 3.82Å; F669-F678 HydrophobicContact CZ-CE2 3.82Å; F669-F678 AromaticContact CZ-CG 3.89Å; F669-F678 HydrophobicContact CZ-CG 3.89Å; F669-F678 AromaticContact CZ-CZ 3.93Å; F669-F678 HydrophobicContact CZ-CZ 3.93Å
670	D	75.4	Confident	80.5	Confident	111 Å²	111	66 Å²	66	59%	0.594	30%	0.301	S	S	*	.	H	α-helix	trans	-63.5	-37.3	179.5	-57.5	-37.5	0	0	0	111.5	R666 C667 M672	R666-D670 PolarHBondContact O-N 3.09Å; C667-D670 VanDerWaalsContact CA-OD2 3.23Å; C667-D670 WeakPolarHBondContact CA-OD2 3.47Å; C667-D670 PolarHBondContact N-OD2 3.42Å; C667-D670 VanDerWaalsContact N-OD2 3.15Å; D670-M672 PolarHBondContact O-N 3.48Å
671	F	69.9	Low	80.5	Confident	70 Å²	70	64.2 Å²	64.2	31%	0.307	29%	0.293	S	S	.	.	S	Bend	trans	-73.5	113.9	173.5	-68.7	-64.5	0	0	0	112.2	C667 F669 F673 N674 R675	C667-F671 WeakPolarHBondContact O-CD2 3.39Å; F669-F671 VanDerWaalsContact C-N 3.32Å; F669-F671 PolarHBondContact O-N 3.29Å; F671-F673 VanDerWaalsContact C-N 3.27Å; F671-F673 PolarHBondContact O-N 3.06Å; F671-F673 VanDerWaalsContact O-N 3.09Å; F671-N674 HydrophobicContact CB-CB 4.22Å; F671-N674 WeakPolarHBondContact O-CB 3.36Å; F671-N674 PolarHBondContact O-N 3.36Å; F671-R675 PolarHBondContact O-N 2.97Å; F671-R675 VanDerWaalsContact O-N 3.13Å
672	M	71.2	Confident	80.6	Confident	156 Å²	156	63.3 Å²	63.3	77%	0.768	29%	0.292	S	S	*	.	H	α-helix	trans	-47.6	-42.5	179.1	-68.9	-166.1	-81.4	0	0	114.5	D670 N674 R675 F676	D670-M672 PolarHBondContact O-N 3.48Å; M672-N674 VanDerWaalsContact C-N 3.33Å; M672-N674 PolarHBondContact O-N 2.91Å; M672-R675 PolarHBondContact O-N 2.95Å; M672-F676 PolarHBondContact O-N 2.89Å
673	F	75.1	Confident	80.7	Confident	71 Å²	71	64.2 Å²	64.2	31%	0.311	30%	0.299	S	S	.	.	H	α-helix	trans	-67	-28.4	178.6	-74.7	-67.8	0	0	0	114.2	F671 D677 T716 R717	F671-F673 VanDerWaalsContact C-N 3.27Å; F671-F673 PolarHBondContact O-N 3.06Å; F671-F673 VanDerWaalsContact O-N 3.09Å; F673-D677 WeakPolarHBondContact O-CB 3.35Å; F673-D677 PolarHBondContact O-N 3.32Å; F673-T716 WeakPolarHBondContact CE1-OG1 3.39Å; F673-R717 HydrophobicContact CD1-CB 4.24Å; F673-R717 HydrophobicContact CD2-CB 4.23Å; F673-R717 HydrophobicContact CD2-CG 3.96Å; F673-R717 HydrophobicContact CE1-CB 4.09Å; F673-R717 HydrophobicContact CE2-CB 4.07Å; F673-R717 HydrophobicContact CE2-CG 4.04Å; F673-R717 HydrophobicContact CG-CB 4.31Å; F673-R717 HydrophobicContact CG-CG 4.32Å; F673-R717 HydrophobicContact CZ-CB 4Å; F673-R717 HydrophobicContact CZ-CG 4.48Å
674	N	81.5	Confident	81	Confident	10 Å²	10	63 Å²	63	5%	0.053	29%	0.293	C	S	.	.	H	α-helix	trans	-79.3	-38.2	174.9	-75.4	-17.2	0	0	0	111.1	Y668 F671 M672 F676 D677 F678	Y668-N674 HydrophobicContact CD2-CB 3.91Å; Y668-N674 HydrophobicContact CE1-CB 4.39Å; Y668-N674 HydrophobicContact CE2-CB 3.63Å; Y668-N674 HydrophobicContact CG-CB 4.39Å; Y668-N674 WeakPolarHBondContact O-CB 3.25Å; Y668-N674 PolarHBondContact O-ND2 3.47Å; Y668-N674 PolarHBondContact OH-O 3.31Å; Y668-N674 VanDerWaalsContact OH-O 3.06Å; F671-N674 HydrophobicContact CB-CB 4.22Å; F671-N674 WeakPolarHBondContact O-CB 3.36Å; F671-N674 PolarHBondContact O-N 3.36Å; M672-N674 VanDerWaalsContact C-N 3.33Å; M672-N674 PolarHBondContact O-N 2.91Å; N674-F676 PolarHBondContact O-N 3.08Å; N674-D677 WeakPolarHBondContact O-CB 3.47Å; N674-D677 PolarHBondContact O-N 2.83Å; N674-F678 WeakPolarHBondContact O-CB 3.36Å; N674-F678 PolarHBondContact O-N 3.09Å
675	R	84.7	Confident	81.5	Confident	176 Å²	176	64.8 Å²	64.8	66%	0.664	30%	0.296	S	S	*	.	H	α-helix	trans	-58	-38.8	170.4	180	178.5	174.1	-178.2	-1.6	111.7	F669 F671 M672 F679	F669-R675 HydrophobicContact CD1-CB 4.45Å; F671-R675 PolarHBondContact O-N 2.97Å; F671-R675 VanDerWaalsContact O-N 3.13Å; M672-R675 PolarHBondContact O-N 2.95Å; R675-F679 PolarHBondContact O-N 3.41Å; R675-F679 VanDerWaalsContact O-N 3.1Å
676	F	80.5	Confident	81.7	Confident	57 Å²	57	63.9 Å²	63.9	25%	0.25	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-45.5	173	176.8	-101.5	0	0	0	112.7	M672 N674 F678 F679 V680 L710 F713	M672-F676 PolarHBondContact O-N 2.89Å; N674-F676 PolarHBondContact O-N 3.08Å; F676-F678 VanDerWaalsContact C-N 3.34Å; F676-F678 PolarHBondContact O-N 3.2Å; F676-F679 PolarHBondContact O-N 3.19Å; F676-V680 HydrophobicContact CE1-CG2 4.25Å; F676-V680 HydrophobicContact CE2-CG2 4.26Å; F676-V680 HydrophobicContact CZ-CG2 4.14Å; F676-V680 WeakPolarHBondContact O-CG2 3.39Å; F676-V680 PolarHBondContact O-N 3.38Å; F676-L710 VanDerWaalsContact CE1-O 3.27Å; F676-L710 WeakPolarHBondContact CE1-O 3.48Å; F676-L710 HydrophobicContact CE2-CB 4.21Å; F676-L710 HydrophobicContact CZ-CB 3.72Å; F676-L710 WeakPolarHBondContact CZ-O 3.07Å; F676-F713 HydrophobicContact CE1-CB 4.06Å; F676-F713 HydrophobicContact CZ-CB 3.88Å; F676-F713 HydrophobicContact CZ-CD2 4.01Å; F676-F713 HydrophobicContact CZ-CG 4.48Å
677	D	82.8	Confident	81.8	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-57.6	-45	175.2	-164.6	22.5	0	0	0	111.8	K659 F673 N674 V680 V681 K714	K659-D677 IonicContact NZ-OD2 3.59Å; K659-D677 PolarHBondContact NZ-OD2 2.88Å; F673-D677 WeakPolarHBondContact O-CB 3.35Å; F673-D677 PolarHBondContact O-N 3.32Å; N674-D677 WeakPolarHBondContact O-CB 3.47Å; N674-D677 PolarHBondContact O-N 2.83Å; D677-V680 PolarHBondContact O-N 2.78Å; D677-V681 WeakPolarHBondContact O-CB 3.47Å; D677-V681 WeakPolarHBondContact O-CG2 3.32Å; D677-V681 PolarHBondContact O-N 3.13Å; D677-K714 VanDerWaalsContact CG-CE 3.44Å; D677-K714 VanDerWaalsContact CG-NZ 3.31Å; D677-K714 WeakPolarHBondContact OD1-CE 3.46Å; D677-K714 IonicContact OD1-NZ 2.63Å; D677-K714 PolarHBondContact OD1-NZ 3.13Å; D677-K714 IonicContact OD2-NZ 2.88Å; D677-K714 PolarHBondContact OD2-NZ 2.86Å
678	F	87.8	Confident	82.1	Confident	63 Å²	63	54.9 Å²	54.9	28%	0.276	26%	0.257	S	S	.	.	H	α-helix	trans	-57.9	-49.2	173.2	177.5	-94.8	0	0	0	112.4	M656 M660 Y668 F669 N674 F676 V680 V681 I682	M656-F678 HydrophobicContact SD-CB 4.45Å; M656-F678 HydrophobicContact SD-CD2 3.65Å; M656-F678 HydrophobicContact SD-CE2 4.38Å; M656-F678 HydrophobicContact SD-CG 4.42Å; M660-F678 HydrophobicContact CE-CD2 4.06Å; M660-F678 HydrophobicContact CE-CE2 4.2Å; Y668-F678 HydrophobicContact CE1-CB 4.03Å; Y668-F678 HydrophobicContact CE1-CD2 4.43Å; F669-F678 HydrophobicContact CE1-CB 4.08Å; F669-F678 AromaticContact CE1-CD1 3.67Å; F669-F678 HydrophobicContact CE1-CD1 3.67Å; F669-F678 HydrophobicContact CE1-CD2 4.06Å; F669-F678 HydrophobicContact CE1-CE1 4.07Å; F669-F678 HydrophobicContact CE1-CE2 4.43Å; F669-F678 AromaticContact CE1-CG 3.66Å; F669-F678 HydrophobicContact CE1-CG 3.66Å; F669-F678 HydrophobicContact CE1-CZ 4.43Å; F669-F678 AromaticContact CZ-CD1 4Å; F669-F678 HydrophobicContact CZ-CD1 4Å; F669-F678 AromaticContact CZ-CD2 3.79Å; F669-F678 HydrophobicContact CZ-CD2 3.79Å; F669-F678 HydrophobicContact CZ-CE1 4.01Å; F669-F678 AromaticContact CZ-CE2 3.82Å; F669-F678 HydrophobicContact CZ-CE2 3.82Å; F669-F678 AromaticContact CZ-CG 3.89Å; F669-F678 HydrophobicContact CZ-CG 3.89Å; F669-F678 AromaticContact CZ-CZ 3.93Å; F669-F678 HydrophobicContact CZ-CZ 3.93Å; N674-F678 WeakPolarHBondContact O-CB 3.36Å; N674-F678 PolarHBondContact O-N 3.09Å; F676-F678 VanDerWaalsContact C-N 3.34Å; F676-F678 PolarHBondContact O-N 3.2Å; F678-V680 PolarHBondContact O-N 3.07Å; F678-V681 PolarHBondContact O-N 3.24Å; F678-I682 HydrophobicContact CD1-CG1 4.22Å; F678-I682 HydrophobicContact CD2-CG1 4.22Å; F678-I682 HydrophobicContact CE1-CG1 3.94Å; F678-I682 HydrophobicContact CE2-CD1 4.19Å; F678-I682 HydrophobicContact CE2-CG1 3.92Å; F678-I682 HydrophobicContact CG-CG1 4.36Å; F678-I682 HydrophobicContact CZ-CD1 4.17Å; F678-I682 HydrophobicContact CZ-CG1 3.78Å; F678-I682 WeakPolarHBondContact O-CB 3.44Å; F678-I682 VanDerWaalsContact O-CG1 3.22Å; F678-I682 WeakPolarHBondContact O-CG1 3.35Å; F678-I682 PolarHBondContact O-N 3Å
679	F	85.6	Confident	82.2	Confident	113 Å²	113	58.4 Å²	58.4	50%	0.496	28%	0.278	S	S	.	.	H	α-helix	trans	-57.9	-49.1	177.8	174.6	-100.7	0	0	0	111.6	R675 F676 V681 I682 C683 L710	R675-F679 PolarHBondContact O-N 3.41Å; R675-F679 VanDerWaalsContact O-N 3.1Å; F676-F679 PolarHBondContact O-N 3.19Å; F679-V681 PolarHBondContact O-N 3.24Å; F679-I682 PolarHBondContact O-N 3.37Å; F679-C683 VanDerWaalsContact CE2-SG 3.59Å; F679-C683 VanDerWaalsContact CZ-SG 3.54Å; F679-C683 WeakPolarHBondContact O-CB 3.48Å; F679-C683 PolarHBondContact O-N 3.22Å; F679-C683 PolarHBondContact O-SG 3.35Å; F679-C683 VanDerWaalsContact O-SG 3.41Å; F679-L710 HydrophobicContact CE1-CD1 4.44Å
680	V	82.5	Confident	82.1	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.024	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-41.4	-178.5	173.9	0	0	0	0	111.7	F676 D677 F678 S684 L710 R711	F676-V680 HydrophobicContact CE1-CG2 4.25Å; F676-V680 HydrophobicContact CE2-CG2 4.26Å; F676-V680 HydrophobicContact CZ-CG2 4.14Å; F676-V680 WeakPolarHBondContact O-CG2 3.39Å; F676-V680 PolarHBondContact O-N 3.38Å; D677-V680 PolarHBondContact O-N 2.78Å; F678-V680 PolarHBondContact O-N 3.07Å; V680-S684 WeakPolarHBondContact O-CB 3.43Å; V680-S684 PolarHBondContact O-N 3.4Å; V680-S684 VanDerWaalsContact O-N 3.11Å; V680-S684 PolarHBondContact O-OG 3.44Å; V680-L710 HydrophobicContact CG2-CB 3.79Å; V680-L710 HydrophobicContact CG2-CD1 4.25Å; V680-R711 HydrophobicContact CG1-CG 3.53Å
681	V	87.3	Confident	82.2	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-46.5	174.9	170.6	0	0	0	0	111.2	F652 M656 D677 F678 F679 S684 I685	F652-V681 HydrophobicContact CB-CG2 3.86Å; M656-V681 HydrophobicContact CE-CG1 3.78Å; M656-V681 HydrophobicContact SD-CB 3.97Å; M656-V681 HydrophobicContact SD-CG1 3.77Å; D677-V681 WeakPolarHBondContact O-CB 3.47Å; D677-V681 WeakPolarHBondContact O-CG2 3.32Å; D677-V681 PolarHBondContact O-N 3.13Å; F678-V681 PolarHBondContact O-N 3.24Å; F679-V681 PolarHBondContact O-N 3.24Å; V681-S684 WeakPolarHBondContact O-CB 3.32Å; V681-S684 PolarHBondContact O-N 3.39Å; V681-S684 VanDerWaalsContact O-N 3.17Å; V681-I685 HydrophobicContact CG1-CD1 3.8Å; V681-I685 HydrophobicContact CG1-CG1 4.45Å; V681-I685 WeakPolarHBondContact O-CG1 3.27Å; V681-I685 PolarHBondContact O-N 3.05Å
682	I	88.3	Confident	82.8	Confident	57 Å²	57	56.7 Å²	56.7	29%	0.292	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-45.1	179.3	-70.1	-68.8	0	0	0	111.7	F678 F679 S684 I685 I686	F678-I682 HydrophobicContact CD1-CG1 4.22Å; F678-I682 HydrophobicContact CD2-CG1 4.22Å; F678-I682 HydrophobicContact CE1-CG1 3.94Å; F678-I682 HydrophobicContact CE2-CD1 4.19Å; F678-I682 HydrophobicContact CE2-CG1 3.92Å; F678-I682 HydrophobicContact CG-CG1 4.36Å; F678-I682 HydrophobicContact CZ-CD1 4.17Å; F678-I682 HydrophobicContact CZ-CG1 3.78Å; F678-I682 WeakPolarHBondContact O-CB 3.44Å; F678-I682 VanDerWaalsContact O-CG1 3.22Å; F678-I682 WeakPolarHBondContact O-CG1 3.35Å; F678-I682 PolarHBondContact O-N 3Å; F679-I682 PolarHBondContact O-N 3.37Å; I682-S684 VanDerWaalsContact C-N 3.26Å; I682-S684 PolarHBondContact O-N 3.22Å; I682-I685 PolarHBondContact O-N 3.23Å; I682-I686 HydrophobicContact CG2-CD1 3.68Å; I682-I686 HydrophobicContact CG2-CG1 4.4Å; I682-I686 WeakPolarHBondContact O-CB 3.37Å; I682-I686 VanDerWaalsContact O-CG1 3.3Å; I682-I686 WeakPolarHBondContact O-CG1 3.34Å; I682-I686 PolarHBondContact O-N 3.35Å
683	C	84	Confident	83.4	Confident	19 Å²	19	53 Å²	53	13%	0.128	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-38	174.3	-74.1	0	0	0	0	112.2	F679 I686 E687	F679-C683 VanDerWaalsContact CE2-SG 3.59Å; F679-C683 VanDerWaalsContact CZ-SG 3.54Å; F679-C683 WeakPolarHBondContact O-CB 3.48Å; F679-C683 PolarHBondContact O-N 3.22Å; F679-C683 PolarHBondContact O-SG 3.35Å; F679-C683 VanDerWaalsContact O-SG 3.41Å; C683-I686 PolarHBondContact O-N 3.48Å; C683-E687 WeakPolarHBondContact O-CB 3.19Å; C683-E687 PolarHBondContact O-N 3.48Å
684	S	83.4	Confident	83.7	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-71.8	-34	178.1	-47.8	0	0	0	0	113	V680 V681 I682 V688 R711	V680-S684 WeakPolarHBondContact O-CB 3.43Å; V680-S684 PolarHBondContact O-N 3.4Å; V680-S684 VanDerWaalsContact O-N 3.11Å; V680-S684 PolarHBondContact O-OG 3.44Å; V681-S684 WeakPolarHBondContact O-CB 3.32Å; V681-S684 PolarHBondContact O-N 3.39Å; V681-S684 VanDerWaalsContact O-N 3.17Å; I682-S684 VanDerWaalsContact C-N 3.26Å; I682-S684 PolarHBondContact O-N 3.22Å; S684-V688 WeakPolarHBondContact O-CG2 3.36Å; S684-V688 PolarHBondContact O-N 2.8Å; S684-V688 VanDerWaalsContact O-N 3.12Å; S684-R711 VanDerWaalsContact CB-NH2 3.3Å; S684-R711 PolarHBondContact OG-NH2 3.4Å
685	I	87.1	Confident	83.6	Confident	59 Å²	59	62.2 Å²	62.2	30%	0.303	30%	0.304	S	S	.	.	H	α-helix	trans	-68.2	-44.2	172.7	-67.3	165.4	0	0	0	109.9	V649 V681 I682 E687 V688 V689	V649-I685 HydrophobicContact CG1-CG1 3.88Å; V681-I685 HydrophobicContact CG1-CD1 3.8Å; V681-I685 HydrophobicContact CG1-CG1 4.45Å; V681-I685 WeakPolarHBondContact O-CG1 3.27Å; V681-I685 PolarHBondContact O-N 3.05Å; I682-I685 PolarHBondContact O-N 3.23Å; I685-E687 VanDerWaalsContact C-N 3.33Å; I685-E687 PolarHBondContact O-N 3.01Å; I685-V688 PolarHBondContact O-N 2.87Å; I685-V689 HydrophobicContact CG2-CG2 4.47Å; I685-V689 WeakPolarHBondContact O-CB 3.2Å; I685-V689 WeakPolarHBondContact O-CG2 3.23Å; I685-V689 PolarHBondContact O-N 3.48Å
686	I	84.9	Confident	82.8	Confident	84 Å²	84	58 Å²	58	43%	0.431	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-44.8	176.3	-72	168.3	0	0	0	110.4	I682 C683 V689 L690	I682-I686 HydrophobicContact CG2-CD1 3.68Å; I682-I686 HydrophobicContact CG2-CG1 4.4Å; I682-I686 WeakPolarHBondContact O-CB 3.37Å; I682-I686 VanDerWaalsContact O-CG1 3.3Å; I682-I686 WeakPolarHBondContact O-CG1 3.34Å; I682-I686 PolarHBondContact O-N 3.35Å; C683-I686 PolarHBondContact O-N 3.48Å; I686-V689 PolarHBondContact O-N 2.7Å; I686-L690 HydrophobicContact CG2-CD1 3.59Å; I686-L690 HydrophobicContact CG2-CG 4.22Å; I686-L690 WeakPolarHBondContact O-CB 3.37Å; I686-L690 WeakPolarHBondContact O-CG 3.44Å; I686-L690 PolarHBondContact O-N 3.21Å
687	E	82	Confident	82.1	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-56.3	-53.1	174.3	-174.1	-163.1	174.7	0	0	112.2	C683 I685 V689 L690 I691 L704 R705 R708	C683-E687 WeakPolarHBondContact O-CB 3.19Å; C683-E687 PolarHBondContact O-N 3.48Å; I685-E687 VanDerWaalsContact C-N 3.33Å; I685-E687 PolarHBondContact O-N 3.01Å; E687-V689 VanDerWaalsContact C-N 3.29Å; E687-V689 PolarHBondContact O-N 2.87Å; E687-L690 PolarHBondContact O-N 3.41Å; E687-L690 VanDerWaalsContact O-N 3.08Å; E687-I691 HydrophobicContact CG-CD1 4.04Å; E687-I691 WeakPolarHBondContact O-CG1 3.44Å; E687-I691 PolarHBondContact O-N 3.34Å; E687-L704 HydrophobicContact CB-CB 3.96Å; E687-L704 HydrophobicContact CB-CD1 4.27Å; E687-L704 HydrophobicContact CG-CB 3.69Å; E687-L704 HydrophobicContact CG-CD1 4.44Å; E687-R705 WeakPolarHBondContact OE1-CA 3.38Å; E687-R705 WeakPolarHBondContact OE1-CB 3.04Å; E687-R705 PolarHBondContact OE1-N 2.82Å; E687-R708 IonicContact OE1-CZ 3.22Å; E687-R708 VanDerWaalsContact OE1-CZ 3.23Å; E687-R708 IonicContact OE1-NE 3.28Å; E687-R708 PolarHBondContact OE1-NE 3.42Å; E687-R708 IonicContact OE1-NH2 3.04Å; E687-R708 PolarHBondContact OE1-NH2 2.91Å; E687-R708 IonicContact OE2-CZ 3.44Å; E687-R708 IonicContact OE2-NE 2.68Å; E687-R708 PolarHBondContact OE2-NE 3.04Å; E687-R708 IonicContact OE2-NH2 2.7Å; E687-R708 PolarHBondContact OE2-NH2 3.48Å
688	V	81	Confident	81	Confident	25 Å²	25	64 Å²	64	15%	0.152	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-39.7	179	170.9	0	0	0	0	111.4	V649 S684 I685 Q692	V649-V688 HydrophobicContact CG2-CG2 4.41Å; S684-V688 WeakPolarHBondContact O-CG2 3.36Å; S684-V688 PolarHBondContact O-N 2.8Å; S684-V688 VanDerWaalsContact O-N 3.12Å; I685-V688 PolarHBondContact O-N 2.87Å; V688-Q692 WeakPolarHBondContact O-CB 3.36Å; V688-Q692 VanDerWaalsContact O-CG 3.3Å; V688-Q692 WeakPolarHBondContact O-CG 3.45Å; V688-Q692 PolarHBondContact O-N 3.15Å
689	V	85.1	Confident	79.6	Confident	73 Å²	73	66.4 Å²	66.4	44%	0.442	35%	0.353	S	S	.	.	H	α-helix	trans	-66.5	-39.9	175	170.5	0	0	0	0	111.6	I685 I686 E687 Q692 T693	I685-V689 HydrophobicContact CG2-CG2 4.47Å; I685-V689 WeakPolarHBondContact O-CB 3.2Å; I685-V689 WeakPolarHBondContact O-CG2 3.23Å; I685-V689 PolarHBondContact O-N 3.48Å; I686-V689 PolarHBondContact O-N 2.7Å; E687-V689 VanDerWaalsContact C-N 3.29Å; E687-V689 PolarHBondContact O-N 2.87Å; V689-Q692 PolarHBondContact O-N 3.12Å; V689-T693 HydrophobicContact CG1-CG2 4.28Å; V689-T693 WeakPolarHBondContact O-CB 3.26Å; V689-T693 VanDerWaalsContact O-CG2 3.29Å; V689-T693 WeakPolarHBondContact O-CG2 3.34Å; V689-T693 PolarHBondContact O-N 2.96Å; V689-T693 PolarHBondContact O-OG1 3.27Å
690	L	84.4	Confident	78.4	Confident	24 Å²	24	62.2 Å²	62.2	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-69.2	-35.8	178.4	-72.6	168.5	0	0	0	112.6	I686 E687 T693 K694 V695 M696 L704	I686-L690 HydrophobicContact CG2-CD1 3.59Å; I686-L690 HydrophobicContact CG2-CG 4.22Å; I686-L690 WeakPolarHBondContact O-CB 3.37Å; I686-L690 WeakPolarHBondContact O-CG 3.44Å; I686-L690 PolarHBondContact O-N 3.21Å; E687-L690 PolarHBondContact O-N 3.41Å; E687-L690 VanDerWaalsContact O-N 3.08Å; L690-T693 WeakPolarHBondContact CA-OG1 3.38Å; L690-T693 PolarHBondContact O-OG1 3.32Å; L690-K694 WeakPolarHBondContact O-CA 3.5Å; L690-K694 PolarHBondContact O-N 3.11Å; L690-V695 HydrophobicContact CD2-CB 4.12Å; L690-V695 HydrophobicContact CD2-CG1 4.22Å; L690-V695 PolarHBondContact O-N 3.18Å; L690-M696 HydrophobicContact CD1-CE 3.71Å; L690-M696 HydrophobicContact CD1-CG 4.48Å; L690-M696 HydrophobicContact CD1-SD 3.78Å; L690-M696 HydrophobicContact CD2-CE 4.07Å; L690-M696 HydrophobicContact CD2-CG 4.2Å; L690-M696 HydrophobicContact CD2-SD 4.46Å; L690-L704 HydrophobicContact CD1-CD1 3.73Å
691	I	77.8	Confident	77.5	Confident	53 Å²	53	62.9 Å²	62.9	27%	0.272	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-53.3	170.8	-66.9	164.8	0	0	0	109.7	E687 T693 K694 V701	E687-I691 HydrophobicContact CG-CD1 4.04Å; E687-I691 WeakPolarHBondContact O-CG1 3.44Å; E687-I691 PolarHBondContact O-N 3.34Å; I691-T693 VanDerWaalsContact C-N 3.33Å; I691-T693 PolarHBondContact O-N 2.86Å; I691-K694 WeakPolarHBondContact O-CG 3.22Å; I691-K694 PolarHBondContact O-N 3.35Å; I691-K694 VanDerWaalsContact O-N 3.14Å; I691-V701 HydrophobicContact CD1-CG1 3.69Å; I691-V701 HydrophobicContact CG1-CG1 3.56Å; I691-V701 HydrophobicContact CG1-CG2 4.1Å
692	Q	81.4	Confident	76.5	Confident	139 Å²	139	64.4 Å²	64.4	65%	0.65	36%	0.356	S	S	*	.	H	α-helix	trans	-64.9	-34.1	-177.2	-72.5	178.2	2.6	0	0	113.2	V688 V689	V688-Q692 WeakPolarHBondContact O-CB 3.36Å; V688-Q692 VanDerWaalsContact O-CG 3.3Å; V688-Q692 WeakPolarHBondContact O-CG 3.45Å; V688-Q692 PolarHBondContact O-N 3.15Å; V689-Q692 PolarHBondContact O-N 3.12Å
693	T	84.7	Confident	75.4	Confident	78 Å²	78	66 Å²	66	48%	0.479	37%	0.368	S	S	.	.	H	α-helix	trans	-85.1	-9.9	176.3	56.6	0	0	0	0	113.9	V689 L690 I691 V695	V689-T693 HydrophobicContact CG1-CG2 4.28Å; V689-T693 WeakPolarHBondContact O-CB 3.26Å; V689-T693 VanDerWaalsContact O-CG2 3.29Å; V689-T693 WeakPolarHBondContact O-CG2 3.34Å; V689-T693 PolarHBondContact O-N 2.96Å; V689-T693 PolarHBondContact O-OG1 3.27Å; L690-T693 WeakPolarHBondContact CA-OG1 3.38Å; L690-T693 PolarHBondContact O-OG1 3.32Å; I691-T693 VanDerWaalsContact C-N 3.33Å; I691-T693 PolarHBondContact O-N 2.86Å; T693-V695 PolarHBondContact O-N 2.67Å; T693-V695 WeakPolarHBondContact OG1-CG2 3.27Å
694	K	80.3	Confident	74.7	Confident	184 Å²	184	67 Å²	67	80%	0.8	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	29.2	-178	-56.5	-172.6	177.7	-171.6	0	114.4	L690 I691	L690-K694 WeakPolarHBondContact O-CA 3.5Å; L690-K694 PolarHBondContact O-N 3.11Å; I691-K694 WeakPolarHBondContact O-CG 3.22Å; I691-K694 PolarHBondContact O-N 3.35Å; I691-K694 VanDerWaalsContact O-N 3.14Å
695	V	79.6	Confident	74.1	Confident	90 Å²	90	69.5 Å²	69.5	55%	0.545	38%	0.381	S	S	.	.			trans	-77.1	-27.7	-173.6	167.8	0	0	0	0	113.1	L690 T693	L690-V695 HydrophobicContact CD2-CB 4.12Å; L690-V695 HydrophobicContact CD2-CG1 4.22Å; L690-V695 PolarHBondContact O-N 3.18Å; T693-V695 PolarHBondContact O-N 2.67Å; T693-V695 WeakPolarHBondContact OG1-CG2 3.27Å
696	M	67.9	Low	73.3	Confident	87 Å²	87	67.4 Å²	67.4	43%	0.429	37%	0.372	S	S	.	.	S	Bend	trans	-109.7	147.3	179.6	-72.6	-168.6	-172.3	0	0	112.5	L690	L690-M696 HydrophobicContact CD1-CE 3.71Å; L690-M696 HydrophobicContact CD1-CG 4.48Å; L690-M696 HydrophobicContact CD1-SD 3.78Å; L690-M696 HydrophobicContact CD2-CE 4.07Å; L690-M696 HydrophobicContact CD2-CG 4.2Å; L690-M696 HydrophobicContact CD2-SD 4.46Å
697	P	65	Low	72.6	Confident	91 Å²	91	64.3 Å²	64.3	59%	0.591	36%	0.358	S	S	*	.			trans	-65.8	156.3	168.9	30.9	-35.8	0	0	0	110.8	L699 G700	P697-L699 VanDerWaalsContact C-N 3.27Å; P697-L699 PolarHBondContact O-N 3.33Å; P697-L699 VanDerWaalsContact O-N 3.11Å; P697-G700 PolarHBondContact O-N 3.14Å
698	P	60.1	Low	72.2	Confident	98 Å²	98	64.3 Å²	64.3	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-56.6	-33.4	-171.5	18.9	-31.9	0	0	0	114.5	G700 V701 S702	P698-G700 PolarHBondContact O-N 2.87Å; P698-V701 WeakPolarHBondContact O-CA 3.3Å; P698-V701 WeakPolarHBondContact O-CB 3.22Å; P698-V701 PolarHBondContact O-N 3.04Å; P698-S702 PolarHBondContact O-N 2.83Å; P698-S702 PolarHBondContact O-OG 3.21Å
699	L	58.2	Low	71.8	Confident	113 Å²	113	63.2 Å²	63.2	59%	0.592	35%	0.352	S	S	*	.	H	α-helix	trans	-54.3	-38.4	174.2	-92.9	80.2	0	0	0	113.2	P697 V701 V703	P697-L699 VanDerWaalsContact C-N 3.27Å; P697-L699 PolarHBondContact O-N 3.33Å; P697-L699 VanDerWaalsContact O-N 3.11Å; L699-V701 VanDerWaalsContact C-N 3.31Å; L699-V703 PolarHBondContact O-N 3.13Å
700	G	61.3	Low	71.3	Confident	24 Å²	24	62 Å²	62	25%	0.247	34%	0.343	C	S	.	.	H	α-helix	trans	-70.5	-30.3	177.7	0	0	0	0	0	112.5	P697 P698 L704	P697-G700 PolarHBondContact O-N 3.14Å; P698-G700 PolarHBondContact O-N 2.87Å; G700-L704 WeakPolarHBondContact O-CG 3.43Å; G700-L704 PolarHBondContact O-N 3.1Å
701	V	63.4	Low	71	Confident	19 Å²	19	61.1 Å²	61.1	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-70.9	-46.2	175.3	179.8	0	0	0	0	110.5	I691 P698 L699 V703 L704 R705	I691-V701 HydrophobicContact CD1-CG1 3.69Å; I691-V701 HydrophobicContact CG1-CG1 3.56Å; I691-V701 HydrophobicContact CG1-CG2 4.1Å; P698-V701 WeakPolarHBondContact O-CA 3.3Å; P698-V701 WeakPolarHBondContact O-CB 3.22Å; P698-V701 PolarHBondContact O-N 3.04Å; L699-V701 VanDerWaalsContact C-N 3.31Å; V701-V703 VanDerWaalsContact C-N 3.34Å; V701-V703 PolarHBondContact O-N 3.33Å; V701-L704 PolarHBondContact O-N 2.97Å; V701-L704 VanDerWaalsContact O-N 3.09Å; V701-R705 PolarHBondContact O-N 2.9Å
702	S	66.5	Low	70.9	Confident	33 Å²	33	59.2 Å²	59.2	23%	0.231	33%	0.328	C	S	.	.	H	α-helix	trans	-56.9	-44.6	179.1	-56	0	0	0	0	112.4	P698 L704 R705 C706	P698-S702 PolarHBondContact O-N 2.83Å; P698-S702 PolarHBondContact O-OG 3.21Å; S702-L704 VanDerWaalsContact C-N 3.31Å; S702-L704 PolarHBondContact O-N 3.12Å; S702-R705 WeakPolarHBondContact O-CA 3.45Å; S702-R705 VanDerWaalsContact O-CB 3.23Å; S702-R705 WeakPolarHBondContact O-CB 3.49Å; S702-R705 PolarHBondContact O-N 3.05Å; S702-R705 VanDerWaalsContact O-N 3.08Å; S702-C706 PolarHBondContact O-N 2.72Å; S702-C706 PolarHBondContact O-SG 3.38Å
703	V	66.2	Low	70.4	Confident	91 Å²	91	55.3 Å²	55.3	55%	0.552	31%	0.309	S	S	*	.	H	α-helix	trans	-66.8	-30.8	178.4	178.5	0	0	0	0	112.5	L699 V701 C706	L699-V703 PolarHBondContact O-N 3.13Å; V701-V703 VanDerWaalsContact C-N 3.34Å; V701-V703 PolarHBondContact O-N 3.33Å; V703-C706 WeakPolarHBondContact O-CB 3.31Å
704	L	69.3	Low	69.8	Low	40 Å²	40	52.5 Å²	52.5	21%	0.209	29%	0.29	C	S	.	.	H	α-helix	trans	-73.2	-33.7	171.4	-70.4	172.8	0	0	0	111.9	E687 L690 G700 V701 S702 C706 A707	E687-L704 HydrophobicContact CB-CB 3.96Å; E687-L704 HydrophobicContact CB-CD1 4.27Å; E687-L704 HydrophobicContact CG-CB 3.69Å; E687-L704 HydrophobicContact CG-CD1 4.44Å; L690-L704 HydrophobicContact CD1-CD1 3.73Å; G700-L704 WeakPolarHBondContact O-CG 3.43Å; G700-L704 PolarHBondContact O-N 3.1Å; V701-L704 PolarHBondContact O-N 2.97Å; V701-L704 VanDerWaalsContact O-N 3.09Å; S702-L704 VanDerWaalsContact C-N 3.31Å; S702-L704 PolarHBondContact O-N 3.12Å; L704-C706 VanDerWaalsContact C-N 3.3Å; L704-C706 PolarHBondContact O-N 3.03Å; L704-A707 VanDerWaalsContact O-CB 3.27Å; L704-A707 WeakPolarHBondContact O-CB 3.21Å; L704-A707 PolarHBondContact O-N 3.45Å
705	R	69.3	Low	69.2	Low	53 Å²	53	44.9 Å²	44.9	20%	0.2	26%	0.259	C	S	.	.	H	α-helix	trans	-59.5	-41.1	172.4	-155	-176	-67.9	-170.6	-1.9	111	L626 E629 E687 V701 S702 A707 R708	L626-R705 HydrophobicContact CD2-CG 4.48Å; E629-R705 WeakPolarHBondContact OE1-CD 3.44Å; E629-R705 IonicContact OE1-CZ 2.62Å; E629-R705 IonicContact OE1-NE 3.44Å; E629-R705 IonicContact OE1-NH1 2.73Å; E629-R705 PolarHBondContact OE1-NH1 2.81Å; E687-R705 WeakPolarHBondContact OE1-CA 3.38Å; E687-R705 WeakPolarHBondContact OE1-CB 3.04Å; E687-R705 PolarHBondContact OE1-N 2.82Å; V701-R705 PolarHBondContact O-N 2.9Å; S702-R705 WeakPolarHBondContact O-CA 3.45Å; S702-R705 VanDerWaalsContact O-CB 3.23Å; S702-R705 WeakPolarHBondContact O-CB 3.49Å; S702-R705 PolarHBondContact O-N 3.05Å; S702-R705 VanDerWaalsContact O-N 3.08Å; R705-A707 PolarHBondContact O-N 3.22Å; R705-R708 VanDerWaalsContact O-CB 3.27Å; R705-R708 WeakPolarHBondContact O-CB 3.41Å; R705-R708 VanDerWaalsContact O-CG 3.31Å; R705-R708 WeakPolarHBondContact O-CG 3.36Å; R705-R708 PolarHBondContact O-N 3.02Å; R705-R708 VanDerWaalsContact O-N 3.07Å
706	C	70	Confident	68.6	Low	16 Å²	16	41.3 Å²	41.3	11%	0.108	24%	0.238	C	C	.	.	H	α-helix	trans	-54	-36.1	172.2	-58.8	0	0	0	0	112.9	S702 V703 L704 R708 L709 I1176 Q1179	S702-C706 PolarHBondContact O-N 2.72Å; S702-C706 PolarHBondContact O-SG 3.38Å; V703-C706 WeakPolarHBondContact O-CB 3.31Å; L704-C706 VanDerWaalsContact C-N 3.3Å; L704-C706 PolarHBondContact O-N 3.03Å; C706-R708 PolarHBondContact O-N 2.81Å; C706-L709 VanDerWaalsContact O-CB 3.28Å; C706-L709 WeakPolarHBondContact O-CB 2.93Å; C706-L709 PolarHBondContact O-N 3.39Å; C706-I1176 HydrophobicContact CB-CG1 4.06Å; C706-Q1179 PolarHBondContact SG-OE1 3.26Å
707	A	70.5	Confident	68.6	Low	18 Å²	18	43 Å²	43	15%	0.149	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.8	-178.4	0	0	0	0	0	113.2	L704 R705 L709 L710	L704-A707 VanDerWaalsContact O-CB 3.27Å; L704-A707 WeakPolarHBondContact O-CB 3.21Å; L704-A707 PolarHBondContact O-N 3.45Å; R705-A707 PolarHBondContact O-N 3.22Å; A707-L709 VanDerWaalsContact C-N 3.32Å; A707-L710 HydrophobicContact CB-CD1 4.39Å; A707-L710 VanDerWaalsContact O-CB 3.29Å; A707-L710 WeakPolarHBondContact O-CB 3.02Å; A707-L710 WeakPolarHBondContact O-CG 3.36Å; A707-L710 PolarHBondContact O-N 2.75Å
708	R	74.5	Confident	68.5	Low	2 Å²	2	41.7 Å²	41.7	1%	0.008	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.1	171.7	-56.6	170	-179.6	177.5	-0.4	112.4	L626 N645 E687 R705 C706 L710 R711	L626-R708 HydrophobicContact CD1-CB 3.83Å; N645-R708 PolarHBondContact ND2-NH1 3.42Å; N645-R708 PolarHBondContact OD1-NH1 2.97Å; E687-R708 IonicContact OE1-CZ 3.22Å; E687-R708 VanDerWaalsContact OE1-CZ 3.23Å; E687-R708 IonicContact OE1-NE 3.28Å; E687-R708 PolarHBondContact OE1-NE 3.42Å; E687-R708 IonicContact OE1-NH2 3.04Å; E687-R708 PolarHBondContact OE1-NH2 2.91Å; E687-R708 IonicContact OE2-CZ 3.44Å; E687-R708 IonicContact OE2-NE 2.68Å; E687-R708 PolarHBondContact OE2-NE 3.04Å; E687-R708 IonicContact OE2-NH2 2.7Å; E687-R708 PolarHBondContact OE2-NH2 3.48Å; R705-R708 VanDerWaalsContact O-CB 3.27Å; R705-R708 WeakPolarHBondContact O-CB 3.41Å; R705-R708 VanDerWaalsContact O-CG 3.31Å; R705-R708 WeakPolarHBondContact O-CG 3.36Å; R705-R708 PolarHBondContact O-N 3.02Å; R705-R708 VanDerWaalsContact O-N 3.07Å; C706-R708 PolarHBondContact O-N 2.81Å; R708-L710 PolarHBondContact O-N 3.34Å; R708-R711 VanDerWaalsContact O-CB 3.23Å; R708-R711 WeakPolarHBondContact O-CB 3.18Å; R708-R711 WeakPolarHBondContact O-CD 3.37Å; R708-R711 WeakPolarHBondContact O-CG 3.31Å; R708-R711 PolarHBondContact O-N 3.21Å; R708-R711 VanDerWaalsContact O-N 3.09Å
709	L	73	Confident	69	Low	2 Å²	2	41.7 Å²	41.7	1%	0.01	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-65.7	-26.3	176.4	-62.2	167.4	0	0	0	111.9	L626 C706 A707 R711 V712 M1172 V1175 I1176	L626-L709 HydrophobicContact CB-CD2 4.26Å; L626-L709 HydrophobicContact CD1-CD2 3.81Å; L626-L709 HydrophobicContact CD1-CG 4.35Å; C706-L709 VanDerWaalsContact O-CB 3.28Å; C706-L709 WeakPolarHBondContact O-CB 2.93Å; C706-L709 PolarHBondContact O-N 3.39Å; A707-L709 VanDerWaalsContact C-N 3.32Å; L709-R711 PolarHBondContact O-N 3.31Å; L709-V712 VanDerWaalsContact O-CB 3.25Å; L709-V712 WeakPolarHBondContact O-CB 3.17Å; L709-V712 WeakPolarHBondContact O-CG2 2.98Å; L709-V712 PolarHBondContact O-N 2.92Å; L709-M1172 HydrophobicContact CB-CE 4.17Å; L709-V1175 HydrophobicContact CD1-CB 3.86Å; L709-V1175 HydrophobicContact CD1-CG1 3.95Å; L709-V1175 HydrophobicContact CD2-CB 4.06Å; L709-V1175 HydrophobicContact CD2-CG1 3.87Å; L709-V1175 HydrophobicContact CD2-CG2 4.44Å; L709-V1175 HydrophobicContact CG-CG1 4.47Å; L709-I1176 HydrophobicContact CD1-CD1 4.46Å; L709-I1176 HydrophobicContact CD1-CG1 3.71Å
710	L	74.6	Confident	69.4	Low	47 Å²	47	38.9 Å²	38.9	25%	0.246	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-55.8	-22.8	171.8	-61.3	178.1	0	0	0	112.5	F676 F679 V680 A707 R708 V712 F713 M1172	F676-L710 VanDerWaalsContact CE1-O 3.27Å; F676-L710 WeakPolarHBondContact CE1-O 3.48Å; F676-L710 HydrophobicContact CE2-CB 4.21Å; F676-L710 HydrophobicContact CZ-CB 3.72Å; F676-L710 WeakPolarHBondContact CZ-O 3.07Å; F679-L710 HydrophobicContact CE1-CD1 4.44Å; V680-L710 HydrophobicContact CG2-CB 3.79Å; V680-L710 HydrophobicContact CG2-CD1 4.25Å; A707-L710 HydrophobicContact CB-CD1 4.39Å; A707-L710 VanDerWaalsContact O-CB 3.29Å; A707-L710 WeakPolarHBondContact O-CB 3.02Å; A707-L710 WeakPolarHBondContact O-CG 3.36Å; A707-L710 PolarHBondContact O-N 2.75Å; R708-L710 PolarHBondContact O-N 3.34Å; L710-V712 PolarHBondContact O-N 2.67Å; L710-F713 HydrophobicContact CD2-CD2 3.95Å; L710-F713 HydrophobicContact CD2-CE2 3.8Å; L710-F713 WeakPolarHBondContact O-CB 3.38Å; L710-F713 PolarHBondContact O-N 3.03Å; L710-M1172 HydrophobicContact CD2-CE 4.34Å
711	R	76.9	Confident	69.6	Low	6 Å²	6	39.4 Å²	39.4	2%	0.023	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-58.7	-29.3	172.1	-61.6	174	-172.2	166.6	0.5	112.5	V619 N622 V680 S684 R708 L709 F713 K714	V619-R711 HydrophobicContact CG1-CB 4.44Å; V619-R711 WeakPolarHBondContact CG1-O 3.42Å; N622-R711 PolarHBondContact OD1-NH1 3.48Å; V680-R711 HydrophobicContact CG1-CG 3.53Å; S684-R711 VanDerWaalsContact CB-NH2 3.3Å; S684-R711 PolarHBondContact OG-NH2 3.4Å; R708-R711 VanDerWaalsContact O-CB 3.23Å; R708-R711 WeakPolarHBondContact O-CB 3.18Å; R708-R711 WeakPolarHBondContact O-CD 3.37Å; R708-R711 WeakPolarHBondContact O-CG 3.31Å; R708-R711 PolarHBondContact O-N 3.21Å; R708-R711 VanDerWaalsContact O-N 3.09Å; L709-R711 PolarHBondContact O-N 3.31Å; R711-F713 PolarHBondContact O-N 3.47Å; R711-K714 VanDerWaalsContact O-CB 3.28Å; R711-K714 WeakPolarHBondContact O-CB 3.33Å; R711-K714 PolarHBondContact O-N 2.94Å
712	V	75.5	Confident	69.8	Low	13 Å²	13	39 Å²	39	8%	0.079	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-59	-34	174.1	178.5	0	0	0	0	111	T623 L709 L710 K714 V715 L1168 M1172	T623-V712 HydrophobicContact CG2-CG2 3.97Å; T623-V712 WeakPolarHBondContact OG1-CG2 3.38Å; L709-V712 VanDerWaalsContact O-CB 3.25Å; L709-V712 WeakPolarHBondContact O-CB 3.17Å; L709-V712 WeakPolarHBondContact O-CG2 2.98Å; L709-V712 PolarHBondContact O-N 2.92Å; L710-V712 PolarHBondContact O-N 2.67Å; V712-K714 PolarHBondContact O-N 2.88Å; V712-V715 WeakPolarHBondContact O-CB 3.47Å; V712-V715 WeakPolarHBondContact O-CG2 3.44Å; V712-V715 PolarHBondContact O-N 3.06Å; V712-L1168 HydrophobicContact CG1-CD1 4.04Å; V712-L1168 HydrophobicContact CG1-CD2 4.14Å; V712-L1168 HydrophobicContact CG1-CG 4.12Å; V712-M1172 HydrophobicContact CB-SD 4.28Å; V712-M1172 HydrophobicContact CG1-SD 4.42Å
713	F	72	Confident	69.8	Low	57 Å²	57	43.5 Å²	43.5	25%	0.25	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-65.4	-8.9	175.7	-65.6	-40.3	0	0	0	114.1	F676 L710 R711 V715 T716 L1168 L1169 M1172	F676-F713 HydrophobicContact CE1-CB 4.06Å; F676-F713 HydrophobicContact CZ-CB 3.88Å; F676-F713 HydrophobicContact CZ-CD2 4.01Å; F676-F713 HydrophobicContact CZ-CG 4.48Å; L710-F713 HydrophobicContact CD2-CD2 3.95Å; L710-F713 HydrophobicContact CD2-CE2 3.8Å; L710-F713 WeakPolarHBondContact O-CB 3.38Å; L710-F713 PolarHBondContact O-N 3.03Å; R711-F713 PolarHBondContact O-N 3.47Å; F713-V715 PolarHBondContact O-N 2.92Å; F713-T716 HydrophobicContact CB-CG2 4.13Å; F713-T716 HydrophobicContact CD1-CG2 3.9Å; F713-T716 HydrophobicContact CG-CG2 4.43Å; F713-T716 WeakPolarHBondContact O-CB 3.22Å; F713-T716 WeakPolarHBondContact O-CG2 3.45Å; F713-T716 PolarHBondContact O-N 2.77Å; F713-T716 PolarHBondContact O-OG1 3.36Å; F713-L1168 HydrophobicContact CD1-CD2 4.28Å; F713-L1168 HydrophobicContact CE1-CD2 3.98Å; F713-L1169 HydrophobicContact CE1-CD2 3.8Å; F713-L1169 HydrophobicContact CZ-CD2 3.78Å; F713-M1172 HydrophobicContact CD1-SD 4.11Å; F713-M1172 HydrophobicContact CD2-CE 4.19Å; F713-M1172 HydrophobicContact CE1-CE 4.09Å; F713-M1172 HydrophobicContact CE1-SD 3.58Å; F713-M1172 VanDerWaalsContact CE1-SD 3.58Å; F713-M1172 HydrophobicContact CE2-CE 3.66Å; F713-M1172 HydrophobicContact CE2-SD 4.27Å; F713-M1172 HydrophobicContact CZ-CE 3.6Å; F713-M1172 HydrophobicContact CZ-SD 3.67Å
714	K	71.6	Confident	69.9	Low	18 Å²	18	41.6 Å²	41.6	8%	0.078	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-56.7	-28.2	164.5	-75.2	-172.5	172.9	-178.9	0	112.1	V615 V619 E655 D677 R711 V712 T716 R717 Y718	V615-K714 HydrophobicContact CG1-CD 4.23Å; V619-K714 HydrophobicContact CG2-CB 4.44Å; V619-K714 HydrophobicContact CG2-CD 3.84Å; E655-K714 IonicContact OE1-NZ 3.86Å; E655-K714 PolarHBondContact OE1-NZ 3.48Å; E655-K714 IonicContact OE2-NZ 3.74Å; E655-K714 PolarHBondContact OE2-NZ 3.41Å; D677-K714 VanDerWaalsContact CG-CE 3.44Å; D677-K714 VanDerWaalsContact CG-NZ 3.31Å; D677-K714 WeakPolarHBondContact OD1-CE 3.46Å; D677-K714 IonicContact OD1-NZ 2.63Å; D677-K714 PolarHBondContact OD1-NZ 3.13Å; D677-K714 IonicContact OD2-NZ 2.88Å; D677-K714 PolarHBondContact OD2-NZ 2.86Å; R711-K714 VanDerWaalsContact O-CB 3.28Å; R711-K714 WeakPolarHBondContact O-CB 3.33Å; R711-K714 PolarHBondContact O-N 2.94Å; V712-K714 PolarHBondContact O-N 2.88Å; K714-T716 VanDerWaalsContact C-N 3.29Å; K714-T716 PolarHBondContact O-N 2.9Å; K714-R717 WeakPolarHBondContact O-CB 3.35Å; K714-R717 PolarHBondContact O-N 3.49Å; K714-Y718 WeakPolarHBondContact O-CE2 3.3Å
715	V	68.5	Low	69.8	Low	25 Å²	25	40.4 Å²	40.4	15%	0.152	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-65	-31	175.8	-179.6	0	0	0	0	112	F620 V712 F713 R717 Y718 W719	F620-V715 HydrophobicContact CZ-CG2 4.47Å; V712-V715 WeakPolarHBondContact O-CB 3.47Å; V712-V715 WeakPolarHBondContact O-CG2 3.44Å; V712-V715 PolarHBondContact O-N 3.06Å; F713-V715 PolarHBondContact O-N 2.92Å; V715-R717 PolarHBondContact O-N 2.65Å; V715-Y718 PolarHBondContact O-N 2.63Å; V715-W719 PolarHBondContact O-N 2.8Å
716	T	67	Low	69.6	Low	14 Å²	14	40.7 Å²	40.7	9%	0.086	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-60.5	-29.9	-179.7	69.7	0	0	0	0	113.1	F673 F713 K714 Y718 W719 L722	F673-T716 WeakPolarHBondContact CE1-OG1 3.39Å; F713-T716 HydrophobicContact CB-CG2 4.13Å; F713-T716 HydrophobicContact CD1-CG2 3.9Å; F713-T716 HydrophobicContact CG-CG2 4.43Å; F713-T716 WeakPolarHBondContact O-CB 3.22Å; F713-T716 WeakPolarHBondContact O-CG2 3.45Å; F713-T716 PolarHBondContact O-N 2.77Å; F713-T716 PolarHBondContact O-OG1 3.36Å; K714-T716 VanDerWaalsContact C-N 3.29Å; K714-T716 PolarHBondContact O-N 2.9Å; T716-Y718 PolarHBondContact O-N 2.62Å; T716-W719 PolarHBondContact O-N 2.9Å; T716-L722 HydrophobicContact CG2-CD2 3.46Å; T716-L722 VanDerWaalsContact CG2-CD2 3.46Å; T716-L722 HydrophobicContact CG2-CG 3.86Å
717	R	66.7	Low	69.4	Low	123 Å²	123	41.8 Å²	41.8	46%	0.464	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-59.5	-28.9	176.1	-175.7	178	179	-158.9	1.6	112.6	F673 K714 V715	F673-R717 HydrophobicContact CD1-CB 4.24Å; F673-R717 HydrophobicContact CD2-CB 4.23Å; F673-R717 HydrophobicContact CD2-CG 3.96Å; F673-R717 HydrophobicContact CE1-CB 4.09Å; F673-R717 HydrophobicContact CE2-CB 4.07Å; F673-R717 HydrophobicContact CE2-CG 4.04Å; F673-R717 HydrophobicContact CG-CB 4.31Å; F673-R717 HydrophobicContact CG-CG 4.32Å; F673-R717 HydrophobicContact CZ-CB 4Å; F673-R717 HydrophobicContact CZ-CG 4.48Å; K714-R717 WeakPolarHBondContact O-CB 3.35Å; K714-R717 PolarHBondContact O-N 3.49Å; V715-R717 PolarHBondContact O-N 2.65Å
718	Y	64.7	Low	69.2	Low	64 Å²	64	41.8 Å²	41.8	25%	0.251	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-24.8	-172.9	-44	-44.9	0	0	0	112.1	Y612 I616 K714 V715 T716 S720	Y612-Y718 HydrophobicContact CD2-CD1 4.32Å; Y612-Y718 AromaticContact CD2-CE1 3.86Å; Y612-Y718 HydrophobicContact CD2-CE1 3.86Å; Y612-Y718 AromaticContact CE2-CD1 3.4Å; Y612-Y718 HydrophobicContact CE2-CD1 3.4Å; Y612-Y718 VanDerWaalsContact CE2-CD1 3.4Å; Y612-Y718 HydrophobicContact CE2-CD2 4.3Å; Y612-Y718 AromaticContact CE2-CE1 3.38Å; Y612-Y718 HydrophobicContact CE2-CE1 3.38Å; Y612-Y718 HydrophobicContact CE2-CE2 4.3Å; Y612-Y718 AromaticContact CE2-CG 3.88Å; Y612-Y718 HydrophobicContact CE2-CG 3.88Å; Y612-Y718 AromaticContact CE2-CZ 3.86Å; I616-Y718 HydrophobicContact CD1-CD2 3.73Å; I616-Y718 HydrophobicContact CD1-CE2 3.53Å; I616-Y718 HydrophobicContact CG1-CD2 4.2Å; I616-Y718 HydrophobicContact CG1-CE2 3.59Å; K714-Y718 WeakPolarHBondContact O-CE2 3.3Å; V715-Y718 PolarHBondContact O-N 2.63Å; T716-Y718 PolarHBondContact O-N 2.62Å; Y718-S720 PolarHBondContact O-N 3.11Å
719	W	69.4	Low	68.7	Low	98 Å²	98	42.7 Å²	42.7	37%	0.371	22%	0.215	S	C	.	.			trans	-85.6	87.9	175.2	-82	55.4	0	0	0	110.1	V715 T716 S721 L722 R723 M1164	V715-W719 PolarHBondContact O-N 2.8Å; T716-W719 PolarHBondContact O-N 2.9Å; W719-S721 PolarHBondContact O-N 3.47Å; W719-S721 VanDerWaalsContact O-N 3.11Å; W719-L722 HydrophobicContact CB-CB 3.73Å; W719-L722 HydrophobicContact CB-CD2 4.47Å; W719-L722 CarbonylContact O-C 3.57Å; W719-L722 WeakPolarHBondContact O-CA 3.45Å; W719-L722 WeakPolarHBondContact O-CB 3.44Å; W719-L722 PolarHBondContact O-N 3.43Å; W719-R723 PolarHBondContact O-N 2.89Å; W719-M1164 HydrophobicContact CH2-CE 3.67Å; W719-M1164 HydrophobicContact CH2-CG 4.12Å; W719-M1164 HydrophobicContact CH2-SD 3.37Å; W719-M1164 WeakPolarHBondContact CH2-SD 3.4Å; W719-M1164 HydrophobicContact CZ2-CE 3.67Å; W719-M1164 HydrophobicContact CZ2-SD 4.01Å; W719-M1164 HydrophobicContact CZ3-CB 4.48Å; W719-M1164 HydrophobicContact CZ3-CG 4.33Å; W719-M1164 HydrophobicContact CZ3-SD 4.13Å
720	S	67	Low	68.5	Low	53 Å²	53	47.8 Å²	47.8	37%	0.371	24%	0.241	S	C	.	.	H	α-helix	trans	-57.8	-31.8	-175.4	-166	0	0	0	0	113.6	Y718 R723 N724	Y718-S720 PolarHBondContact O-N 3.11Å; S720-R723 PolarHBondContact O-N 3.32Å; S720-R723 PolarHBondContact OG-NH2 2.94Å; S720-N724 WeakPolarHBondContact O-CB 3.35Å; S720-N724 PolarHBondContact O-N 3.42Å; S720-N724 PolarHBondContact O-OD1 2.87Å; S720-N724 VanDerWaalsContact O-OD1 3.07Å
721	S	65.3	Low	68	Low	35 Å²	35	48.1 Å²	48.1	25%	0.245	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-39.3	174.2	-176.3	0	0	0	0	112.1	W719 N724 L725	W719-S721 PolarHBondContact O-N 3.47Å; W719-S721 VanDerWaalsContact O-N 3.11Å; S721-N724 PolarHBondContact O-N 3.39Å; S721-L725 WeakPolarHBondContact O-CB 3.36Å; S721-L725 PolarHBondContact O-N 2.89Å
722	L	66.7	Low	67.7	Low	11 Å²	11	48 Å²	48	6%	0.058	25%	0.252	C	S	.	.	H	α-helix	trans	-69.6	-36	173.7	179.2	48.9	0	0	0	111.7	T716 W719 L725 V726 V1165	T716-L722 HydrophobicContact CG2-CD2 3.46Å; T716-L722 VanDerWaalsContact CG2-CD2 3.46Å; T716-L722 HydrophobicContact CG2-CG 3.86Å; W719-L722 HydrophobicContact CB-CB 3.73Å; W719-L722 HydrophobicContact CB-CD2 4.47Å; W719-L722 CarbonylContact O-C 3.57Å; W719-L722 WeakPolarHBondContact O-CA 3.45Å; W719-L722 WeakPolarHBondContact O-CB 3.44Å; W719-L722 PolarHBondContact O-N 3.43Å; L722-L725 HydrophobicContact CD1-CD2 3.97Å; L722-V726 HydrophobicContact CD1-CG2 3.89Å; L722-V726 WeakPolarHBondContact O-CB 3.28Å; L722-V726 VanDerWaalsContact O-CG2 3.28Å; L722-V726 WeakPolarHBondContact O-CG2 3.35Å; L722-V726 PolarHBondContact O-N 3.33Å; L722-V1165 HydrophobicContact CB-CG2 4.49Å; L722-V1165 HydrophobicContact CD1-CB 4.31Å; L722-V1165 HydrophobicContact CD1-CG1 3.54Å; L722-V1165 HydrophobicContact CD1-CG2 3.74Å; L722-V1165 HydrophobicContact CD2-CG2 4.29Å; L722-V1165 HydrophobicContact CG-CG2 4.4Å
723	R	68.1	Low	67.5	Low	128 Å²	128	51.2 Å²	51.2	48%	0.483	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-45.9	172	-178.5	-176.2	61.4	176.9	-5.5	112.1	W719 S720 L725 V726 G727	W719-R723 PolarHBondContact O-N 2.89Å; S720-R723 PolarHBondContact O-N 3.32Å; S720-R723 PolarHBondContact OG-NH2 2.94Å; R723-L725 VanDerWaalsContact C-N 3.35Å; R723-V726 PolarHBondContact O-N 3.41Å; R723-G727 PolarHBondContact O-N 3.21Å
724	N	67.5	Low	67.3	Low	50 Å²	50	57.3 Å²	57.3	27%	0.267	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-45.5	177.1	-67.8	0.2	0	0	0	110.4	S720 S721 G727 S728 E847	S720-N724 WeakPolarHBondContact O-CB 3.35Å; S720-N724 PolarHBondContact O-N 3.42Å; S720-N724 PolarHBondContact O-OD1 2.87Å; S720-N724 VanDerWaalsContact O-OD1 3.07Å; S721-N724 PolarHBondContact O-N 3.39Å; N724-G727 PolarHBondContact O-N 3.07Å; N724-S728 PolarHBondContact O-N 3.19Å; N724-S728 PolarHBondContact O-OG 3.06Å; N724-E847 PolarHBondContact ND2-OE1 3.37Å
725	L	66.3	Low	67.2	Low	15 Å²	15	58.5 Å²	58.5	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-60.7	174.1	-178.6	136.6	0	0	0	110.4	S721 L722 R723 G727 S728 L729 I1162 I1290	S721-L725 WeakPolarHBondContact O-CB 3.36Å; S721-L725 PolarHBondContact O-N 2.89Å; L722-L725 HydrophobicContact CD1-CD2 3.97Å; R723-L725 VanDerWaalsContact C-N 3.35Å; L725-G727 PolarHBondContact O-N 3.36Å; L725-G727 VanDerWaalsContact O-N 3.12Å; L725-S728 CarbonylContact O-C 3.49Å; L725-S728 PolarHBondContact O-N 2.76Å; L725-S728 PolarHBondContact O-OG 2.89Å; L725-L729 HydrophobicContact CD2-CD1 3.49Å; L725-L729 VanDerWaalsContact CD2-CD1 3.49Å; L725-L729 HydrophobicContact CD2-CG 4.25Å; L725-L729 HydrophobicContact CG-CD1 4.02Å; L725-L729 HydrophobicContact CG-CG 4.29Å; L725-L729 VanDerWaalsContact O-CG 3.27Å; L725-L729 WeakPolarHBondContact O-CG 3.08Å; L725-L729 PolarHBondContact O-N 3.35Å; L725-I1162 HydrophobicContact CD1-CG1 4.33Å; L725-I1290 HydrophobicContact CD1-CG2 3.97Å
726	V	65.3	Low	67.4	Low	59 Å²	59	57.9 Å²	57.9	36%	0.358	30%	0.301	S	S	.	.	H	α-helix	trans	-53.2	-36.7	177.6	169.1	0	0	0	0	112.5	L722 R723 L729 L730	L722-V726 HydrophobicContact CD1-CG2 3.89Å; L722-V726 WeakPolarHBondContact O-CB 3.28Å; L722-V726 VanDerWaalsContact O-CG2 3.28Å; L722-V726 WeakPolarHBondContact O-CG2 3.35Å; L722-V726 PolarHBondContact O-N 3.33Å; R723-V726 PolarHBondContact O-N 3.41Å; V726-L729 PolarHBondContact O-N 2.88Å; V726-L730 HydrophobicContact CG1-CD1 3.94Å; V726-L730 HydrophobicContact CG1-CG 4.36Å; V726-L730 WeakPolarHBondContact O-CB 3.43Å; V726-L730 VanDerWaalsContact O-CG 3.3Å; V726-L730 WeakPolarHBondContact O-CG 3.3Å; V726-L730 PolarHBondContact O-N 2.97Å
727	G	66.4	Low	67.6	Low	39 Å²	39	60.7 Å²	60.7	40%	0.402	32%	0.318	S	S	.	.	H	α-helix	trans	-60.4	-52	172.3	0	0	0	0	0	113.2	R723 N724 L725 L729 L730 A731	R723-G727 PolarHBondContact O-N 3.21Å; N724-G727 PolarHBondContact O-N 3.07Å; L725-G727 PolarHBondContact O-N 3.36Å; L725-G727 VanDerWaalsContact O-N 3.12Å; G727-L729 VanDerWaalsContact C-N 3.3Å; G727-L729 PolarHBondContact O-N 2.84Å; G727-L730 PolarHBondContact O-N 2.83Å; G727-A731 PolarHBondContact O-N 3.46Å
728	S	66.1	Low	67.8	Low	19 Å²	19	55.9 Å²	55.9	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-29.1	176.5	67.1	0	0	0	0	113.5	N724 L725 S732 T843	N724-S728 PolarHBondContact O-N 3.19Å; N724-S728 PolarHBondContact O-OG 3.06Å; L725-S728 CarbonylContact O-C 3.49Å; L725-S728 PolarHBondContact O-N 2.76Å; L725-S728 PolarHBondContact O-OG 2.89Å; S728-S732 VanDerWaalsContact O-CB 3.31Å; S728-S732 WeakPolarHBondContact O-CB 3.35Å; S728-S732 PolarHBondContact O-N 2.88Å; S728-S732 PolarHBondContact O-OG 3.33Å; S728-T843 WeakPolarHBondContact CB-OG1 3.27Å; S728-T843 PolarHBondContact OG-OG1 3.12Å
729	L	65.3	Low	68.1	Low	21 Å²	21	53.1 Å²	53.1	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-71	-39.8	173.6	-64.3	-170.9	0	0	0	112	L725 V726 G727 S732 L733 F1286 M1287 I1290	L725-L729 HydrophobicContact CD2-CD1 3.49Å; L725-L729 VanDerWaalsContact CD2-CD1 3.49Å; L725-L729 HydrophobicContact CD2-CG 4.25Å; L725-L729 HydrophobicContact CG-CD1 4.02Å; L725-L729 HydrophobicContact CG-CG 4.29Å; L725-L729 VanDerWaalsContact O-CG 3.27Å; L725-L729 WeakPolarHBondContact O-CG 3.08Å; L725-L729 PolarHBondContact O-N 3.35Å; V726-L729 PolarHBondContact O-N 2.88Å; G727-L729 VanDerWaalsContact C-N 3.3Å; G727-L729 PolarHBondContact O-N 2.84Å; L729-S732 WeakPolarHBondContact CA-OG 3.05Å; L729-S732 PolarHBondContact O-N 3.41Å; L729-S732 PolarHBondContact O-OG 2.88Å; L729-S732 VanDerWaalsContact O-OG 3.09Å; L729-L733 WeakPolarHBondContact O-CB 3.36Å; L729-L733 PolarHBondContact O-N 3.49Å; L729-F1286 HydrophobicContact CB-CZ 3.94Å; L729-F1286 HydrophobicContact CD1-CE1 3.72Å; L729-F1286 HydrophobicContact CD1-CZ 3.63Å; L729-F1286 HydrophobicContact CD2-CE1 4.45Å; L729-F1286 HydrophobicContact CD2-CE2 3.86Å; L729-F1286 HydrophobicContact CD2-CZ 3.57Å; L729-F1286 HydrophobicContact CG-CE1 4.44Å; L729-F1286 HydrophobicContact CG-CZ 3.86Å; L729-M1287 HydrophobicContact CD1-CE 4.14Å; L729-I1290 HydrophobicContact CD1-CD1 3.88Å; L729-I1290 HydrophobicContact CD2-CD1 3.62Å; L729-I1290 HydrophobicContact CD2-CG1 4.25Å; L729-I1290 HydrophobicContact CG-CD1 4.38Å
730	L	68.2	Low	68.4	Low	108 Å²	108	51.1 Å²	51.1	57%	0.565	29%	0.289	S	S	*	.	H	α-helix	trans	-69	-37.8	173.3	-72.5	170.5	0	0	0	112.1	V726 G727 L733	V726-L730 HydrophobicContact CG1-CD1 3.94Å; V726-L730 HydrophobicContact CG1-CG 4.36Å; V726-L730 WeakPolarHBondContact O-CB 3.43Å; V726-L730 VanDerWaalsContact O-CG 3.3Å; V726-L730 WeakPolarHBondContact O-CG 3.3Å; V726-L730 PolarHBondContact O-N 2.97Å; G727-L730 PolarHBondContact O-N 2.83Å; L730-L733 HydrophobicContact CD2-CD2 4.4Å; L730-L733 WeakPolarHBondContact O-CB 3.3Å; L730-L733 PolarHBondContact O-N 2.91Å
731	A	63.8	Low	68.8	Low	55 Å²	55	51.8 Å²	51.8	46%	0.455	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-42	173.7	0	0	0	0	0	112.1	M497 G727	M497-A731 HydrophobicContact CE-CB 4.11Å; G727-A731 PolarHBondContact O-N 3.46Å
732	S	69.5	Low	69.3	Low	4 Å²	4	51 Å²	51	3%	0.028	28%	0.283	C	S	.	.	H	α-helix	trans	-77.2	-20.1	178.7	57.7	0	0	0	0	114	S728 L729 K734 S735 I736 N839	S728-S732 VanDerWaalsContact O-CB 3.31Å; S728-S732 WeakPolarHBondContact O-CB 3.35Å; S728-S732 PolarHBondContact O-N 2.88Å; S728-S732 PolarHBondContact O-OG 3.33Å; L729-S732 WeakPolarHBondContact CA-OG 3.05Å; L729-S732 PolarHBondContact O-N 3.41Å; L729-S732 PolarHBondContact O-OG 2.88Å; L729-S732 VanDerWaalsContact O-OG 3.09Å; S732-K734 PolarHBondContact O-N 2.82Å; S732-K734 VanDerWaalsContact O-N 3.07Å; S732-S735 WeakPolarHBondContact O-CA 3.49Å; S732-S735 WeakPolarHBondContact O-CB 3.39Å; S732-S735 PolarHBondContact O-N 3.01Å; S732-S735 PolarHBondContact O-OG 3.47Å; S732-I736 PolarHBondContact O-N 3.35Å; S732-N839 WeakPolarHBondContact CB-ND2 3.29Å; S732-N839 WeakPolarHBondContact CB-OD1 3.22Å
733	L	71.5	Confident	69.9	Low	80 Å²	80	51.8 Å²	51.8	42%	0.419	29%	0.287	S	S	.	.	H	α-helix	trans	-50.8	-36.8	-179.9	-174.2	63.1	0	0	0	113.1	L729 L730 S735 I736 V737	L729-L733 WeakPolarHBondContact O-CB 3.36Å; L729-L733 PolarHBondContact O-N 3.49Å; L730-L733 HydrophobicContact CD2-CD2 4.4Å; L730-L733 WeakPolarHBondContact O-CB 3.3Å; L730-L733 PolarHBondContact O-N 2.91Å; L733-S735 VanDerWaalsContact C-N 3.3Å; L733-S735 PolarHBondContact O-N 2.93Å; L733-I736 PolarHBondContact O-N 2.89Å; L733-V737 HydrophobicContact CD1-CG2 3.95Å; L733-V737 HydrophobicContact CG-CG2 4.11Å; L733-V737 WeakPolarHBondContact O-CB 3.31Å; L733-V737 VanDerWaalsContact O-CG2 3.31Å; L733-V737 WeakPolarHBondContact O-CG2 3.44Å; L733-V737 PolarHBondContact O-N 3.3Å
734	K	69.3	Low	70.6	Confident	184 Å²	184	51.7 Å²	51.7	80%	0.8	29%	0.291	S	S	*	.	H	α-helix	trans	-62.4	-34.5	176.4	-176	174.3	179.6	176.3	0	113.2	S732	S732-K734 PolarHBondContact O-N 2.82Å; S732-K734 VanDerWaalsContact O-N 3.07Å
735	S	67.8	Low	71.2	Confident	44 Å²	44	50.3 Å²	50.3	31%	0.308	28%	0.283	S	S	.	.	H	α-helix	trans	-77.1	-40.9	174.3	70.5	0	0	0	0	111.6	S732 L733 S738 L739 I835	S732-S735 WeakPolarHBondContact O-CA 3.49Å; S732-S735 WeakPolarHBondContact O-CB 3.39Å; S732-S735 PolarHBondContact O-N 3.01Å; S732-S735 PolarHBondContact O-OG 3.47Å; L733-S735 VanDerWaalsContact C-N 3.3Å; L733-S735 PolarHBondContact O-N 2.93Å; S735-S738 WeakPolarHBondContact O-CB 3.06Å; S735-S738 PolarHBondContact O-N 3.35Å; S735-L739 PolarHBondContact O-N 3.05Å; S735-I835 WeakPolarHBondContact OG-CG2 3.37Å
736	I	73.1	Confident	72.1	Confident	12 Å²	12	51 Å²	51	6%	0.062	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-46.1	-180	-66.7	163.7	0	0	0	111.4	S732 L733 S738 L739 L740 F832 I835 F1286	S732-I736 PolarHBondContact O-N 3.35Å; L733-I736 PolarHBondContact O-N 2.89Å; I736-S738 VanDerWaalsContact C-N 3.26Å; I736-S738 PolarHBondContact O-N 2.87Å; I736-L739 CarbonylContact O-C 3.22Å; I736-L739 WeakPolarHBondContact O-CA 3.34Å; I736-L739 WeakPolarHBondContact O-CB 3.38Å; I736-L739 PolarHBondContact O-N 2.84Å; I736-L740 HydrophobicContact CG2-CD1 3.89Å; I736-L740 HydrophobicContact CG2-CG 4.16Å; I736-L740 WeakPolarHBondContact O-CG 3.44Å; I736-L740 PolarHBondContact O-N 2.85Å; I736-F832 HydrophobicContact CG1-CE2 4.25Å; I736-F832 HydrophobicContact CG2-CE2 3.92Å; I736-I835 HydrophobicContact CG1-CG2 4.39Å; I736-F1286 HydrophobicContact CD1-CD2 4.35Å; I736-F1286 HydrophobicContact CD1-CE2 3.62Å; I736-F1286 HydrophobicContact CD1-CZ 4.37Å
737	V	72.5	Confident	73.1	Confident	73 Å²	73	49 Å²	49	44%	0.442	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-37.6	176.5	169.4	0	0	0	0	111.3	L733 L739 L740 V741	L733-V737 HydrophobicContact CD1-CG2 3.95Å; L733-V737 HydrophobicContact CG-CG2 4.11Å; L733-V737 WeakPolarHBondContact O-CB 3.31Å; L733-V737 VanDerWaalsContact O-CG2 3.31Å; L733-V737 WeakPolarHBondContact O-CG2 3.44Å; L733-V737 PolarHBondContact O-N 3.3Å; V737-L739 VanDerWaalsContact C-N 3.27Å; V737-L739 PolarHBondContact O-N 3.25Å; V737-L740 PolarHBondContact O-N 2.99Å; V737-V741 WeakPolarHBondContact O-CG2 3.35Å; V737-V741 PolarHBondContact O-N 2.89Å
738	S	69.4	Low	74.1	Confident	22 Å²	22	48 Å²	48	15%	0.154	26%	0.258	C	S	.	.	H	α-helix	trans	-66.1	-28.8	174.9	-162.3	0	0	0	0	112.5	S293 L294 S735 I736	S293-S738 PolarHBondContact OG-OG 2.9Å; L294-S738 WeakPolarHBondContact CD2-O 3.02Å; L294-S738 WeakPolarHBondContact CD2-OG 3.26Å; S735-S738 WeakPolarHBondContact O-CB 3.06Å; S735-S738 PolarHBondContact O-N 3.35Å; I736-S738 VanDerWaalsContact C-N 3.26Å; I736-S738 PolarHBondContact O-N 2.87Å
739	L	71.9	Confident	75.1	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-79.4	-42.5	173.1	-172.4	152.7	0	0	0	112	S735 I736 V737 V741 L742 L743 V831 F832 I835	S735-L739 PolarHBondContact O-N 3.05Å; I736-L739 CarbonylContact O-C 3.22Å; I736-L739 WeakPolarHBondContact O-CA 3.34Å; I736-L739 WeakPolarHBondContact O-CB 3.38Å; I736-L739 PolarHBondContact O-N 2.84Å; V737-L739 VanDerWaalsContact C-N 3.27Å; V737-L739 PolarHBondContact O-N 3.25Å; L739-V741 PolarHBondContact O-N 2.96Å; L739-L742 CarbonylContact O-C 3.24Å; L739-L742 WeakPolarHBondContact O-CA 3.46Å; L739-L742 VanDerWaalsContact O-CB 3.31Å; L739-L742 WeakPolarHBondContact O-CB 3.41Å; L739-L742 PolarHBondContact O-N 3.35Å; L739-L743 HydrophobicContact CD2-CB 4.48Å; L739-L743 PolarHBondContact O-N 3.34Å; L739-V831 HydrophobicContact CD1-CB 3.8Å; L739-V831 HydrophobicContact CD1-CG1 3.49Å; L739-V831 VanDerWaalsContact CD1-CG1 3.49Å; L739-F832 HydrophobicContact CD1-CB 3.72Å; L739-F832 HydrophobicContact CD1-CD2 4.45Å; L739-F832 HydrophobicContact CD2-CB 3.87Å; L739-F832 HydrophobicContact CD2-CD2 4.2Å; L739-F832 HydrophobicContact CD2-CG 4.35Å; L739-F832 HydrophobicContact CG-CB 4.49Å; L739-I835 HydrophobicContact CD1-CD1 3.83Å
740	L	75.7	Confident	76.2	Confident	56 Å²	56	47.8 Å²	47.8	29%	0.293	26%	0.255	S	S	.	.	H	α-helix	trans	-59.6	-34.4	177.5	-69.4	174.3	0	0	0	111.7	I736 V737 L743 F744 I1281	I736-L740 HydrophobicContact CG2-CD1 3.89Å; I736-L740 HydrophobicContact CG2-CG 4.16Å; I736-L740 WeakPolarHBondContact O-CG 3.44Å; I736-L740 PolarHBondContact O-N 2.85Å; V737-L740 PolarHBondContact O-N 2.99Å; L740-L743 HydrophobicContact CD2-CD2 4.46Å; L740-F744 VanDerWaalsContact O-CB 3.24Å; L740-F744 WeakPolarHBondContact O-CB 3.04Å; L740-F744 PolarHBondContact O-N 3.09Å; L740-I1281 HydrophobicContact CD2-CG2 4.41Å
741	V	76	Confident	77.3	Confident	67 Å²	67	42.7 Å²	42.7	41%	0.406	23%	0.228	S	C	.	.	H	α-helix	trans	-66	-38.2	170.9	170.3	0	0	0	0	112.3	L294 V737 L739 L745	L294-V741 HydrophobicContact CD1-CG1 4.5Å; V737-V741 WeakPolarHBondContact O-CG2 3.35Å; V737-V741 PolarHBondContact O-N 2.89Å; L739-V741 PolarHBondContact O-N 2.96Å; V741-L745 VanDerWaalsContact O-CB 3.23Å; V741-L745 WeakPolarHBondContact O-CB 3.46Å; V741-L745 PolarHBondContact O-N 3.42Å
742	L	75.5	Confident	78.4	Confident	18 Å²	18	40.2 Å²	40.2	9%	0.094	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-46.4	175.2	-171	74.9	0	0	0	111.5	V288 L294 V297 I301 L739 L745 F746 L828	V288-L742 HydrophobicContact CG2-CD1 4.46Å; L294-L742 HydrophobicContact CD2-CB 4.26Å; L294-L742 HydrophobicContact CD2-CD1 4.46Å; V297-L742 HydrophobicContact CG1-CD2 4.11Å; I301-L742 HydrophobicContact CD1-CD2 4.39Å; L739-L742 CarbonylContact O-C 3.24Å; L739-L742 WeakPolarHBondContact O-CA 3.46Å; L739-L742 VanDerWaalsContact O-CB 3.31Å; L739-L742 WeakPolarHBondContact O-CB 3.41Å; L739-L742 PolarHBondContact O-N 3.35Å; L742-L745 PolarHBondContact O-N 3.06Å; L742-F746 WeakPolarHBondContact O-CB 3.1Å; L742-F746 PolarHBondContact O-N 2.82Å; L742-L828 HydrophobicContact CD2-CD2 4.1Å; L742-L828 HydrophobicContact CG-CD2 4.33Å
743	L	78.6	Confident	79.2	Confident	27 Å²	27	42.2 Å²	42.2	14%	0.141	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-47.2	176.9	171.2	58.8	0	0	0	111.1	L739 L740 L745 F746 I747 L828	L739-L743 HydrophobicContact CD2-CB 4.48Å; L739-L743 PolarHBondContact O-N 3.34Å; L740-L743 HydrophobicContact CD2-CD2 4.46Å; L743-L745 PolarHBondContact O-N 3.01Å; L743-F746 PolarHBondContact O-N 3.4Å; L743-I747 HydrophobicContact CD1-CD1 3.76Å; L743-I747 HydrophobicContact CD1-CG1 4.13Å; L743-I747 HydrophobicContact CG-CD1 3.84Å; L743-I747 VanDerWaalsContact O-CG1 3.24Å; L743-I747 WeakPolarHBondContact O-CG1 3.14Å; L743-I747 PolarHBondContact O-N 3.02Å; L743-L828 HydrophobicContact CD1-CB 4.04Å; L743-L828 HydrophobicContact CD1-CD1 3.62Å; L743-L828 HydrophobicContact CD1-CG 4.39Å
744	F	82.8	Confident	80	Confident	127 Å²	127	38.4 Å²	38.4	56%	0.557	20%	0.197	S	C	*	.	H	α-helix	trans	-62.6	-41.8	176.2	-177.6	-105.7	0	0	0	112.4	L740 F746 I747 V748	L740-F744 VanDerWaalsContact O-CB 3.24Å; L740-F744 WeakPolarHBondContact O-CB 3.04Å; L740-F744 PolarHBondContact O-N 3.09Å; F744-F746 VanDerWaalsContact C-N 3.33Å; F744-F746 PolarHBondContact O-N 3.36Å; F744-I747 PolarHBondContact O-N 2.86Å; F744-V748 HydrophobicContact CD1-CG2 4.2Å; F744-V748 HydrophobicContact CD2-CG2 4.48Å; F744-V748 HydrophobicContact CE1-CG2 3.79Å; F744-V748 HydrophobicContact CE2-CG2 4.09Å; F744-V748 HydrophobicContact CZ-CG2 3.73Å; F744-V748 WeakPolarHBondContact O-CB 3.12Å; F744-V748 VanDerWaalsContact O-CG2 3.28Å; F744-V748 WeakPolarHBondContact O-CG2 3.38Å; F744-V748 PolarHBondContact O-N 3.27Å
745	L	80.4	Confident	80.9	Confident	20 Å²	20	29.6 Å²	29.6	11%	0.105	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-41.1	175.6	-178.3	152.7	0	0	0	111.8	L285 L287 V288 V741 L742 L743 V748 I749	L285-L745 HydrophobicContact CD2-CD2 4.21Å; L287-L745 HydrophobicContact CB-CD1 3.89Å; L287-L745 HydrophobicContact CD1-CD1 4.13Å; V288-L745 HydrophobicContact CG2-CD1 4.16Å; V288-L745 HydrophobicContact CG2-CD2 4.31Å; V741-L745 VanDerWaalsContact O-CB 3.23Å; V741-L745 WeakPolarHBondContact O-CB 3.46Å; V741-L745 PolarHBondContact O-N 3.42Å; L742-L745 PolarHBondContact O-N 3.06Å; L743-L745 PolarHBondContact O-N 3.01Å; L745-V748 PolarHBondContact O-N 3.48Å; L745-I749 HydrophobicContact CD2-CD1 3.65Å; L745-I749 WeakPolarHBondContact O-CG1 3.5Å; L745-I749 PolarHBondContact O-N 3.48Å; L745-I749 VanDerWaalsContact O-N 3.08Å
746	F	84.2	Confident	81.5	Confident	31 Å²	31	29.2 Å²	29.2	14%	0.136	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-47.2	174.5	176.5	-84.2	0	0	0	112	L742 L743 F744 V748 I749 F750 L788 L820 C823 L828	L742-F746 WeakPolarHBondContact O-CB 3.1Å; L742-F746 PolarHBondContact O-N 2.82Å; L743-F746 PolarHBondContact O-N 3.4Å; F744-F746 VanDerWaalsContact C-N 3.33Å; F744-F746 PolarHBondContact O-N 3.36Å; F746-V748 VanDerWaalsContact C-N 3.31Å; F746-V748 PolarHBondContact O-N 2.92Å; F746-I749 PolarHBondContact O-N 3.49Å; F746-I749 VanDerWaalsContact O-N 3.15Å; F746-F750 HydrophobicContact CD1-CD2 4.19Å; F746-F750 HydrophobicContact CD2-CD2 4.15Å; F746-F750 HydrophobicContact CD2-CE2 4Å; F746-F750 AromaticContact CE1-CD2 3.74Å; F746-F750 HydrophobicContact CE1-CD2 3.74Å; F746-F750 HydrophobicContact CE1-CE2 4.08Å; F746-F750 HydrophobicContact CE1-CG 4.32Å; F746-F750 AromaticContact CE2-CD2 3.72Å; F746-F750 HydrophobicContact CE2-CD2 3.72Å; F746-F750 AromaticContact CE2-CE2 3.29Å; F746-F750 HydrophobicContact CE2-CE2 3.29Å; F746-F750 HydrophobicContact CE2-CZ 4.15Å; F746-F750 HydrophobicContact CG-CD2 4.35Å; F746-F750 AromaticContact CZ-CD2 3.47Å; F746-F750 HydrophobicContact CZ-CD2 3.47Å; F746-F750 VanDerWaalsContact CZ-CD2 3.47Å; F746-F750 AromaticContact CZ-CE2 3.31Å; F746-F750 HydrophobicContact CZ-CE2 3.31Å; F746-F750 HydrophobicContact CZ-CG 4.25Å; F746-F750 AromaticContact CZ-CZ 3.97Å; F746-F750 HydrophobicContact CZ-CZ 3.97Å; F746-F750 PolarHBondContact O-N 2.69Å; F746-L788 HydrophobicContact CE1-CD2 4.15Å; F746-L820 HydrophobicContact CE1-CD1 3.66Å; F746-L820 HydrophobicContact CZ-CD1 4.09Å; F746-C823 HydrophobicContact CE2-CB 3.72Å; F746-C823 HydrophobicContact CZ-CB 3.51Å; F746-L828 HydrophobicContact CB-CD1 3.72Å; F746-L828 HydrophobicContact CD1-CD1 3.4Å; F746-L828 VanDerWaalsContact CD1-CD1 3.4Å; F746-L828 HydrophobicContact CD2-CD1 4.02Å; F746-L828 HydrophobicContact CE1-CD1 4Å; F746-L828 HydrophobicContact CG-CD1 3.44Å; F746-L828 VanDerWaalsContact CG-CD1 3.44Å
747	I	87.8	Confident	82	Confident	15 Å²	15	30.7 Å²	30.7	8%	0.077	16%	0.16	C	C	.	.	H	α-helix	trans	-56.1	-45.9	175.7	-69.7	163.3	0	0	0	110.5	L743 F744 I749 F750 A751 L781 V784 F785 L788	L743-I747 HydrophobicContact CD1-CD1 3.76Å; L743-I747 HydrophobicContact CD1-CG1 4.13Å; L743-I747 HydrophobicContact CG-CD1 3.84Å; L743-I747 VanDerWaalsContact O-CG1 3.24Å; L743-I747 WeakPolarHBondContact O-CG1 3.14Å; L743-I747 PolarHBondContact O-N 3.02Å; F744-I747 PolarHBondContact O-N 2.86Å; I747-I749 PolarHBondContact O-N 3.31Å; I747-F750 PolarHBondContact O-N 3Å; I747-A751 WeakPolarHBondContact O-CB 3.25Å; I747-A751 PolarHBondContact O-N 3.42Å; I747-L781 HydrophobicContact CG2-CD2 3.65Å; I747-V784 HydrophobicContact CB-CG1 4.48Å; I747-V784 HydrophobicContact CG2-CG1 4.06Å; I747-F785 HydrophobicContact CD1-CD2 4.25Å; I747-L788 HydrophobicContact CD1-CD1 4.12Å; I747-L788 HydrophobicContact CG1-CD1 3.42Å; I747-L788 VanDerWaalsContact CG1-CD1 3.42Å
748	V	86.6	Confident	82.7	Confident	18 Å²	18	27.3 Å²	27.3	11%	0.109	14%	0.14	C	C	.	.	H	α-helix	trans	-62.2	-40	178.1	168.6	0	0	0	0	111.9	F744 L745 F746 L752 F777 L781	F744-V748 HydrophobicContact CD1-CG2 4.2Å; F744-V748 HydrophobicContact CD2-CG2 4.48Å; F744-V748 HydrophobicContact CE1-CG2 3.79Å; F744-V748 HydrophobicContact CE2-CG2 4.09Å; F744-V748 HydrophobicContact CZ-CG2 3.73Å; F744-V748 WeakPolarHBondContact O-CB 3.12Å; F744-V748 VanDerWaalsContact O-CG2 3.28Å; F744-V748 WeakPolarHBondContact O-CG2 3.38Å; F744-V748 PolarHBondContact O-N 3.27Å; L745-V748 PolarHBondContact O-N 3.48Å; F746-V748 VanDerWaalsContact C-N 3.31Å; F746-V748 PolarHBondContact O-N 2.92Å; V748-L752 HydrophobicContact CG1-CD1 3.93Å; V748-L752 HydrophobicContact CG1-CG 4.46Å; V748-L752 WeakPolarHBondContact O-CB 3.24Å; V748-L752 VanDerWaalsContact O-CG 3.27Å; V748-L752 WeakPolarHBondContact O-CG 3.33Å; V748-L752 PolarHBondContact O-N 2.88Å; V748-F777 HydrophobicContact CG1-CE2 4.31Å; V748-F777 HydrophobicContact CG1-CZ 4.26Å; V748-F777 HydrophobicContact CG2-CZ 4.24Å; V748-L781 HydrophobicContact CG2-CD2 3.96Å
749	I	86.3	Confident	83.5	Confident	15 Å²	15	26.8 Å²	26.8	8%	0.077	14%	0.138	C	C	.	.	H	α-helix	trans	-63.5	-49.2	176.5	-73.5	172.1	0	0	0	110.8	V281 P284 L285 L745 F746 I747 L753	V281-I749 HydrophobicContact CG1-CG2 4.3Å; V281-I749 WeakPolarHBondContact CG1-O 3.44Å; P284-I749 HydrophobicContact CG-CD1 4.39Å; P284-I749 HydrophobicContact CG-CG1 4.01Å; L285-I749 HydrophobicContact CD2-CD1 3.42Å; L285-I749 VanDerWaalsContact CD2-CD1 3.42Å; L285-I749 HydrophobicContact CG-CD1 3.68Å; L745-I749 HydrophobicContact CD2-CD1 3.65Å; L745-I749 WeakPolarHBondContact O-CG1 3.5Å; L745-I749 PolarHBondContact O-N 3.48Å; L745-I749 VanDerWaalsContact O-N 3.08Å; F746-I749 PolarHBondContact O-N 3.49Å; F746-I749 VanDerWaalsContact O-N 3.15Å; I747-I749 PolarHBondContact O-N 3.31Å; I749-L753 VanDerWaalsContact O-CB 3.3Å; I749-L753 WeakPolarHBondContact O-CB 3.43Å; I749-L753 PolarHBondContact O-N 3.36Å
750	F	89.4	Confident	84	Confident	22 Å²	22	26.7 Å²	26.7	10%	0.096	14%	0.138	C	C	.	.	H	α-helix	trans	-70.6	-35.4	-179.5	-84.9	-97.1	0	0	0	112.6	F746 I747 L753 G754 V784 Y816 I819 L820	F746-F750 HydrophobicContact CD1-CD2 4.19Å; F746-F750 HydrophobicContact CD2-CD2 4.15Å; F746-F750 HydrophobicContact CD2-CE2 4Å; F746-F750 AromaticContact CE1-CD2 3.74Å; F746-F750 HydrophobicContact CE1-CD2 3.74Å; F746-F750 HydrophobicContact CE1-CE2 4.08Å; F746-F750 HydrophobicContact CE1-CG 4.32Å; F746-F750 AromaticContact CE2-CD2 3.72Å; F746-F750 HydrophobicContact CE2-CD2 3.72Å; F746-F750 AromaticContact CE2-CE2 3.29Å; F746-F750 HydrophobicContact CE2-CE2 3.29Å; F746-F750 HydrophobicContact CE2-CZ 4.15Å; F746-F750 HydrophobicContact CG-CD2 4.35Å; F746-F750 AromaticContact CZ-CD2 3.47Å; F746-F750 HydrophobicContact CZ-CD2 3.47Å; F746-F750 VanDerWaalsContact CZ-CD2 3.47Å; F746-F750 AromaticContact CZ-CE2 3.31Å; F746-F750 HydrophobicContact CZ-CE2 3.31Å; F746-F750 HydrophobicContact CZ-CG 4.25Å; F746-F750 AromaticContact CZ-CZ 3.97Å; F746-F750 HydrophobicContact CZ-CZ 3.97Å; F746-F750 PolarHBondContact O-N 2.69Å; I747-F750 PolarHBondContact O-N 3Å; F750-L753 PolarHBondContact O-N 3.37Å; F750-G754 PolarHBondContact O-N 3.21Å; F750-V784 HydrophobicContact CB-CG1 4.07Å; F750-V784 HydrophobicContact CB-CG2 4.32Å; F750-Y816 HydrophobicContact CD1-CD2 4.39Å; F750-Y816 AromaticContact CD1-CE2 3.8Å; F750-Y816 HydrophobicContact CD1-CE2 3.8Å; F750-Y816 HydrophobicContact CE1-CE2 4.48Å; F750-Y816 PolarHBondContact O-OH 3.19Å; F750-I819 HydrophobicContact CE1-CG2 4.13Å; F750-I819 HydrophobicContact CZ-CG2 4Å; F750-L820 HydrophobicContact CB-CD1 3.96Å; F750-L820 HydrophobicContact CD1-CB 3.91Å; F750-L820 HydrophobicContact CD1-CD1 3.81Å; F750-L820 HydrophobicContact CD1-CD2 4.43Å; F750-L820 HydrophobicContact CD1-CG 4.26Å; F750-L820 HydrophobicContact CD2-CD1 4.45Å; F750-L820 HydrophobicContact CE1-CB 4.1Å; F750-L820 HydrophobicContact CE1-CD1 4.45Å; F750-L820 HydrophobicContact CG-CD1 3.81Å
751	A	90.6	Very high	84.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.3	-44.8	175.6	0	0	0	0	0	112.1	I747 M755 S780 L781 V784	I747-A751 WeakPolarHBondContact O-CB 3.25Å; I747-A751 PolarHBondContact O-N 3.42Å; A751-M755 VanDerWaalsContact O-CB 3.3Å; A751-M755 WeakPolarHBondContact O-CB 3.24Å; A751-M755 PolarHBondContact O-N 2.86Å; A751-S780 WeakPolarHBondContact O-CB 3.46Å; A751-L781 HydrophobicContact CB-CD2 3.71Å; A751-L781 HydrophobicContact CB-CG 4.11Å; A751-V784 HydrophobicContact CB-CB 4.49Å; A751-V784 HydrophobicContact CB-CG2 4.18Å
752	L	87.9	Confident	85	Confident	3 Å²	3	25 Å²	25	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-65.9	-37.4	174	-71.9	174.8	0	0	0	112	L191 V281 V748 M755 Q756 F777	L191-L752 HydrophobicContact CB-CD1 4.48Å; L191-L752 HydrophobicContact CB-CD2 4.24Å; V281-L752 HydrophobicContact CB-CB 4.43Å; V281-L752 HydrophobicContact CG1-CB 3.5Å; V281-L752 VanDerWaalsContact CG1-CB 3.5Å; V281-L752 HydrophobicContact CG1-CD1 4.16Å; V281-L752 HydrophobicContact CG1-CG 4.48Å; V281-L752 HydrophobicContact CG2-CB 3.99Å; V748-L752 HydrophobicContact CG1-CD1 3.93Å; V748-L752 HydrophobicContact CG1-CG 4.46Å; V748-L752 WeakPolarHBondContact O-CB 3.24Å; V748-L752 VanDerWaalsContact O-CG 3.27Å; V748-L752 WeakPolarHBondContact O-CG 3.33Å; V748-L752 PolarHBondContact O-N 2.88Å; L752-M755 HydrophobicContact CD2-CE 3.84Å; L752-M755 PolarHBondContact O-N 3.04Å; L752-Q756 WeakPolarHBondContact O-CG 3.42Å; L752-Q756 PolarHBondContact O-N 3.38Å; L752-Q756 VanDerWaalsContact O-N 3.1Å; L752-F777 HydrophobicContact CD2-CD2 3.66Å; L752-F777 HydrophobicContact CD2-CE2 3.83Å; L752-F777 HydrophobicContact CG-CD2 4.16Å; L752-F777 HydrophobicContact CG-CE2 3.89Å
753	L	86.4	Confident	85.5	Confident	46 Å²	46	27.4 Å²	27.4	24%	0.241	13%	0.134	C	C	.	.	H	α-helix	trans	-64.1	-49.6	175	178	60.3	0	0	0	111.5	A278 I749 F750 M755 Q756 L757 Y816	A278-L753 HydrophobicContact CB-CD1 3.79Å; I749-L753 VanDerWaalsContact O-CB 3.3Å; I749-L753 WeakPolarHBondContact O-CB 3.43Å; I749-L753 PolarHBondContact O-N 3.36Å; F750-L753 PolarHBondContact O-N 3.37Å; L753-M755 VanDerWaalsContact C-N 3.31Å; L753-M755 PolarHBondContact O-N 3.36Å; L753-Q756 PolarHBondContact O-N 3.02Å; L753-Q756 VanDerWaalsContact O-N 3.1Å; L753-L757 HydrophobicContact CD1-CD1 4.07Å; L753-L757 HydrophobicContact CD1-CG 4.31Å; L753-L757 HydrophobicContact CG-CD1 4.02Å; L753-L757 WeakPolarHBondContact O-CG 3.4Å; L753-L757 PolarHBondContact O-N 2.85Å; L753-Y816 HydrophobicContact CB-CE2 4.33Å; L753-Y816 HydrophobicContact CD2-CD2 4Å; L753-Y816 HydrophobicContact CD2-CE2 3.97Å; L753-Y816 HydrophobicContact CG-CD2 4.19Å; L753-Y816 HydrophobicContact CG-CE2 3.96Å
754	G	88.2	Confident	85.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-38.1	176	0	0	0	0	0	112.6	F750 Q756 L757 F758	F750-G754 PolarHBondContact O-N 3.21Å; G754-Q756 VanDerWaalsContact C-N 3.34Å; G754-Q756 PolarHBondContact O-N 3.5Å; G754-L757 PolarHBondContact O-N 3.11Å; G754-F758 PolarHBondContact O-N 3.08Å
755	M	87.7	Confident	85.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-34.2	173.4	-170.4	172.1	81.3	0	0	112.9	L191 I194 P196 A751 L752 L753 G759 F774 F777	L191-M755 WeakPolarHBondContact O-CE 3.31Å; I194-M755 WeakPolarHBondContact O-CE 3.48Å; P196-M755 HydrophobicContact CG-CG 3.73Å; A751-M755 VanDerWaalsContact O-CB 3.3Å; A751-M755 WeakPolarHBondContact O-CB 3.24Å; A751-M755 PolarHBondContact O-N 2.86Å; L752-M755 HydrophobicContact CD2-CE 3.84Å; L752-M755 PolarHBondContact O-N 3.04Å; L753-M755 VanDerWaalsContact C-N 3.31Å; L753-M755 PolarHBondContact O-N 3.36Å; M755-G759 WeakPolarHBondContact O-CA 3.4Å; M755-G759 PolarHBondContact O-N 3.19Å; M755-F774 WeakPolarHBondContact CG-O 3.42Å; M755-F777 HydrophobicContact SD-CB 4.08Å
756	Q	81.8	Confident	84.7	Confident	35 Å²	35	32.2 Å²	32.2	16%	0.164	16%	0.159	C	C	.	.	H	α-helix	trans	-79.2	-22	174.5	-65.6	-62	-68.4	0	0	113.7	A278 L752 L753 G754	A278-Q756 HydrophobicContact CB-CB 4.5Å; L752-Q756 WeakPolarHBondContact O-CG 3.42Å; L752-Q756 PolarHBondContact O-N 3.38Å; L752-Q756 VanDerWaalsContact O-N 3.1Å; L753-Q756 PolarHBondContact O-N 3.02Å; L753-Q756 VanDerWaalsContact O-N 3.1Å; G754-Q756 VanDerWaalsContact C-N 3.34Å; G754-Q756 PolarHBondContact O-N 3.5Å
757	L	82.3	Confident	84.1	Confident	44 Å²	44	32.4 Å²	32.4	23%	0.23	16%	0.161	C	C	.	.	H	α-helix	trans	-88.4	-51.1	177.9	-67.5	172.2	0	0	0	112.2	L753 G754 R761 Y804 Y816	L753-L757 HydrophobicContact CD1-CD1 4.07Å; L753-L757 HydrophobicContact CD1-CG 4.31Å; L753-L757 HydrophobicContact CG-CD1 4.02Å; L753-L757 WeakPolarHBondContact O-CG 3.4Å; L753-L757 PolarHBondContact O-N 2.85Å; G754-L757 PolarHBondContact O-N 3.11Å; L757-R761 WeakPolarHBondContact O-CD 3.44Å; L757-R761 PolarHBondContact O-NE 3.18Å; L757-Y804 PolarHBondContact O-OH 3.34Å; L757-Y816 HydrophobicContact CD1-CD2 3.87Å; L757-Y816 HydrophobicContact CD1-CE2 4.45Å; L757-Y816 HydrophobicContact CD1-CG 4.4Å
758	F	87.8	Confident	83.5	Confident	1 Å²	1	36.5 Å²	36.5	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-111.7	-16.8	-166.1	-46.4	-45.2	0	0	0	114.6	G754 G760 R761 F762 F774 Y804 V813 Y816 Y817	G754-F758 PolarHBondContact O-N 3.08Å; F758-G760 PolarHBondContact O-N 2.62Å; F758-R761 VanDerWaalsContact O-CB 3.31Å; F758-R761 WeakPolarHBondContact O-CB 3.28Å; F758-R761 PolarHBondContact O-N 3.35Å; F758-F762 HydrophobicContact CB-CD1 4.25Å; F758-F762 HydrophobicContact CB-CE1 3.69Å; F758-F762 HydrophobicContact CB-CZ 4.12Å; F758-F762 HydrophobicContact CG-CE1 4.11Å; F758-F762 HydrophobicContact CG-CZ 4.34Å; F758-F774 HydrophobicContact CB-CB 4.09Å; F758-F774 HydrophobicContact CB-CD2 4.01Å; F758-F774 HydrophobicContact CB-CG 4.21Å; F758-F774 HydrophobicContact CD2-CD1 4.38Å; F758-F774 AromaticContact CD2-CD2 3.7Å; F758-F774 HydrophobicContact CD2-CD2 3.7Å; F758-F774 HydrophobicContact CD2-CE1 4.42Å; F758-F774 AromaticContact CD2-CE2 3.75Å; F758-F774 HydrophobicContact CD2-CE2 3.75Å; F758-F774 HydrophobicContact CD2-CG 4.04Å; F758-F774 HydrophobicContact CD2-CZ 4.12Å; F758-F774 HydrophobicContact CE2-CE2 4.4Å; F758-F774 HydrophobicContact CE2-CZ 4.47Å; F758-F774 HydrophobicContact CG-CD2 4.3Å; F758-Y804 HydrophobicContact CD1-CE2 4.01Å; F758-Y804 HydrophobicContact CE1-CE2 4.03Å; F758-V813 HydrophobicContact CD1-CG1 4.4Å; F758-V813 HydrophobicContact CE1-CG1 3.28Å; F758-V813 HydrophobicContact CE1-CG2 4.49Å; F758-V813 HydrophobicContact CZ-CG1 3.45Å; F758-V813 VanDerWaalsContact CZ-CG1 3.45Å; F758-Y816 AromaticContact CE2-CD1 3.64Å; F758-Y816 HydrophobicContact CE2-CD1 3.64Å; F758-Y816 AromaticContact CE2-CE1 3.74Å; F758-Y816 HydrophobicContact CE2-CE1 3.74Å; F758-Y816 HydrophobicContact CE2-CG 4.07Å; F758-Y816 AromaticContact CZ-CD1 3.95Å; F758-Y816 HydrophobicContact CZ-CD1 3.95Å; F758-Y816 HydrophobicContact CZ-CE1 4.49Å; F758-Y816 HydrophobicContact CZ-CG 4.05Å; F758-Y817 AromaticContact CE2-CE2 3.95Å; F758-Y817 HydrophobicContact CE2-CE2 3.95Å; F758-Y817 AromaticContact CZ-CE2 3.88Å; F758-Y817 HydrophobicContact CZ-CE2 3.88Å
759	G	85.4	Confident	83.4	Confident	11 Å²	11	39.3 Å²	39.3	11%	0.113	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	128.3	-176.1	0	0	0	0	0	112.1	M755 R761 F774	M755-G759 WeakPolarHBondContact O-CA 3.4Å; M755-G759 PolarHBondContact O-N 3.19Å; G759-R761 PolarHBondContact O-N 3.32Å; G759-F774 WeakPolarHBondContact CA-O 3.46Å
760	G	82.2	Confident	83.4	Confident	4 Å²	4	39.3 Å²	39.3	4%	0.041	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	-8.1	-174.3	0	0	0	0	0	115	F758 N763 D775	F758-G760 PolarHBondContact O-N 2.62Å; G760-N763 PolarHBondContact O-ND2 3.14Å; G760-D775 PolarHBondContact N-OD1 3.49Å
761	R	85.7	Confident	83.4	Confident	89 Å²	89	42.1 Å²	42.1	34%	0.336	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-16.5	179.6	-53.6	-170.1	-171.6	-111.5	-10.8	113.9	D272 L757 F758 G759 N763	D272-R761 IonicContact OD2-CZ 3.01Å; D272-R761 IonicContact OD2-NH1 2.9Å; D272-R761 IonicContact OD2-NH2 2.64Å; D272-R761 PolarHBondContact OD2-NH2 2.79Å; L757-R761 WeakPolarHBondContact O-CD 3.44Å; L757-R761 PolarHBondContact O-NE 3.18Å; F758-R761 VanDerWaalsContact O-CB 3.31Å; F758-R761 WeakPolarHBondContact O-CB 3.28Å; F758-R761 PolarHBondContact O-N 3.35Å; G759-R761 PolarHBondContact O-N 3.32Å; R761-N763 PolarHBondContact O-N 3.32Å
762	F	88.5	Confident	83.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.203	C	C	.	.			trans	-83.3	44.8	178.8	-73.7	19.3	0	0	0	111.5	F758 P770 N773 F774 N799	F758-F762 HydrophobicContact CB-CD1 4.25Å; F758-F762 HydrophobicContact CB-CE1 3.69Å; F758-F762 HydrophobicContact CB-CZ 4.12Å; F758-F762 HydrophobicContact CG-CE1 4.11Å; F758-F762 HydrophobicContact CG-CZ 4.34Å; F762-P770 HydrophobicContact CB-CG 4.23Å; F762-P770 HydrophobicContact CD2-CG 4.06Å; F762-N773 HydrophobicContact CB-CB 4.14Å; F762-N773 HydrophobicContact CD2-CB 3.8Å; F762-N773 HydrophobicContact CG-CB 4.38Å; F762-F774 AromaticContact CE2-CD2 3.92Å; F762-F774 HydrophobicContact CE2-CD2 3.92Å; F762-F774 HydrophobicContact CE2-CE2 4.22Å; F762-F774 HydrophobicContact CZ-CD2 4.01Å; F762-F774 HydrophobicContact CZ-CE2 4.22Å; F762-N799 HydrophobicContact CD2-CB 4.37Å; F762-N799 HydrophobicContact CE2-CB 3.97Å; F762-N799 HydrophobicContact CZ-CB 4.14Å
763	N	84.4	Confident	83.5	Confident	68 Å²	68	42.6 Å²	42.6	36%	0.364	20%	0.204	S	C	.	.			trans	-114.1	78	171.5	-63.7	-45.2	0	0	0	106.7	G760 R761 K769	G760-N763 PolarHBondContact O-ND2 3.14Å; R761-N763 PolarHBondContact O-N 3.32Å; N763-K769 WeakPolarHBondContact OD1-CE 3.36Å; N763-K769 PolarHBondContact OD1-NZ 3.31Å
764	F	83.6	Confident	83.7	Confident	23 Å²	23	40.4 Å²	40.4	10%	0.101	19%	0.193	C	C	.	.			trans	-65.6	132.3	175	-58.6	-56.6	0	0	0	108.2	R766 E767 P770 N799 R802	F764-R766 PolarHBondContact O-N 2.89Å; F764-E767 HydrophobicContact CB-CB 4.29Å; F764-P770 HydrophobicContact CE2-CG 4.21Å; F764-N799 HydrophobicContact CE2-CB 4.22Å; F764-N799 WeakPolarHBondContact CE2-OD1 3.23Å; F764-N799 HydrophobicContact CZ-CB 4.15Å; F764-R802 HydrophobicContact CD1-CG 4.21Å; F764-R802 HydrophobicContact CE1-CB 3.98Å; F764-R802 HydrophobicContact CE1-CG 3.68Å; F764-R802 HydrophobicContact CZ-CB 4.16Å; F764-R802 HydrophobicContact CZ-CG 4.21Å
765	P	74.1	Confident	83.8	Confident	109 Å²	109	41.8 Å²	41.8	71%	0.708	20%	0.2	S	C	*	.	S	Bend	trans	-61.5	143.5	166.6	29.8	-33.3	0	0	0	106.6	E767	P765-E767 PolarHBondContact O-N 3.27Å; P765-E767 VanDerWaalsContact O-N 3.12Å
766	R	67.9	Low	83.8	Confident	142 Å²	142	43.1 Å²	43.1	54%	0.536	21%	0.21	S	C	.	.	S	Bend	trans	77.8	-75.8	-177.4	-54.1	169	160.6	-150	-15.4	110.8	F764 F2561 N2562	F764-R766 PolarHBondContact O-N 2.89Å; R766-F2561 WeakPolarHBondContact CA-O 3.49Å; R766-F2561 HydrophobicContact CB-CB 4.03Å; R766-F2561 WeakPolarHBondContact CB-O 3.24Å; R766-F2561 VanDerWaalsContact CD-CB 3.46Å; R766-F2561 HydrophobicContact CG-CB 3.58Å; R766-F2561 WeakPolarHBondContact CG-O 3.09Å; R766-F2561 VanDerWaalsContact NH1-CD2 3.35Å; R766-N2562 PolarHBondContact O-OD1 3.45Å
767	E	71.7	Confident	84.2	Confident	36 Å²	36	44.2 Å²	44.2	17%	0.168	21%	0.214	C	C	.	.	S	Bend	trans	-60.3	152.3	-167.5	-49.8	-166.1	-165.9	0	0	117.3	Y410 F764 P765 R802 N2455 Y2563	Y410-E767 PolarHBondContact OH-OE1 2.9Å; Y410-E767 PolarHBondContact OH-OE2 2.81Å; Y410-E767 VanDerWaalsContact OH-OE2 3.07Å; F764-E767 HydrophobicContact CB-CB 4.29Å; P765-E767 PolarHBondContact O-N 3.27Å; P765-E767 VanDerWaalsContact O-N 3.12Å; E767-R802 VanDerWaalsContact CD-NH2 3.26Å; E767-R802 IonicContact OE1-CZ 2.6Å; E767-R802 VanDerWaalsContact OE1-CZ 3.29Å; E767-R802 IonicContact OE1-NH1 3.33Å; E767-R802 PolarHBondContact OE1-NH1 2.88Å; E767-R802 VanDerWaalsContact OE1-NH1 3.16Å; E767-R802 IonicContact OE1-NH2 3.33Å; E767-R802 PolarHBondContact OE1-NH2 3.06Å; E767-R802 IonicContact OE2-CZ 2.9Å; E767-R802 IonicContact OE2-NH1 2.66Å; E767-R802 PolarHBondContact OE2-NH1 3.21Å; E767-R802 IonicContact OE2-NH2 3.31Å; E767-N2455 PolarHBondContact OE1-ND2 3.39Å; E767-Y2563 WeakPolarHBondContact CG-O 3.34Å; E767-Y2563 VanDerWaalsContact OE1-O 3.1Å
768	E	74.7	Confident	84.5	Confident	101 Å²	101	46.5 Å²	46.5	47%	0.472	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-60.1	143.6	172.5	-83.7	-159.3	-158.9	0	0	111.6	P770 I2447	E768-P770 WeakPolarHBondContact O-CD 3.4Å; E768-I2447 VanDerWaalsContact OE1-CG2 3.23Å; E768-I2447 WeakPolarHBondContact OE1-CG2 3.49Å
769	K	83.9	Confident	84.7	Confident	76 Å²	76	46.8 Å²	46.8	33%	0.33	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-70.1	119.9	-174.8	-179.7	165.1	-172.5	155.8	0	111.6	N763 R771 D775	N763-K769 WeakPolarHBondContact OD1-CE 3.36Å; N763-K769 PolarHBondContact OD1-NZ 3.31Å; K769-R771 PolarHBondContact O-N 3.04Å; K769-D775 VanDerWaalsContact CE-OD2 3.28Å; K769-D775 WeakPolarHBondContact CE-OD2 3.49Å; K769-D775 IonicContact NZ-OD2 2.75Å; K769-D775 PolarHBondContact NZ-OD2 3.46Å
770	P	87.8	Confident	85	Confident	15 Å²	15	46.3 Å²	46.3	10%	0.097	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-61.8	137.7	-178	24.6	-34.5	0	0	0	111.7	F762 F764 E768 S772 N773	F762-P770 HydrophobicContact CB-CG 4.23Å; F762-P770 HydrophobicContact CD2-CG 4.06Å; F764-P770 HydrophobicContact CE2-CG 4.21Å; E768-P770 WeakPolarHBondContact O-CD 3.4Å; P770-S772 VanDerWaalsContact C-N 3.34Å; P770-N773 PolarHBondContact O-ND2 3.37Å
771	R	88.6	Confident	85.5	Confident	82 Å²	82	47.8 Å²	47.8	31%	0.309	22%	0.223	S	C	.	.	S	Bend	trans	-67.2	-36.8	-179.5	-61.8	-58	-167.9	108.9	5.3	111.7	K769 N773 Q779 Y1252 D1256	K769-R771 PolarHBondContact O-N 3.04Å; R771-N773 PolarHBondContact O-N 3.41Å; R771-N773 PolarHBondContact O-ND2 3.1Å; R771-Q779 VanDerWaalsContact O-CD 3.28Å; R771-Q779 PolarHBondContact O-NE2 2.99Å; R771-Y1252 HydrophobicContact CB-CD1 4.01Å; R771-Y1252 HydrophobicContact CB-CD2 3.74Å; R771-Y1252 HydrophobicContact CB-CE1 4Å; R771-Y1252 HydrophobicContact CB-CE2 3.75Å; R771-Y1252 HydrophobicContact CB-CG 3.92Å; R771-Y1252 HydrophobicContact CG-CD2 4.29Å; R771-Y1252 HydrophobicContact CG-CG 4.23Å; R771-D1256 IonicContact CZ-OD2 3.55Å; R771-D1256 IonicContact NH1-OD1 2.71Å; R771-D1256 PolarHBondContact NH1-OD1 2.98Å; R771-D1256 VanDerWaalsContact NH1-OD1 3.16Å; R771-D1256 IonicContact NH1-OD2 2.74Å; R771-D1256 PolarHBondContact NH1-OD2 3.34Å; R771-D1256 IonicContact NH2-OD2 3.44Å; R771-D1256 PolarHBondContact NH2-OD2 3.3Å
772	S	89.2	Confident	85.8	Confident	4 Å²	4	44 Å²	44	3%	0.028	21%	0.209	C	C	.	.	S	Bend	trans	-73.8	44.8	176.9	48.3	0	0	0	0	113.7	P770 T783	P770-S772 VanDerWaalsContact C-N 3.34Å; S772-T783 VanDerWaalsContact O-CG2 3.25Å; S772-T783 WeakPolarHBondContact O-CG2 3.35Å
773	N	91.4	Very high	86	Confident	9 Å²	9	44 Å²	44	5%	0.048	21%	0.209	C	C	.	.			trans	-90.2	-174.8	-179.3	66.1	70.8	0	0	0	113.7	F762 P770 R771 D775 T783	F762-N773 HydrophobicContact CB-CB 4.14Å; F762-N773 HydrophobicContact CD2-CB 3.8Å; F762-N773 HydrophobicContact CG-CB 4.38Å; P770-N773 PolarHBondContact O-ND2 3.37Å; R771-N773 PolarHBondContact O-N 3.41Å; R771-N773 PolarHBondContact O-ND2 3.1Å; N773-D775 PolarHBondContact OD1-N 3.47Å; N773-T783 PolarHBondContact O-OG1 3.15Å
774	F	91.8	Very high	86.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.192	C	C	.	.			trans	-128.5	22.9	-175.7	-71.5	-92.7	0	0	0	112.9	M755 F758 G759 F762 S780 T783 V784 I787 Y816	M755-F774 WeakPolarHBondContact CG-O 3.42Å; F758-F774 HydrophobicContact CB-CB 4.09Å; F758-F774 HydrophobicContact CB-CD2 4.01Å; F758-F774 HydrophobicContact CB-CG 4.21Å; F758-F774 HydrophobicContact CD2-CD1 4.38Å; F758-F774 AromaticContact CD2-CD2 3.7Å; F758-F774 HydrophobicContact CD2-CD2 3.7Å; F758-F774 HydrophobicContact CD2-CE1 4.42Å; F758-F774 AromaticContact CD2-CE2 3.75Å; F758-F774 HydrophobicContact CD2-CE2 3.75Å; F758-F774 HydrophobicContact CD2-CG 4.04Å; F758-F774 HydrophobicContact CD2-CZ 4.12Å; F758-F774 HydrophobicContact CE2-CE2 4.4Å; F758-F774 HydrophobicContact CE2-CZ 4.47Å; F758-F774 HydrophobicContact CG-CD2 4.3Å; G759-F774 WeakPolarHBondContact CA-O 3.46Å; F762-F774 AromaticContact CE2-CD2 3.92Å; F762-F774 HydrophobicContact CE2-CD2 3.92Å; F762-F774 HydrophobicContact CE2-CE2 4.22Å; F762-F774 HydrophobicContact CZ-CD2 4.01Å; F762-F774 HydrophobicContact CZ-CE2 4.22Å; F774-S780 WeakPolarHBondContact CA-OG 3.4Å; F774-S780 PolarHBondContact O-OG 3.3Å; F774-T783 HydrophobicContact CD2-CG2 4.29Å; F774-T783 HydrophobicContact CE1-CG2 4.21Å; F774-T783 HydrophobicContact CE2-CG2 3.59Å; F774-T783 HydrophobicContact CZ-CG2 3.54Å; F774-V784 HydrophobicContact CE1-CG2 3.98Å; F774-I787 HydrophobicContact CZ-CD1 4.44Å; F774-Y816 HydrophobicContact CZ-CE1 4.28Å
775	D	89.5	Confident	86.7	Confident	28 Å²	28	40.6 Å²	40.6	15%	0.15	19%	0.191	C	C	.	.	S	Bend	trans	-83.3	-15.4	-168.2	-69.3	9.1	0	0	0	114.1	G760 K769 N773	G760-D775 PolarHBondContact N-OD1 3.49Å; K769-D775 VanDerWaalsContact CE-OD2 3.28Å; K769-D775 WeakPolarHBondContact CE-OD2 3.49Å; K769-D775 IonicContact NZ-OD2 2.75Å; K769-D775 PolarHBondContact NZ-OD2 3.46Å; N773-D775 PolarHBondContact OD1-N 3.47Å
776	S	88.5	Confident	87.5	Confident	29 Å²	29	35.6 Å²	35.6	20%	0.203	16%	0.158	C	C	.	.	S	Bend	trans	-140.9	144.5	175.3	71.1	0	0	0	0	110.1	Y778 Q779 S780	S776-Y778 VanDerWaalsContact C-N 3.26Å; S776-Y778 PolarHBondContact O-N 2.85Å; S776-Y778 VanDerWaalsContact O-N 3.13Å; S776-Y778 WeakPolarHBondContact OG-CD1 3.28Å; S776-Y778 VanDerWaalsContact OG-CE1 3.26Å; S776-Y778 WeakPolarHBondContact OG-CE1 3.37Å; S776-Q779 PolarHBondContact O-N 3.13Å; S776-S780 PolarHBondContact O-N 3.37Å; S776-S780 PolarHBondContact O-OG 3.13Å; S776-S780 VanDerWaalsContact O-OG 3.07Å
777	F	89.4	Confident	88.6	Confident	58 Å²	58	28.8 Å²	28.8	25%	0.254	13%	0.133	S	C	.	.	H	α-helix	trans	-53.9	-38.6	-173.6	174.9	-119.1	0	0	0	113.7	G192 V748 L752 M755 S780 L781	G192-F777 WeakPolarHBondContact O-CB 3.31Å; V748-F777 HydrophobicContact CG1-CE2 4.31Å; V748-F777 HydrophobicContact CG1-CZ 4.26Å; V748-F777 HydrophobicContact CG2-CZ 4.24Å; L752-F777 HydrophobicContact CD2-CD2 3.66Å; L752-F777 HydrophobicContact CD2-CE2 3.83Å; L752-F777 HydrophobicContact CG-CD2 4.16Å; L752-F777 HydrophobicContact CG-CE2 3.89Å; M755-F777 HydrophobicContact SD-CB 4.08Å; F777-S780 PolarHBondContact O-N 2.84Å; F777-L781 HydrophobicContact CD1-CD1 4.19Å; F777-L781 HydrophobicContact CD2-CG 4.33Å; F777-L781 HydrophobicContact CE1-CD1 3.76Å; F777-L781 HydrophobicContact CE1-CG 4.48Å; F777-L781 HydrophobicContact CE2-CD1 4.15Å; F777-L781 HydrophobicContact CE2-CD2 4Å; F777-L781 HydrophobicContact CE2-CG 4.01Å; F777-L781 HydrophobicContact CZ-CD1 3.75Å; F777-L781 HydrophobicContact CZ-CD2 4.1Å; F777-L781 HydrophobicContact CZ-CG 4.1Å; F777-L781 VanDerWaalsContact O-CG 3.25Å; F777-L781 WeakPolarHBondContact O-CG 3.42Å; F777-L781 PolarHBondContact O-N 2.88Å
778	Y	89.3	Confident	89.4	Confident	92 Å²	92	27.6 Å²	27.6	36%	0.361	13%	0.127	S	C	.	.	H	α-helix	trans	-68.4	-38.4	177.2	84.8	-95.5	0	0	0	112.4	S776 L781 I782 N1267 P1270	S776-Y778 VanDerWaalsContact C-N 3.26Å; S776-Y778 PolarHBondContact O-N 2.85Å; S776-Y778 VanDerWaalsContact O-N 3.13Å; S776-Y778 WeakPolarHBondContact OG-CD1 3.28Å; S776-Y778 VanDerWaalsContact OG-CE1 3.26Å; S776-Y778 WeakPolarHBondContact OG-CE1 3.37Å; Y778-L781 WeakPolarHBondContact O-CB 3.4Å; Y778-L781 PolarHBondContact O-N 3.18Å; Y778-I782 HydrophobicContact CD2-CD1 3.88Å; Y778-I782 HydrophobicContact CE2-CD1 4.26Å; Y778-I782 WeakPolarHBondContact O-CG1 3.2Å; Y778-I782 PolarHBondContact O-N 3.41Å; Y778-I782 VanDerWaalsContact O-N 3.11Å; Y778-N1267 PolarHBondContact OH-OD1 2.95Å; Y778-P1270 HydrophobicContact CD2-CB 4.26Å; Y778-P1270 HydrophobicContact CE2-CB 3.75Å
779	Q	91.5	Very high	89.9	Confident	7 Å²	7	23 Å²	23	3%	0.033	11%	0.106	C	C	.	.	H	α-helix	trans	-70.8	-39.7	176.2	-173.5	53.9	58.8	0	0	110.7	R771 S776 L781 I782 T783 Y1252	R771-Q779 VanDerWaalsContact O-CD 3.28Å; R771-Q779 PolarHBondContact O-NE2 2.99Å; S776-Q779 PolarHBondContact O-N 3.13Å; Q779-L781 VanDerWaalsContact C-N 3.29Å; Q779-L781 PolarHBondContact O-N 3.07Å; Q779-I782 PolarHBondContact O-N 3.03Å; Q779-I782 VanDerWaalsContact O-N 3.1Å; Q779-T783 PolarHBondContact NE2-OG1 2.82Å; Q779-T783 VanDerWaalsContact NE2-OG1 3.15Å; Q779-T783 WeakPolarHBondContact O-CB 3.27Å; Q779-T783 PolarHBondContact O-N 3.02Å; Q779-T783 PolarHBondContact O-OG1 3.38Å; Q779-Y1252 PolarHBondContact NE2-OH 3.34Å
780	S	92.2	Very high	90	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.1	-38	171.5	-49.4	0	0	0	0	112.3	A751 F774 S776 F777 V784	A751-S780 WeakPolarHBondContact O-CB 3.46Å; F774-S780 WeakPolarHBondContact CA-OG 3.4Å; F774-S780 PolarHBondContact O-OG 3.3Å; S776-S780 PolarHBondContact O-N 3.37Å; S776-S780 PolarHBondContact O-OG 3.13Å; S776-S780 VanDerWaalsContact O-OG 3.07Å; F777-S780 PolarHBondContact O-N 2.84Å; S780-V784 VanDerWaalsContact O-CB 3.3Å; S780-V784 WeakPolarHBondContact O-CB 3.32Å; S780-V784 VanDerWaalsContact O-CG2 3.27Å; S780-V784 WeakPolarHBondContact O-CG2 3.19Å; S780-V784 PolarHBondContact O-N 2.79Å
781	L	91.4	Very high	90	Very high	36 Å²	36	20.3 Å²	20.3	19%	0.188	10%	0.097	C	C	.	.	H	α-helix	trans	-64.3	-40.8	173.5	-71.8	171.3	0	0	0	111.8	I747 V748 A751 F777 Y778 Q779 F785	I747-L781 HydrophobicContact CG2-CD2 3.65Å; V748-L781 HydrophobicContact CG2-CD2 3.96Å; A751-L781 HydrophobicContact CB-CD2 3.71Å; A751-L781 HydrophobicContact CB-CG 4.11Å; F777-L781 HydrophobicContact CD1-CD1 4.19Å; F777-L781 HydrophobicContact CD2-CG 4.33Å; F777-L781 HydrophobicContact CE1-CD1 3.76Å; F777-L781 HydrophobicContact CE1-CG 4.48Å; F777-L781 HydrophobicContact CE2-CD1 4.15Å; F777-L781 HydrophobicContact CE2-CD2 4Å; F777-L781 HydrophobicContact CE2-CG 4.01Å; F777-L781 HydrophobicContact CZ-CD1 3.75Å; F777-L781 HydrophobicContact CZ-CD2 4.1Å; F777-L781 HydrophobicContact CZ-CG 4.1Å; F777-L781 VanDerWaalsContact O-CG 3.25Å; F777-L781 WeakPolarHBondContact O-CG 3.42Å; F777-L781 PolarHBondContact O-N 2.88Å; Y778-L781 WeakPolarHBondContact O-CB 3.4Å; Y778-L781 PolarHBondContact O-N 3.18Å; Q779-L781 VanDerWaalsContact C-N 3.29Å; Q779-L781 PolarHBondContact O-N 3.07Å; L781-F785 VanDerWaalsContact O-CB 3.28Å; L781-F785 WeakPolarHBondContact O-CB 3.45Å; L781-F785 PolarHBondContact O-N 3.36Å
782	I	92.1	Very high	89.9	Confident	9 Å²	9	17.8 Å²	17.8	5%	0.046	9%	0.09	C	C	.	.	H	α-helix	trans	-66.7	-51.2	176.9	-65.4	161.1	0	0	0	110.5	Y778 Q779 V784 F785 Q786 L1251 V1273	Y778-I782 HydrophobicContact CD2-CD1 3.88Å; Y778-I782 HydrophobicContact CE2-CD1 4.26Å; Y778-I782 WeakPolarHBondContact O-CG1 3.2Å; Y778-I782 PolarHBondContact O-N 3.41Å; Y778-I782 VanDerWaalsContact O-N 3.11Å; Q779-I782 PolarHBondContact O-N 3.03Å; Q779-I782 VanDerWaalsContact O-N 3.1Å; I782-V784 VanDerWaalsContact C-N 3.3Å; I782-V784 PolarHBondContact O-N 3.36Å; I782-F785 CarbonylContact O-C 3.56Å; I782-F785 WeakPolarHBondContact O-CA 3.2Å; I782-F785 PolarHBondContact O-N 3.43Å; I782-Q786 WeakPolarHBondContact O-CB 3.24Å; I782-Q786 PolarHBondContact O-N 3.45Å; I782-L1251 HydrophobicContact CG2-CD2 3.68Å; I782-V1273 HydrophobicContact CD1-CB 4.49Å; I782-V1273 HydrophobicContact CD1-CG1 4.18Å; I782-V1273 HydrophobicContact CD1-CG2 3.51Å; I782-V1273 HydrophobicContact CG1-CG1 3.9Å; I782-V1273 HydrophobicContact CG1-CG2 4.15Å
783	T	92.5	Very high	90	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.9	-38	179.9	-53.7	0	0	0	0	111.5	S772 N773 F774 Q779 Q786 I787	S772-T783 VanDerWaalsContact O-CG2 3.25Å; S772-T783 WeakPolarHBondContact O-CG2 3.35Å; N773-T783 PolarHBondContact O-OG1 3.15Å; F774-T783 HydrophobicContact CD2-CG2 4.29Å; F774-T783 HydrophobicContact CE1-CG2 4.21Å; F774-T783 HydrophobicContact CE2-CG2 3.59Å; F774-T783 HydrophobicContact CZ-CG2 3.54Å; Q779-T783 PolarHBondContact NE2-OG1 2.82Å; Q779-T783 VanDerWaalsContact NE2-OG1 3.15Å; Q779-T783 WeakPolarHBondContact O-CB 3.27Å; Q779-T783 PolarHBondContact O-N 3.02Å; Q779-T783 PolarHBondContact O-OG1 3.38Å; T783-Q786 PolarHBondContact O-N 3.22Å; T783-I787 HydrophobicContact CG2-CD1 4.48Å; T783-I787 WeakPolarHBondContact O-CD1 3.42Å; T783-I787 WeakPolarHBondContact O-CG1 3.11Å; T783-I787 PolarHBondContact O-N 3.45Å
784	V	93	Very high	90	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.9	-43	171.9	167	0	0	0	0	111.5	I747 F750 A751 F774 S780 I782 Q786 I787 L788 L820	I747-V784 HydrophobicContact CB-CG1 4.48Å; I747-V784 HydrophobicContact CG2-CG1 4.06Å; F750-V784 HydrophobicContact CB-CG1 4.07Å; F750-V784 HydrophobicContact CB-CG2 4.32Å; A751-V784 HydrophobicContact CB-CB 4.49Å; A751-V784 HydrophobicContact CB-CG2 4.18Å; F774-V784 HydrophobicContact CE1-CG2 3.98Å; S780-V784 VanDerWaalsContact O-CB 3.3Å; S780-V784 WeakPolarHBondContact O-CB 3.32Å; S780-V784 VanDerWaalsContact O-CG2 3.27Å; S780-V784 WeakPolarHBondContact O-CG2 3.19Å; S780-V784 PolarHBondContact O-N 2.79Å; I782-V784 VanDerWaalsContact C-N 3.3Å; I782-V784 PolarHBondContact O-N 3.36Å; V784-Q786 VanDerWaalsContact C-N 3.28Å; V784-Q786 PolarHBondContact O-N 3.12Å; V784-I787 PolarHBondContact O-N 3.18Å; V784-L788 HydrophobicContact CG1-CD1 3.74Å; V784-L788 HydrophobicContact CG1-CG 4.38Å; V784-L788 WeakPolarHBondContact O-CB 3.26Å; V784-L788 WeakPolarHBondContact O-CD1 3.38Å; V784-L788 WeakPolarHBondContact O-CG 3.4Å; V784-L788 PolarHBondContact O-N 3.23Å; V784-L820 HydrophobicContact CB-CD2 4.37Å; V784-L820 HydrophobicContact CG1-CD1 4.07Å; V784-L820 HydrophobicContact CG1-CD2 4.07Å; V784-L820 HydrophobicContact CG2-CD2 4Å
785	F	89.9	Confident	89.8	Confident	19 Å²	19	21.2 Å²	21.2	8%	0.083	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-34	175.7	-174.5	-99.7	0	0	0	112.6	I747 L781 I782 L788 T789 W1247 V1277 I1280 F1285	I747-F785 HydrophobicContact CD1-CD2 4.25Å; L781-F785 VanDerWaalsContact O-CB 3.28Å; L781-F785 WeakPolarHBondContact O-CB 3.45Å; L781-F785 PolarHBondContact O-N 3.36Å; I782-F785 CarbonylContact O-C 3.56Å; I782-F785 WeakPolarHBondContact O-CA 3.2Å; I782-F785 PolarHBondContact O-N 3.43Å; F785-L788 CarbonylContact O-C 3.56Å; F785-L788 WeakPolarHBondContact O-CA 3.02Å; F785-L788 WeakPolarHBondContact O-CB 3.49Å; F785-L788 PolarHBondContact O-N 2.78Å; F785-T789 HydrophobicContact CD1-CG2 4.44Å; F785-T789 HydrophobicContact CE1-CG2 4.07Å; F785-T789 HydrophobicContact CZ-CG2 4.34Å; F785-T789 PolarHBondContact O-N 3.29Å; F785-T789 PolarHBondContact O-OG1 2.69Å; F785-W1247 AromaticContact CD1-CH2 3.62Å; F785-W1247 HydrophobicContact CD1-CH2 3.62Å; F785-W1247 AromaticContact CD1-CZ2 4Å; F785-W1247 HydrophobicContact CD1-CZ2 4Å; F785-W1247 AromaticContact CE1-CH2 3.9Å; F785-W1247 HydrophobicContact CE1-CH2 3.9Å; F785-W1247 HydrophobicContact CE1-CZ2 4.17Å; F785-V1277 HydrophobicContact CD1-CG2 4.19Å; F785-V1277 HydrophobicContact CE1-CG2 3.95Å; F785-V1277 HydrophobicContact CE2-CG1 4.42Å; F785-V1277 HydrophobicContact CZ-CG1 4.21Å; F785-V1277 HydrophobicContact CZ-CG2 4.34Å; F785-I1280 HydrophobicContact CE1-CD1 4.16Å; F785-I1280 HydrophobicContact CE1-CG2 4.31Å; F785-I1280 HydrophobicContact CZ-CG2 3.81Å; F785-F1285 HydrophobicContact CZ-CE2 4.44Å
786	Q	91.8	Very high	89.8	Confident	4 Å²	4	19.9 Å²	19.9	2%	0.019	10%	0.099	C	C	.	.	H	α-helix	trans	-61.6	-49.3	172.9	177.5	177	-11.8	0	0	112.2	I782 T783 V784 L788 T789 S790 E791 W1247 P1248	I782-Q786 WeakPolarHBondContact O-CB 3.24Å; I782-Q786 PolarHBondContact O-N 3.45Å; T783-Q786 PolarHBondContact O-N 3.22Å; V784-Q786 VanDerWaalsContact C-N 3.28Å; V784-Q786 PolarHBondContact O-N 3.12Å; Q786-L788 PolarHBondContact O-N 3.2Å; Q786-T789 WeakPolarHBondContact CA-OG1 3.27Å; Q786-T789 PolarHBondContact O-N 3.29Å; Q786-T789 PolarHBondContact O-OG1 2.94Å; Q786-S790 PolarHBondContact O-N 3.49Å; Q786-E791 VanDerWaalsContact CG-O 3.27Å; Q786-E791 WeakPolarHBondContact CG-O 3.32Å; Q786-W1247 HydrophobicContact CB-CZ2 4.31Å; Q786-P1248 HydrophobicContact CG-CB 4.5Å; Q786-P1248 HydrophobicContact CG-CG 3.88Å
787	I	91.1	Very high	90	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.1	-31.6	174.5	-61.3	160.2	0	0	0	111.2	F774 T783 V784 T789 S790 W793 A796 Y817 L820 F821	F774-I787 HydrophobicContact CZ-CD1 4.44Å; T783-I787 HydrophobicContact CG2-CD1 4.48Å; T783-I787 WeakPolarHBondContact O-CD1 3.42Å; T783-I787 WeakPolarHBondContact O-CG1 3.11Å; T783-I787 PolarHBondContact O-N 3.45Å; V784-I787 PolarHBondContact O-N 3.18Å; I787-T789 VanDerWaalsContact C-N 3.33Å; I787-S790 PolarHBondContact O-N 3.1Å; I787-W793 HydrophobicContact CB-CB 4.28Å; I787-W793 HydrophobicContact CG1-CB 4.07Å; I787-W793 HydrophobicContact CG2-CB 4.13Å; I787-A796 HydrophobicContact CD1-CB 4.42Å; I787-A796 HydrophobicContact CG1-CB 4.46Å; I787-Y817 HydrophobicContact CD1-CD1 3.84Å; I787-Y817 HydrophobicContact CD1-CE1 3.77Å; I787-L820 HydrophobicContact CB-CD2 3.93Å; I787-L820 HydrophobicContact CB-CG 4.35Å; I787-L820 HydrophobicContact CD1-CD2 3.77Å; I787-L820 HydrophobicContact CG1-CD2 4.47Å; I787-L820 HydrophobicContact CG2-CB 4.35Å; I787-L820 HydrophobicContact CG2-CD2 3.74Å; I787-L820 HydrophobicContact CG2-CG 3.75Å; I787-F821 HydrophobicContact CG2-CB 4.48Å
788	L	87.8	Confident	90.1	Very high	10 Å²	10	16.4 Å²	16.4	5%	0.052	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-5.5	175.6	-64.7	170.9	0	0	0	115.1	F746 I747 V784 F785 Q786 L820 N825	F746-L788 HydrophobicContact CE1-CD2 4.15Å; I747-L788 HydrophobicContact CD1-CD1 4.12Å; I747-L788 HydrophobicContact CG1-CD1 3.42Å; I747-L788 VanDerWaalsContact CG1-CD1 3.42Å; V784-L788 HydrophobicContact CG1-CD1 3.74Å; V784-L788 HydrophobicContact CG1-CG 4.38Å; V784-L788 WeakPolarHBondContact O-CB 3.26Å; V784-L788 WeakPolarHBondContact O-CD1 3.38Å; V784-L788 WeakPolarHBondContact O-CG 3.4Å; V784-L788 PolarHBondContact O-N 3.23Å; F785-L788 CarbonylContact O-C 3.56Å; F785-L788 WeakPolarHBondContact O-CA 3.02Å; F785-L788 WeakPolarHBondContact O-CB 3.49Å; F785-L788 PolarHBondContact O-N 2.78Å; Q786-L788 PolarHBondContact O-N 3.2Å; L788-L820 HydrophobicContact CD1-CD1 4.4Å; L788-L820 HydrophobicContact CD2-CD1 3.75Å; L788-L820 HydrophobicContact CD2-CG 4.47Å; L788-L820 HydrophobicContact CG-CD1 4.07Å; L788-N825 VanDerWaalsContact C-OD1 3.31Å; L788-N825 VanDerWaalsContact CA-OD1 3.31Å; L788-N825 WeakPolarHBondContact CA-OD1 3.27Å; L788-N825 PolarHBondContact O-OD1 3.46Å
789	T	85.7	Confident	90.1	Very high	4 Å²	4	12.5 Å²	12.5	3%	0.025	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	3.8	165.4	50.2	0	0	0	0	112.3	F785 Q786 I787 E791 F1244 W1247	F785-T789 HydrophobicContact CD1-CG2 4.44Å; F785-T789 HydrophobicContact CE1-CG2 4.07Å; F785-T789 HydrophobicContact CZ-CG2 4.34Å; F785-T789 PolarHBondContact O-N 3.29Å; F785-T789 PolarHBondContact O-OG1 2.69Å; Q786-T789 WeakPolarHBondContact CA-OG1 3.27Å; Q786-T789 PolarHBondContact O-N 3.29Å; Q786-T789 PolarHBondContact O-OG1 2.94Å; I787-T789 VanDerWaalsContact C-N 3.33Å; T789-E791 PolarHBondContact O-N 3.13Å; T789-F1244 HydrophobicContact CG2-CD2 3.81Å; T789-F1244 HydrophobicContact CG2-CE2 3.62Å; T789-F1244 HydrophobicContact CG2-CG 4.37Å; T789-F1244 HydrophobicContact CG2-CZ 4.07Å; T789-W1247 HydrophobicContact CG2-CZ2 4.1Å; T789-W1247 WeakPolarHBondContact OG1-CZ2 3.47Å; T789-W1247 PolarHBondContact OG1-NE1 2.88Å
790	S	86	Confident	90	Very high	35 Å²	35	12.2 Å²	12.2	25%	0.245	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	19.4	-175.4	41.2	0	0	0	0	115.7	Q786 I787	Q786-S790 PolarHBondContact O-N 3.49Å; I787-S790 PolarHBondContact O-N 3.1Å
791	E	87.1	Confident	89.9	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.066	C	C	.	.	S	Bend	trans	-100.8	128.4	-177.4	165.2	89.8	128.2	0	0	110.5	Q786 T789 W793 F1244 E1245 G1246 W1247 P1248 F2463	Q786-E791 VanDerWaalsContact CG-O 3.27Å; Q786-E791 WeakPolarHBondContact CG-O 3.32Å; T789-E791 PolarHBondContact O-N 3.13Å; E791-W793 PolarHBondContact O-N 3.38Å; E791-F1244 VanDerWaalsContact OE1-C 3.3Å; E791-E1245 PolarHBondContact OE1-N 2.86Å; E791-G1246 WeakPolarHBondContact OE1-CA 3.38Å; E791-G1246 PolarHBondContact OE1-N 3.01Å; E791-W1247 VanDerWaalsContact OE1-CD1 3.31Å; E791-W1247 PolarHBondContact OE1-N 3.48Å; E791-W1247 VanDerWaalsContact OE1-N 3.14Å; E791-P1248 HydrophobicContact CG-CG 3.49Å; E791-P1248 VanDerWaalsContact CG-CG 3.49Å; E791-P1248 WeakPolarHBondContact OE1-CD 3.49Å; E791-F2463 VanDerWaalsContact OE2-CA 3.28Å; E791-F2463 WeakPolarHBondContact OE2-CA 3.5Å; E791-F2463 VanDerWaalsContact OE2-CB 3.23Å; E791-F2463 WeakPolarHBondContact OE2-CB 3.35Å; E791-F2463 PolarHBondContact OE2-N 3.48Å
792	D	87	Confident	89.7	Confident	30 Å²	30	14.2 Å²	14.2	16%	0.16	7%	0.069	C	C	.	.	S	Bend	trans	50.8	23.8	174.4	-67	-36.4	0	0	0	113.6	E432 N794 E795 A796	E432-D792 PolarHBondContact OE2-N 3.43Å; D792-N794 WeakPolarHBondContact CA-OD1 3.14Å; D792-N794 PolarHBondContact O-N 2.81Å; D792-N794 PolarHBondContact O-OD1 2.76Å; D792-E795 PolarHBondContact O-N 2.95Å; D792-A796 PolarHBondContact O-N 2.69Å
793	W	91.3	Very high	89.4	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-72.1	-23.3	-175	75.7	-93.3	0	0	0	112.2	F426 Q427 T430 E432 I787 E791 M797 F821	F426-W793 HydrophobicContact CD1-CH2 4Å; F426-W793 AromaticContact CE1-CH2 3.72Å; F426-W793 HydrophobicContact CE1-CH2 3.72Å; F426-W793 HydrophobicContact CE1-CZ2 4.25Å; F426-W793 HydrophobicContact CE1-CZ3 4.44Å; Q427-W793 HydrophobicContact CB-CH2 4.34Å; Q427-W793 HydrophobicContact CB-CZ2 4.37Å; Q427-W793 HydrophobicContact CG-CZ2 4.26Å; T430-W793 HydrophobicContact CG2-CZ2 3.66Å; T430-W793 WeakPolarHBondContact OG1-CZ2 3.45Å; T430-W793 PolarHBondContact OG1-NE1 3.37Å; E432-W793 VanDerWaalsContact CB-NE1 3.26Å; E432-W793 HydrophobicContact CG-CG 4.45Å; I787-W793 HydrophobicContact CB-CB 4.28Å; I787-W793 HydrophobicContact CG1-CB 4.07Å; I787-W793 HydrophobicContact CG2-CB 4.13Å; E791-W793 PolarHBondContact O-N 3.38Å; W793-M797 HydrophobicContact CE3-CB 4.46Å; W793-M797 HydrophobicContact CZ3-CB 4.46Å; W793-M797 HydrophobicContact CZ3-CE 4.13Å; W793-M797 HydrophobicContact CZ3-SD 3.8Å; W793-M797 WeakPolarHBondContact O-CB 3.33Å; W793-M797 PolarHBondContact O-N 2.73Å; W793-F821 AromaticContact CD1-CD2 3.83Å; W793-F821 AromaticContact CD1-CE2 3.7Å; W793-F821 AromaticContact CD2-CD2 3.9Å; W793-F821 HydrophobicContact CD2-CD2 3.9Å; W793-F821 HydrophobicContact CD2-CE2 4.37Å; W793-F821 AromaticContact CE2-CD2 3.84Å; W793-F821 AromaticContact CE2-CE2 3.92Å; W793-F821 AromaticContact CG-CD2 3.94Å; W793-F821 HydrophobicContact CG-CD2 3.94Å; W793-F821 HydrophobicContact CG-CE2 4.27Å; W793-F821 AromaticContact NE1-CD2 3.72Å; W793-F821 AromaticContact NE1-CE2 3.41Å
794	N	90.9	Very high	89	Confident	5 Å²	5	16.9 Å²	16.9	3%	0.027	8%	0.082	C	C	.	.	H	α-helix	trans	-60.4	-48.7	170.1	53.6	-5.7	0	0	0	111.7	Q427 E432 D792 M797 Y798	Q427-N794 HydrophobicContact CG-CB 4.48Å; E432-N794 HydrophobicContact CG-CB 3.93Å; E432-N794 VanDerWaalsContact CG-CG 3.46Å; E432-N794 WeakPolarHBondContact CG-ND2 3.29Å; E432-N794 PolarHBondContact OE1-ND2 3.01Å; D792-N794 WeakPolarHBondContact CA-OD1 3.14Å; D792-N794 PolarHBondContact O-N 2.81Å; D792-N794 PolarHBondContact O-OD1 2.76Å; N794-M797 CarbonylContact O-C 3.29Å; N794-M797 WeakPolarHBondContact O-CB 3.36Å; N794-M797 PolarHBondContact O-N 3.16Å; N794-M797 VanDerWaalsContact O-N 3.14Å; N794-Y798 HydrophobicContact CB-CE1 4.43Å; N794-Y798 HydrophobicContact CB-CE2 4.1Å; N794-Y798 VanDerWaalsContact O-CD1 3.28Å; N794-Y798 WeakPolarHBondContact O-CD1 3.46Å; N794-Y798 WeakPolarHBondContact O-CD2 3.23Å; N794-Y798 PolarHBondContact O-N 2.76Å
795	E	88.9	Confident	87.8	Confident	80 Å²	80	22.8 Å²	22.8	37%	0.374	12%	0.124	S	C	.	.	H	α-helix	trans	-63.7	-45.6	178.6	-161.9	-129	126.5	0	0	110.8	D792 M797 Y798 N799	D792-E795 PolarHBondContact O-N 2.95Å; E795-M797 PolarHBondContact O-N 3.28Å; E795-Y798 PolarHBondContact O-N 3.39Å; E795-Y798 VanDerWaalsContact O-N 3.12Å; E795-N799 PolarHBondContact O-N 3.28Å; E795-N799 PolarHBondContact O-ND2 2.75Å; E795-N799 PolarHBondContact OE1-ND2 3.17Å
796	A	89.4	Confident	86.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.4	-36.2	173.8	0	0	0	0	0	112.3	I787 D792 G800 Y817	I787-A796 HydrophobicContact CD1-CB 4.42Å; I787-A796 HydrophobicContact CG1-CB 4.46Å; D792-A796 PolarHBondContact O-N 2.69Å; A796-G800 PolarHBondContact O-N 2.97Å; A796-Y817 VanDerWaalsContact C-CE1 3.42Å; A796-Y817 HydrophobicContact CB-CE1 3.97Å; A796-Y817 VanDerWaalsContact O-CE1 3.3Å; A796-Y817 WeakPolarHBondContact O-CE1 3.07Å; A796-Y817 PolarHBondContact O-OH 2.93Å
797	M	92.1	Very high	85.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-70.9	-41.4	173.9	-179.3	-173.7	65.2	0	0	112.4	L423 W793 N794 E795 G800 I801 C814 Y817	L423-M797 HydrophobicContact CD1-CE 4.27Å; L423-M797 HydrophobicContact CD1-SD 3.92Å; L423-M797 HydrophobicContact CD2-CE 4.2Å; L423-M797 HydrophobicContact CD2-SD 4.31Å; L423-M797 HydrophobicContact CG-CE 4.27Å; L423-M797 HydrophobicContact CG-SD 4.46Å; W793-M797 HydrophobicContact CE3-CB 4.46Å; W793-M797 HydrophobicContact CZ3-CB 4.46Å; W793-M797 HydrophobicContact CZ3-CE 4.13Å; W793-M797 HydrophobicContact CZ3-SD 3.8Å; W793-M797 WeakPolarHBondContact O-CB 3.33Å; W793-M797 PolarHBondContact O-N 2.73Å; N794-M797 CarbonylContact O-C 3.29Å; N794-M797 WeakPolarHBondContact O-CB 3.36Å; N794-M797 PolarHBondContact O-N 3.16Å; N794-M797 VanDerWaalsContact O-N 3.14Å; E795-M797 PolarHBondContact O-N 3.28Å; M797-G800 WeakPolarHBondContact O-CA 3.29Å; M797-G800 PolarHBondContact O-N 2.96Å; M797-I801 HydrophobicContact CG-CD1 3.85Å; M797-I801 HydrophobicContact CG-CG1 4.39Å; M797-I801 WeakPolarHBondContact O-CG1 3.3Å; M797-I801 PolarHBondContact O-N 2.94Å; M797-I801 HydrophobicContact SD-CD1 4.35Å; M797-C814 HydrophobicContact CG-CB 4.45Å; M797-C814 HydrophobicContact SD-CB 3.98Å; M797-Y817 HydrophobicContact CB-CD1 3.84Å; M797-Y817 HydrophobicContact CB-CD2 4.21Å; M797-Y817 HydrophobicContact CB-CE1 4.29Å; M797-Y817 HydrophobicContact CB-CG 3.79Å; M797-Y817 HydrophobicContact CG-CD2 4.06Å; M797-Y817 HydrophobicContact CG-CG 3.95Å
798	Y	90.9	Very high	84.6	Confident	13 Å²	13	41.6 Å²	41.6	5%	0.051	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-47.2	177.9	-54.7	-30.9	0	0	0	110.8	N409 I412 T413 Q427 N794 E795 G800 I801 R802	N409-Y798 HydrophobicContact CB-CD2 4.1Å; N409-Y798 HydrophobicContact CB-CE1 4.45Å; N409-Y798 HydrophobicContact CB-CE2 4.06Å; N409-Y798 HydrophobicContact CB-CG 4.35Å; N409-Y798 WeakPolarHBondContact ND2-CE2 3.29Å; N409-Y798 PolarHBondContact ND2-OH 2.76Å; I412-Y798 HydrophobicContact CB-CD1 4.31Å; I412-Y798 HydrophobicContact CD1-CD1 4.01Å; I412-Y798 HydrophobicContact CD1-CG 4.34Å; I412-Y798 HydrophobicContact CG2-CD1 3.97Å; I412-Y798 HydrophobicContact CG2-CE1 4.17Å; T413-Y798 HydrophobicContact CG2-CE1 3.78Å; T413-Y798 VanDerWaalsContact CG2-OH 3.25Å; T413-Y798 WeakPolarHBondContact CG2-OH 3.35Å; Q427-Y798 VanDerWaalsContact CD-OH 3.23Å; Q427-Y798 PolarHBondContact NE2-OH 2.83Å; Q427-Y798 PolarHBondContact OE1-OH 3.28Å; N794-Y798 HydrophobicContact CB-CE1 4.43Å; N794-Y798 HydrophobicContact CB-CE2 4.1Å; N794-Y798 VanDerWaalsContact O-CD1 3.28Å; N794-Y798 WeakPolarHBondContact O-CD1 3.46Å; N794-Y798 WeakPolarHBondContact O-CD2 3.23Å; N794-Y798 PolarHBondContact O-N 2.76Å; E795-Y798 PolarHBondContact O-N 3.39Å; E795-Y798 VanDerWaalsContact O-N 3.12Å; Y798-G800 VanDerWaalsContact C-N 3.31Å; Y798-G800 PolarHBondContact O-N 2.95Å; Y798-I801 PolarHBondContact O-N 3.2Å; Y798-R802 VanDerWaalsContact O-CB 3.22Å; Y798-R802 WeakPolarHBondContact O-CB 3.39Å; Y798-R802 PolarHBondContact O-N 3.4Å
799	N	90	Very high	83.8	Confident	11 Å²	11	45 Å²	45	6%	0.059	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-41.3	173.8	-70.4	-35.6	0	0	0	111.5	F762 F764 E795 R802 S803	F762-N799 HydrophobicContact CD2-CB 4.37Å; F762-N799 HydrophobicContact CE2-CB 3.97Å; F762-N799 HydrophobicContact CZ-CB 4.14Å; F764-N799 HydrophobicContact CE2-CB 4.22Å; F764-N799 WeakPolarHBondContact CE2-OD1 3.23Å; F764-N799 HydrophobicContact CZ-CB 4.15Å; E795-N799 PolarHBondContact O-N 3.28Å; E795-N799 PolarHBondContact O-ND2 2.75Å; E795-N799 PolarHBondContact OE1-ND2 3.17Å; N799-R802 PolarHBondContact O-N 3.02Å; N799-S803 WeakPolarHBondContact O-CB 3.29Å; N799-S803 PolarHBondContact O-N 3.19Å
800	G	89.3	Confident	83.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-55.3	-53.3	172.4	0	0	0	0	0	113.5	A796 M797 Y798 S803	A796-G800 PolarHBondContact O-N 2.97Å; M797-G800 WeakPolarHBondContact O-CA 3.29Å; M797-G800 PolarHBondContact O-N 2.96Å; Y798-G800 VanDerWaalsContact C-N 3.31Å; Y798-G800 PolarHBondContact O-N 2.95Å; G800-S803 PolarHBondContact O-N 3.12Å; G800-S803 PolarHBondContact O-OG 2.81Å
801	I	89.7	Confident	83	Confident	11 Å²	11	44.3 Å²	44.3	6%	0.056	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-45.4	179.2	-68.3	165.9	0	0	0	110.8	I412 L423 M797 Y798 S803 Y804 I811 C814	I412-I801 HydrophobicContact CD1-CB 3.98Å; I412-I801 HydrophobicContact CD1-CD1 4.19Å; I412-I801 HydrophobicContact CD1-CG2 3.87Å; I412-I801 HydrophobicContact CG1-CG2 4.23Å; I412-I801 HydrophobicContact CG2-CD1 3.94Å; L423-I801 HydrophobicContact CD2-CD1 4.26Å; M797-I801 HydrophobicContact CG-CD1 3.85Å; M797-I801 HydrophobicContact CG-CG1 4.39Å; M797-I801 WeakPolarHBondContact O-CG1 3.3Å; M797-I801 PolarHBondContact O-N 2.94Å; M797-I801 HydrophobicContact SD-CD1 4.35Å; Y798-I801 PolarHBondContact O-N 3.2Å; I801-S803 VanDerWaalsContact C-N 3.31Å; I801-S803 PolarHBondContact O-N 2.91Å; I801-Y804 PolarHBondContact O-N 3.08Å; I801-I811 HydrophobicContact CG2-CG1 4.5Å; I801-C814 HydrophobicContact CD1-CB 4.11Å
802	R	86.5	Confident	82.8	Confident	67 Å²	67	47.1 Å²	47.1	25%	0.253	24%	0.243	S	C	.	.	H	α-helix	trans	-65.5	-30.3	-177.5	-172.5	-176.4	178.5	-164.3	7.3	113.4	Y410 F764 E767 Y798 N799 Y804	Y410-R802 VanDerWaalsContact CZ-NH1 3.35Å; Y410-R802 PolarHBondContact OH-NH1 2.61Å; Y410-R802 VanDerWaalsContact OH-NH1 3.15Å; F764-R802 HydrophobicContact CD1-CG 4.21Å; F764-R802 HydrophobicContact CE1-CB 3.98Å; F764-R802 HydrophobicContact CE1-CG 3.68Å; F764-R802 HydrophobicContact CZ-CB 4.16Å; F764-R802 HydrophobicContact CZ-CG 4.21Å; E767-R802 VanDerWaalsContact CD-NH2 3.26Å; E767-R802 IonicContact OE1-CZ 2.6Å; E767-R802 VanDerWaalsContact OE1-CZ 3.29Å; E767-R802 IonicContact OE1-NH1 3.33Å; E767-R802 PolarHBondContact OE1-NH1 2.88Å; E767-R802 VanDerWaalsContact OE1-NH1 3.16Å; E767-R802 IonicContact OE1-NH2 3.33Å; E767-R802 PolarHBondContact OE1-NH2 3.06Å; E767-R802 IonicContact OE2-CZ 2.9Å; E767-R802 IonicContact OE2-NH1 2.66Å; E767-R802 PolarHBondContact OE2-NH1 3.21Å; E767-R802 IonicContact OE2-NH2 3.31Å; Y798-R802 VanDerWaalsContact O-CB 3.22Å; Y798-R802 WeakPolarHBondContact O-CB 3.39Å; Y798-R802 PolarHBondContact O-N 3.4Å; N799-R802 PolarHBondContact O-N 3.02Å; R802-Y804 PolarHBondContact O-N 2.94Å
803	S	86.3	Confident	82.8	Confident	20 Å²	20	46.5 Å²	46.5	14%	0.14	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-6.9	178.2	75	0	0	0	0	114.6	N799 G800 I801	N799-S803 WeakPolarHBondContact O-CB 3.29Å; N799-S803 PolarHBondContact O-N 3.19Å; G800-S803 PolarHBondContact O-N 3.12Å; G800-S803 PolarHBondContact O-OG 2.81Å; I801-S803 VanDerWaalsContact C-N 3.31Å; I801-S803 PolarHBondContact O-N 2.91Å
804	Y	84.5	Confident	82.6	Confident	45 Å²	45	47 Å²	47	18%	0.176	24%	0.244	C	C	.	.			trans	-113.1	101.2	174.7	-72.3	-103.6	0	0	0	111.3	L757 F758 I801 R802 N806 V809 V813	L757-Y804 PolarHBondContact O-OH 3.34Å; F758-Y804 HydrophobicContact CD1-CE2 4.01Å; F758-Y804 HydrophobicContact CE1-CE2 4.03Å; I801-Y804 PolarHBondContact O-N 3.08Å; R802-Y804 PolarHBondContact O-N 2.94Å; Y804-N806 CarbonylContact O-C 3.6Å; Y804-N806 PolarHBondContact O-N 3.39Å; Y804-V809 HydrophobicContact CD1-CG1 4.44Å; Y804-V813 HydrophobicContact CD2-CG2 3.62Å; Y804-V813 HydrophobicContact CE2-CG2 3.54Å; Y804-V813 HydrophobicContact CG-CG2 4.2Å
805	S	68.5	Low	82.5	Confident	125 Å²	125	48.3 Å²	48.3	87%	0.874	25%	0.25	S	S	*	.	S	Bend	trans	-46.2	-37.2	177.5	170	0	0	0	0	114.4	S807	S805-S807 PolarHBondContact O-N 3.33Å
806	N	66.8	Low	82.5	Confident	122 Å²	122	45.4 Å²	45.4	65%	0.652	24%	0.236	S	C	*	.	S	Bend	trans	-78.1	86.1	172	-82	-43.7	0	0	0	111	Y804 R808 V809 G810	Y804-N806 CarbonylContact O-C 3.6Å; Y804-N806 PolarHBondContact O-N 3.39Å; N806-R808 PolarHBondContact O-N 2.65Å; N806-V809 HydrophobicContact CB-CB 4.29Å; N806-V809 HydrophobicContact CB-CG2 4.21Å; N806-V809 WeakPolarHBondContact O-CA 2.98Å; N806-V809 WeakPolarHBondContact O-CB 3.45Å; N806-V809 PolarHBondContact O-N 3.28Å; N806-G810 PolarHBondContact O-N 3.31Å
807	S	66.6	Low	82.7	Confident	78 Å²	78	45.4 Å²	45.4	55%	0.545	24%	0.236	S	C	.	.	H	α-helix	trans	-39.7	-44.5	179.8	168.2	0	0	0	0	114.9	S805 V809 G810 I811	S805-S807 PolarHBondContact O-N 3.33Å; S807-V809 VanDerWaalsContact C-N 3.28Å; S807-V809 PolarHBondContact O-N 3.02Å; S807-G810 PolarHBondContact O-N 3.19Å; S807-G810 VanDerWaalsContact O-N 3.16Å; S807-I811 WeakPolarHBondContact O-CG1 3.4Å; S807-I811 PolarHBondContact O-N 3.38Å
808	R	71.4	Confident	82.5	Confident	217 Å²	217	46.6 Å²	46.6	82%	0.819	24%	0.243	S	C	*	.	H	α-helix	trans	-61.8	-31.3	178	-66.8	-174	-176.9	-179.8	1.9	114.2	N806	N806-R808 PolarHBondContact O-N 2.65Å
809	V	72.2	Confident	82.4	Confident	81 Å²	81	48.2 Å²	48.2	49%	0.491	25%	0.253	S	S	.	.	H	α-helix	trans	-85	-38.9	173.7	-177.5	0	0	0	0	109.8	Y804 N806 S807 I811 M812	Y804-V809 HydrophobicContact CD1-CG1 4.44Å; N806-V809 HydrophobicContact CB-CB 4.29Å; N806-V809 HydrophobicContact CB-CG2 4.21Å; N806-V809 WeakPolarHBondContact O-CA 2.98Å; N806-V809 WeakPolarHBondContact O-CB 3.45Å; N806-V809 PolarHBondContact O-N 3.28Å; S807-V809 VanDerWaalsContact C-N 3.28Å; S807-V809 PolarHBondContact O-N 3.02Å; V809-I811 VanDerWaalsContact C-N 3.32Å; V809-I811 PolarHBondContact O-N 3.15Å; V809-M812 VanDerWaalsContact O-CB 3.27Å; V809-M812 WeakPolarHBondContact O-CB 3.38Å; V809-M812 PolarHBondContact O-N 2.65Å
810	G	74.9	Confident	82.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-56.6	-40.2	174.5	0	0	0	0	0	113.3	N806 S807 M812 V813	N806-G810 PolarHBondContact O-N 3.31Å; S807-G810 PolarHBondContact O-N 3.19Å; S807-G810 VanDerWaalsContact O-N 3.16Å; G810-M812 PolarHBondContact O-N 3.25Å; G810-V813 WeakPolarHBondContact O-CB 3.49Å; G810-V813 VanDerWaalsContact O-CG2 3.3Å; G810-V813 WeakPolarHBondContact O-CG2 3.46Å; G810-V813 PolarHBondContact O-N 2.62Å
811	I	80	Confident	82.2	Confident	25 Å²	25	48.1 Å²	48.1	13%	0.128	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-64.7	-28.8	176.7	-62.4	158.3	0	0	0	111.6	L420 I801 S807 V809 V813 C814 M2480	L420-I811 HydrophobicContact CD2-CD1 4.12Å; L420-I811 HydrophobicContact CD2-CG1 4.32Å; L420-I811 HydrophobicContact CD2-CG2 4.31Å; I801-I811 HydrophobicContact CG2-CG1 4.5Å; S807-I811 WeakPolarHBondContact O-CG1 3.4Å; S807-I811 PolarHBondContact O-N 3.38Å; V809-I811 VanDerWaalsContact C-N 3.32Å; V809-I811 PolarHBondContact O-N 3.15Å; I811-V813 PolarHBondContact O-N 2.84Å; I811-C814 WeakPolarHBondContact O-CB 3.44Å; I811-C814 PolarHBondContact O-N 2.66Å; I811-C814 VanDerWaalsContact O-N 3.15Å; I811-C814 PolarHBondContact O-SG 3.22Å; I811-M2480 HydrophobicContact CB-CE 3.92Å; I811-M2480 HydrophobicContact CB-SD 4.45Å; I811-M2480 HydrophobicContact CG2-CE 3.59Å; I811-M2480 HydrophobicContact CG2-SD 3.47Å; I811-M2480 WeakPolarHBondContact CG2-SD 3.28Å
812	M	82.8	Confident	81.9	Confident	60 Å²	60	48.7 Å²	48.7	30%	0.296	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-64.9	-21.7	174.8	-52.9	-58.7	177	0	0	112.7	V809 G810 C814 L815 M2480	V809-M812 VanDerWaalsContact O-CB 3.27Å; V809-M812 WeakPolarHBondContact O-CB 3.38Å; V809-M812 PolarHBondContact O-N 2.65Å; G810-M812 PolarHBondContact O-N 3.25Å; M812-C814 PolarHBondContact O-N 2.94Å; M812-L815 WeakPolarHBondContact O-CB 3.5Å; M812-L815 WeakPolarHBondContact O-CG 3.32Å; M812-L815 PolarHBondContact O-N 3.26Å; M812-M2480 HydrophobicContact CE-CB 4.11Å; M812-M2480 HydrophobicContact CE-CE 3.6Å; M812-M2480 HydrophobicContact SD-CB 3.7Å; M812-M2480 HydrophobicContact SD-CE 4.02Å
813	V	85.9	Confident	81.6	Confident	16 Å²	16	46.7 Å²	46.7	10%	0.097	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-64.2	-27.5	176.1	178.8	0	0	0	0	111.8	F758 Y804 G810 I811 L815 Y816 Y817	F758-V813 HydrophobicContact CD1-CG1 4.4Å; F758-V813 HydrophobicContact CE1-CG1 3.28Å; F758-V813 HydrophobicContact CE1-CG2 4.49Å; F758-V813 HydrophobicContact CZ-CG1 3.45Å; F758-V813 VanDerWaalsContact CZ-CG1 3.45Å; Y804-V813 HydrophobicContact CD2-CG2 3.62Å; Y804-V813 HydrophobicContact CE2-CG2 3.54Å; Y804-V813 HydrophobicContact CG-CG2 4.2Å; G810-V813 WeakPolarHBondContact O-CB 3.49Å; G810-V813 VanDerWaalsContact O-CG2 3.3Å; G810-V813 WeakPolarHBondContact O-CG2 3.46Å; G810-V813 PolarHBondContact O-N 2.62Å; I811-V813 PolarHBondContact O-N 2.84Å; V813-L815 PolarHBondContact O-N 3.29Å; V813-Y816 WeakPolarHBondContact O-CB 3.45Å; V813-Y816 PolarHBondContact O-N 2.89Å; V813-Y817 HydrophobicContact CG1-CD2 4.36Å; V813-Y817 HydrophobicContact CG1-CE2 3.91Å
814	C	87.8	Confident	81.1	Confident	12 Å²	12	46 Å²	46	8%	0.081	25%	0.246	C	C	.	.	H	α-helix	trans	-56.6	-26.2	176.9	82.9	0	0	0	0	111.8	L423 M797 I801 I811 M812 Y816 Y817 V818	L423-C814 HydrophobicContact CD1-CB 4.06Å; L423-C814 HydrophobicContact CD2-CB 4.09Å; M797-C814 HydrophobicContact CG-CB 4.45Å; M797-C814 HydrophobicContact SD-CB 3.98Å; I801-C814 HydrophobicContact CD1-CB 4.11Å; I811-C814 WeakPolarHBondContact O-CB 3.44Å; I811-C814 PolarHBondContact O-N 2.66Å; I811-C814 VanDerWaalsContact O-N 3.15Å; I811-C814 PolarHBondContact O-SG 3.22Å; M812-C814 PolarHBondContact O-N 2.94Å; C814-Y816 VanDerWaalsContact C-N 3.28Å; C814-Y816 PolarHBondContact O-N 3.35Å; C814-Y817 PolarHBondContact O-N 3.31Å; C814-Y817 VanDerWaalsContact O-N 3.09Å; C814-V818 WeakPolarHBondContact O-CG2 3.1Å; C814-V818 PolarHBondContact O-N 2.62Å
815	L	87.2	Confident	80.4	Confident	32 Å²	32	44.4 Å²	44.4	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-28.4	176.9	-55.3	-177.2	0	0	0	112.8	M812 V813 I819 T2478	M812-L815 WeakPolarHBondContact O-CB 3.5Å; M812-L815 WeakPolarHBondContact O-CG 3.32Å; M812-L815 PolarHBondContact O-N 3.26Å; V813-L815 PolarHBondContact O-N 3.29Å; L815-I819 WeakPolarHBondContact O-CB 3.26Å; L815-I819 WeakPolarHBondContact O-CD1 3.43Å; L815-I819 WeakPolarHBondContact O-CG1 3.21Å; L815-I819 PolarHBondContact O-N 2.68Å; L815-T2478 HydrophobicContact CD1-CG2 4.23Å
816	Y	90.8	Very high	80.2	Confident	19 Å²	19	39.3 Å²	39.3	8%	0.075	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-46	170.1	168.7	-87.6	0	0	0	111	F750 L753 L757 F758 F774 V813 C814 I819 L820	F750-Y816 HydrophobicContact CD1-CD2 4.39Å; F750-Y816 AromaticContact CD1-CE2 3.8Å; F750-Y816 HydrophobicContact CD1-CE2 3.8Å; F750-Y816 HydrophobicContact CE1-CE2 4.48Å; F750-Y816 PolarHBondContact O-OH 3.19Å; L753-Y816 HydrophobicContact CB-CE2 4.33Å; L753-Y816 HydrophobicContact CD2-CD2 4Å; L753-Y816 HydrophobicContact CD2-CE2 3.97Å; L753-Y816 HydrophobicContact CG-CD2 4.19Å; L753-Y816 HydrophobicContact CG-CE2 3.96Å; L757-Y816 HydrophobicContact CD1-CD2 3.87Å; L757-Y816 HydrophobicContact CD1-CE2 4.45Å; L757-Y816 HydrophobicContact CD1-CG 4.4Å; F758-Y816 AromaticContact CE2-CD1 3.64Å; F758-Y816 HydrophobicContact CE2-CD1 3.64Å; F758-Y816 AromaticContact CE2-CE1 3.74Å; F758-Y816 HydrophobicContact CE2-CE1 3.74Å; F758-Y816 HydrophobicContact CE2-CG 4.07Å; F758-Y816 AromaticContact CZ-CD1 3.95Å; F758-Y816 HydrophobicContact CZ-CD1 3.95Å; F758-Y816 HydrophobicContact CZ-CE1 4.49Å; F758-Y816 HydrophobicContact CZ-CG 4.05Å; F774-Y816 HydrophobicContact CZ-CE1 4.28Å; V813-Y816 WeakPolarHBondContact O-CB 3.45Å; V813-Y816 PolarHBondContact O-N 2.89Å; C814-Y816 VanDerWaalsContact C-N 3.28Å; C814-Y816 PolarHBondContact O-N 3.35Å; Y816-I819 PolarHBondContact O-N 3.47Å; Y816-L820 HydrophobicContact CE1-CD2 4.09Å; Y816-L820 WeakPolarHBondContact O-CB 3.14Å; Y816-L820 PolarHBondContact O-N 2.78Å
817	Y	92	Very high	79.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-44.6	-177.8	-67.7	-94.3	0	0	0	111.7	F758 I787 A796 M797 V813 C814 I819 L820 F821	F758-Y817 AromaticContact CE2-CE2 3.95Å; F758-Y817 HydrophobicContact CE2-CE2 3.95Å; F758-Y817 AromaticContact CZ-CE2 3.88Å; F758-Y817 HydrophobicContact CZ-CE2 3.88Å; I787-Y817 HydrophobicContact CD1-CD1 3.84Å; I787-Y817 HydrophobicContact CD1-CE1 3.77Å; A796-Y817 VanDerWaalsContact C-CE1 3.42Å; A796-Y817 HydrophobicContact CB-CE1 3.97Å; A796-Y817 VanDerWaalsContact O-CE1 3.3Å; A796-Y817 WeakPolarHBondContact O-CE1 3.07Å; A796-Y817 PolarHBondContact O-OH 2.93Å; M797-Y817 HydrophobicContact CB-CD1 3.84Å; M797-Y817 HydrophobicContact CB-CD2 4.21Å; M797-Y817 HydrophobicContact CB-CE1 4.29Å; M797-Y817 HydrophobicContact CB-CG 3.79Å; M797-Y817 HydrophobicContact CG-CD2 4.06Å; M797-Y817 HydrophobicContact CG-CG 3.95Å; V813-Y817 HydrophobicContact CG1-CD2 4.36Å; V813-Y817 HydrophobicContact CG1-CE2 3.91Å; C814-Y817 PolarHBondContact O-N 3.31Å; C814-Y817 VanDerWaalsContact O-N 3.09Å; Y817-I819 VanDerWaalsContact C-N 3.29Å; Y817-I819 PolarHBondContact O-N 2.93Å; Y817-L820 PolarHBondContact O-N 2.88Å; Y817-F821 VanDerWaalsContact O-CB 3.23Å; Y817-F821 WeakPolarHBondContact O-CB 3.27Å; Y817-F821 PolarHBondContact O-N 3.46Å
818	V	88.3	Confident	79.6	Confident	25 Å²	25	31.4 Å²	31.4	15%	0.152	15%	0.154	C	C	.	.	H	α-helix	trans	-60.3	-40.3	171.7	175.5	0	0	0	0	110.5	L423 F426 C814 I822 I2475	L423-V818 HydrophobicContact CD1-CG2 4.45Å; F426-V818 HydrophobicContact CD1-CG2 4.12Å; F426-V818 HydrophobicContact CE1-CB 4.49Å; F426-V818 HydrophobicContact CE1-CG1 4.4Å; F426-V818 HydrophobicContact CE1-CG2 3.82Å; F426-V818 HydrophobicContact CZ-CG1 4.15Å; F426-V818 HydrophobicContact CZ-CG2 4.39Å; C814-V818 WeakPolarHBondContact O-CG2 3.1Å; C814-V818 PolarHBondContact O-N 2.62Å; V818-I822 HydrophobicContact CG1-CD1 3.94Å; V818-I822 WeakPolarHBondContact O-CG1 3.11Å; V818-I822 PolarHBondContact O-N 3.33Å; V818-I2475 WeakPolarHBondContact O-CD1 3.38Å
819	I	88.3	Confident	79	Confident	47 Å²	47	22.9 Å²	22.9	24%	0.241	12%	0.124	C	C	.	.	H	α-helix	trans	-71.3	-34	178.8	-69.6	167.7	0	0	0	112.4	F750 L815 Y816 Y817 C823 I2475 T2478	F750-I819 HydrophobicContact CE1-CG2 4.13Å; F750-I819 HydrophobicContact CZ-CG2 4Å; L815-I819 WeakPolarHBondContact O-CB 3.26Å; L815-I819 WeakPolarHBondContact O-CD1 3.43Å; L815-I819 WeakPolarHBondContact O-CG1 3.21Å; L815-I819 PolarHBondContact O-N 2.68Å; Y816-I819 PolarHBondContact O-N 3.47Å; Y817-I819 VanDerWaalsContact C-N 3.29Å; Y817-I819 PolarHBondContact O-N 2.93Å; I819-C823 VanDerWaalsContact O-CB 3.32Å; I819-C823 WeakPolarHBondContact O-CB 3.32Å; I819-C823 PolarHBondContact O-N 2.95Å; I819-I2475 VanDerWaalsContact CA-CD1 3.42Å; I819-I2475 HydrophobicContact CB-CD1 4.26Å; I819-I2475 HydrophobicContact CG1-CD1 4.39Å; I819-I2475 HydrophobicContact CG2-CD1 4.35Å; I819-I2475 WeakPolarHBondContact O-CD1 3.34Å; I819-T2478 HydrophobicContact CD1-CG2 3.95Å
820	L	90	Very high	78.4	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-73.5	-50.4	176	176.2	54.1	0	0	0	112.1	F746 F750 V784 I787 L788 Y816 Y817 I822 C823 G824	F746-L820 HydrophobicContact CE1-CD1 3.66Å; F746-L820 HydrophobicContact CZ-CD1 4.09Å; F750-L820 HydrophobicContact CB-CD1 3.96Å; F750-L820 HydrophobicContact CD1-CB 3.91Å; F750-L820 HydrophobicContact CD1-CD1 3.81Å; F750-L820 HydrophobicContact CD1-CD2 4.43Å; F750-L820 HydrophobicContact CD1-CG 4.26Å; F750-L820 HydrophobicContact CD2-CD1 4.45Å; F750-L820 HydrophobicContact CE1-CB 4.1Å; F750-L820 HydrophobicContact CE1-CD1 4.45Å; F750-L820 HydrophobicContact CG-CD1 3.81Å; V784-L820 HydrophobicContact CB-CD2 4.37Å; V784-L820 HydrophobicContact CG1-CD1 4.07Å; V784-L820 HydrophobicContact CG1-CD2 4.07Å; V784-L820 HydrophobicContact CG2-CD2 4Å; I787-L820 HydrophobicContact CB-CD2 3.93Å; I787-L820 HydrophobicContact CB-CG 4.35Å; I787-L820 HydrophobicContact CD1-CD2 3.77Å; I787-L820 HydrophobicContact CG1-CD2 4.47Å; I787-L820 HydrophobicContact CG2-CB 4.35Å; I787-L820 HydrophobicContact CG2-CD2 3.74Å; I787-L820 HydrophobicContact CG2-CG 3.75Å; L788-L820 HydrophobicContact CD1-CD1 4.4Å; L788-L820 HydrophobicContact CD2-CD1 3.75Å; L788-L820 HydrophobicContact CD2-CG 4.47Å; L788-L820 HydrophobicContact CG-CD1 4.07Å; Y816-L820 HydrophobicContact CE1-CD2 4.09Å; Y816-L820 WeakPolarHBondContact O-CB 3.14Å; Y816-L820 PolarHBondContact O-N 2.78Å; Y817-L820 PolarHBondContact O-N 2.88Å; L820-I822 PolarHBondContact O-N 3.17Å; L820-C823 PolarHBondContact O-N 2.84Å; L820-G824 PolarHBondContact O-N 2.74Å
821	F	86.4	Confident	77.8	Confident	8 Å²	8	19.3 Å²	19.3	4%	0.035	10%	0.102	C	C	.	.	H	α-helix	trans	-55.3	-52.3	-175.6	177.6	-87	0	0	0	111.3	F426 T430 I787 W793 Y817 N825 Y826	F426-F821 HydrophobicContact CZ-CD1 4.06Å; T430-F821 VanDerWaalsContact CB-CZ 3.47Å; T430-F821 HydrophobicContact CG2-CD1 4.07Å; T430-F821 HydrophobicContact CG2-CE1 3.38Å; T430-F821 HydrophobicContact CG2-CE2 4.06Å; T430-F821 HydrophobicContact CG2-CZ 3.4Å; T430-F821 VanDerWaalsContact CG2-CZ 3.4Å; I787-F821 HydrophobicContact CG2-CB 4.48Å; W793-F821 AromaticContact CD1-CD2 3.83Å; W793-F821 AromaticContact CD1-CE2 3.7Å; W793-F821 AromaticContact CD2-CD2 3.9Å; W793-F821 HydrophobicContact CD2-CD2 3.9Å; W793-F821 HydrophobicContact CD2-CE2 4.37Å; W793-F821 AromaticContact CE2-CD2 3.84Å; W793-F821 AromaticContact CE2-CE2 3.92Å; W793-F821 AromaticContact CG-CD2 3.94Å; W793-F821 HydrophobicContact CG-CD2 3.94Å; W793-F821 HydrophobicContact CG-CE2 4.27Å; W793-F821 AromaticContact NE1-CD2 3.72Å; W793-F821 AromaticContact NE1-CE2 3.41Å; Y817-F821 VanDerWaalsContact O-CB 3.23Å; Y817-F821 WeakPolarHBondContact O-CB 3.27Å; Y817-F821 PolarHBondContact O-N 3.46Å; F821-N825 VanDerWaalsContact CD2-ND2 3.26Å; F821-N825 WeakPolarHBondContact CD2-ND2 3.46Å; F821-N825 WeakPolarHBondContact CE2-ND2 3.38Å; F821-N825 VanDerWaalsContact O-CB 3.25Å; F821-N825 WeakPolarHBondContact O-CB 3.46Å; F821-N825 PolarHBondContact O-N 2.93Å; F821-N825 VanDerWaalsContact O-N 3.11Å; F821-N825 PolarHBondContact O-ND2 3.17Å; F821-Y826 HydrophobicContact CD1-CE2 4.48Å; F821-Y826 AromaticContact CE1-CE2 3.94Å; F821-Y826 HydrophobicContact CE1-CE2 3.94Å
822	I	82.4	Confident	77.1	Confident	24 Å²	24	18.6 Å²	18.6	12%	0.123	10%	0.098	C	C	.	.	H	α-helix	trans	-71.5	-50.8	-177.1	-38.2	165.2	0	0	0	108.4	F426 V818 L820 G824 N825 Y826 I2475	F426-I822 HydrophobicContact CE2-CD1 3.77Å; F426-I822 HydrophobicContact CE2-CG1 4.13Å; F426-I822 HydrophobicContact CZ-CD1 3.92Å; F426-I822 HydrophobicContact CZ-CG1 3.89Å; V818-I822 HydrophobicContact CG1-CD1 3.94Å; V818-I822 WeakPolarHBondContact O-CG1 3.11Å; V818-I822 PolarHBondContact O-N 3.33Å; L820-I822 PolarHBondContact O-N 3.17Å; I822-G824 PolarHBondContact O-N 3.47Å; I822-N825 PolarHBondContact O-N 3.12Å; I822-Y826 HydrophobicContact CB-CD2 4.12Å; I822-Y826 HydrophobicContact CB-CE2 4.43Å; I822-Y826 HydrophobicContact CG2-CD1 3.95Å; I822-Y826 HydrophobicContact CG2-CD2 3.41Å; I822-Y826 VanDerWaalsContact CG2-CD2 3.41Å; I822-Y826 HydrophobicContact CG2-CE1 4.26Å; I822-Y826 HydrophobicContact CG2-CE2 3.75Å; I822-Y826 HydrophobicContact CG2-CG 3.48Å; I822-Y826 VanDerWaalsContact CG2-CG 3.48Å; I822-Y826 WeakPolarHBondContact O-CA 3.19Å; I822-Y826 WeakPolarHBondContact O-CB 3.29Å; I822-Y826 PolarHBondContact O-N 3.32Å; I822-I2475 HydrophobicContact CB-CD1 3.49Å; I822-I2475 VanDerWaalsContact CB-CD1 3.49Å; I822-I2475 HydrophobicContact CB-CG1 3.68Å; I822-I2475 HydrophobicContact CD1-CD1 4.17Å; I822-I2475 HydrophobicContact CG1-CD1 4.16Å; I822-I2475 HydrophobicContact CG2-CD1 4.41Å; I822-I2475 HydrophobicContact CG2-CG1 4.18Å
823	C	79.6	Confident	75.9	Confident	25 Å²	25	15.8 Å²	15.8	17%	0.169	8%	0.084	C	C	.	.	I	π-helix	trans	-56.1	-35.3	-175.3	-116.5	0	0	0	0	113.5	F746 I819 L820 I827 L828 D2474 I2475	F746-C823 HydrophobicContact CE2-CB 3.72Å; F746-C823 HydrophobicContact CZ-CB 3.51Å; I819-C823 VanDerWaalsContact O-CB 3.32Å; I819-C823 WeakPolarHBondContact O-CB 3.32Å; I819-C823 PolarHBondContact O-N 2.95Å; L820-C823 PolarHBondContact O-N 2.84Å; C823-I827 WeakPolarHBondContact O-CA 3.27Å; C823-I827 VanDerWaalsContact O-CB 3.27Å; C823-I827 WeakPolarHBondContact O-CB 3.5Å; C823-I827 PolarHBondContact O-N 3.33Å; C823-L828 PolarHBondContact O-N 3.43Å; C823-D2474 VanDerWaalsContact CA-OD1 3.3Å; C823-D2474 WeakPolarHBondContact CA-OD1 3.29Å; C823-D2474 PolarHBondContact SG-OD2 3.22Å; C823-I2475 HydrophobicContact CB-CD1 4.44Å; C823-I2475 HydrophobicContact CB-CG1 3.76Å
824	G	75.8	Confident	74.8	Confident	4 Å²	4	15.3 Å²	15.3	4%	0.041	8%	0.083	C	C	.	.	I	π-helix	trans	-72	-67.4	175.5	0	0	0	0	0	113.8	L820 I822 Y826 L828 L829	L820-G824 PolarHBondContact O-N 2.74Å; I822-G824 PolarHBondContact O-N 3.47Å; G824-Y826 PolarHBondContact O-N 3.21Å; G824-L828 PolarHBondContact O-N 3.42Å; G824-L829 PolarHBondContact O-N 3.02Å
825	N	70.8	Confident	73.6	Confident	12 Å²	12	16 Å²	16	6%	0.064	9%	0.085	C	C	.	.	I	π-helix	trans	-70.6	-27.3	-168.5	-55.2	-11	0	0	0	110.4	L788 F821 I822 L829 N830	L788-N825 VanDerWaalsContact C-OD1 3.31Å; L788-N825 VanDerWaalsContact CA-OD1 3.31Å; L788-N825 WeakPolarHBondContact CA-OD1 3.27Å; L788-N825 PolarHBondContact O-OD1 3.46Å; F821-N825 VanDerWaalsContact CD2-ND2 3.26Å; F821-N825 WeakPolarHBondContact CD2-ND2 3.46Å; F821-N825 WeakPolarHBondContact CE2-ND2 3.38Å; F821-N825 VanDerWaalsContact O-CB 3.25Å; F821-N825 WeakPolarHBondContact O-CB 3.46Å; F821-N825 PolarHBondContact O-N 2.93Å; F821-N825 VanDerWaalsContact O-N 3.11Å; F821-N825 PolarHBondContact O-ND2 3.17Å; I822-N825 PolarHBondContact O-N 3.12Å; N825-L829 WeakPolarHBondContact O-CB 3.44Å; N825-N830 PolarHBondContact O-ND2 3.2Å
826	Y	64.9	Low	72.5	Confident	19 Å²	19	15 Å²	15	8%	0.075	8%	0.081	C	C	.	.	I	π-helix	trans	-93.3	-65.6	175.8	-68.7	-119.1	0	0	0	110.4	M466 F821 I822 G824 N830 R2472 H2473 D2474	M466-Y826 HydrophobicContact CE-CE1 4.27Å; M466-Y826 HydrophobicContact CE-CE2 4.22Å; M466-Y826 HydrophobicContact SD-CE1 3.55Å; M466-Y826 VanDerWaalsContact SD-CE1 3.55Å; M466-Y826 HydrophobicContact SD-CE2 4.16Å; M466-Y826 PolarHBondContact SD-OH 2.7Å; F821-Y826 HydrophobicContact CD1-CE2 4.48Å; F821-Y826 AromaticContact CE1-CE2 3.94Å; F821-Y826 HydrophobicContact CE1-CE2 3.94Å; I822-Y826 HydrophobicContact CB-CD2 4.12Å; I822-Y826 HydrophobicContact CB-CE2 4.43Å; I822-Y826 HydrophobicContact CG2-CD1 3.95Å; I822-Y826 HydrophobicContact CG2-CD2 3.41Å; I822-Y826 VanDerWaalsContact CG2-CD2 3.41Å; I822-Y826 HydrophobicContact CG2-CE1 4.26Å; I822-Y826 HydrophobicContact CG2-CE2 3.75Å; I822-Y826 HydrophobicContact CG2-CG 3.48Å; I822-Y826 VanDerWaalsContact CG2-CG 3.48Å; I822-Y826 WeakPolarHBondContact O-CA 3.19Å; I822-Y826 WeakPolarHBondContact O-CB 3.29Å; I822-Y826 PolarHBondContact O-N 3.32Å; G824-Y826 PolarHBondContact O-N 3.21Å; Y826-N830 VanDerWaalsContact O-CB 3.25Å; Y826-N830 WeakPolarHBondContact O-CB 3.31Å; Y826-N830 PolarHBondContact O-ND2 3.26Å; Y826-R2472 WeakPolarHBondContact CD1-O 3.15Å; Y826-H2473 VanDerWaalsContact C-CA 3.46Å; Y826-H2473 VanDerWaalsContact CB-CA 3.44Å; Y826-H2473 PolarHBondContact O-CD2 3.28Å; Y826-H2473 PolarHBondContact O-N 3.48Å; Y826-D2474 WeakPolarHBondContact CB-OD1 3.41Å
827	I	60.4	Low	71	Confident	27 Å²	27	15 Å²	15	14%	0.138	8%	0.083	C	C	.	.	I	π-helix	trans	-63.6	-62.4	-178.3	-94.6	168.4	0	0	0	112.7	I301 C823 N830 V831 H2473 D2474	I301-I827 HydrophobicContact CD1-CG2 4.33Å; I301-I827 HydrophobicContact CG2-CD1 3.66Å; I301-I827 HydrophobicContact CG2-CG1 3.98Å; C823-I827 WeakPolarHBondContact O-CA 3.27Å; C823-I827 VanDerWaalsContact O-CB 3.27Å; C823-I827 WeakPolarHBondContact O-CB 3.5Å; C823-I827 PolarHBondContact O-N 3.33Å; I827-N830 PolarHBondContact O-N 3.2Å; I827-V831 WeakPolarHBondContact O-CG2 3.23Å; I827-V831 PolarHBondContact O-N 3.46Å; I827-V831 VanDerWaalsContact O-N 3.11Å; I827-H2473 WeakPolarHBondContact CA-CD2 3.33Å; I827-H2473 HydrophobicContact CG1-CB 4.24Å; I827-H2473 WeakPolarHBondContact CG1-ND1 3.2Å; I827-H2473 PolarHBondContact O-CD2 3.13Å; I827-H2473 VanDerWaalsContact O-CD2 3.31Å; I827-H2473 PolarHBondContact O-NE2 2.81Å; I827-D2474 HydrophobicContact CD1-CB 4.02Å; I827-D2474 WeakPolarHBondContact CD1-OD2 3.42Å; I827-D2474 HydrophobicContact CG1-CB 3.77Å; I827-D2474 WeakPolarHBondContact CG1-OD2 3.29Å; I827-D2474 PolarHBondContact N-OD1 2.94Å
828	L	60.1	Low	69.7	Low	7 Å²	7	16.1 Å²	16.1	4%	0.037	9%	0.089	C	C	.	.	I	π-helix	trans	-74.6	-48.5	-159.1	-64.4	168.9	0	0	0	112.7	L742 L743 F746 C823 G824 N830 F832	L742-L828 HydrophobicContact CD2-CD2 4.1Å; L742-L828 HydrophobicContact CG-CD2 4.33Å; L743-L828 HydrophobicContact CD1-CB 4.04Å; L743-L828 HydrophobicContact CD1-CD1 3.62Å; L743-L828 HydrophobicContact CD1-CG 4.39Å; F746-L828 HydrophobicContact CB-CD1 3.72Å; F746-L828 HydrophobicContact CD1-CD1 3.4Å; F746-L828 VanDerWaalsContact CD1-CD1 3.4Å; F746-L828 HydrophobicContact CD2-CD1 4.02Å; F746-L828 HydrophobicContact CE1-CD1 4Å; F746-L828 HydrophobicContact CG-CD1 3.44Å; F746-L828 VanDerWaalsContact CG-CD1 3.44Å; C823-L828 PolarHBondContact O-N 3.43Å; G824-L828 PolarHBondContact O-N 3.42Å; L828-N830 PolarHBondContact O-N 3.3Å; L828-F832 PolarHBondContact O-N 3.41Å
829	L	58.7	Low	68.5	Low	38 Å²	38	17.2 Å²	17.2	20%	0.199	9%	0.094	C	C	.	.	H	α-helix	trans	-52.3	-31	178.1	-167	146.5	0	0	0	111.6	G824 N825 F832 L833 F1285 W2469	G824-L829 PolarHBondContact O-N 3.02Å; N825-L829 WeakPolarHBondContact O-CB 3.44Å; L829-F832 WeakPolarHBondContact O-CB 3.41Å; L829-F832 PolarHBondContact O-N 2.69Å; L829-L833 PolarHBondContact O-N 3.08Å; L829-F1285 HydrophobicContact CD1-CE1 3.92Å; L829-F1285 HydrophobicContact CG-CE1 3.99Å; L829-W2469 HydrophobicContact CD1-CH2 4.43Å; L829-W2469 HydrophobicContact CD2-CD2 4.43Å; L829-W2469 HydrophobicContact CD2-CE3 3.67Å; L829-W2469 HydrophobicContact CD2-CH2 3.38Å; L829-W2469 HydrophobicContact CD2-CZ2 4.09Å; L829-W2469 HydrophobicContact CD2-CZ3 3.15Å; L829-W2469 HydrophobicContact CG-CH2 3.5Å; L829-W2469 HydrophobicContact CG-CZ2 4.19Å; L829-W2469 HydrophobicContact CG-CZ3 3.8Å; L829-W2469 VanDerWaalsContact O-CZ3 3.25Å; L829-W2469 WeakPolarHBondContact O-CZ3 3.46Å
830	N	59.5	Low	67.2	Low	3 Å²	3	16 Å²	16	2%	0.016	9%	0.088	C	C	.	.	H	α-helix	trans	-110	-16	-165.7	-63.8	-44.1	0	0	0	115.5	N825 Y826 I827 L828 A834 P2471 R2472	N825-N830 PolarHBondContact O-ND2 3.2Å; Y826-N830 VanDerWaalsContact O-CB 3.25Å; Y826-N830 WeakPolarHBondContact O-CB 3.31Å; Y826-N830 PolarHBondContact O-ND2 3.26Å; I827-N830 PolarHBondContact O-N 3.2Å; L828-N830 PolarHBondContact O-N 3.3Å; N830-A834 WeakPolarHBondContact O-CB 3.36Å; N830-A834 PolarHBondContact O-N 2.89Å; N830-P2471 HydrophobicContact CB-CB 3.58Å; N830-P2471 VanDerWaalsContact CG-CA 3.4Å; N830-P2471 WeakPolarHBondContact OD1-CA 3.46Å; N830-P2471 WeakPolarHBondContact OD1-CB 3.14Å; N830-R2472 VanDerWaalsContact CB-CA 3.45Å; N830-R2472 HydrophobicContact CB-CB 4.23Å; N830-R2472 HydrophobicContact CB-CG 3.72Å; N830-R2472 VanDerWaalsContact CG-N 3.28Å; N830-R2472 WeakPolarHBondContact ND2-CA 3.4Å; N830-R2472 PolarHBondContact ND2-N 3.4Å; N830-R2472 PolarHBondContact O-NE 3.21Å; N830-R2472 VanDerWaalsContact O-NE 3.08Å
831	V	62.9	Low	65.9	Low	3 Å²	3	16.8 Å²	16.8	2%	0.018	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-38.2	152.4	178.9	0	0	0	0	108.6	V297 I301 F477 L739 I827 A834 I835 H2473	V297-V831 HydrophobicContact CG1-CG1 4.16Å; I301-V831 HydrophobicContact CD1-CG2 3.89Å; I301-V831 HydrophobicContact CG1-CG2 3.78Å; F477-V831 HydrophobicContact CE2-CB 4.24Å; F477-V831 HydrophobicContact CE2-CG1 3.87Å; F477-V831 HydrophobicContact CE2-CG2 4.13Å; F477-V831 HydrophobicContact CZ-CG1 4.29Å; F477-V831 HydrophobicContact CZ-CG2 4.04Å; L739-V831 HydrophobicContact CD1-CB 3.8Å; L739-V831 HydrophobicContact CD1-CG1 3.49Å; L739-V831 VanDerWaalsContact CD1-CG1 3.49Å; I827-V831 WeakPolarHBondContact O-CG2 3.23Å; I827-V831 PolarHBondContact O-N 3.46Å; I827-V831 VanDerWaalsContact O-N 3.11Å; V831-A834 PolarHBondContact O-N 2.89Å; V831-I835 HydrophobicContact CG1-CD1 3.95Å; V831-I835 WeakPolarHBondContact O-CG1 3.38Å; V831-I835 PolarHBondContact O-N 3.44Å; V831-H2473 VanDerWaalsContact CG2-NE2 3.34Å; V831-H2473 WeakPolarHBondContact CG2-NE2 3.35Å
832	F	63.6	Low	64.8	Low	10 Å²	10	17.7 Å²	17.7	4%	0.044	10%	0.1	C	C	.	.	H	α-helix	trans	-69.5	-43.2	-177.2	177.6	-108.1	0	0	0	113.9	I736 L739 L828 L829 A834 I835 A836 F1285 F1286 N1289 W2469	I736-F832 HydrophobicContact CG1-CE2 4.25Å; I736-F832 HydrophobicContact CG2-CE2 3.92Å; L739-F832 HydrophobicContact CD1-CB 3.72Å; L739-F832 HydrophobicContact CD1-CD2 4.45Å; L739-F832 HydrophobicContact CD2-CB 3.87Å; L739-F832 HydrophobicContact CD2-CD2 4.2Å; L739-F832 HydrophobicContact CD2-CG 4.35Å; L739-F832 HydrophobicContact CG-CB 4.49Å; L828-F832 PolarHBondContact O-N 3.41Å; L829-F832 WeakPolarHBondContact O-CB 3.41Å; L829-F832 PolarHBondContact O-N 2.69Å; F832-A834 VanDerWaalsContact C-N 3.32Å; F832-A834 PolarHBondContact O-N 2.84Å; F832-I835 PolarHBondContact O-N 2.65Å; F832-A836 PolarHBondContact O-N 3.23Å; F832-F1285 HydrophobicContact CD1-CD1 4.34Å; F832-F1285 HydrophobicContact CE1-CB 3.78Å; F832-F1285 HydrophobicContact CE1-CD1 4.38Å; F832-F1285 WeakPolarHBondContact CE1-O 3.45Å; F832-F1285 HydrophobicContact CZ-CB 4.43Å; F832-F1286 HydrophobicContact CZ-CB 4.19Å; F832-F1286 HydrophobicContact CZ-CD2 4.11Å; F832-N1289 WeakPolarHBondContact CD1-ND2 3.32Å; F832-N1289 WeakPolarHBondContact CE1-ND2 3.5Å; F832-W2469 HydrophobicContact CD1-CH2 4.06Å
833	L	59.4	Low	63.8	Low	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.9	-41.9	171.5	-145.1	-167.5	0	0	0	111.4	L829 I835 A836 V837 N1289 V1292 W2469 P2471	L829-L833 PolarHBondContact O-N 3.08Å; L833-I835 VanDerWaalsContact C-N 3.34Å; L833-I835 PolarHBondContact O-N 3.11Å; L833-A836 WeakPolarHBondContact O-CB 3.37Å; L833-A836 PolarHBondContact O-N 3Å; L833-V837 HydrophobicContact CD2-CG2 3.51Å; L833-V837 PolarHBondContact O-N 3.43Å; L833-N1289 WeakPolarHBondContact CA-ND2 3.04Å; L833-N1289 HydrophobicContact CD2-CB 4.3Å; L833-N1289 HydrophobicContact CG-CB 4.37Å; L833-V1292 HydrophobicContact CD1-CG1 4.07Å; L833-V1292 HydrophobicContact CD2-CG1 4.49Å; L833-W2469 HydrophobicContact CB-CE3 3.88Å; L833-W2469 HydrophobicContact CB-CZ3 3.75Å; L833-W2469 HydrophobicContact CD1-CB 4.12Å; L833-W2469 HydrophobicContact CD1-CD2 4.4Å; L833-W2469 HydrophobicContact CD1-CE3 3.63Å; L833-W2469 HydrophobicContact CD1-CZ3 4.39Å; L833-W2469 HydrophobicContact CG-CD2 4.47Å; L833-W2469 HydrophobicContact CG-CE3 3.6Å; L833-W2469 HydrophobicContact CG-CZ3 3.97Å; L833-P2471 HydrophobicContact CB-CB 3.54Å; L833-P2471 HydrophobicContact CB-CG 3.78Å; L833-P2471 HydrophobicContact CD1-CB 3.65Å; L833-P2471 HydrophobicContact CD1-CG 3.44Å; L833-P2471 VanDerWaalsContact CD1-CG 3.44Å; L833-P2471 HydrophobicContact CG-CB 4.19Å; L833-P2471 HydrophobicContact CG-CG 4.11Å
834	A	62.8	Low	62.8	Low	7 Å²	7	17.4 Å²	17.4	6%	0.058	10%	0.103	C	C	.	.	H	α-helix	trans	-61.5	-42	-179.9	0	0	0	0	0	112.2	F477 N830 V831 F832 A836 V837 D838 R2472	F477-A834 HydrophobicContact CD2-CB 3.63Å; F477-A834 HydrophobicContact CE2-CB 4.21Å; N830-A834 WeakPolarHBondContact O-CB 3.36Å; N830-A834 PolarHBondContact O-N 2.89Å; V831-A834 PolarHBondContact O-N 2.89Å; F832-A834 VanDerWaalsContact C-N 3.32Å; F832-A834 PolarHBondContact O-N 2.84Å; A834-A836 VanDerWaalsContact C-N 3.33Å; A834-A836 PolarHBondContact O-N 2.66Å; A834-V837 PolarHBondContact O-N 2.89Å; A834-D838 VanDerWaalsContact O-CB 3.31Å; A834-D838 WeakPolarHBondContact O-CB 3.47Å; A834-D838 VanDerWaalsContact O-CG 3.22Å; A834-D838 PolarHBondContact O-N 2.91Å; A834-R2472 VanDerWaalsContact CB-NH2 3.31Å
835	I	62	Low	61.9	Low	25 Å²	25	21.7 Å²	21.7	13%	0.128	12%	0.122	C	C	.	.	H	α-helix	trans	-62.6	-39.2	172.5	-70.6	175.4	0	0	0	111.1	S735 I736 L739 V831 F832 L833 D838 N839	S735-I835 WeakPolarHBondContact OG-CG2 3.37Å; I736-I835 HydrophobicContact CG1-CG2 4.39Å; L739-I835 HydrophobicContact CD1-CD1 3.83Å; V831-I835 HydrophobicContact CG1-CD1 3.95Å; V831-I835 WeakPolarHBondContact O-CG1 3.38Å; V831-I835 PolarHBondContact O-N 3.44Å; F832-I835 PolarHBondContact O-N 2.65Å; L833-I835 VanDerWaalsContact C-N 3.34Å; L833-I835 PolarHBondContact O-N 3.11Å; I835-D838 PolarHBondContact O-N 3.45Å; I835-N839 WeakPolarHBondContact CG2-ND2 3.45Å; I835-N839 PolarHBondContact O-N 3.21Å; I835-N839 VanDerWaalsContact O-N 3.15Å; I835-N839 PolarHBondContact O-ND2 3.28Å
836	A	63.8	Low	61.2	Low	11 Å²	11	24.7 Å²	24.7	9%	0.091	14%	0.137	C	C	.	.	H	α-helix	trans	-64.9	-50.9	176.3	0	0	0	0	0	112.3	F832 L833 A834 D838 N839 L840 N1289	F832-A836 PolarHBondContact O-N 3.23Å; L833-A836 WeakPolarHBondContact O-CB 3.37Å; L833-A836 PolarHBondContact O-N 3Å; A834-A836 VanDerWaalsContact C-N 3.33Å; A834-A836 PolarHBondContact O-N 2.66Å; A836-D838 VanDerWaalsContact C-N 3.27Å; A836-D838 PolarHBondContact O-N 3.05Å; A836-N839 PolarHBondContact O-N 3.42Å; A836-L840 WeakPolarHBondContact O-CB 3.5Å; A836-L840 VanDerWaalsContact O-CD1 3.29Å; A836-L840 WeakPolarHBondContact O-CD1 2.94Å; A836-L840 VanDerWaalsContact O-CG 3.22Å; A836-L840 WeakPolarHBondContact O-CG 3.48Å; A836-L840 PolarHBondContact O-N 3.04Å; A836-L840 VanDerWaalsContact O-N 3.09Å; A836-N1289 HydrophobicContact CB-CB 3.74Å
837	V	60.4	Low	60.9	Low	19 Å²	19	26.6 Å²	26.6	12%	0.115	15%	0.147	C	C	.	.	H	α-helix	trans	-51.7	-47.9	173	165.7	0	0	0	0	110.9	L833 A834 L840 A841 I1296	L833-V837 HydrophobicContact CD2-CG2 3.51Å; L833-V837 PolarHBondContact O-N 3.43Å; A834-V837 PolarHBondContact O-N 2.89Å; V837-L840 PolarHBondContact O-N 3.33Å; V837-A841 WeakPolarHBondContact O-CB 3.2Å; V837-A841 PolarHBondContact O-N 3.17Å; V837-I1296 HydrophobicContact CG2-CD1 4.04Å
838	D	63	Low	60.7	Low	25 Å²	25	28.3 Å²	28.3	13%	0.134	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-51.5	-175.2	-80.9	-21.2	0	0	0	111.4	R481 A834 I835 A836 L840 A841 D842	R481-D838 WeakPolarHBondContact CD-OD1 3.28Å; R481-D838 VanDerWaalsContact CD-OD2 3.26Å; R481-D838 WeakPolarHBondContact CD-OD2 3.14Å; R481-D838 IonicContact CZ-OD1 3.67Å; R481-D838 VanDerWaalsContact CZ-OD1 3.3Å; R481-D838 IonicContact NE-OD1 3.17Å; R481-D838 IonicContact NH1-OD1 3.57Å; R481-D838 PolarHBondContact NH1-OD1 3.36Å; R481-D838 PolarHBondContact NH2-O 3.11Å; A834-D838 VanDerWaalsContact O-CB 3.31Å; A834-D838 WeakPolarHBondContact O-CB 3.47Å; A834-D838 VanDerWaalsContact O-CG 3.22Å; A834-D838 PolarHBondContact O-N 2.91Å; I835-D838 PolarHBondContact O-N 3.45Å; A836-D838 VanDerWaalsContact C-N 3.27Å; A836-D838 PolarHBondContact O-N 3.05Å; D838-L840 VanDerWaalsContact C-N 3.33Å; D838-L840 PolarHBondContact O-N 3.15Å; D838-A841 PolarHBondContact O-N 3.14Å; D838-D842 PolarHBondContact O-N 3.44Å
839	N	63.5	Low	60.4	Low	47 Å²	47	31.8 Å²	31.8	25%	0.251	17%	0.169	S	C	.	.	H	α-helix	trans	-65.1	-34.3	-179.3	-71.7	-69.2	0	0	0	112.7	S732 I835 A836 D842 T843	S732-N839 WeakPolarHBondContact CB-ND2 3.29Å; S732-N839 WeakPolarHBondContact CB-OD1 3.22Å; I835-N839 WeakPolarHBondContact CG2-ND2 3.45Å; I835-N839 PolarHBondContact O-N 3.21Å; I835-N839 VanDerWaalsContact O-N 3.15Å; I835-N839 PolarHBondContact O-ND2 3.28Å; A836-N839 PolarHBondContact O-N 3.42Å; N839-D842 PolarHBondContact O-N 2.86Å; N839-T843 PolarHBondContact O-N 3.44Å; N839-T843 PolarHBondContact O-OG1 3Å
840	L	61.1	Low	60.2	Low	21 Å²	21	33.8 Å²	33.8	11%	0.11	18%	0.176	C	C	.	.	H	α-helix	trans	-74.4	-36.5	178.9	-67.8	162.5	0	0	0	113.2	A836 V837 D838 D842 T843 G844 I1290	A836-L840 WeakPolarHBondContact O-CB 3.5Å; A836-L840 VanDerWaalsContact O-CD1 3.29Å; A836-L840 WeakPolarHBondContact O-CD1 2.94Å; A836-L840 VanDerWaalsContact O-CG 3.22Å; A836-L840 WeakPolarHBondContact O-CG 3.48Å; A836-L840 PolarHBondContact O-N 3.04Å; A836-L840 VanDerWaalsContact O-N 3.09Å; V837-L840 PolarHBondContact O-N 3.33Å; D838-L840 VanDerWaalsContact C-N 3.33Å; D838-L840 PolarHBondContact O-N 3.15Å; L840-D842 PolarHBondContact O-N 3.11Å; L840-T843 WeakPolarHBondContact O-CA 3.48Å; L840-T843 WeakPolarHBondContact O-CB 3.29Å; L840-T843 PolarHBondContact O-N 2.98Å; L840-G844 PolarHBondContact O-N 3.45Å; L840-I1290 HydrophobicContact CD1-CB 4.03Å; L840-I1290 HydrophobicContact CD1-CG1 3.97Å; L840-I1290 HydrophobicContact CD1-CG2 3.97Å; L840-I1290 HydrophobicContact CD2-CG1 4.47Å; L840-I1290 HydrophobicContact CD2-CG2 3.92Å
841	A	63.2	Low	60.1	Low	18 Å²	18	39.8 Å²	39.8	15%	0.149	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-30.8	175.3	0	0	0	0	0	112	V837 D838 Q845 V1297	V837-A841 WeakPolarHBondContact O-CB 3.2Å; V837-A841 PolarHBondContact O-N 3.17Å; D838-A841 PolarHBondContact O-N 3.14Å; A841-Q845 PolarHBondContact O-N 2.84Å; A841-V1297 HydrophobicContact CB-CG2 3.94Å
842	D	62.3	Low	59.6	Low	26 Å²	26	43.4 Å²	43.4	14%	0.139	22%	0.221	C	C	.	.	H	α-helix	trans	-75.4	-33	173.8	-61.3	-45.5	0	0	0	111.9	R481 K485 Y490 D838 N839 L840 Q845 I846	R481-D842 IonicContact CZ-OD2 3.41Å; R481-D842 IonicContact NH2-OD1 3.2Å; R481-D842 PolarHBondContact NH2-OD1 3.05Å; R481-D842 IonicContact NH2-OD2 3.91Å; R481-D842 PolarHBondContact NH2-OD2 2.99Å; K485-D842 IonicContact NZ-OD1 2.73Å; K485-D842 PolarHBondContact NZ-OD1 3.32Å; Y490-D842 HydrophobicContact CE1-CB 4.37Å; Y490-D842 WeakPolarHBondContact CE1-OD1 3.28Å; Y490-D842 WeakPolarHBondContact CE1-OD2 3.43Å; Y490-D842 VanDerWaalsContact CZ-OD2 3.25Å; Y490-D842 PolarHBondContact OH-OD2 2.99Å; D838-D842 PolarHBondContact O-N 3.44Å; N839-D842 PolarHBondContact O-N 2.86Å; L840-D842 PolarHBondContact O-N 3.11Å; D842-Q845 PolarHBondContact O-N 3.17Å; D842-I846 WeakPolarHBondContact O-CG1 3.2Å; D842-I846 PolarHBondContact O-N 3.41Å
843	T	61.1	Low	59.1	Low	22 Å²	22	46.2 Å²	46.2	14%	0.135	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-42.1	170.8	-47.7	0	0	0	0	112.1	S728 N839 L840 Q845 I846 E847	S728-T843 WeakPolarHBondContact CB-OG1 3.27Å; S728-T843 PolarHBondContact OG-OG1 3.12Å; N839-T843 PolarHBondContact O-N 3.44Å; N839-T843 PolarHBondContact O-OG1 3Å; L840-T843 WeakPolarHBondContact O-CA 3.48Å; L840-T843 WeakPolarHBondContact O-CB 3.29Å; L840-T843 PolarHBondContact O-N 2.98Å; T843-Q845 VanDerWaalsContact C-N 3.28Å; T843-Q845 PolarHBondContact O-N 3.31Å; T843-I846 CarbonylContact O-C 3.5Å; T843-I846 WeakPolarHBondContact O-CA 3.34Å; T843-I846 WeakPolarHBondContact O-CB 3.38Å; T843-I846 PolarHBondContact O-N 2.85Å; T843-E847 PolarHBondContact O-N 3.46Å
844	G	59.3	Low	58.7	Low	22 Å²	22	49.9 Å²	49.9	23%	0.227	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-37.8	175.4	0	0	0	0	0	112.9	L840 I846 E847 E848	L840-G844 PolarHBondContact O-N 3.45Å; G844-I846 VanDerWaalsContact C-N 3.29Å; G844-I846 PolarHBondContact O-N 2.84Å; G844-E847 PolarHBondContact O-N 3.35Å; G844-E848 PolarHBondContact O-N 3.36Å
845	Q	57.6	Low	58.2	Low	93 Å²	93	53.2 Å²	53.2	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-71.4	-20.6	173.5	-66	-167.3	16.8	0	0	113.9	A841 D842 T843 K849	A841-Q845 PolarHBondContact O-N 2.84Å; D842-Q845 PolarHBondContact O-N 3.17Å; T843-Q845 VanDerWaalsContact C-N 3.28Å; T843-Q845 PolarHBondContact O-N 3.31Å; Q845-K849 VanDerWaalsContact O-CB 3.28Å; Q845-K849 WeakPolarHBondContact O-CB 3.38Å; Q845-K849 WeakPolarHBondContact O-CD 3.18Å; Q845-K849 WeakPolarHBondContact O-CG 3.48Å; Q845-K849 PolarHBondContact O-N 2.81Å
846	I	56.2	Low	57.6	Low	75 Å²	75	52.5 Å²	52.5	39%	0.385	27%	0.274	S	S	.	.	H	α-helix	trans	-79.5	-38.7	170.9	-64.9	165.7	0	0	0	109.9	D842 T843 G844 K849 K850	D842-I846 WeakPolarHBondContact O-CG1 3.2Å; D842-I846 PolarHBondContact O-N 3.41Å; T843-I846 CarbonylContact O-C 3.5Å; T843-I846 WeakPolarHBondContact O-CA 3.34Å; T843-I846 WeakPolarHBondContact O-CB 3.38Å; T843-I846 PolarHBondContact O-N 2.85Å; G844-I846 VanDerWaalsContact C-N 3.29Å; G844-I846 PolarHBondContact O-N 2.84Å; I846-K849 CarbonylContact O-C 3.52Å; I846-K849 PolarHBondContact O-N 3.3Å; I846-K850 HydrophobicContact CG2-CD 4.12Å; I846-K850 HydrophobicContact CG2-CG 4.32Å; I846-K850 WeakPolarHBondContact O-CB 3.27Å; I846-K850 WeakPolarHBondContact O-CG 3.42Å; I846-K850 PolarHBondContact O-N 2.75Å
847	E	57.9	Low	56.8	Low	60 Å²	60	56 Å²	56	28%	0.28	29%	0.291	S	S	.	.	H	α-helix	trans	-69.5	-44	175	-63.8	-156.2	153.2	0	0	112.1	N724 T843 G844 K849 K850 E851	N724-E847 PolarHBondContact ND2-OE1 3.37Å; T843-E847 PolarHBondContact O-N 3.46Å; G844-E847 PolarHBondContact O-N 3.35Å; E847-K849 VanDerWaalsContact C-N 3.27Å; E847-K849 PolarHBondContact O-N 2.89Å; E847-K850 PolarHBondContact O-N 2.87Å; E847-K850 VanDerWaalsContact O-N 3.11Å; E847-E851 PolarHBondContact O-N 2.56Å
848	E	56.8	Low	56.1	Low	62 Å²	62	60 Å²	60	29%	0.29	31%	0.307	S	S	.	.	H	α-helix	trans	-54.4	-45.3	169.2	-80.1	-173.6	-115	0	0	110	G844 K850 E851 E852 Q1301 R1308	G844-E848 PolarHBondContact O-N 3.36Å; E848-K850 PolarHBondContact O-N 3.24Å; E848-E851 PolarHBondContact O-N 2.91Å; E848-E852 WeakPolarHBondContact O-CB 3.44Å; E848-E852 VanDerWaalsContact O-CG 3.29Å; E848-E852 WeakPolarHBondContact O-CG 3.45Å; E848-E852 PolarHBondContact O-N 2.86Å; E848-Q1301 PolarHBondContact OE1-NE2 2.82Å; E848-R1308 IonicContact OE1-NH2 3.75Å; E848-R1308 PolarHBondContact OE1-NH2 2.94Å; E848-R1308 IonicContact OE2-CZ 2.68Å; E848-R1308 IonicContact OE2-NH1 3.2Å; E848-R1308 PolarHBondContact OE2-NH1 2.96Å; E848-R1308 IonicContact OE2-NH2 3.35Å; E848-R1308 PolarHBondContact OE2-NH2 3.31Å
849	K	53.1	Low	55.3	Low	81 Å²	81	61 Å²	61	35%	0.352	32%	0.316	S	S	.	.	H	α-helix	trans	-72.9	-21.8	178.2	-74.4	172.3	-171	131.1	0	115.3	Q845 I846 E847 E852 T853	Q845-K849 VanDerWaalsContact O-CB 3.28Å; Q845-K849 WeakPolarHBondContact O-CB 3.38Å; Q845-K849 WeakPolarHBondContact O-CD 3.18Å; Q845-K849 WeakPolarHBondContact O-CG 3.48Å; Q845-K849 PolarHBondContact O-N 2.81Å; I846-K849 CarbonylContact O-C 3.52Å; I846-K849 PolarHBondContact O-N 3.3Å; E847-K849 VanDerWaalsContact C-N 3.27Å; E847-K849 PolarHBondContact O-N 2.89Å; K849-E852 CarbonylContact O-C 3.49Å; K849-E852 WeakPolarHBondContact O-CA 3.29Å; K849-E852 PolarHBondContact O-N 3.48Å; K849-T853 PolarHBondContact O-N 2.68Å; K849-T853 PolarHBondContact O-OG1 3.48Å
850	K	55.1	Low	54.3	Low	79 Å²	79	62.3 Å²	62.3	34%	0.343	32%	0.323	S	S	.	.	H	α-helix	trans	-84.1	-33.1	174.6	-75.4	-168.4	175.9	-168.9	0	111.8	E501 I846 E847 E848 E852 T853 D854	E501-K850 IonicContact OE1-NZ 3.64Å; E501-K850 PolarHBondContact OE1-NZ 3.44Å; E501-K850 IonicContact OE2-NZ 2.64Å; E501-K850 PolarHBondContact OE2-NZ 2.84Å; I846-K850 HydrophobicContact CG2-CD 4.12Å; I846-K850 HydrophobicContact CG2-CG 4.32Å; I846-K850 WeakPolarHBondContact O-CB 3.27Å; I846-K850 WeakPolarHBondContact O-CG 3.42Å; I846-K850 PolarHBondContact O-N 2.75Å; E847-K850 PolarHBondContact O-N 2.87Å; E847-K850 VanDerWaalsContact O-N 3.11Å; E848-K850 PolarHBondContact O-N 3.24Å; K850-E852 PolarHBondContact O-N 3.47Å; K850-T853 WeakPolarHBondContact CA-OG1 3.37Å; K850-T853 PolarHBondContact O-N 3.25Å; K850-T853 PolarHBondContact O-OG1 3.31Å; K850-D854 WeakPolarHBondContact O-CB 3.41Å; K850-D854 PolarHBondContact O-N 3.37Å
851	E	56.7	Low	53.5	Low	129 Å²	129	66.4 Å²	66.4	60%	0.603	35%	0.345	S	S	*	.	H	α-helix	trans	-65.1	-32.1	161.2	-66.9	-168.4	-174.4	0	0	111.5	E847 E848 T853 N855 R2372	E847-E851 PolarHBondContact O-N 2.56Å; E848-E851 PolarHBondContact O-N 2.91Å; E851-T853 VanDerWaalsContact C-N 3.29Å; E851-T853 PolarHBondContact O-N 3.45Å; E851-N855 VanDerWaalsContact O-CB 3.29Å; E851-N855 WeakPolarHBondContact O-CB 3.37Å; E851-N855 PolarHBondContact O-N 3.18Å; E851-N855 VanDerWaalsContact O-N 3.16Å; E851-N855 PolarHBondContact O-ND2 3.39Å; E851-N855 VanDerWaalsContact O-ND2 3.15Å; E851-R2372 PolarHBondContact O-NH2 3.24Å
852	E	53.1	Low	52.6	Low	80 Å²	80	71.2 Å²	71.2	37%	0.374	37%	0.368	S	S	.	.	H	α-helix	trans	-82	13.8	167.1	-59.3	-171.7	162.2	0	0	115.4	E848 K849 K850 R2372 Q2373	E848-E852 WeakPolarHBondContact O-CB 3.44Å; E848-E852 VanDerWaalsContact O-CG 3.29Å; E848-E852 WeakPolarHBondContact O-CG 3.45Å; E848-E852 PolarHBondContact O-N 2.86Å; K849-E852 CarbonylContact O-C 3.49Å; K849-E852 WeakPolarHBondContact O-CA 3.29Å; K849-E852 PolarHBondContact O-N 3.48Å; K850-E852 PolarHBondContact O-N 3.47Å; E852-R2372 HydrophobicContact CB-CB 4.09Å; E852-R2372 HydrophobicContact CB-CG 4.16Å; E852-R2372 HydrophobicContact CG-CB 3.74Å; E852-R2372 HydrophobicContact CG-CG 4.03Å; E852-R2372 WeakPolarHBondContact O-CD 3.08Å; E852-R2372 PolarHBondContact O-NE 2.84Å; E852-R2372 PolarHBondContact O-NH1 3.24Å; E852-R2372 PolarHBondContact O-NH2 3.03Å; E852-Q2373 PolarHBondContact OE1-N 2.9Å
853	T	52.6	Low	51.6	Low	68 Å²	68	73.4 Å²	73.4	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-117.9	-41.4	157.5	21.3	0	0	0	0	112.6	K849 K850 E851 D857 R2372	K849-T853 PolarHBondContact O-N 2.68Å; K849-T853 PolarHBondContact O-OG1 3.48Å; K850-T853 WeakPolarHBondContact CA-OG1 3.37Å; K850-T853 PolarHBondContact O-N 3.25Å; K850-T853 PolarHBondContact O-OG1 3.31Å; E851-T853 VanDerWaalsContact C-N 3.29Å; E851-T853 PolarHBondContact O-N 3.45Å; T853-D857 VanDerWaalsContact O-CG 3.25Å; T853-D857 PolarHBondContact O-N 3.43Å; T853-D857 VanDerWaalsContact O-OD2 3.08Å; T853-R2372 VanDerWaalsContact CA-NH2 3.25Å; T853-R2372 VanDerWaalsContact O-CZ 3.3Å; T853-R2372 PolarHBondContact O-NH1 3.14Å; T853-R2372 PolarHBondContact O-NH2 2.96Å
854	D	50.9	Low	50.4	Low	77 Å²	77	78.1 Å²	78.1	41%	0.412	40%	0.402	S	S	.	.	H	α-helix	trans	-58	-62.9	172.5	-101.1	37.8	0	0	0	116.4	K850 G856 D857 K858 R2372	K850-D854 WeakPolarHBondContact O-CB 3.41Å; K850-D854 PolarHBondContact O-N 3.37Å; D854-G856 PolarHBondContact O-N 3.49Å; D854-D857 PolarHBondContact O-N 3.15Å; D854-K858 HydrophobicContact CB-CD 4.37Å; D854-K858 WeakPolarHBondContact O-CB 3.27Å; D854-K858 VanDerWaalsContact O-CG 3.3Å; D854-K858 WeakPolarHBondContact O-CG 3.17Å; D854-K858 PolarHBondContact O-N 3.48Å; D854-K858 WeakPolarHBondContact OD2-CE 3.25Å; D854-K858 IonicContact OD2-NZ 2.75Å; D854-K858 PolarHBondContact OD2-NZ 2.58Å; D854-R2372 VanDerWaalsContact C-NH2 3.26Å
855	N	52.7	Low	49.2	Very low	78 Å²	78	85.7 Å²	85.7	42%	0.417	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	34.5	176.6	-60.2	-44	0	0	0	116.2	E851 R2372	E851-N855 VanDerWaalsContact O-CB 3.29Å; E851-N855 WeakPolarHBondContact O-CB 3.37Å; E851-N855 PolarHBondContact O-N 3.18Å; E851-N855 VanDerWaalsContact O-N 3.16Å; E851-N855 PolarHBondContact O-ND2 3.39Å; E851-N855 VanDerWaalsContact O-ND2 3.15Å; N855-R2372 VanDerWaalsContact C-CZ 3.41Å; N855-R2372 PolarHBondContact O-NE 2.76Å
856	G	49.3	Very low	47.9	Very low	10 Å²	10	87.7 Å²	87.7	10%	0.103	45%	0.45	C	S	.	.	H	α-helix	trans	-164.6	-36.6	-172.1	0	0	0	0	0	110.8	D854 S859 N860 R2372	D854-G856 PolarHBondContact O-N 3.49Å; G856-S859 CarbonylContact O-C 3.26Å; G856-S859 PolarHBondContact O-N 3.13Å; G856-N860 WeakPolarHBondContact O-CB 3.21Å; G856-N860 VanDerWaalsContact O-CG 3.24Å; G856-N860 PolarHBondContact O-N 2.8Å; G856-N860 PolarHBondContact O-ND2 2.85Å; G856-R2372 VanDerWaalsContact CA-CZ 3.41Å; G856-R2372 VanDerWaalsContact CA-NH1 3.34Å; G856-R2372 VanDerWaalsContact N-CZ 3.3Å
857	D	46.1	Very low	46.6	Very low	83 Å²	83	90.8 Å²	90.8	44%	0.444	47%	0.473	S	S	.	.	H	α-helix	trans	-69.8	-43.1	159.7	-59.8	-26.7	0	0	0	109.8	T853 D854 S859 N860 N861	T853-D857 VanDerWaalsContact O-CG 3.25Å; T853-D857 PolarHBondContact O-N 3.43Å; T853-D857 VanDerWaalsContact O-OD2 3.08Å; D854-D857 PolarHBondContact O-N 3.15Å; D857-S859 VanDerWaalsContact C-N 3.26Å; D857-S859 PolarHBondContact O-N 2.94Å; D857-N860 PolarHBondContact O-N 2.76Å; D857-N860 VanDerWaalsContact O-N 3.16Å; D857-N861 WeakPolarHBondContact O-CB 2.89Å; D857-N861 PolarHBondContact O-N 3.04Å
858	K	47.3	Very low	45.1	Very low	104 Å²	104	97 Å²	97	45%	0.452	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-31.5	167.1	-67.7	167.9	174.2	168.1	0	112.6	D854 N862	D854-K858 HydrophobicContact CB-CD 4.37Å; D854-K858 WeakPolarHBondContact O-CB 3.27Å; D854-K858 VanDerWaalsContact O-CG 3.3Å; D854-K858 WeakPolarHBondContact O-CG 3.17Å; D854-K858 PolarHBondContact O-N 3.48Å; D854-K858 WeakPolarHBondContact OD2-CE 3.25Å; D854-K858 IonicContact OD2-NZ 2.75Å; D854-K858 PolarHBondContact OD2-NZ 2.58Å; K858-N862 WeakPolarHBondContact O-CB 3.46Å; K858-N862 PolarHBondContact O-N 2.9Å; K858-N862 PolarHBondContact O-OD1 3.06Å
859	S	45.5	Very low	43.6	Very low	46 Å²	46	99.2 Å²	99.2	32%	0.322	52%	0.516	S	S	.	.	H	α-helix	trans	-77.4	-25	175.7	-145.2	0	0	0	0	112.2	G856 D857 N2369	G856-S859 CarbonylContact O-C 3.26Å; G856-S859 PolarHBondContact O-N 3.13Å; D857-S859 VanDerWaalsContact C-N 3.26Å; D857-S859 PolarHBondContact O-N 2.94Å; S859-N2369 WeakPolarHBondContact CB-OD1 3.43Å; S859-N2369 PolarHBondContact O-ND2 3.19Å; S859-N2369 PolarHBondContact O-OD1 3.34Å; S859-N2369 PolarHBondContact OG-OD1 2.99Å
860	N	41.5	Very low	42.5	Very low	75 Å²	75	104 Å²	104	40%	0.401	54%	0.54	S	S	.	.	H	α-helix	trans	-78	-38.9	171.4	-80.5	-30.3	0	0	0	111.3	G856 D857 N2369	G856-N860 WeakPolarHBondContact O-CB 3.21Å; G856-N860 VanDerWaalsContact O-CG 3.24Å; G856-N860 PolarHBondContact O-N 2.8Å; G856-N860 PolarHBondContact O-ND2 2.85Å; D857-N860 PolarHBondContact O-N 2.76Å; D857-N860 VanDerWaalsContact O-N 3.16Å; N860-N2369 WeakPolarHBondContact CA-ND2 3.38Å; N860-N2369 PolarHBondContact N-ND2 3.27Å; N860-N2369 PolarHBondContact OD1-ND2 3.46Å
861	N	45.6	Very low	41.4	Very low	106 Å²	106	104 Å²	104	57%	0.567	54%	0.543	S	S	*	.	H	α-helix	trans	-81.7	-38.8	-174.3	-67.5	-8.1	0	0	0	113.4	D857 E863 N864	D857-N861 WeakPolarHBondContact O-CB 2.89Å; D857-N861 PolarHBondContact O-N 3.04Å; N861-E863 PolarHBondContact O-N 3.31Å; N861-N864 PolarHBondContact O-N 3.47Å; N861-N864 VanDerWaalsContact O-N 3.15Å
862	N	44.1	Very low	40	Very low	119 Å²	119	104.4 Å²	104.4	64%	0.636	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-0.6	-176.1	-76.3	14.7	0	0	0	115	K858	K858-N862 WeakPolarHBondContact O-CB 3.46Å; K858-N862 PolarHBondContact O-N 2.9Å; K858-N862 PolarHBondContact O-OD1 3.06Å
863	E	41.1	Very low	39	Very low	73 Å²	73	108.2 Å²	108.2	34%	0.341	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.9	9	177	-71.2	-168.6	-167.8	0	0	114	N861 L2367 K2368	N861-E863 PolarHBondContact O-N 3.31Å; E863-L2367 WeakPolarHBondContact OE1-CA 3.09Å; E863-K2368 PolarHBondContact OE1-N 3.41Å; E863-K2368 WeakPolarHBondContact OE2-CD 3.48Å; E863-K2368 WeakPolarHBondContact OE2-CE 3.08Å; E863-K2368 WeakPolarHBondContact OE2-CG 3.37Å; E863-K2368 IonicContact OE2-NZ 3.26Å; E863-K2368 PolarHBondContact OE2-NZ 3.18Å
864	N	35.8	Very low	37.8	Very low	121 Å²	121	112.5 Å²	112.5	65%	0.647	59%	0.585	S	S	*	*	S	Bend	trans	-120.5	-1	-173.7	-64.7	-6.4	0	0	0	114.9	N861 K2368	N861-N864 PolarHBondContact O-N 3.47Å; N861-N864 VanDerWaalsContact O-N 3.15Å; N864-K2368 PolarHBondContact OD1-NZ 3.16Å
865	E	33.7	Very low	37	Very low	180 Å²	180	111.5 Å²	111.5	84%	0.841	59%	0.593	S	S	*	*	S	Bend	trans	-135.8	27.7	-166.5	-148.3	176.3	-168.7	0	0	116.5
866	V	30.8	Very low	36	Very low	135 Å²	135	114.7 Å²	114.7	82%	0.818	61%	0.605	S	S	*	*			trans	-136.8	81.8	168.5	-171.2	0	0	0	0	112.5
867	T	29.1	Very low	35.2	Very low	141 Å²	141	123 Å²	123	87%	0.865	63%	0.633	S	S	*	*				174.4	121.1	129.9	24.1	0	0	0	0	112.3
868	R	25.7	Very low	34.6	Very low	189 Å²	189	124 Å²	124	71%	0.713	64%	0.639	S	S	*	*				169	125.1	111.2	-176.6	169.2	-172.5	140.6	-0.4	112.4	D871	R868-D871 IonicContact CZ-OD1 3.69Å; R868-D871 VanDerWaalsContact CZ-OD1 3.3Å; R868-D871 IonicContact CZ-OD2 3.92Å; R868-D871 IonicContact NE-OD1 3.57Å; R868-D871 PolarHBondContact NE-OD1 2.95Å; R868-D871 IonicContact NE-OD2 3.67Å; R868-D871 VanDerWaalsContact NH2-CG 3.26Å; R868-D871 IonicContact NH2-OD1 2.81Å; R868-D871 PolarHBondContact NH2-OD1 2.85Å; R868-D871 IonicContact NH2-OD2 3.5Å; R868-D871 PolarHBondContact NH2-OD2 3.07Å
869	S	26.9	Very low	33.9	Very low	109 Å²	109	126.3 Å²	126.3	76%	0.762	65%	0.649	S	S	*	*			trans	-177.3	144.5	159.1	-72.1	0	0	0	0	108
870	E	30	Very low	33.6	Very low	182 Å²	182	129.3 Å²	129.3	85%	0.85	66%	0.661	S	S	*	*	S	Bend	cis	-154.4	140.2	-26.8	-91.4	-167.5	107.6	0	0	106.2
871	D	30	Very low	33.2	Very low	79 Å²	79	128 Å²	128	42%	0.422	65%	0.654	S	S	.	*			cis	-160.1	-164.5	-27.8	-149.2	80.9	0	0	0	109.3	R868	R868-D871 IonicContact CZ-OD1 3.69Å; R868-D871 VanDerWaalsContact CZ-OD1 3.3Å; R868-D871 IonicContact CZ-OD2 3.92Å; R868-D871 IonicContact NE-OD1 3.57Å; R868-D871 PolarHBondContact NE-OD1 2.95Å; R868-D871 IonicContact NE-OD2 3.67Å; R868-D871 VanDerWaalsContact NH2-CG 3.26Å; R868-D871 IonicContact NH2-OD1 2.81Å; R868-D871 PolarHBondContact NH2-OD1 2.85Å; R868-D871 IonicContact NH2-OD2 3.5Å; R868-D871 PolarHBondContact NH2-OD2 3.07Å
872	I	28.7	Very low	32.9	Very low	137 Å²	137	130.5 Å²	130.5	70%	0.703	66%	0.656	S	S	*	*			trans	56.8	-158.3	-178.2	-2.4	176.6	0	0	0	112	E874	I872-E874 HydrophobicContact CG2-CB 4.25Å; I872-E874 HydrophobicContact CG2-CG 3.91Å
873	I	31.8	Very low	32.5	Very low	161 Å²	161	128 Å²	128	83%	0.826	64%	0.642	S	S	*	*			cis	-138.7	133.2	6.5	-57.4	165.8	0	0	0	106.5
874	E	27.2	Very low	32.1	Very low	158 Å²	158	131.6 Å²	131.6	74%	0.738	65%	0.653	S	S	*	*			cis	-159.3	158.3	-22	-156.1	-77.2	-73.1	0	0	105.9	I872	I872-E874 HydrophobicContact CG2-CB 4.25Å; I872-E874 HydrophobicContact CG2-CG 3.91Å
875	G	33.9	Very low	31.9	Very low	56 Å²	56	129.8 Å²	129.8	58%	0.577	64%	0.641	S	S	*	*			trans	157.9	126.9	175.1	0	0	0	0	0	114.5
876	E	32.2	Very low	31.6	Very low	145 Å²	145	125 Å²	125	68%	0.678	63%	0.627	S	S	*	*	S	Bend	trans	68.2	68.7	159.9	-154.3	77.1	-72.9	0	0	118
877	R	31.8	Very low	31.8	Very low	185 Å²	185	125 Å²	125	70%	0.698	62%	0.621	S	S	*	*			trans	67.7	119.3	131.9	-81.7	-173.1	-75.9	166.2	-2.6	120.9
878	D	33.5	Very low	32.5	Very low	103 Å²	103	121.7 Å²	121.7	55%	0.551	60%	0.598	S	S	*	*				84.8	128.5	123.3	-81.2	-34.4	0	0	0	120.9
879	K	33.4	Very low	33	Very low	153 Å²	153	116.8 Å²	116.8	67%	0.665	59%	0.586	S	S	*	*			trans	54	99.7	133.1	-56.7	161	-171.9	130.7	0	114.8
880	D	40	Very low	33.4	Very low	108 Å²	108	119.7 Å²	119.7	58%	0.578	58%	0.581	S	S	*	*			cis	-154.2	141.3	49	-94.6	-8.9	0	0	0	112.1	R882	D880-R882 IonicContact OD2-CZ 2.73Å; D880-R882 IonicContact OD2-NE 2.7Å; D880-R882 IonicContact OD2-NH2 3.67Å; D880-R882 PolarHBondContact OD2-NH2 3.36Å
881	N	31.4	Very low	33.6	Very low	49 Å²	49	117.9 Å²	117.9	26%	0.262	57%	0.57	S	S	.	*				65.8	75.5	58.7	-60.7	-50.9	0	0	0	114.2	I900	N881-I900 CarbonylContact C-O 3.15Å; N881-I900 VanDerWaalsContact C-O 3.26Å; N881-I900 HydrophobicContact CB-CB 4Å; N881-I900 HydrophobicContact CB-CD1 4.24Å; N881-I900 HydrophobicContact CB-CG1 3.88Å; N881-I900 PolarHBondContact OD1-N 3.42Å
882	R	40.1	Very low	33.8	Very low	158 Å²	158	120 Å²	120	60%	0.596	59%	0.586	S	S	*	*			trans	-160.8	83.7	162.4	-109.5	137.8	-101.7	-104.4	15.4	116.7	D880 I900 T902	D880-R882 IonicContact OD2-CZ 2.73Å; D880-R882 IonicContact OD2-NE 2.7Å; D880-R882 IonicContact OD2-NH2 3.67Å; D880-R882 PolarHBondContact OD2-NH2 3.36Å; R882-I900 CarbonylContact C-O 3.43Å; R882-I900 WeakPolarHBondContact CA-O 3.45Å; R882-I900 PolarHBondContact N-O 3.42Å; R882-T902 VanDerWaalsContact CG-OG1 3.27Å; R882-T902 WeakPolarHBondContact CG-OG1 3.25Å; R882-T902 PolarHBondContact NH1-OG1 3.11Å
883	I	35.3	Very low	33.8	Very low	67 Å²	67	118.2 Å²	118.2	34%	0.344	59%	0.585	S	S	.	*			trans	78.2	144.5	151.8	-128.1	158.2	0	0	0	118.1	I900 N901 T902 E903	I883-I900 PolarHBondContact N-O 3.31Å; I883-N901 WeakPolarHBondContact CA-OD1 3.22Å; I883-N901 HydrophobicContact CB-CB 4.24Å; I883-N901 HydrophobicContact CD1-CB 3.92Å; I883-N901 HydrophobicContact CG1-CB 3.71Å; I883-T902 VanDerWaalsContact CG2-O 3.27Å; I883-T902 WeakPolarHBondContact CG2-O 3.31Å; I883-E903 WeakPolarHBondContact CG2-O 3.46Å
884	Y	32.6	Very low	33.7	Very low	147 Å²	147	116.2 Å²	116.2	58%	0.576	58%	0.581	S	S	*	*			cis	73.6	-170.3	21.1	-76.1	-141.7	0	0	0	113.6	N901	Y884-N901 WeakPolarHBondContact CB-OD1 3.46Å
885	Q	31.2	Very low	33.7	Very low	83 Å²	83	114.1 Å²	114.1	39%	0.388	58%	0.579	S	S	.	*				-111.3	159.2	-75.6	-101.9	-179.5	-49.8	0	0	107.6	I887 D888 K905	Q885-I887 HydrophobicContact CB-CG1 4.39Å; Q885-I887 HydrophobicContact CG-CG1 4.49Å; Q885-D888 PolarHBondContact NE2-OD1 3.21Å; Q885-K905 PolarHBondContact O-NZ 3.02Å
886	S	29.1	Very low	33.5	Very low	80 Å²	80	117.4 Å²	117.4	56%	0.559	59%	0.588	S	S	*	*	S	Bend		-77.1	149.8	56.2	77.9	0	0	0	0	112.1
887	I	35.1	Very low	33.5	Very low	134 Å²	134	115.6 Å²	115.6	69%	0.687	59%	0.587	S	S	*	*	S	Bend		47.5	63.2	55.7	-45.4	176.4	0	0	0	109.6	Q885	Q885-I887 HydrophobicContact CB-CG1 4.39Å; Q885-I887 HydrophobicContact CG-CG1 4.49Å
888	D	41.8	Very low	33.6	Very low	72 Å²	72	112.4 Å²	112.4	39%	0.385	59%	0.588	S	S	.	*			cis	-154.7	161.9	4.5	-123.1	12.6	0	0	0	106.1	Q885 R890	Q885-D888 PolarHBondContact NE2-OD1 3.21Å; D888-R890 IonicContact OD2-CZ 3.48Å; D888-R890 IonicContact OD2-NH1 2.87Å; D888-R890 IonicContact OD2-NH2 3.85Å; D888-R890 PolarHBondContact OD2-NH2 2.96Å
889	D	37.5	Very low	33.6	Very low	87 Å²	87	112.5 Å²	112.5	47%	0.465	59%	0.588	S	S	.	*				32.7	120.4	90.6	-168.8	21	0	0	0	110.7	K891	D889-K891 WeakPolarHBondContact OD1-CE 3.3Å; D889-K891 WeakPolarHBondContact OD2-CE 3.28Å; D889-K891 IonicContact OD2-NZ 3.64Å; D889-K891 PolarHBondContact OD2-NZ 3.05Å
890	R	34.2	Very low	33.7	Very low	170 Å²	170	109.4 Å²	109.4	64%	0.642	58%	0.578	S	S	*	*				175.2	100.7	104.4	-87.6	-176.3	179.6	134.3	35.8	113.9	D888	D888-R890 IonicContact OD2-CZ 3.48Å; D888-R890 IonicContact OD2-NH1 2.87Å; D888-R890 IonicContact OD2-NH2 3.85Å; D888-R890 PolarHBondContact OD2-NH2 2.96Å
891	K	34.6	Very low	33.1	Very low	143 Å²	143	107.5 Å²	107.5	62%	0.622	57%	0.567	S	S	*	*				71.5	164.4	118.9	-70	171.1	-165.5	168.9	0	116.1	D889	D889-K891 WeakPolarHBondContact OD1-CE 3.3Å; D889-K891 WeakPolarHBondContact OD2-CE 3.28Å; D889-K891 IonicContact OD2-NZ 3.64Å; D889-K891 PolarHBondContact OD2-NZ 3.05Å
892	T	34.4	Very low	33.4	Very low	124 Å²	124	108.1 Å²	108.1	76%	0.761	57%	0.573	S	S	*	*			cis	-144.3	145.2	12.1	-18	0	0	0	0	106.3
893	S	28.1	Very low	33	Very low	99 Å²	99	109 Å²	109	69%	0.692	58%	0.584	S	S	*	*	S	Bend	cis	-155.6	166.5	18.2	-38.2	0	0	0	0	107.3
894	T	30.7	Very low	32.6	Very low	120 Å²	120	109.1 Å²	109.1	74%	0.736	59%	0.59	S	S	*	*			cis	-164.4	135.4	31.5	-68.6	0	0	0	0	109.9
895	T	26.6	Very low	32.3	Very low	114 Å²	114	108.9 Å²	108.9	70%	0.699	59%	0.592	S	S	*	*			trans	54	80.1	158.7	-51.3	0	0	0	0	117.2
896	T	29.1	Very low	32.4	Very low	124 Å²	124	112.1 Å²	112.1	76%	0.761	61%	0.611	S	S	*	*				69.5	136.3	68.6	-46.8	0	0	0	0	112.8
897	T	32.7	Very low	32.3	Very low	108 Å²	108	114.1 Å²	114.1	66%	0.663	62%	0.621	S	S	*	*				178.4	138.2	86.4	-53.6	0	0	0	0	114.4
898	T	33.9	Very low	31.7	Very low	118 Å²	118	115.9 Å²	115.9	72%	0.724	63%	0.626	S	S	*	*			trans	68	143	155.1	47.7	0	0	0	0	123.5
899	I	33.4	Very low	30.9	Very low	104 Å²	104	117 Å²	117	53%	0.533	64%	0.635	S	S	.	*			cis	-152.7	-75.3	-2.5	-179.7	166.5	0	0	0	120.4
900	I	36.4	Very low	30.5	Very low	89 Å²	89	119.8 Å²	119.8	46%	0.456	65%	0.645	S	S	.	*			trans	-94	-179.7	-144.9	-5	167.7	0	0	0	118.8	N881 R882 I883	N881-I900 CarbonylContact C-O 3.15Å; N881-I900 VanDerWaalsContact C-O 3.26Å; N881-I900 HydrophobicContact CB-CB 4Å; N881-I900 HydrophobicContact CB-CD1 4.24Å; N881-I900 HydrophobicContact CB-CG1 3.88Å; N881-I900 PolarHBondContact OD1-N 3.42Å; R882-I900 CarbonylContact C-O 3.43Å; R882-I900 WeakPolarHBondContact CA-O 3.45Å; R882-I900 PolarHBondContact N-O 3.42Å; I883-I900 PolarHBondContact N-O 3.31Å
901	N	27.9	Very low	30.4	Very low	67 Å²	67	119.9 Å²	119.9	36%	0.358	65%	0.653	S	S	.	*			trans	-142.5	124.6	-141.1	-69.4	-16.1	0	0	0	117.3	I883 Y884	I883-N901 WeakPolarHBondContact CA-OD1 3.22Å; I883-N901 HydrophobicContact CB-CB 4.24Å; I883-N901 HydrophobicContact CD1-CB 3.92Å; I883-N901 HydrophobicContact CG1-CB 3.71Å; Y884-N901 WeakPolarHBondContact CB-OD1 3.46Å
902	T	36.3	Very low	31	Very low	62 Å²	62	118.8 Å²	118.8	38%	0.38	65%	0.649	S	S	.	*			trans	-163.1	154	150.2	-19.7	0	0	0	0	113.5	R882 I883	R882-T902 VanDerWaalsContact CG-OG1 3.27Å; R882-T902 WeakPolarHBondContact CG-OG1 3.25Å; R882-T902 PolarHBondContact NH1-OG1 3.11Å; I883-T902 VanDerWaalsContact CG2-O 3.27Å; I883-T902 WeakPolarHBondContact CG2-O 3.31Å
903	E	31.6	Very low	31.1	Very low	178 Å²	178	120.2 Å²	120.2	83%	0.832	65%	0.646	S	S	*	*			trans	72.4	113	170	-71.7	-173.6	-164.7	0	0	121	I883	I883-E903 WeakPolarHBondContact CG2-O 3.46Å
904	S	28.2	Very low	31.7	Very low	68 Å²	68	121 Å²	121	48%	0.476	64%	0.642	S	S	.	*			trans	-160.2	156.2	-178.8	70.1	0	0	0	0	110.3
905	K	25.6	Very low	31.7	Very low	143 Å²	143	121.1 Å²	121.1	62%	0.622	64%	0.638	S	S	*	*			trans	68.5	132.7	162	-70.8	152.4	179.5	163.3	0	114.5	Q885	Q885-K905 PolarHBondContact O-NZ 3.02Å
906	L	32.8	Very low	31.9	Very low	150 Å²	150	120.6 Å²	120.6	79%	0.785	63%	0.634	S	S	*	*				67	133.2	61.1	-174	75.7	0	0	0	111.1
907	T	27.2	Very low	31.9	Very low	123 Å²	123	120.2 Å²	120.2	76%	0.755	63%	0.632	S	S	*	*			trans	69.5	147.3	-162.9	75.5	0	0	0	0	111.4
908	E	22.2	Very low	32.7	Very low	170 Å²	170	123.2 Å²	123.2	79%	0.794	64%	0.639	S	S	*	*			cis	-130.5	171.3	17.9	-73.2	-179.8	117.6	0	0	113.7
909	V	25.8	Very low	32.5	Very low	97 Å²	97	124 Å²	124	59%	0.588	64%	0.637	S	S	*	*			trans	20.8	122.9	131.9	-172	0	0	0	0	115.4
910	H	28.9	Very low	32.1	Very low	145 Å²	145	124.9 Å²	124.9	67%	0.671	64%	0.643	S	S	*	*				-135.7	137.9	64.8	-79.3	-81.8	0	0	0	115.1	E912	H910-E912 CarbonylContact C-O 2.94Å; H910-E912 VanDerWaalsContact C-O 3.25Å; H910-E912 HydrophobicContact CB-CB 3.53Å; H910-E912 IonicContact CE1-OE2 2.83Å; H910-E912 PolarHBondContact CE1-OE2 3.43Å; H910-E912 VanDerWaalsContact CE1-OE2 3.32Å; H910-E912 IonicContact CG-OE2 2.58Å; H910-E912 VanDerWaalsContact ND1-CB 3.26Å; H910-E912 WeakPolarHBondContact ND1-CB 3.37Å; H910-E912 IonicContact ND1-OE1 2.75Å; H910-E912 IonicContact ND1-OE2 2.7Å; H910-E912 PolarHBondContact ND1-OE2 2.77Å
911	H	32.7	Very low	32.4	Very low	172 Å²	172	126 Å²	126	80%	0.796	65%	0.65	S	S	*	*			trans	-153.5	38.4	171.9	-173.6	-54.9	0	0	0	106.9	F913	H911-F913 VanDerWaalsContact C-N 3.26Å
912	E	46.4	Very low	33.2	Very low	119 Å²	119	130.4 Å²	130.4	56%	0.556	67%	0.668	S	S	*	*			cis	11.4	67	45.8	-78.7	147.1	143.6	0	0	113.3	H910	H910-E912 CarbonylContact C-O 2.94Å; H910-E912 VanDerWaalsContact C-O 3.25Å; H910-E912 HydrophobicContact CB-CB 3.53Å; H910-E912 IonicContact CE1-OE2 2.83Å; H910-E912 PolarHBondContact CE1-OE2 3.43Å; H910-E912 VanDerWaalsContact CE1-OE2 3.32Å; H910-E912 IonicContact CG-OE2 2.58Å; H910-E912 VanDerWaalsContact ND1-CB 3.26Å; H910-E912 WeakPolarHBondContact ND1-CB 3.37Å; H910-E912 IonicContact ND1-OE1 2.75Å; H910-E912 IonicContact ND1-OE2 2.7Å; H910-E912 PolarHBondContact ND1-OE2 2.77Å
913	F	35.9	Very low	32.9	Very low	155 Å²	155	130.2 Å²	130.2	68%	0.68	66%	0.664	S	S	*	*			cis	64.7	166.1	47.5	-124.9	-127.6	0	0	0	109	H911	H911-F913 VanDerWaalsContact C-N 3.26Å
914	N	40.9	Very low	33.1	Very low	114 Å²	114	124.3 Å²	124.3	61%	0.61	64%	0.639	S	S	*	*			trans	68.3	63.1	-165.6	-36.5	-72.2	0	0	0	110.5	V916	N914-V916 PolarHBondContact O-N 3.35Å
915	D	30.9	Very low	33.2	Very low	124 Å²	124	123.6 Å²	123.6	66%	0.663	63%	0.629	S	S	*	*				60.8	14.8	74.4	-46.9	-54.3	0	0	0	114.1
916	V	30.8	Very low	33.4	Very low	102 Å²	102	121.6 Å²	121.6	62%	0.618	63%	0.626	S	S	*	*			trans	-116.3	27.6	176.1	-155.9	0	0	0	0	112.6	N914	N914-V916 PolarHBondContact O-N 3.35Å
917	T	30.1	Very low	33.9	Very low	117 Å²	117	119 Å²	119	72%	0.718	62%	0.617	S	S	*	*	S	Bend	trans	-123	-1.5	174.3	-26.6	0	0	0	0	114.3	L919	T917-L919 PolarHBondContact O-N 3.05Å; T917-L919 VanDerWaalsContact O-N 3.09Å
918	Q	48.3	Very low	33.9	Very low	171 Å²	171	120.5 Å²	120.5	80%	0.799	62%	0.619	S	S	*	*	S	Bend	trans	-66.8	1.3	164.3	-87	-176.2	-21.6	0	0	113.4
919	L	29.5	Very low	34.1	Very low	133 Å²	133	119.3 Å²	119.3	70%	0.696	62%	0.617	S	S	*	*	S	Bend	trans	-139	-15.9	-162.6	-86.7	170.8	0	0	0	118.8	T917	T917-L919 PolarHBondContact O-N 3.05Å; T917-L919 VanDerWaalsContact O-N 3.09Å
920	L	25.8	Very low	33.9	Very low	124 Å²	124	121.3 Å²	121.3	65%	0.649	62%	0.62	S	S	*	*	S	Bend	trans	-118.7	-51.1	-165.4	-116.5	80.3	0	0	0	117.7	Q922 L923	L920-Q922 PolarHBondContact O-N 2.68Å; L920-L923 WeakPolarHBondContact O-CD1 3.23Å
921	D	42.5	Very low	33.7	Very low	112 Å²	112	122.2 Å²	122.2	60%	0.599	62%	0.624	S	S	*	*			trans	-83.4	36.4	-169.9	-136.1	17.9	0	0	0	113.2	L923	D921-L923 PolarHBondContact O-N 3.01Å
922	Q	45.1	Very low	33.3	Very low	160 Å²	160	117.8 Å²	117.8	75%	0.748	63%	0.625	S	S	*	*			trans	-76.9	26.2	-172.3	-157.5	172.9	44	0	0	111.9	L920	L920-Q922 PolarHBondContact O-N 2.68Å
923	L	29.9	Very low	32.2	Very low	57 Å²	57	119.7 Å²	119.7	30%	0.298	64%	0.639	S	S	.	*			trans	-148.6	11	-130.5	-82.8	175.8	0	0	0	119	L920 D921 K2033 P2034	L920-L923 WeakPolarHBondContact O-CD1 3.23Å; D921-L923 PolarHBondContact O-N 3.01Å; L923-K2033 HydrophobicContact CD1-CB 3.67Å; L923-K2033 HydrophobicContact CD2-CB 4.17Å; L923-K2033 HydrophobicContact CG-CB 4.38Å; L923-K2033 CarbonylContact O-C 3.48Å; L923-K2033 VanDerWaalsContact O-C 3.22Å; L923-P2034 VanDerWaalsContact C-C 3.48Å; L923-P2034 CarbonylContact C-O 3.22Å; L923-P2034 WeakPolarHBondContact CB-O 3.44Å; L923-P2034 CarbonylContact O-C 3.54Å; L923-P2034 WeakPolarHBondContact O-CA 3.4Å; L923-P2034 VanDerWaalsContact O-N 3.12Å
924	N	34.9	Very low	31.7	Very low	55 Å²	55	115.6 Å²	115.6	29%	0.294	63%	0.634	S	S	.	*			trans	68.6	142.7	143.4	-164.9	40.5	0	0	0	119.7	P120 P2034 S2035	P120-N924 PolarHBondContact O-ND2 2.91Å; N924-P2034 CarbonylContact O-C 3.07Å; N924-P2034 VanDerWaalsContact O-C 3.24Å; N924-P2034 WeakPolarHBondContact O-CA 3.1Å; N924-S2035 PolarHBondContact O-N 3.27Å; N924-S2035 VanDerWaalsContact O-N 3.07Å
925	L	31.9	Very low	31	Very low	52 Å²	52	114.7 Å²	114.7	27%	0.272	63%	0.629	S	S	.	*			trans	71.8	119.9	170.8	-51.8	147.5	0	0	0	115.7	K119 P120 S2035 L2036	K119-L925 HydrophobicContact CB-CD1 4.24Å; K119-L925 HydrophobicContact CD-CB 4.22Å; K119-L925 HydrophobicContact CD-CD1 4.42Å; K119-L925 PolarHBondContact NZ-O 3.24Å; P120-L925 WeakPolarHBondContact O-CD1 3.35Å; L925-S2035 VanDerWaalsContact C-C 3.48Å; L925-S2035 CarbonylContact C-O 3.55Å; L925-S2035 CarbonylContact O-C 3.01Å; L925-S2035 PolarHBondContact O-N 3.18Å; L925-S2035 VanDerWaalsContact O-N 3.12Å; L925-L2036 PolarHBondContact O-N 2.96Å
926	D	29.6	Very low	30.8	Very low	102 Å²	102	117.8 Å²	117.8	55%	0.545	63%	0.631	S	S	.	*				-146.4	120.9	75.3	-67.9	-40.6	0	0	0	115.1	K119 S2035	K119-D926 IonicContact NZ-OD1 3.28Å; K119-D926 PolarHBondContact NZ-OD1 3.29Å; K119-D926 IonicContact NZ-OD2 2.62Å; K119-D926 PolarHBondContact NZ-OD2 2.84Å; D926-S2035 PolarHBondContact N-O 2.68Å
927	P	42.6	Very low	30.9	Very low	95 Å²	95	122.1 Å²	122.1	62%	0.617	64%	0.636	S	S	*	*			trans	-98.6	179.9	161.1	38.5	-33	0	0	0	111.9
928	I	27.5	Very low	30.9	Very low	154 Å²	154	119.5 Å²	119.5	79%	0.79	62%	0.618	S	S	*	*			trans	87	167.9	-163.2	-52.1	157	0	0	0	109.7
929	I	25.4	Very low	29.9	Very low	146 Å²	146	119.7 Å²	119.7	75%	0.749	62%	0.616	S	S	*	*			trans	77.9	120.4	-170.6	-54.7	-178.1	0	0	0	113.1
930	E	22.5	Very low	29.8	Very low	139 Å²	139	118.8 Å²	118.8	65%	0.65	61%	0.612	S	S	*	*			cis	-158.3	-170.9	-21.2	-144.9	106.6	-104.5	0	0	112.6	G932	E930-G932 PolarHBondContact O-N 3.47Å
931	E	24	Very low	29.8	Very low	164 Å²	164	120.8 Å²	120.8	77%	0.766	61%	0.611	S	S	*	*			trans	-45.4	101.1	164.3	-59.4	176.3	134.8	0	0	114.1	D933	E931-D933 PolarHBondContact O-N 3.01Å; E931-D933 VanDerWaalsContact O-N 3.13Å
932	G	25.3	Very low	29	Very low	78 Å²	78	121 Å²	121	80%	0.804	61%	0.608	S	S	*	*			trans	44.8	-102.6	143.2	0	0	0	0	0	118	E930 A934	E930-G932 PolarHBondContact O-N 3.47Å; G932-A934 PolarHBondContact O-N 3.27Å
933	D	23.1	Very low	28.2	Very low	159 Å²	159	117.6 Å²	117.6	85%	0.85	60%	0.595	S	S	*	*			trans	-12.3	111.7	179.3	-61.2	7.7	0	0	0	116	E931	E931-D933 PolarHBondContact O-N 3.01Å; E931-D933 VanDerWaalsContact O-N 3.13Å
934	A	25.3	Very low	28	Very low	69 Å²	69	121.3 Å²	121.3	57%	0.57	61%	0.609	S	S	*	*			cis	-166.4	-167.8	7.2	0	0	0	0	0	110.7	G932	G932-A934 PolarHBondContact O-N 3.27Å
935	D	26.4	Very low	27.6	Very low	95 Å²	95	128 Å²	128	51%	0.508	63%	0.63	S	S	.	*			trans	33.4	109.4	136.2	-55.1	-16.1	0	0	0	118.8	R937	D935-R937 HydrophobicContact CB-CB 3.79Å; D935-R937 HydrophobicContact CB-CG 3.72Å; D935-R937 IonicContact OD2-CZ 2.73Å; D935-R937 IonicContact OD2-NE 2.67Å; D935-R937 PolarHBondContact OD2-NE 3.46Å; D935-R937 IonicContact OD2-NH2 3.13Å; D935-R937 PolarHBondContact OD2-NH2 2.9Å
936	R	25.5	Very low	27.5	Very low	190 Å²	190	135.4 Å²	135.4	72%	0.717	66%	0.655	S	S	*	*				-88.8	115.7	112.9	-81.5	-170	167.3	-173.6	-3.6	107.2	L938	R936-L938 HydrophobicContact CG-CD1 4.42Å
937	R	33.5	Very low	27.6	Very low	192 Å²	192	135.8 Å²	135.8	73%	0.725	66%	0.661	S	S	*	*			cis	37.8	107.4	25.3	-81.2	-171.1	-129.8	-171.2	10	112.6	D935	D935-R937 HydrophobicContact CB-CB 3.79Å; D935-R937 HydrophobicContact CB-CG 3.72Å; D935-R937 IonicContact OD2-CZ 2.73Å; D935-R937 IonicContact OD2-NE 2.67Å; D935-R937 PolarHBondContact OD2-NE 3.46Å; D935-R937 IonicContact OD2-NH2 3.13Å; D935-R937 PolarHBondContact OD2-NH2 2.9Å
938	L	30.5	Very low	27.1	Very low	62 Å²	62	137.7 Å²	137.7	33%	0.325	67%	0.666	S	S	.	*			trans	85.4	117.3	-149	-57	154.3	0	0	0	110.3	R936 D940 R941	R936-L938 HydrophobicContact CG-CD1 4.42Å; L938-D940 WeakPolarHBondContact CA-O 3.42Å; L938-D940 PolarHBondContact N-O 3.05Å; L938-R941 HydrophobicContact CD2-CB 4.29Å; L938-R941 HydrophobicContact CD2-CG 4.1Å
939	F	28.1	Very low	27.5	Very low	175 Å²	175	136.7 Å²	136.7	77%	0.768	66%	0.662	S	S	*	*	S	Bend	cis	-110.3	139.2	-13	-67.2	-96	0	0	0	107.9	R941	F939-R941 WeakPolarHBondContact CD1-O 3.47Å
940	D	25.5	Very low	28.1	Very low	114 Å²	114	136.6 Å²	136.6	61%	0.61	66%	0.66	S	S	*	*			cis	-71.4	170.2	6.8	-65	-70.8	0	0	0	115.7	L938 E942	L938-D940 WeakPolarHBondContact CA-O 3.42Å; L938-D940 PolarHBondContact N-O 3.05Å; D940-E942 HydrophobicContact CB-CB 4.45Å; D940-E942 PolarHBondContact OD1-N 2.82Å
941	R	26	Very low	28.7	Very low	167 Å²	167	136 Å²	136	63%	0.63	66%	0.661	S	S	*	*			cis	0.8	93.1	-17.6	-56.1	177.3	99.1	158.2	5.8	115.9	L938 F939 D943	L938-R941 HydrophobicContact CD2-CB 4.29Å; L938-R941 HydrophobicContact CD2-CG 4.1Å; F939-R941 WeakPolarHBondContact CD1-O 3.47Å; R941-D943 HydrophobicContact CB-CB 3.67Å; R941-D943 HydrophobicContact CG-CB 3.95Å; R941-D943 IonicContact CZ-OD2 2.65Å; R941-D943 IonicContact NE-OD2 2.76Å; R941-D943 PolarHBondContact NE-OD2 2.81Å; R941-D943 IonicContact NH2-OD2 3.01Å; R941-D943 PolarHBondContact NH2-OD2 3.23Å
942	E	26.2	Very low	29.5	Very low	115 Å²	115	132.3 Å²	132.3	54%	0.537	65%	0.647	S	S	.	*				-63.1	127.5	59.2	-66.6	-165.8	173.4	0	0	115.8	D940 K944	D940-E942 HydrophobicContact CB-CB 4.45Å; D940-E942 PolarHBondContact OD1-N 2.82Å; E942-K944 HydrophobicContact CB-CB 4.46Å; E942-K944 VanDerWaalsContact CB-N 3.3Å; E942-K944 HydrophobicContact CG-CG 4.25Å; E942-K944 IonicContact OE1-NZ 2.88Å; E942-K944 PolarHBondContact OE1-NZ 3.44Å; E942-K944 WeakPolarHBondContact OE2-CD 3.33Å; E942-K944 WeakPolarHBondContact OE2-CG 3.1Å; E942-K944 IonicContact OE2-NZ 3.33Å; E942-K944 PolarHBondContact OE2-NZ 2.81Å
943	D	27.8	Very low	30.1	Very low	89 Å²	89	131.9 Å²	131.9	48%	0.476	63%	0.626	S	S	.	*			cis	52.7	29.8	-17.5	-123.3	-8.4	0	0	0	118.8	R941 R945	R941-D943 HydrophobicContact CB-CB 3.67Å; R941-D943 HydrophobicContact CG-CB 3.95Å; R941-D943 IonicContact CZ-OD2 2.65Å; R941-D943 IonicContact NE-OD2 2.76Å; R941-D943 PolarHBondContact NE-OD2 2.81Å; R941-D943 IonicContact NH2-OD2 3.01Å; R941-D943 PolarHBondContact NH2-OD2 3.23Å; D943-R945 PolarHBondContact O-N 2.93Å; D943-R945 PolarHBondContact OD1-N 3.41Å
944	K	25.8	Very low	30.7	Very low	135 Å²	135	125.2 Å²	125.2	59%	0.587	60%	0.595	S	S	*	*				-57.8	96.7	109.9	-76.7	-173.5	-173.1	77.3	0	104	E942	E942-K944 HydrophobicContact CB-CB 4.46Å; E942-K944 VanDerWaalsContact CB-N 3.3Å; E942-K944 HydrophobicContact CG-CG 4.25Å; E942-K944 IonicContact OE1-NZ 2.88Å; E942-K944 PolarHBondContact OE1-NZ 3.44Å; E942-K944 WeakPolarHBondContact OE2-CD 3.33Å; E942-K944 WeakPolarHBondContact OE2-CG 3.1Å; E942-K944 IonicContact OE2-NZ 3.33Å; E942-K944 PolarHBondContact OE2-NZ 2.81Å
945	R	26.5	Very low	31.1	Very low	195 Å²	195	123.2 Å²	123.2	74%	0.736	58%	0.575	S	S	*	*				32.7	82.3	78.2	-68.2	-176.2	168.3	-164.1	-0.2	110.2	D943	D943-R945 PolarHBondContact O-N 2.93Å; D943-R945 PolarHBondContact OD1-N 3.41Å
946	R	30.4	Very low	31.4	Very low	209 Å²	209	120.8 Å²	120.8	79%	0.789	56%	0.561	S	S	*	*			trans	74.9	135.8	173.6	-52.9	129.7	-174.2	-172.7	0.3	111.9
947	T	31	Very low	31.8	Very low	109 Å²	109	118.4 Å²	118.4	67%	0.669	56%	0.562	S	S	*	*			cis	-163.4	151.8	8.2	5.3	0	0	0	0	109.8
948	D	32.6	Very low	31.6	Very low	135 Å²	135	113.1 Å²	113.1	72%	0.722	55%	0.545	S	S	*	.			trans	63.4	130.9	147.9	-46.8	-25.6	0	0	0	121.7
949	D	36.8	Very low	31.5	Very low	134 Å²	134	115.2 Å²	115.2	72%	0.717	55%	0.553	S	S	*	*			trans	77.9	131	140.4	-62.9	-9.4	0	0	0	125.7
950	M	36.5	Very low	31.4	Very low	144 Å²	144	109.3 Å²	109.3	71%	0.709	53%	0.529	S	S	*	.			trans	74.7	117	142.4	-71.3	178.2	-89.8	0	0	123.2
951	D	36.4	Very low	31.6	Very low	125 Å²	125	108.5 Å²	108.5	67%	0.668	52%	0.521	S	S	*	.				63.9	159.6	122.5	-53	-14.8	0	0	0	121.3
952	D	41.1	Very low	31.9	Very low	87 Å²	87	104.3 Å²	104.3	47%	0.465	52%	0.518	S	S	.	.			cis	-170.4	151.8	-21.3	171.3	49.4	0	0	0	109.9	S2062 K2063	D952-S2062 VanDerWaalsContact OD2-CA 3.22Å; D952-S2062 WeakPolarHBondContact OD2-CA 3.24Å; D952-S2062 PolarHBondContact OD2-N 3.3Å; D952-K2063 PolarHBondContact OD2-N 2.96Å
953	D	37.6	Very low	32	Very low	70 Å²	70	109.1 Å²	109.1	37%	0.374	53%	0.531	S	S	.	.			trans	41.6	-169.6	159.7	-83.6	-13.2	0	0	0	120.4	K2063 V2064 S2209	D953-K2063 WeakPolarHBondContact CB-O 3.29Å; D953-K2063 WeakPolarHBondContact OD2-CA 3.17Å; D953-K2063 PolarHBondContact OD2-N 3.46Å; D953-K2063 VanDerWaalsContact OD2-O 3.11Å; D953-V2064 PolarHBondContact OD2-N 2.98Å; D953-S2209 WeakPolarHBondContact OD1-CB 3.07Å; D953-S2209 PolarHBondContact OD1-OG 2.84Å
954	G	35.6	Very low	32.2	Very low	18 Å²	18	111.7 Å²	111.7	19%	0.186	55%	0.545	C	S	.	.			cis	174.6	159.3	-22	0	0	0	0	0	116.5	K2063 N2207	G954-K2063 WeakPolarHBondContact CA-O 3.13Å; G954-N2207 WeakPolarHBondContact O-CB 3.3Å; G954-N2207 PolarHBondContact O-ND2 2.68Å
955	D	33.1	Very low	32.4	Very low	28 Å²	28	110.3 Å²	110.3	15%	0.15	55%	0.552	C	S	.	*			trans	45.3	174.1	155.9	-117.9	51.8	0	0	0	131.1	V2064 L2065 M2104 N2207 K2208 S2209	D955-V2064 WeakPolarHBondContact CB-O 3.42Å; D955-L2065 PolarHBondContact OD2-N 3.11Å; D955-M2104 CarbonylContact O-C 3.46Å; D955-M2104 VanDerWaalsContact O-C 3.32Å; D955-M2104 VanDerWaalsContact O-CA 3.24Å; D955-M2104 WeakPolarHBondContact O-CA 3.33Å; D955-M2104 PolarHBondContact O-N 3.28Å; D955-N2207 WeakPolarHBondContact O-CB 3.4Å; D955-K2208 VanDerWaalsContact N-N 3.13Å; D955-S2209 PolarHBondContact OD1-N 3.19Å
956	D	33.9	Very low	32.5	Very low	43 Å²	43	108.9 Å²	108.9	23%	0.23	55%	0.554	C	S	.	*			trans	-91.4	-130.5	-152.1	-90.3	-38.5	0	0	0	116.8	K2102 L2103 M2104	D956-K2102 VanDerWaalsContact CG-C 3.49Å; D956-K2102 WeakPolarHBondContact OD1-CA 3.44Å; D956-K2102 PolarHBondContact OD1-N 3.29Å; D956-K2102 PolarHBondContact OD2-N 3.09Å; D956-L2103 VanDerWaalsContact C-C 3.44Å; D956-L2103 VanDerWaalsContact CG-N 3.31Å; D956-L2103 CarbonylContact O-C 3.48Å; D956-L2103 VanDerWaalsContact O-C 3.25Å; D956-L2103 WeakPolarHBondContact O-CA 3.42Å; D956-L2103 WeakPolarHBondContact O-CB 3.22Å; D956-L2103 WeakPolarHBondContact O-CD1 3.37Å; D956-L2103 PolarHBondContact OD1-N 3.32Å; D956-M2104 PolarHBondContact O-N 2.89Å
957	L	32.3	Very low	32.5	Very low	140 Å²	140	105.3 Å²	105.3	73%	0.733	55%	0.55	S	S	*	*			trans	102.1	-97.1	-179.1	-46.9	-177.9	0	0	0	126.6	K2102 L2103	L957-K2102 CarbonylContact C-O 3.11Å; L957-K2102 VanDerWaalsContact CA-O 3.31Å; L957-K2102 WeakPolarHBondContact CA-O 3.45Å; L957-K2102 PolarHBondContact N-O 3.43Å; L957-K2102 WeakPolarHBondContact O-CE 3.12Å; L957-K2102 PolarHBondContact O-NZ 3.16Å; L957-K2102 VanDerWaalsContact O-NZ 3.11Å; L957-L2103 HydrophobicContact CB-CD1 4.26Å
958	K	29.4	Very low	32.4	Very low	82 Å²	82	106.8 Å²	106.8	36%	0.357	55%	0.554	S	S	.	*			trans	95.9	168.3	-178.3	-69.8	-154.4	-173.2	-176.8	0	120.6	K2102 L2103 S2203 N2204	K958-K2102 HydrophobicContact CD-CD 3.73Å; K958-K2102 HydrophobicContact CD-CG 4.08Å; K958-K2102 HydrophobicContact CG-CD 4Å; K958-K2102 HydrophobicContact CG-CG 4.16Å; K958-L2103 HydrophobicContact CB-CB 4.09Å; K958-L2103 HydrophobicContact CB-CG 4.13Å; K958-L2103 HydrophobicContact CG-CB 3.46Å; K958-L2103 VanDerWaalsContact CG-CB 3.46Å; K958-L2103 HydrophobicContact CG-CD2 4.25Å; K958-L2103 HydrophobicContact CG-CG 3.7Å; K958-L2103 VanDerWaalsContact N-CD1 3.27Å; K958-S2203 WeakPolarHBondContact CD-O 3.25Å; K958-S2203 VanDerWaalsContact CE-O 3.23Å; K958-S2203 WeakPolarHBondContact CE-O 3.48Å; K958-S2203 PolarHBondContact NZ-O 3.21Å; K958-N2204 WeakPolarHBondContact CE-O 3.39Å
959	E	28.4	Very low	32.2	Very low	106 Å²	106	106.6 Å²	106.6	50%	0.495	55%	0.553	S	S	.	*			cis	-158.1	178.9	23.8	-144.7	115.4	-164.1	0	0	115.5	K2102	E959-K2102 IonicContact OE2-NZ 3.56Å; E959-K2102 PolarHBondContact OE2-NZ 3.35Å
960	D	26.8	Very low	31.8	Very low	50 Å²	50	106.8 Å²	106.8	27%	0.267	55%	0.554	S	S	.	*			trans	74.9	-137.7	159.3	-95.7	-59.2	0	0	0	125.9	Y2201 K2202 S2203	D960-Y2201 VanDerWaalsContact OD1-C 3.26Å; D960-Y2201 WeakPolarHBondContact OD1-CD1 3.23Å; D960-K2202 PolarHBondContact N-O 2.95Å; D960-K2202 WeakPolarHBondContact O-CD 3.36Å; D960-K2202 WeakPolarHBondContact O-CE 3.36Å; D960-K2202 PolarHBondContact O-NZ 2.9Å; D960-K2202 WeakPolarHBondContact OD1-CB 3.4Å; D960-K2202 PolarHBondContact OD1-N 2.82Å; D960-K2202 VanDerWaalsContact OD1-N 3.1Å; D960-S2203 PolarHBondContact N-OG 3.4Å; D960-S2203 VanDerWaalsContact O-CB 3.29Å; D960-S2203 WeakPolarHBondContact O-CB 3.17Å; D960-S2203 PolarHBondContact O-OG 2.89Å
961	Q	28.9	Very low	31.4	Very low	97 Å²	97	105.6 Å²	105.6	45%	0.453	55%	0.55	S	S	.	*				-104.2	167.5	-124.4	-87.9	153.9	54.9	0	0	122.2	Y2201	Q961-Y2201 HydrophobicContact CB-CE1 4.43Å; Q961-Y2201 HydrophobicContact CG-CD1 3.3Å; Q961-Y2201 HydrophobicContact CG-CE1 3.49Å; Q961-Y2201 VanDerWaalsContact CG-CE1 3.49Å; Q961-Y2201 HydrophobicContact CG-CG 4.37Å
962	S	32.1	Very low	31.1	Very low	80 Å²	80	105.9 Å²	105.9	56%	0.559	55%	0.552	S	S	*	*			trans	49.1	168	142.3	65.3	0	0	0	0	126.9
963	R	30.2	Very low	30.5	Very low	215 Å²	215	108.4 Å²	108.4	81%	0.811	57%	0.565	S	S	*	*			trans	90.2	114.3	159.7	-65.7	-179.3	175.9	151.1	-0.3	122.2
964	D	30.3	Very low	30	Very low	144 Å²	144	110.3 Å²	110.3	77%	0.77	58%	0.576	S	S	*	*				29.6	140	102.3	-27.8	-43.7	0	0	0	117.6
965	S	31.4	Very low	29.6	Very low	105 Å²	105	118.9 Å²	118.9	73%	0.734	60%	0.602	S	S	*	*				177.9	154.5	51.8	51.6	0	0	0	0	115.7
966	H	28.6	Very low	29.3	Very low	166 Å²	166	122.3 Å²	122.3	77%	0.769	63%	0.628	S	S	*	*			trans	73.6	136.3	146.2	-91.6	-81.7	0	0	0	125.9
967	D	30.2	Very low	29	Very low	134 Å²	134	125.2 Å²	125.2	72%	0.717	65%	0.648	S	S	*	*			trans	82.6	156	145.4	-64.5	-19.3	0	0	0	124.1
968	D	29.4	Very low	28.8	Very low	140 Å²	140	122.6 Å²	122.6	75%	0.749	63%	0.634	S	S	*	*			trans	60.1	119	-169.2	-58.8	-33.6	0	0	0	115.3
969	N	27.1	Very low	28.7	Very low	131 Å²	131	125.1 Å²	125.1	70%	0.701	65%	0.648	S	S	*	*				53.8	129.5	61.5	-58.7	-31.8	0	0	0	111.5
970	D	29	Very low	28.6	Very low	138 Å²	138	123.7 Å²	123.7	74%	0.738	64%	0.643	S	S	*	*			cis	-131.6	171.4	21.3	-116.7	-55.1	0	0	0	115.1
971	N	28.7	Very low	28.6	Very low	118 Å²	118	125 Å²	125	63%	0.631	65%	0.65	S	S	*	*			trans	-55.5	-175.3	172.5	-60.7	-83	0	0	0	115.4
972	D	30.1	Very low	28.6	Very low	132 Å²	132	126 Å²	126	71%	0.706	65%	0.653	S	S	*	*			trans	71.1	93.7	150.3	-58.7	-10.2	0	0	0	118.7
973	D	28.2	Very low	28.3	Very low	139 Å²	139	130.5 Å²	130.5	74%	0.743	67%	0.667	S	S	*	*				80.1	140.3	111.1	-67.2	-14.8	0	0	0	122.3
974	D	27.5	Very low	28.2	Very low	110 Å²	110	128.7 Å²	128.7	59%	0.588	67%	0.665	S	S	*	*			trans	86	151.4	131.4	-107.5	-16	0	0	0	123.2
975	R	26.2	Very low	28	Very low	198 Å²	198	128.4 Å²	128.4	75%	0.747	66%	0.664	S	S	*	*			trans	64.6	106.6	153.3	-64.7	152.8	-146.6	170.8	16.3	116.3
976	S	26.3	Very low	27.8	Very low	100 Å²	100	129.6 Å²	129.6	70%	0.699	67%	0.667	S	S	*	*				74.4	164.5	63.9	78	0	0	0	0	114.3
977	V	28.7	Very low	27.8	Very low	104 Å²	104	127 Å²	127	63%	0.63	66%	0.663	S	S	*	*			trans	78.6	81.8	-170.4	-168.9	0	0	0	0	112.1	N2391	V977-N2391 PolarHBondContact O-ND2 3.29Å; V977-N2391 PolarHBondContact O-OD1 3.01Å; V977-N2391 VanDerWaalsContact O-OD1 3.05Å
978	D	26.8	Very low	27.7	Very low	85 Å²	85	124.9 Å²	124.9	46%	0.455	66%	0.658	S	S	.	*				79.4	143.3	76.1	-63.3	-48.1	0	0	0	116.5	N2391	D978-N2391 PolarHBondContact N-ND2 3.03Å; D978-N2391 PolarHBondContact N-OD1 3.31Å; D978-N2391 VanDerWaalsContact O-CG 3.24Å; D978-N2391 PolarHBondContact O-ND2 3.46Å
979	E	27.7	Very low	27.8	Very low	136 Å²	136	121.8 Å²	121.8	64%	0.636	65%	0.648	S	S	*	*			trans	72.7	136.9	169.1	-51.1	-152.6	-170.6	0	0	122.7	N2391	E979-N2391 WeakPolarHBondContact O-CB 3.36Å
980	N	25.9	Very low	28	Very low	76 Å²	76	119.9 Å²	119.9	41%	0.406	63%	0.631	S	S	.	*			cis	-170.6	132	-11.3	-99.7	-30.3	0	0	0	113	L2392	N980-L2392 CarbonylContact C-O 3.59Å; N980-L2392 WeakPolarHBondContact CA-O 3.25Å
981	D	27.3	Very low	28.1	Very low	77 Å²	77	122.7 Å²	122.7	41%	0.412	63%	0.631	S	S	.	*			trans	105.5	135.7	140	-141	29.4	0	0	0	125.3	L2392	D981-L2392 PolarHBondContact N-O 2.79Å
982	K	28.3	Very low	28	Very low	119 Å²	119	124.2 Å²	124.2	52%	0.517	63%	0.634	S	S	.	*			trans	36.1	135.1	152.8	-78.2	170	-156.9	76.4	0	126.7
983	M	27.4	Very low	27.9	Very low	174 Å²	174	121.4 Å²	121.4	86%	0.857	63%	0.625	S	S	*	*				98.2	108.3	129.3	-166.7	149.4	161.7	0	0	124.7
984	K	27.1	Very low	28	Very low	176 Å²	176	123.7 Å²	123.7	77%	0.765	63%	0.631	S	S	*	*			trans	-1.1	134.4	148.4	-53	173.4	176.9	-180	0	122.5
985	D	26.6	Very low	28	Very low	138 Å²	138	125.2 Å²	125.2	74%	0.738	64%	0.638	S	S	*	*				173.7	146.4	93.8	-102.6	-25.4	0	0	0	115.2
986	T	27.3	Very low	28.1	Very low	130 Å²	130	121.2 Å²	121.2	80%	0.798	64%	0.64	S	S	*	*			trans	59.3	-178.8	166.2	71	0	0	0	0	119.3
987	T	28.3	Very low	28.3	Very low	113 Å²	113	119.6 Å²	119.6	69%	0.693	63%	0.629	S	S	*	*			cis	-149.1	153.6	-10.2	37	0	0	0	0	109.9
988	S	28.4	Very low	28.4	Very low	88 Å²	88	120 Å²	120	62%	0.615	63%	0.631	S	S	*	*			trans	-176	162.8	158.2	173.9	0	0	0	0	114.2	E2380	S988-E2380 PolarHBondContact OG-OE2 2.96Å
989	S	31.4	Very low	28.6	Very low	76 Å²	76	126.2 Å²	126.2	53%	0.531	66%	0.655	S	S	.	*			trans	-164.4	137.9	-174.6	157.4	0	0	0	0	118.2
990	R	31.1	Very low	28.9	Very low	91 Å²	91	128.7 Å²	128.7	34%	0.343	66%	0.663	S	S	.	*			trans	66.1	116.5	150.9	-79.3	-156.9	-173.4	111.1	0.7	125.2	P2378 S2379	R990-P2378 WeakPolarHBondContact CA-O 3.06Å; R990-P2378 PolarHBondContact N-O 3.2Å; R990-P2378 VanDerWaalsContact N-O 3.17Å; R990-S2379 CarbonylContact C-O 3.52Å
991	R	30.2	Very low	29.9	Very low	197 Å²	197	131.5 Å²	131.5	74%	0.743	68%	0.677	S	S	*	*			trans	158.6	-174.4	136.8	-91.3	168.3	175.8	179.2	1.8	114.5	I2377 P2378 S2379	R991-I2377 CarbonylContact C-O 3.36Å; R991-P2378 VanDerWaalsContact N-C 3.27Å; R991-P2378 PolarHBondContact N-O 3.49Å; R991-P2378 CarbonylContact O-C 3.43Å; R991-P2378 WeakPolarHBondContact O-CA 3.48Å; R991-P2378 WeakPolarHBondContact O-CD 3.02Å; R991-S2379 PolarHBondContact N-O 3.46Å; R991-S2379 WeakPolarHBondContact O-CB 3.37Å; R991-S2379 PolarHBondContact O-N 2.62Å; R991-S2379 PolarHBondContact O-OG 3.24Å
992	H	28.2	Very low	31.2	Very low	150 Å²	150	133.2 Å²	133.2	69%	0.694	68%	0.68	S	S	*	*			trans	76.9	49.9	-173.3	-72.6	-53.9	0	0	0	117.8	P2378 S2379	H992-P2378 WeakPolarHBondContact O-CD 3.44Å; H992-S2379 PolarHBondContact CD2-OG 3.14Å; H992-S2379 VanDerWaalsContact CD2-OG 3.28Å
993	S	27.8	Very low	32.8	Very low	73 Å²	73	132.7 Å²	132.7	51%	0.51	69%	0.689	S	S	.	*			trans	-55	159.1	145.4	51.5	0	0	0	0	111.8
994	E	28.8	Very low	34.8	Very low	187 Å²	187	125.9 Å²	125.9	87%	0.874	66%	0.656	S	S	*	*			trans	75.2	103.2	175.3	-50.2	-160.2	139.1	0	0	118
995	I	28.6	Very low	36.9	Very low	142 Å²	142	118.6 Å²	118.6	73%	0.728	63%	0.627	S	S	*	*			trans	-128.5	120.3	146.4	-65.6	-177.8	0	0	0	108.3	S997	I995-S997 PolarHBondContact O-N 2.83Å
996	S	27.7	Very low	38.6	Very low	113 Å²	113	118.9 Å²	118.9	79%	0.79	63%	0.628	S	S	*	*			trans	-86.8	102.5	173.2	-176.5	0	0	0	0	110.4	T998	S996-T998 PolarHBondContact O-N 3.47Å
997	S	31.5	Very low	40.6	Very low	66 Å²	66	114.7 Å²	114.7	46%	0.462	61%	0.607	S	S	.	*			trans	-95.5	83.6	179.3	59.5	0	0	0	0	112.2	I995	I995-S997 PolarHBondContact O-N 2.83Å
998	T	29.3	Very low	42.4	Very low	112 Å²	112	111.9 Å²	111.9	69%	0.687	59%	0.592	S	S	*	*			trans	-58.9	137.1	156.6	45.3	0	0	0	0	109.1	S996 K1000	S996-T998 PolarHBondContact O-N 3.47Å; T998-K1000 PolarHBondContact O-N 2.89Å
999	K	31.4	Very low	44.5	Very low	217 Å²	217	107.7 Å²	107.7	94%	0.943	56%	0.563	S	S	*	*			trans	-49.6	108.3	-175.5	-69.2	-177.5	178.1	-177.1	0	111.4
1000	K	33.8	Very low	46.4	Very low	188 Å²	188	109 Å²	109	82%	0.817	56%	0.559	S	S	*	*			trans	-106.3	137.1	161.1	-73	-173.6	176.8	-178.5	0	108.5	T998	T998-K1000 PolarHBondContact O-N 2.89Å
1001	I	47.4	Very low	48.2	Very low	134 Å²	134	112.5 Å²	112.5	69%	0.687	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64	137.9	172.8	-58.6	165.5	0	0	0	107.2	N1028	I1001-N1028 HydrophobicContact CG2-CB 4.44Å
1002	K	55.4	Low	50.4	Low	113 Å²	113	109 Å²	109	49%	0.491	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-62.7	133.8	175.9	-68.9	-178.7	179.3	178.4	0	108.8	H1024	K1002-H1024 PolarHBondContact O-CE1 3.28Å; K1002-H1024 PolarHBondContact O-NE2 2.92Å; K1002-H1024 VanDerWaalsContact O-NE2 3.1Å
1003	P	61.4	Low	52.6	Low	109 Å²	109	104 Å²	104	71%	0.708	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-73	151	174.3	29.8	-33.8	0	0	0	111
1004	I	69.3	Low	54.9	Low	30 Å²	30	105 Å²	105	15%	0.154	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-59.5	128	168.5	-60.8	172.3	0	0	0	107.8	N1006 P1015 V1021 H1024	I1004-N1006 PolarHBondContact O-N 3.29Å; I1004-N1006 PolarHBondContact O-OD1 3.02Å; I1004-P1015 HydrophobicContact CG2-CB 4.37Å; I1004-V1021 HydrophobicContact CD1-CB 4.43Å; I1004-V1021 HydrophobicContact CD1-CG2 3.97Å; I1004-H1024 HydrophobicContact CD1-CB 3.96Å; I1004-H1024 HydrophobicContact CG1-CB 3.85Å; I1004-H1024 VanDerWaalsContact CG1-CG 3.4Å; I1004-H1024 WeakPolarHBondContact CG1-ND1 3.35Å
1005	P	70	Confident	57	Low	24 Å²	24	97.6 Å²	97.6	16%	0.156	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-69.1	129.4	-179.8	23.9	-29.8	0	0	0	111.1	A1007 R1020 H1090	P1005-A1007 PolarHBondContact O-N 3.1Å; P1005-A1007 VanDerWaalsContact O-O 3.1Å; P1005-R1020 PolarHBondContact O-NH2 3.45Å; P1005-H1090 WeakPolarHBondContact CB-NE2 3.45Å; P1005-H1090 WeakPolarHBondContact CG-NE2 3.43Å
1006	N	63.5	Low	59.3	Low	144 Å²	144	96.1 Å²	96.1	77%	0.77	51%	0.514	S	S	*	.	S	Bend	trans	-62	-8.7	-171.2	-65.2	6.4	0	0	0	115.8	I1004 P1015	I1004-N1006 PolarHBondContact O-N 3.29Å; I1004-N1006 PolarHBondContact O-OD1 3.02Å; N1006-P1015 VanDerWaalsContact O-CG 3.25Å; N1006-P1015 WeakPolarHBondContact O-CG 3Å
1007	A	69.5	Low	61.9	Low	42 Å²	42	93.1 Å²	93.1	35%	0.347	49%	0.489	S	S	.	.	S	Bend	trans	-75.6	147.3	172.9	0	0	0	0	0	111.2	P1005 S1009 R1020	P1005-A1007 PolarHBondContact O-N 3.1Å; P1005-A1007 VanDerWaalsContact O-O 3.1Å; A1007-S1009 PolarHBondContact O-N 2.86Å; A1007-R1020 PolarHBondContact O-NH1 3.34Å; A1007-R1020 PolarHBondContact O-NH2 2.92Å
1008	S	66.8	Low	64.4	Low	53 Å²	53	95 Å²	95	37%	0.371	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-69.2	124.8	172.7	50.3	0	0	0	0	111.1	F1013	S1008-F1013 WeakPolarHBondContact CA-O 3.28Å
1009	S	72.3	Confident	66.9	Low	1 Å²	1	94.7 Å²	94.7	1%	0.007	49%	0.488	C	S	.	.	B	Isolated β-bridge	trans	-77.3	137	174	41.7	0	0	0	0	110.3	A1007 F1011 I1012 F1013 R1020 I1083	A1007-S1009 PolarHBondContact O-N 2.86Å; S1009-F1011 PolarHBondContact O-N 2.84Å; S1009-I1012 PolarHBondContact O-N 3.46Å; S1009-F1013 PolarHBondContact N-O 3.44Å; S1009-F1013 PolarHBondContact O-N 3.17Å; S1009-F1013 WeakPolarHBondContact OG-CB 3.31Å; S1009-R1020 WeakPolarHBondContact OG-CD 3.25Å; S1009-R1020 PolarHBondContact OG-NE 3.43Å; S1009-I1083 VanDerWaalsContact CB-O 3.29Å; S1009-I1083 WeakPolarHBondContact CB-O 3.44Å; S1009-I1083 PolarHBondContact OG-O 2.99Å
1010	F	70.5	Confident	69.5	Low	102 Å²	102	84.3 Å²	84.3	45%	0.447	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	18.8	-171.6	-64.2	-76.4	0	0	0	115.5	I1012 F1013 I1082 I1083	F1010-I1012 HydrophobicContact CB-CD1 4.37Å; F1010-I1012 WeakPolarHBondContact O-CG1 3.49Å; F1010-I1012 PolarHBondContact O-N 3.13Å; F1010-F1013 HydrophobicContact CD2-CD2 4.4Å; F1010-F1013 HydrophobicContact CD2-CE2 4.45Å; F1010-I1082 HydrophobicContact CE1-CG2 4.28Å; F1010-I1082 HydrophobicContact CE2-CG2 3.67Å; F1010-I1082 HydrophobicContact CZ-CB 4.43Å; F1010-I1082 HydrophobicContact CZ-CG2 3.38Å; F1010-I1083 HydrophobicContact CE2-CG1 4.49Å
1011	F	68.2	Low	71.9	Confident	166 Å²	166	78.3 Å²	78.3	73%	0.728	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	2.9	-167	-52.9	-83	0	0	0	115.4	S1009 L1089	S1009-F1011 PolarHBondContact O-N 2.84Å; F1011-L1089 HydrophobicContact CE1-CD1 4.46Å; F1011-L1089 HydrophobicContact CE2-CD1 3.63Å; F1011-L1089 HydrophobicContact CZ-CD1 3.48Å; F1011-L1089 VanDerWaalsContact CZ-CD1 3.48Å
1012	I	77.5	Confident	73.7	Confident	123 Å²	123	74.2 Å²	74.2	63%	0.631	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-39.5	-173.2	-67.2	160.9	0	0	0	111.3	S1009 F1010 N1014	S1009-I1012 PolarHBondContact O-N 3.46Å; F1010-I1012 HydrophobicContact CB-CD1 4.37Å; F1010-I1012 WeakPolarHBondContact O-CG1 3.49Å; F1010-I1012 PolarHBondContact O-N 3.13Å; I1012-N1014 PolarHBondContact O-N 3.25Å
1013	F	73.4	Confident	75.2	Confident	45 Å²	45	69.1 Å²	69.1	20%	0.197	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-100.9	91.1	-172.2	-58.1	-77.2	0	0	0	112.1	S1008 S1009 F1010 F1019 R1020	S1008-F1013 WeakPolarHBondContact CA-O 3.28Å; S1009-F1013 PolarHBondContact N-O 3.44Å; S1009-F1013 PolarHBondContact O-N 3.17Å; S1009-F1013 WeakPolarHBondContact OG-CB 3.31Å; F1010-F1013 HydrophobicContact CD2-CD2 4.4Å; F1010-F1013 HydrophobicContact CD2-CE2 4.45Å; F1013-F1019 HydrophobicContact CD1-CD1 4.18Å; F1013-F1019 AromaticContact CE1-CD1 3.73Å; F1013-F1019 HydrophobicContact CE1-CD1 3.73Å; F1013-F1019 HydrophobicContact CE1-CE1 4.18Å; F1013-F1019 HydrophobicContact CZ-CD1 4.32Å; F1013-F1019 HydrophobicContact CZ-CE1 4.32Å; F1013-R1020 HydrophobicContact CB-CB 4.43Å; F1013-R1020 PolarHBondContact O-NH1 3.1Å
1014	N	76.4	Confident	76.3	Confident	95 Å²	95	64.9 Å²	64.9	51%	0.508	36%	0.357	S	S	.	.			trans	-52.2	146.7	169.2	-152.9	21	0	0	0	110.9	I1012 T1016 N1017	I1012-N1014 PolarHBondContact O-N 3.25Å; N1014-T1016 PolarHBondContact ND2-OG1 2.75Å; N1014-T1016 PolarHBondContact O-N 3.49Å; N1014-N1017 VanDerWaalsContact O-CB 3.28Å; N1014-N1017 WeakPolarHBondContact O-CB 3.28Å; N1014-N1017 PolarHBondContact O-N 3.1Å
1015	P	72.9	Confident	77.1	Confident	31 Å²	31	69.1 Å²	69.1	20%	0.201	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.3	-178.5	-24.8	34.8	0	0	0	114.7	I1004 N1006	I1004-P1015 HydrophobicContact CG2-CB 4.37Å; N1006-P1015 VanDerWaalsContact O-CG 3.25Å; N1006-P1015 WeakPolarHBondContact O-CG 3Å
1016	T	77.1	Confident	77.9	Confident	111 Å²	111	69.9 Å²	69.9	68%	0.681	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.2	176.4	53.5	0	0	0	0	114.5	N1014	N1014-T1016 PolarHBondContact ND2-OG1 2.75Å; N1014-T1016 PolarHBondContact O-N 3.49Å
1017	N	81.5	Confident	78.9	Confident	50 Å²	50	63.6 Å²	63.6	27%	0.267	35%	0.348	S	S	.	.			trans	-69	124.2	-178.8	-175.2	-45.2	0	0	0	110.2	N1014 F1019 R1020 V1021	N1014-N1017 VanDerWaalsContact O-CB 3.28Å; N1014-N1017 WeakPolarHBondContact O-CB 3.28Å; N1014-N1017 PolarHBondContact O-N 3.1Å; N1017-F1019 PolarHBondContact O-N 3.45Å; N1017-F1019 WeakPolarHBondContact OD1-CB 3.45Å; N1017-F1019 PolarHBondContact OD1-N 3.15Å; N1017-R1020 HydrophobicContact CB-CB 4.37Å; N1017-R1020 WeakPolarHBondContact O-CB 3.46Å; N1017-R1020 PolarHBondContact O-N 3.3Å; N1017-V1021 PolarHBondContact O-N 3.07Å; N1017-V1021 VanDerWaalsContact O-N 3.11Å
1018	P	83.7	Confident	79.5	Confident	104 Å²	104	64.4 Å²	64.4	68%	0.675	35%	0.346	S	S	*	.	H	α-helix	trans	-59.3	-32.5	-174.7	23.5	-34.4	0	0	0	113.1	R1020 V1021 A1022	P1018-R1020 VanDerWaalsContact C-N 3.34Å; P1018-R1020 PolarHBondContact O-N 3.22Å; P1018-V1021 PolarHBondContact O-N 3.26Å; P1018-A1022 WeakPolarHBondContact O-CB 3.13Å; P1018-A1022 PolarHBondContact O-N 3.17Å
1019	F	83.7	Confident	80.4	Confident	106 Å²	106	64.1 Å²	64.1	47%	0.465	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-39.9	175.4	-179.1	-114	0	0	0	111.9	F1013 N1017 C1023 I1083	F1013-F1019 HydrophobicContact CD1-CD1 4.18Å; F1013-F1019 AromaticContact CE1-CD1 3.73Å; F1013-F1019 HydrophobicContact CE1-CD1 3.73Å; F1013-F1019 HydrophobicContact CE1-CE1 4.18Å; F1013-F1019 HydrophobicContact CZ-CD1 4.32Å; F1013-F1019 HydrophobicContact CZ-CE1 4.32Å; N1017-F1019 PolarHBondContact O-N 3.45Å; N1017-F1019 WeakPolarHBondContact OD1-CB 3.45Å; N1017-F1019 PolarHBondContact OD1-N 3.15Å; F1019-C1023 WeakPolarHBondContact O-CB 3.43Å; F1019-C1023 PolarHBondContact O-N 3.33Å; F1019-C1023 PolarHBondContact O-SG 2.87Å; F1019-I1083 HydrophobicContact CD1-CG2 4.35Å; F1019-I1083 HydrophobicContact CE1-CD1 3.86Å; F1019-I1083 HydrophobicContact CE1-CG2 4.16Å; F1019-I1083 HydrophobicContact CZ-CD1 4.14Å
1020	R	85.4	Confident	80.8	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-71.9	-36.4	178.3	-172.9	173.8	177.6	-155.8	-8	112.1	P1005 A1007 S1009 F1013 N1017 P1018 H1024 I1083 T1084	P1005-R1020 PolarHBondContact O-NH2 3.45Å; A1007-R1020 PolarHBondContact O-NH1 3.34Å; A1007-R1020 PolarHBondContact O-NH2 2.92Å; S1009-R1020 WeakPolarHBondContact OG-CD 3.25Å; S1009-R1020 PolarHBondContact OG-NE 3.43Å; F1013-R1020 HydrophobicContact CB-CB 4.43Å; F1013-R1020 PolarHBondContact O-NH1 3.1Å; N1017-R1020 HydrophobicContact CB-CB 4.37Å; N1017-R1020 WeakPolarHBondContact O-CB 3.46Å; N1017-R1020 PolarHBondContact O-N 3.3Å; P1018-R1020 VanDerWaalsContact C-N 3.34Å; P1018-R1020 PolarHBondContact O-N 3.22Å; R1020-H1024 WeakPolarHBondContact O-CB 3.37Å; R1020-H1024 PolarHBondContact O-N 2.95Å; R1020-I1083 PolarHBondContact NE-O 3.31Å; R1020-T1084 PolarHBondContact NE-O 3.23Å; R1020-T1084 PolarHBondContact NH2-O 3.36Å
1021	V	83.7	Confident	81.5	Confident	62 Å²	62	66.8 Å²	66.8	38%	0.376	36%	0.359	S	S	.	.	H	α-helix	trans	-64.1	-47.7	173.1	179.6	0	0	0	0	110.5	I1004 N1017 P1018 C1023 H1024 E1025	I1004-V1021 HydrophobicContact CD1-CB 4.43Å; I1004-V1021 HydrophobicContact CD1-CG2 3.97Å; N1017-V1021 PolarHBondContact O-N 3.07Å; N1017-V1021 VanDerWaalsContact O-N 3.11Å; P1018-V1021 PolarHBondContact O-N 3.26Å; V1021-C1023 PolarHBondContact O-N 2.97Å; V1021-H1024 WeakPolarHBondContact O-CB 3.25Å; V1021-H1024 PolarHBondContact O-N 2.93Å; V1021-E1025 PolarHBondContact O-N 2.85Å
1022	A	86.3	Confident	82.4	Confident	47 Å²	47	60.1 Å²	60.1	39%	0.388	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-44.8	176.4	0	0	0	0	0	112.4	P1018 H1024 E1025 V1026	P1018-A1022 WeakPolarHBondContact O-CB 3.13Å; P1018-A1022 PolarHBondContact O-N 3.17Å; A1022-H1024 PolarHBondContact O-N 3.43Å; A1022-E1025 PolarHBondContact O-N 3.21Å; A1022-V1026 WeakPolarHBondContact O-CG2 3.47Å; A1022-V1026 PolarHBondContact O-N 3.34Å
1023	C	86.7	Confident	82.4	Confident	6 Å²	6	58 Å²	58	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-36.3	174.1	-67.6	0	0	0	0	112	F1019 V1021 C1027 L1080 I1083 T1084	F1019-C1023 WeakPolarHBondContact O-CB 3.43Å; F1019-C1023 PolarHBondContact O-N 3.33Å; F1019-C1023 PolarHBondContact O-SG 2.87Å; V1021-C1023 PolarHBondContact O-N 2.97Å; C1023-C1027 WeakPolarHBondContact O-CB 3.04Å; C1023-C1027 PolarHBondContact O-N 3.34Å; C1023-C1027 PolarHBondContact O-SG 3.36Å; C1023-L1080 HydrophobicContact CB-CD2 4.11Å; C1023-L1080 VanDerWaalsContact SG-CD2 3.55Å; C1023-I1083 HydrophobicContact CB-CG2 4.19Å; C1023-T1084 VanDerWaalsContact C-CG2 3.4Å; C1023-T1084 HydrophobicContact CB-CG2 3.58Å
1024	H	84.8	Confident	82.9	Confident	20 Å²	20	58 Å²	58	9%	0.093	32%	0.322	C	S	.	.	H	α-helix	trans	-72.5	-38.5	179.2	-177.5	-102.7	0	0	0	112.6	K1002 I1004 R1020 V1021 A1022 N1028 T1084	K1002-H1024 PolarHBondContact O-CE1 3.28Å; K1002-H1024 PolarHBondContact O-NE2 2.92Å; K1002-H1024 VanDerWaalsContact O-NE2 3.1Å; I1004-H1024 HydrophobicContact CD1-CB 3.96Å; I1004-H1024 HydrophobicContact CG1-CB 3.85Å; I1004-H1024 VanDerWaalsContact CG1-CG 3.4Å; I1004-H1024 WeakPolarHBondContact CG1-ND1 3.35Å; R1020-H1024 WeakPolarHBondContact O-CB 3.37Å; R1020-H1024 PolarHBondContact O-N 2.95Å; V1021-H1024 WeakPolarHBondContact O-CB 3.25Å; V1021-H1024 PolarHBondContact O-N 2.93Å; A1022-H1024 PolarHBondContact O-N 3.43Å; H1024-N1028 PolarHBondContact CD2-ND2 2.7Å; H1024-N1028 PolarHBondContact CE1-ND2 2.86Å; H1024-N1028 PolarHBondContact ND1-ND2 3.44Å; H1024-N1028 PolarHBondContact NE2-ND2 3.49Å; H1024-N1028 PolarHBondContact O-N 2.94Å; H1024-N1028 VanDerWaalsContact O-N 3.09Å; H1024-N1028 PolarHBondContact O-ND2 3.32Å; H1024-T1084 VanDerWaalsContact CA-CG2 3.47Å; H1024-T1084 HydrophobicContact CB-CG2 3.83Å; H1024-T1084 VanDerWaalsContact N-CG2 3.28Å
1025	E	85.5	Confident	83.3	Confident	120 Å²	120	56.5 Å²	56.5	56%	0.561	31%	0.313	S	S	*	.	H	α-helix	trans	-63	-48.4	173.3	-174.2	167.9	-170.1	0	0	111.2	V1021 A1022 C1027 N1028 H1029	V1021-E1025 PolarHBondContact O-N 2.85Å; A1022-E1025 PolarHBondContact O-N 3.21Å; E1025-C1027 PolarHBondContact O-N 2.81Å; E1025-N1028 PolarHBondContact O-N 3.13Å; E1025-H1029 PolarHBondContact O-N 3.13Å
1026	V	87.5	Confident	83.8	Confident	40 Å²	40	55.6 Å²	55.6	24%	0.242	31%	0.307	C	S	.	.	H	α-helix	trans	-57.1	-49.7	174.3	172.4	0	0	0	0	111.2	A1022 N1028 H1029 F1032 L1080	A1022-V1026 WeakPolarHBondContact O-CG2 3.47Å; A1022-V1026 PolarHBondContact O-N 3.34Å; V1026-N1028 VanDerWaalsContact C-N 3.29Å; V1026-N1028 PolarHBondContact O-N 3.28Å; V1026-H1029 WeakPolarHBondContact O-CB 3.41Å; V1026-H1029 PolarHBondContact O-N 3.1Å; V1026-H1029 VanDerWaalsContact O-N 3.1Å; V1026-F1032 HydrophobicContact CG1-CD2 3.82Å; V1026-F1032 HydrophobicContact CG1-CE2 4.26Å; V1026-F1032 HydrophobicContact CG1-CG 4.34Å; V1026-F1032 WeakPolarHBondContact O-CB 3.37Å; V1026-F1032 WeakPolarHBondContact O-CG 2.75Å; V1026-L1080 HydrophobicContact CG1-CD1 4.25Å
1027	C	84.4	Confident	83.9	Confident	11 Å²	11	52 Å²	52	7%	0.074	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-33.3	-179.3	-73.1	0	0	0	0	113.8	C1023 E1025 F1032 N1033	C1023-C1027 WeakPolarHBondContact O-CB 3.04Å; C1023-C1027 PolarHBondContact O-N 3.34Å; C1023-C1027 PolarHBondContact O-SG 3.36Å; E1025-C1027 PolarHBondContact O-N 2.81Å; C1027-F1032 HydrophobicContact CB-CE1 4.47Å; C1027-N1033 PolarHBondContact O-ND2 3.32Å
1028	N	81.9	Confident	84	Confident	59 Å²	59	52.6 Å²	52.6	32%	0.316	29%	0.289	S	S	.	.	H	α-helix	trans	-85.2	-11.8	177.8	-75.8	-76.6	0	0	0	113.3	I1001 H1024 E1025 V1026 S1030	I1001-N1028 HydrophobicContact CG2-CB 4.44Å; H1024-N1028 PolarHBondContact CD2-ND2 2.7Å; H1024-N1028 PolarHBondContact CE1-ND2 2.86Å; H1024-N1028 PolarHBondContact ND1-ND2 3.44Å; H1024-N1028 PolarHBondContact NE2-ND2 3.49Å; H1024-N1028 PolarHBondContact O-N 2.94Å; H1024-N1028 VanDerWaalsContact O-N 3.09Å; H1024-N1028 PolarHBondContact O-ND2 3.32Å; E1025-N1028 PolarHBondContact O-N 3.13Å; V1026-N1028 VanDerWaalsContact C-N 3.29Å; V1026-N1028 PolarHBondContact O-N 3.28Å; N1028-S1030 PolarHBondContact O-N 3.17Å
1029	H	84.4	Confident	84.1	Confident	47 Å²	47	48.4 Å²	48.4	22%	0.218	26%	0.262	C	S	.	.			trans	-64.2	134.8	-179	-144.4	-77	0	0	0	110.9	E1025 V1026 Y1031 F1032 N1033 Y2189	E1025-H1029 PolarHBondContact O-N 3.13Å; V1026-H1029 WeakPolarHBondContact O-CB 3.41Å; V1026-H1029 PolarHBondContact O-N 3.1Å; V1026-H1029 VanDerWaalsContact O-N 3.1Å; H1029-Y1031 AromaticContact CE1-CD2 3.12Å; H1029-Y1031 WeakPolarHBondContact CE1-CD2 3.3Å; H1029-Y1031 AromaticContact CE1-CE2 3.57Å; H1029-Y1031 AromaticContact CE1-CG 3.89Å; H1029-Y1031 WeakPolarHBondContact ND1-CB 3.44Å; H1029-Y1031 AromaticContact ND1-CD2 3.15Å; H1029-Y1031 WeakPolarHBondContact ND1-CD2 3.27Å; H1029-Y1031 AromaticContact ND1-CG 3.48Å; H1029-Y1031 PolarHBondContact ND1-N 2.91Å; H1029-Y1031 PolarHBondContact O-N 3.41Å; H1029-Y1031 VanDerWaalsContact O-N 3.07Å; H1029-F1032 HydrophobicContact CB-CB 4.49Å; H1029-F1032 PolarHBondContact O-N 2.83Å; H1029-N1033 PolarHBondContact O-N 2.92Å; H1029-N1033 PolarHBondContact O-ND2 3.15Å; H1029-Y2189 AromaticContact CD2-CE1 3.94Å; H1029-Y2189 AromaticContact NE2-CD1 3.88Å
1030	S	81.7	Confident	84.1	Confident	80 Å²	80	43.6 Å²	43.6	56%	0.559	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.1	177.6	-169.4	0	0	0	0	112.4	N1028 N1034	N1028-S1030 PolarHBondContact O-N 3.17Å; S1030-N1034 WeakPolarHBondContact O-CB 3.47Å; S1030-N1034 PolarHBondContact O-N 3.31Å; S1030-N1034 VanDerWaalsContact O-N 3.11Å; S1030-N1034 PolarHBondContact O-ND2 3.15Å; S1030-N1034 PolarHBondContact O-OD1 3.35Å
1031	Y	84.6	Confident	83.9	Confident	79 Å²	79	48.5 Å²	48.5	31%	0.31	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-47.9	178.1	-71.8	-32.8	0	0	0	112.8	H1029 N1033 N1034 I1035 V2187 P2188 Y2189	H1029-Y1031 AromaticContact CE1-CD2 3.12Å; H1029-Y1031 WeakPolarHBondContact CE1-CD2 3.3Å; H1029-Y1031 AromaticContact CE1-CE2 3.57Å; H1029-Y1031 AromaticContact CE1-CG 3.89Å; H1029-Y1031 WeakPolarHBondContact ND1-CB 3.44Å; H1029-Y1031 AromaticContact ND1-CD2 3.15Å; H1029-Y1031 WeakPolarHBondContact ND1-CD2 3.27Å; H1029-Y1031 AromaticContact ND1-CG 3.48Å; H1029-Y1031 PolarHBondContact ND1-N 2.91Å; H1029-Y1031 PolarHBondContact O-N 3.41Å; H1029-Y1031 VanDerWaalsContact O-N 3.07Å; Y1031-N1033 VanDerWaalsContact C-N 3.27Å; Y1031-N1033 PolarHBondContact O-N 3.34Å; Y1031-N1034 WeakPolarHBondContact O-CA 3.3Å; Y1031-N1034 WeakPolarHBondContact O-CB 3.13Å; Y1031-N1034 PolarHBondContact O-N 2.78Å; Y1031-I1035 WeakPolarHBondContact O-CG1 3.32Å; Y1031-I1035 PolarHBondContact O-N 3.31Å; Y1031-V2187 HydrophobicContact CD1-CB 4.03Å; Y1031-V2187 HydrophobicContact CD1-CG1 3.56Å; Y1031-V2187 HydrophobicContact CD1-CG2 3.54Å; Y1031-V2187 HydrophobicContact CD2-CG1 4.19Å; Y1031-V2187 HydrophobicContact CE1-CB 4.49Å; Y1031-V2187 HydrophobicContact CE1-CG1 4.34Å; Y1031-V2187 HydrophobicContact CE1-CG2 4.01Å; Y1031-V2187 HydrophobicContact CG-CB 4.41Å; Y1031-V2187 HydrophobicContact CG-CG1 3.46Å; Y1031-V2187 VanDerWaalsContact CG-CG1 3.46Å; Y1031-V2187 HydrophobicContact CG-CG2 4.32Å; Y1031-P2188 VanDerWaalsContact CD2-C 3.46Å; Y1031-P2188 WeakPolarHBondContact CE2-O 3.18Å; Y1031-P2188 PolarHBondContact OH-O 3.46Å; Y1031-Y2189 VanDerWaalsContact CE2-N 3.28Å
1032	F	86.6	Confident	84	Confident	27 Å²	27	48.3 Å²	48.3	12%	0.118	27%	0.265	C	S	.	.	H	α-helix	trans	-55	-45.2	172	179.1	-101.2	0	0	0	111.3	V1026 C1027 H1029 N1034 I1035 V1036 E1077 L1080	V1026-F1032 HydrophobicContact CG1-CD2 3.82Å; V1026-F1032 HydrophobicContact CG1-CE2 4.26Å; V1026-F1032 HydrophobicContact CG1-CG 4.34Å; V1026-F1032 WeakPolarHBondContact O-CB 3.37Å; V1026-F1032 WeakPolarHBondContact O-CG 2.75Å; C1027-F1032 HydrophobicContact CB-CE1 4.47Å; H1029-F1032 HydrophobicContact CB-CB 4.49Å; H1029-F1032 PolarHBondContact O-N 2.83Å; F1032-N1034 VanDerWaalsContact C-N 3.25Å; F1032-N1034 PolarHBondContact O-N 3.49Å; F1032-I1035 PolarHBondContact O-N 2.95Å; F1032-V1036 HydrophobicContact CZ-CG2 4.49Å; F1032-V1036 WeakPolarHBondContact O-CB 3.1Å; F1032-V1036 VanDerWaalsContact O-CG2 3.29Å; F1032-V1036 WeakPolarHBondContact O-CG2 3.32Å; F1032-V1036 PolarHBondContact O-N 3.26Å; F1032-E1077 HydrophobicContact CE1-CG 4.2Å; F1032-E1077 HydrophobicContact CZ-CB 4.24Å; F1032-E1077 HydrophobicContact CZ-CG 3.71Å; F1032-L1080 HydrophobicContact CE2-CD1 3.87Å; F1032-L1080 HydrophobicContact CZ-CD1 4.35Å
1033	N	78.3	Confident	83.9	Confident	78 Å²	78	46.2 Å²	46.2	42%	0.417	25%	0.248	S	C	.	.	H	α-helix	trans	-69.9	-16.4	177.3	-70	-89.1	0	0	0	114.2	C1027 H1029 Y1031 R1141	C1027-N1033 PolarHBondContact O-ND2 3.32Å; H1029-N1033 PolarHBondContact O-N 2.92Å; H1029-N1033 PolarHBondContact O-ND2 3.15Å; Y1031-N1033 VanDerWaalsContact C-N 3.27Å; Y1031-N1033 PolarHBondContact O-N 3.34Å; N1033-R1141 PolarHBondContact O-NH1 2.94Å
1034	N	83.4	Confident	83.7	Confident	46 Å²	46	46.2 Å²	46.2	25%	0.246	25%	0.248	C	C	.	.	H	α-helix	trans	-88.2	-49.4	172.2	-76.1	-6.7	0	0	0	111.2	S1030 Y1031 F1032 V1036 L1037 V1038 R1141	S1030-N1034 WeakPolarHBondContact O-CB 3.47Å; S1030-N1034 PolarHBondContact O-N 3.31Å; S1030-N1034 VanDerWaalsContact O-N 3.11Å; S1030-N1034 PolarHBondContact O-ND2 3.15Å; S1030-N1034 PolarHBondContact O-OD1 3.35Å; Y1031-N1034 WeakPolarHBondContact O-CA 3.3Å; Y1031-N1034 WeakPolarHBondContact O-CB 3.13Å; Y1031-N1034 PolarHBondContact O-N 2.78Å; F1032-N1034 VanDerWaalsContact C-N 3.25Å; F1032-N1034 PolarHBondContact O-N 3.49Å; N1034-V1036 VanDerWaalsContact C-N 3.32Å; N1034-V1036 PolarHBondContact O-N 3.27Å; N1034-L1037 WeakPolarHBondContact O-CA 2.93Å; N1034-L1037 WeakPolarHBondContact O-CB 3.4Å; N1034-L1037 PolarHBondContact O-N 3.43Å; N1034-V1038 PolarHBondContact O-N 3.45Å; N1034-R1141 VanDerWaalsContact OD1-CZ 3.32Å; N1034-R1141 PolarHBondContact OD1-NH1 2.83Å; N1034-R1141 PolarHBondContact OD1-NH2 3.35Å
1035	I	86	Confident	83.6	Confident	62 Å²	62	47.8 Å²	47.8	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-53.9	-50.7	176.7	-67.6	163.8	0	0	0	109.7	Y1031 F1032 L1037 V1038 C1039 V2187	Y1031-I1035 WeakPolarHBondContact O-CG1 3.32Å; Y1031-I1035 PolarHBondContact O-N 3.31Å; F1032-I1035 PolarHBondContact O-N 2.95Å; I1035-L1037 VanDerWaalsContact C-N 3.25Å; I1035-L1037 PolarHBondContact O-N 3.29Å; I1035-V1038 PolarHBondContact O-N 2.96Å; I1035-C1039 PolarHBondContact O-N 3.22Å; I1035-C1039 PolarHBondContact O-SG 2.98Å; I1035-V2187 HydrophobicContact CD1-CG1 3.69Å; I1035-V2187 HydrophobicContact CG1-CB 4.44Å; I1035-V2187 HydrophobicContact CG1-CG1 3.99Å
1036	V	82.4	Confident	83.6	Confident	13 Å²	13	44.6 Å²	44.6	8%	0.079	25%	0.25	C	C	.	.	H	α-helix	trans	-57.3	-38.3	177.7	169.9	0	0	0	0	111.8	F1032 N1034 I1040 E1077	F1032-V1036 HydrophobicContact CZ-CG2 4.49Å; F1032-V1036 WeakPolarHBondContact O-CB 3.1Å; F1032-V1036 VanDerWaalsContact O-CG2 3.29Å; F1032-V1036 WeakPolarHBondContact O-CG2 3.32Å; F1032-V1036 PolarHBondContact O-N 3.26Å; N1034-V1036 VanDerWaalsContact C-N 3.32Å; N1034-V1036 PolarHBondContact O-N 3.27Å; V1036-I1040 HydrophobicContact CG1-CD1 3.86Å; V1036-I1040 WeakPolarHBondContact O-CD1 3.39Å; V1036-I1040 WeakPolarHBondContact O-CG1 3.23Å; V1036-I1040 PolarHBondContact O-N 2.89Å; V1036-E1077 HydrophobicContact CG2-CG 3.9Å
1037	L	79.6	Confident	83.3	Confident	36 Å²	36	43.4 Å²	43.4	19%	0.188	24%	0.242	C	C	.	.	H	α-helix	trans	-68.2	-40.8	175.9	-176.4	67.9	0	0	0	112.4	N1034 I1035 I1040 L1041 A1138	N1034-L1037 WeakPolarHBondContact O-CA 2.93Å; N1034-L1037 WeakPolarHBondContact O-CB 3.4Å; N1034-L1037 PolarHBondContact O-N 3.43Å; I1035-L1037 VanDerWaalsContact C-N 3.25Å; I1035-L1037 PolarHBondContact O-N 3.29Å; L1037-I1040 WeakPolarHBondContact O-CB 3.4Å; L1037-I1040 PolarHBondContact O-N 2.97Å; L1037-L1041 HydrophobicContact CG-CD1 4.28Å; L1037-L1041 WeakPolarHBondContact O-CG 3.36Å; L1037-L1041 PolarHBondContact O-N 2.85Å; L1037-A1138 HydrophobicContact CD1-CB 4.27Å
1038	V	84	Confident	83.3	Confident	62 Å²	62	43.9 Å²	43.9	38%	0.376	25%	0.246	S	C	.	.	H	α-helix	trans	-63.7	-46.6	175	174.8	0	0	0	0	110	N1034 I1035 I1040 L1041 V1042	N1034-V1038 PolarHBondContact O-N 3.45Å; I1035-V1038 PolarHBondContact O-N 2.96Å; V1038-I1040 VanDerWaalsContact C-N 3.3Å; V1038-I1040 PolarHBondContact O-N 3.36Å; V1038-L1041 PolarHBondContact O-N 3.1Å; V1038-L1041 VanDerWaalsContact O-N 3.12Å; V1038-V1042 HydrophobicContact CG1-CG2 4.21Å; V1038-V1042 WeakPolarHBondContact O-CG2 3.41Å; V1038-V1042 PolarHBondContact O-N 2.9Å
1039	C	85.8	Confident	83.5	Confident	16 Å²	16	42.8 Å²	42.8	11%	0.108	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-38.4	174.5	-63.3	0	0	0	0	112.6	I1035 S1043 F1070 F1074	I1035-C1039 PolarHBondContact O-N 3.22Å; I1035-C1039 PolarHBondContact O-SG 2.98Å; C1039-S1043 WeakPolarHBondContact O-CB 3.42Å; C1039-S1043 PolarHBondContact O-N 3.28Å; C1039-F1070 HydrophobicContact CB-CD1 4.09Å; C1039-F1070 HydrophobicContact CB-CE1 4.3Å; C1039-F1074 HydrophobicContact CB-CE1 4.04Å; C1039-F1074 HydrophobicContact CB-CZ 4.13Å
1040	I	83.6	Confident	83.5	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-48.3	173.2	-72.5	155.1	0	0	0	111.1	V1036 L1037 V1038 S1043 S1044 F1074 R1134 R1137	V1036-I1040 HydrophobicContact CG1-CD1 3.86Å; V1036-I1040 WeakPolarHBondContact O-CD1 3.39Å; V1036-I1040 WeakPolarHBondContact O-CG1 3.23Å; V1036-I1040 PolarHBondContact O-N 2.89Å; L1037-I1040 WeakPolarHBondContact O-CB 3.4Å; L1037-I1040 PolarHBondContact O-N 2.97Å; V1038-I1040 VanDerWaalsContact C-N 3.3Å; V1038-I1040 PolarHBondContact O-N 3.36Å; I1040-S1043 PolarHBondContact O-N 3Å; I1040-S1044 WeakPolarHBondContact O-CB 3.3Å; I1040-S1044 PolarHBondContact O-N 3.1Å; I1040-S1044 PolarHBondContact O-OG 2.58Å; I1040-F1074 HydrophobicContact CG1-CE1 3.88Å; I1040-F1074 HydrophobicContact CG1-CZ 3.95Å; I1040-R1134 HydrophobicContact CG2-CB 4.19Å; I1040-R1134 WeakPolarHBondContact CG2-O 3.36Å; I1040-R1137 HydrophobicContact CD1-CB 4.06Å; I1040-R1137 HydrophobicContact CD1-CG 4.31Å
1041	L	80.2	Confident	83.6	Confident	103 Å²	103	40.1 Å²	40.1	54%	0.539	23%	0.226	S	C	.	.	H	α-helix	trans	-65.1	-46.8	-177.8	-70.8	169.9	0	0	0	111.5	L1037 V1038 S1044 A1045	L1037-L1041 HydrophobicContact CG-CD1 4.28Å; L1037-L1041 WeakPolarHBondContact O-CG 3.36Å; L1037-L1041 PolarHBondContact O-N 2.85Å; V1038-L1041 PolarHBondContact O-N 3.1Å; V1038-L1041 VanDerWaalsContact O-N 3.12Å; L1041-S1044 PolarHBondContact O-N 3.02Å; L1041-A1045 PolarHBondContact O-N 3.14Å
1042	V	86.2	Confident	83.4	Confident	59 Å²	59	37.3 Å²	37.3	36%	0.358	22%	0.217	S	C	.	.	H	α-helix	trans	-65	-45.9	176.6	-178	0	0	0	0	110.6	V1038 S1044 A1045 M1046 F1070	V1038-V1042 HydrophobicContact CG1-CG2 4.21Å; V1038-V1042 WeakPolarHBondContact O-CG2 3.41Å; V1038-V1042 PolarHBondContact O-N 2.9Å; V1042-S1044 PolarHBondContact O-N 2.76Å; V1042-A1045 PolarHBondContact O-N 2.99Å; V1042-A1045 VanDerWaalsContact O-N 3.13Å; V1042-M1046 HydrophobicContact CG1-CE 4.33Å; V1042-M1046 HydrophobicContact CG1-CG 4.48Å; V1042-M1046 WeakPolarHBondContact O-CG 3.2Å; V1042-M1046 PolarHBondContact O-N 3.37Å; V1042-F1070 HydrophobicContact CB-CE1 4.49Å; V1042-F1070 HydrophobicContact CB-CZ 3.98Å; V1042-F1070 HydrophobicContact CG1-CE1 4.48Å; V1042-F1070 HydrophobicContact CG1-CE2 4.19Å; V1042-F1070 HydrophobicContact CG1-CZ 3.58Å
1043	S	83.7	Confident	83.1	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-57.9	-31.6	174.5	172.7	0	0	0	0	113.1	C1039 I1040 L1047 R1134	C1039-S1043 WeakPolarHBondContact O-CB 3.42Å; C1039-S1043 PolarHBondContact O-N 3.28Å; I1040-S1043 PolarHBondContact O-N 3Å; S1043-L1047 WeakPolarHBondContact O-CG 3.15Å; S1043-L1047 PolarHBondContact O-N 3.18Å; S1043-R1134 PolarHBondContact OG-NH1 2.99Å
1044	S	82.7	Confident	83.1	Confident	6 Å²	6	35.4 Å²	35.4	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-77.3	-39.3	177.9	-54.4	0	0	0	0	111.1	I1040 L1041 V1042 M1046 L1047 A1048 P1135 F1489	I1040-S1044 WeakPolarHBondContact O-CB 3.3Å; I1040-S1044 PolarHBondContact O-N 3.1Å; I1040-S1044 PolarHBondContact O-OG 2.58Å; L1041-S1044 PolarHBondContact O-N 3.02Å; V1042-S1044 PolarHBondContact O-N 2.76Å; S1044-M1046 VanDerWaalsContact C-N 3.29Å; S1044-M1046 PolarHBondContact O-N 2.68Å; S1044-L1047 PolarHBondContact O-N 3.31Å; S1044-A1048 PolarHBondContact O-N 2.99Å; S1044-P1135 WeakPolarHBondContact OG-CD 3.36Å; S1044-P1135 WeakPolarHBondContact OG-CG 3.28Å; S1044-F1489 WeakPolarHBondContact O-CZ 3.46Å
1045	A	83.9	Confident	82.6	Confident	52 Å²	52	36 Å²	36	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-61.8	-35.9	171.6	0	0	0	0	0	112.3	L1041 V1042 A1048 A1049	L1041-A1045 PolarHBondContact O-N 3.14Å; V1042-A1045 PolarHBondContact O-N 2.99Å; V1042-A1045 VanDerWaalsContact O-N 3.13Å; A1045-A1048 PolarHBondContact O-N 2.81Å; A1045-A1049 PolarHBondContact O-N 3.19Å
1046	M	84.2	Confident	82	Confident	54 Å²	54	35.2 Å²	35.2	27%	0.266	22%	0.219	S	C	.	.	H	α-helix	trans	-65.4	-39.4	174.5	-66.2	-51.1	96.9	0	0	112.3	V1042 S1044 A1048 A1049 E1050 L1063 F1070	V1042-M1046 HydrophobicContact CG1-CE 4.33Å; V1042-M1046 HydrophobicContact CG1-CG 4.48Å; V1042-M1046 WeakPolarHBondContact O-CG 3.2Å; V1042-M1046 PolarHBondContact O-N 3.37Å; S1044-M1046 VanDerWaalsContact C-N 3.29Å; S1044-M1046 PolarHBondContact O-N 2.68Å; M1046-A1048 VanDerWaalsContact C-N 3.32Å; M1046-A1048 PolarHBondContact O-N 2.82Å; M1046-A1049 PolarHBondContact O-N 3.41Å; M1046-E1050 PolarHBondContact O-N 2.75Å; M1046-L1063 HydrophobicContact CB-CD2 3.79Å; M1046-L1063 HydrophobicContact CG-CD2 4.12Å; M1046-L1063 HydrophobicContact SD-CD2 3.6Å; M1046-F1070 HydrophobicContact CG-CE2 4.12Å
1047	L	81.5	Confident	82	Confident	14 Å²	14	35.7 Å²	35.7	7%	0.073	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-35.5	174.9	-70.3	168	0	0	0	112.3	S1043 S1044 A1049 E1050 R1131 V1132	S1043-L1047 WeakPolarHBondContact O-CG 3.15Å; S1043-L1047 PolarHBondContact O-N 3.18Å; S1044-L1047 PolarHBondContact O-N 3.31Å; L1047-A1049 PolarHBondContact O-N 2.89Å; L1047-E1050 WeakPolarHBondContact O-CB 3.34Å; L1047-E1050 PolarHBondContact O-N 3.4Å; L1047-R1131 HydrophobicContact CD1-CB 3.86Å; L1047-V1132 HydrophobicContact CD1-CG2 4.32Å
1048	A	85.3	Confident	82.3	Confident	21 Å²	21	37.1 Å²	37.1	17%	0.174	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-7	173.6	0	0	0	0	0	113.9	S1044 A1045 M1046 F1489 F1520	S1044-A1048 PolarHBondContact O-N 2.99Å; A1045-A1048 PolarHBondContact O-N 2.81Å; M1046-A1048 VanDerWaalsContact C-N 3.32Å; M1046-A1048 PolarHBondContact O-N 2.82Å; A1048-F1489 HydrophobicContact CB-CE2 4Å; A1048-F1520 HydrophobicContact CB-CB 4.25Å; A1048-F1520 HydrophobicContact CB-CD1 4.24Å; A1048-F1520 HydrophobicContact CB-CD2 3.74Å; A1048-F1520 HydrophobicContact CB-CE2 4.14Å; A1048-F1520 HydrophobicContact CB-CG 3.8Å; A1048-F1520 VanDerWaalsContact O-CB 3.27Å; A1048-F1520 WeakPolarHBondContact O-CB 3.36Å
1049	A	86.1	Confident	82.4	Confident	37 Å²	37	39.1 Å²	39.1	31%	0.306	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	1.8	176.9	0	0	0	0	0	113.4	A1045 M1046 L1047 R1059 L1063	A1045-A1049 PolarHBondContact O-N 3.19Å; M1046-A1049 PolarHBondContact O-N 3.41Å; L1047-A1049 PolarHBondContact O-N 2.89Å; A1049-R1059 WeakPolarHBondContact O-CD 3.41Å; A1049-R1059 PolarHBondContact O-NH1 3.5Å; A1049-L1063 HydrophobicContact CB-CD1 4.42Å; A1049-L1063 HydrophobicContact CB-CD2 4.37Å; A1049-L1063 VanDerWaalsContact O-CD1 3.32Å; A1049-L1063 WeakPolarHBondContact O-CD1 3.42Å
1050	E	82.8	Confident	82.3	Confident	42 Å²	42	38.8 Å²	38.8	20%	0.196	24%	0.238	C	C	.	.			trans	-61.5	150.1	176.5	-167.3	172.2	-160.5	0	0	111.7	M1046 L1047 R1059 M1496 Q1497	M1046-E1050 PolarHBondContact O-N 2.75Å; L1047-E1050 WeakPolarHBondContact O-CB 3.34Å; L1047-E1050 PolarHBondContact O-N 3.4Å; E1050-R1059 PolarHBondContact O-NH1 2.94Å; E1050-R1059 VanDerWaalsContact O-NH1 3.12Å; E1050-M1496 HydrophobicContact CB-CE 4.02Å; E1050-Q1497 PolarHBondContact OE2-NE2 3.42Å
1051	D	83.8	Confident	82.4	Confident	29 Å²	29	43.1 Å²	43.1	16%	0.155	26%	0.258	C	S	.	.			trans	-98.8	111.5	173.8	-160.1	-38.1	0	0	0	109.4	L1053 R1059 N1060	D1051-L1053 PolarHBondContact O-N 3.07Å; D1051-L1053 WeakPolarHBondContact OD1-CB 3.37Å; D1051-L1053 PolarHBondContact OD1-N 2.9Å; D1051-R1059 VanDerWaalsContact CB-NH2 3.35Å; D1051-R1059 IonicContact OD1-NH2 3.53Å; D1051-R1059 IonicContact OD2-CZ 2.64Å; D1051-R1059 IonicContact OD2-NE 2.9Å; D1051-R1059 IonicContact OD2-NH2 3.03Å; D1051-R1059 PolarHBondContact OD2-NH2 3.07Å; D1051-N1060 WeakPolarHBondContact CB-ND2 3.33Å; D1051-N1060 WeakPolarHBondContact CB-OD1 3.05Å; D1051-N1060 PolarHBondContact N-OD1 3.09Å; D1051-N1060 PolarHBondContact O-ND2 3.34Å
1052	P	82.1	Confident	82.8	Confident	20 Å²	20	42.8 Å²	42.8	13%	0.13	26%	0.256	C	S	.	.	S	Bend	trans	-76.2	-10.4	179.4	32.2	-35.7	0	0	0	113.1	M1496 K1501 Q1518	P1052-M1496 HydrophobicContact CB-CG 4.34Å; P1052-M1496 WeakPolarHBondContact CB-O 3.49Å; P1052-M1496 HydrophobicContact CG-CG 3.93Å; P1052-K1501 WeakPolarHBondContact O-CE 3.29Å; P1052-K1501 WeakPolarHBondContact O-CG 3.48Å; P1052-K1501 PolarHBondContact O-NZ 3.23Å; P1052-Q1518 WeakPolarHBondContact CD-O 3.3Å; P1052-Q1518 WeakPolarHBondContact CG-O 3.3Å
1053	L	79.2	Confident	82.8	Confident	27 Å²	27	41.1 Å²	41.1	14%	0.141	25%	0.245	C	C	.	.	S	Bend	trans	-91.4	-58.3	-166.5	-168.9	57.9	0	0	0	112.8	D1051 K1501 D1552 F1554 S1555 D1556	D1051-L1053 PolarHBondContact O-N 3.07Å; D1051-L1053 WeakPolarHBondContact OD1-CB 3.37Å; D1051-L1053 PolarHBondContact OD1-N 2.9Å; L1053-K1501 PolarHBondContact O-NZ 3.25Å; L1053-D1552 HydrophobicContact CD1-CB 3.84Å; L1053-F1554 HydrophobicContact CD1-CB 4.39Å; L1053-F1554 HydrophobicContact CD2-CB 3.89Å; L1053-F1554 HydrophobicContact CG-CB 4.05Å; L1053-S1555 WeakPolarHBondContact O-CA 3.25Å; L1053-D1556 PolarHBondContact O-N 3.04Å
1054	D	77.9	Confident	82.6	Confident	38 Å²	38	43.2 Å²	43.2	20%	0.203	26%	0.256	C	S	.	.			trans	-110.7	109.6	174.2	175.2	12.6	0	0	0	110.8	S1056 S1057 N1060 R1733	D1054-S1056 VanDerWaalsContact CG-OG 3.29Å; D1054-S1056 PolarHBondContact O-N 3.44Å; D1054-S1056 WeakPolarHBondContact OD1-CA 3.29Å; D1054-S1056 VanDerWaalsContact OD1-CB 3.27Å; D1054-S1056 WeakPolarHBondContact OD1-CB 3.23Å; D1054-S1056 PolarHBondContact OD1-N 3.04Å; D1054-S1056 PolarHBondContact OD1-OG 3.35Å; D1054-S1056 PolarHBondContact OD2-OG 3.09Å; D1054-S1056 VanDerWaalsContact OD2-OG 3.13Å; D1054-S1057 VanDerWaalsContact O-CB 3.27Å; D1054-S1057 WeakPolarHBondContact O-CB 3.16Å; D1054-S1057 PolarHBondContact O-N 2.99Å; D1054-S1057 PolarHBondContact OD1-N 2.87Å; D1054-S1057 PolarHBondContact OD2-N 2.96Å; D1054-N1060 PolarHBondContact O-ND2 2.85Å; D1054-R1733 IonicContact OD2-NH1 2.66Å; D1054-R1733 PolarHBondContact OD2-NH1 3.37Å
1055	A	72.8	Confident	82.8	Confident	57 Å²	57	50.3 Å²	50.3	47%	0.471	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.7	177.3	0	0	0	0	0	113.3	D1556	A1055-D1556 WeakPolarHBondContact CB-OD1 3.24Å; A1055-D1556 PolarHBondContact N-OD1 2.79Å
1056	S	75.3	Confident	83	Confident	46 Å²	46	52.4 Å²	52.4	32%	0.322	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-6.6	178.8	80.5	0	0	0	0	114.4	D1054 Q1061 R1733	D1054-S1056 VanDerWaalsContact CG-OG 3.29Å; D1054-S1056 PolarHBondContact O-N 3.44Å; D1054-S1056 WeakPolarHBondContact OD1-CA 3.29Å; D1054-S1056 VanDerWaalsContact OD1-CB 3.27Å; D1054-S1056 WeakPolarHBondContact OD1-CB 3.23Å; D1054-S1056 PolarHBondContact OD1-N 3.04Å; D1054-S1056 PolarHBondContact OD1-OG 3.35Å; D1054-S1056 PolarHBondContact OD2-OG 3.09Å; D1054-S1056 VanDerWaalsContact OD2-OG 3.13Å; S1056-Q1061 PolarHBondContact O-NE2 3.21Å; S1056-R1733 PolarHBondContact OG-NH1 2.93Å; S1056-R1733 PolarHBondContact OG-NH2 3.19Å
1057	S	81.5	Confident	82.8	Confident	24 Å²	24	50.5 Å²	50.5	17%	0.168	27%	0.273	C	S	.	.			trans	-49.9	139.1	-177.6	175.4	0	0	0	0	112.5	D1054 R1059 N1060 Q1061	D1054-S1057 VanDerWaalsContact O-CB 3.27Å; D1054-S1057 WeakPolarHBondContact O-CB 3.16Å; D1054-S1057 PolarHBondContact O-N 2.99Å; D1054-S1057 PolarHBondContact OD1-N 2.87Å; D1054-S1057 PolarHBondContact OD2-N 2.96Å; S1057-R1059 PolarHBondContact O-N 3.04Å; S1057-R1059 VanDerWaalsContact O-N 3.14Å; S1057-N1060 WeakPolarHBondContact O-CA 3.49Å; S1057-N1060 WeakPolarHBondContact O-CB 3.39Å; S1057-N1060 PolarHBondContact O-N 3.27Å; S1057-Q1061 PolarHBondContact O-N 3.08Å
1058	A	86.6	Confident	83	Confident	66 Å²	66	55.5 Å²	55.5	55%	0.545	29%	0.292	S	S	.	.	H	α-helix	trans	-55.7	-33.7	179.4	0	0	0	0	0	112.4	Q1061 I1062	A1058-Q1061 PolarHBondContact O-N 3.15Å; A1058-I1062 WeakPolarHBondContact O-CG1 3.27Å; A1058-I1062 PolarHBondContact O-N 3.33Å
1059	R	86.2	Confident	83.2	Confident	104 Å²	104	59.9 Å²	59.9	39%	0.392	31%	0.308	S	S	.	.	H	α-helix	trans	-56.3	-50.3	170.2	173.6	162.1	64.8	127.4	-14.2	111.4	A1049 E1050 D1051 S1057 I1062 L1063	A1049-R1059 WeakPolarHBondContact O-CD 3.41Å; A1049-R1059 PolarHBondContact O-NH1 3.5Å; E1050-R1059 PolarHBondContact O-NH1 2.94Å; E1050-R1059 VanDerWaalsContact O-NH1 3.12Å; D1051-R1059 VanDerWaalsContact CB-NH2 3.35Å; D1051-R1059 IonicContact OD1-NH2 3.53Å; D1051-R1059 IonicContact OD2-CZ 2.64Å; D1051-R1059 IonicContact OD2-NE 2.9Å; D1051-R1059 IonicContact OD2-NH2 3.03Å; D1051-R1059 PolarHBondContact OD2-NH2 3.07Å; S1057-R1059 PolarHBondContact O-N 3.04Å; S1057-R1059 VanDerWaalsContact O-N 3.14Å; R1059-I1062 PolarHBondContact O-N 3.38Å; R1059-L1063 HydrophobicContact CG-CD1 3.82Å; R1059-L1063 WeakPolarHBondContact O-CB 3.44Å; R1059-L1063 WeakPolarHBondContact O-CG 3.25Å; R1059-L1063 PolarHBondContact O-N 3.15Å
1060	N	83.6	Confident	83.2	Confident	9 Å²	9	58.7 Å²	58.7	5%	0.048	30%	0.295	C	S	.	.	H	α-helix	trans	-66.7	-36.4	178.4	-78.6	-9.6	0	0	0	112.6	D1051 D1054 S1057 L1063 N1064	D1051-N1060 WeakPolarHBondContact CB-ND2 3.33Å; D1051-N1060 WeakPolarHBondContact CB-OD1 3.05Å; D1051-N1060 PolarHBondContact N-OD1 3.09Å; D1051-N1060 PolarHBondContact O-ND2 3.34Å; D1054-N1060 PolarHBondContact O-ND2 2.85Å; S1057-N1060 WeakPolarHBondContact O-CA 3.49Å; S1057-N1060 WeakPolarHBondContact O-CB 3.39Å; S1057-N1060 PolarHBondContact O-N 3.27Å; N1060-L1063 PolarHBondContact O-N 3.44Å; N1060-N1064 WeakPolarHBondContact O-CB 3.44Å; N1060-N1064 VanDerWaalsContact O-CG 3.27Å; N1060-N1064 PolarHBondContact O-N 2.95Å; N1060-N1064 PolarHBondContact O-ND2 2.83Å
1061	Q	84.5	Confident	83.3	Confident	94 Å²	94	56.9 Å²	56.9	44%	0.439	29%	0.287	S	S	.	.	H	α-helix	trans	-60.9	-46.6	173.9	-62.4	-177.3	33.8	0	0	111.6	S1056 S1057 A1058 N1064 Y1065	S1056-Q1061 PolarHBondContact O-NE2 3.21Å; S1057-Q1061 PolarHBondContact O-N 3.08Å; A1058-Q1061 PolarHBondContact O-N 3.15Å; Q1061-N1064 PolarHBondContact O-N 3.21Å; Q1061-Y1065 VanDerWaalsContact O-CD2 3.23Å; Q1061-Y1065 WeakPolarHBondContact O-CD2 3.1Å; Q1061-Y1065 PolarHBondContact O-N 3.07Å; Q1061-Y1065 VanDerWaalsContact O-N 3.14Å
1062	I	88.8	Confident	83.5	Confident	96 Å²	96	58.4 Å²	58.4	49%	0.492	30%	0.3	S	S	.	.	H	α-helix	trans	-61.6	-45.5	176.2	-68.2	165.4	0	0	0	111.2	A1058 R1059 N1064 Y1065 F1066	A1058-I1062 WeakPolarHBondContact O-CG1 3.27Å; A1058-I1062 PolarHBondContact O-N 3.33Å; R1059-I1062 PolarHBondContact O-N 3.38Å; I1062-N1064 VanDerWaalsContact C-N 3.33Å; I1062-N1064 PolarHBondContact O-N 3.38Å; I1062-Y1065 PolarHBondContact O-N 3.09Å; I1062-F1066 HydrophobicContact CG2-CD2 3.93Å; I1062-F1066 HydrophobicContact CG2-CE2 3.66Å; I1062-F1066 VanDerWaalsContact O-CD2 3.27Å; I1062-F1066 WeakPolarHBondContact O-CD2 3.4Å; I1062-F1066 PolarHBondContact O-N 3.01Å; I1062-F1066 VanDerWaalsContact O-N 3.15Å
1063	L	85.5	Confident	83.8	Confident	24 Å²	24	59.1 Å²	59.1	13%	0.126	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-35.6	178	-68.2	167.5	0	0	0	112.6	M1046 A1049 R1059 N1060 F1066 D1067	M1046-L1063 HydrophobicContact CB-CD2 3.79Å; M1046-L1063 HydrophobicContact CG-CD2 4.12Å; M1046-L1063 HydrophobicContact SD-CD2 3.6Å; A1049-L1063 HydrophobicContact CB-CD1 4.42Å; A1049-L1063 HydrophobicContact CB-CD2 4.37Å; A1049-L1063 VanDerWaalsContact O-CD1 3.32Å; A1049-L1063 WeakPolarHBondContact O-CD1 3.42Å; R1059-L1063 HydrophobicContact CG-CD1 3.82Å; R1059-L1063 WeakPolarHBondContact O-CB 3.44Å; R1059-L1063 WeakPolarHBondContact O-CG 3.25Å; R1059-L1063 PolarHBondContact O-N 3.15Å; N1060-L1063 PolarHBondContact O-N 3.44Å; L1063-F1066 PolarHBondContact O-N 3.4Å; L1063-D1067 PolarHBondContact O-N 3.11Å
1064	N	79.6	Confident	84.2	Confident	47 Å²	47	57.9 Å²	57.9	25%	0.251	30%	0.297	S	S	.	.	H	α-helix	trans	-65.2	-40.6	173.9	-76.8	-44.9	0	0	0	112	N1060 Q1061 I1062 F1066 D1067 Y1068	N1060-N1064 WeakPolarHBondContact O-CB 3.44Å; N1060-N1064 VanDerWaalsContact O-CG 3.27Å; N1060-N1064 PolarHBondContact O-N 2.95Å; N1060-N1064 PolarHBondContact O-ND2 2.83Å; Q1061-N1064 PolarHBondContact O-N 3.21Å; I1062-N1064 VanDerWaalsContact C-N 3.33Å; I1062-N1064 PolarHBondContact O-N 3.38Å; N1064-F1066 VanDerWaalsContact C-N 3.3Å; N1064-F1066 PolarHBondContact O-N 3.45Å; N1064-D1067 PolarHBondContact O-N 3.28Å; N1064-Y1068 WeakPolarHBondContact O-CD2 3.42Å; N1064-Y1068 VanDerWaalsContact O-CG 3.24Å; N1064-Y1068 PolarHBondContact O-N 3.12Å
1065	Y	87.5	Confident	84.7	Confident	155 Å²	155	58.2 Å²	58.2	61%	0.608	30%	0.301	S	S	*	.	H	α-helix	trans	-60.5	-39.2	172.3	-64	-50.5	0	0	0	112.1	Q1061 I1062 Y1068 F1069	Q1061-Y1065 VanDerWaalsContact O-CD2 3.23Å; Q1061-Y1065 WeakPolarHBondContact O-CD2 3.1Å; Q1061-Y1065 PolarHBondContact O-N 3.07Å; Q1061-Y1065 VanDerWaalsContact O-N 3.14Å; I1062-Y1065 PolarHBondContact O-N 3.09Å; Y1065-Y1068 HydrophobicContact CD1-CD2 4.1Å; Y1065-Y1068 HydrophobicContact CD1-CE2 4.16Å; Y1065-Y1068 PolarHBondContact O-N 2.87Å; Y1065-F1069 PolarHBondContact O-N 2.87Å; Y1065-F1069 VanDerWaalsContact O-N 3.09Å
1066	F	87.3	Confident	85.5	Confident	97 Å²	97	59.6 Å²	59.6	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-67.4	-37.4	174	-77	-63.3	0	0	0	113.2	I1062 L1063 N1064 F1069 F1070	I1062-F1066 HydrophobicContact CG2-CD2 3.93Å; I1062-F1066 HydrophobicContact CG2-CE2 3.66Å; I1062-F1066 VanDerWaalsContact O-CD2 3.27Å; I1062-F1066 WeakPolarHBondContact O-CD2 3.4Å; I1062-F1066 PolarHBondContact O-N 3.01Å; I1062-F1066 VanDerWaalsContact O-N 3.15Å; L1063-F1066 PolarHBondContact O-N 3.4Å; N1064-F1066 VanDerWaalsContact C-N 3.3Å; N1064-F1066 PolarHBondContact O-N 3.45Å; F1066-F1069 WeakPolarHBondContact O-CB 3.41Å; F1066-F1069 PolarHBondContact O-N 2.91Å; F1066-F1070 HydrophobicContact CB-CD2 4.37Å; F1066-F1070 HydrophobicContact CB-CE2 4.05Å; F1066-F1070 WeakPolarHBondContact O-CD2 3.34Å; F1066-F1070 WeakPolarHBondContact O-CG 3.37Å; F1066-F1070 PolarHBondContact O-N 3.26Å
1067	D	82	Confident	86.1	Confident	14 Å²	14	57.7 Å²	57.7	8%	0.075	29%	0.289	C	S	.	.	H	α-helix	trans	-73.1	-30.2	175.6	-179.4	68.6	0	0	0	113.2	L1063 N1064 F1069 T1071 Y1114 R1131 R1134	L1063-D1067 PolarHBondContact O-N 3.11Å; N1064-D1067 PolarHBondContact O-N 3.28Å; D1067-F1069 VanDerWaalsContact C-N 3.34Å; D1067-T1071 WeakPolarHBondContact O-CB 3.35Å; D1067-T1071 PolarHBondContact O-N 3.42Å; D1067-T1071 PolarHBondContact O-OG1 3.2Å; D1067-T1071 PolarHBondContact OD1-OG1 3.46Å; D1067-Y1114 PolarHBondContact O-OH 3.01Å; D1067-Y1114 PolarHBondContact OD2-OH 3.22Å; D1067-Y1114 VanDerWaalsContact OD2-OH 3.08Å; D1067-R1131 IonicContact OD1-CZ 3.36Å; D1067-R1131 IonicContact OD1-NH1 2.62Å; D1067-R1131 IonicContact OD2-CZ 2.65Å; D1067-R1131 IonicContact OD2-NH1 2.63Å; D1067-R1131 PolarHBondContact OD2-NH1 2.97Å; D1067-R1131 IonicContact OD2-NH2 3.05Å; D1067-R1131 PolarHBondContact OD2-NH2 2.64Å; D1067-R1134 IonicContact OD1-CZ 2.8Å; D1067-R1134 IonicContact OD1-NH1 2.82Å; D1067-R1134 PolarHBondContact OD1-NH1 3.04Å; D1067-R1134 IonicContact OD1-NH2 3.44Å; D1067-R1134 PolarHBondContact OD1-NH2 3.25Å
1068	Y	84.2	Confident	86.4	Confident	118 Å²	118	57 Å²	57	46%	0.463	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-47.3	165.8	-60.8	-24.3	0	0	0	110.5	N1064 Y1065 S1072 Y1114	N1064-Y1068 WeakPolarHBondContact O-CD2 3.42Å; N1064-Y1068 VanDerWaalsContact O-CG 3.24Å; N1064-Y1068 PolarHBondContact O-N 3.12Å; Y1065-Y1068 HydrophobicContact CD1-CD2 4.1Å; Y1065-Y1068 HydrophobicContact CD1-CE2 4.16Å; Y1065-Y1068 PolarHBondContact O-N 2.87Å; Y1068-S1072 WeakPolarHBondContact O-CB 3.04Å; Y1068-S1072 PolarHBondContact O-N 3.25Å; Y1068-Y1114 HydrophobicContact CD1-CD1 4.19Å; Y1068-Y1114 AromaticContact CD1-CE1 3.59Å; Y1068-Y1114 HydrophobicContact CD1-CE1 3.59Å; Y1068-Y1114 HydrophobicContact CD1-CE2 4.42Å; Y1068-Y1114 AromaticContact CD1-CZ 3.72Å; Y1068-Y1114 AromaticContact CE1-CD1 3.73Å; Y1068-Y1114 HydrophobicContact CE1-CD1 3.73Å; Y1068-Y1114 AromaticContact CE1-CE1 3.5Å; Y1068-Y1114 HydrophobicContact CE1-CE1 3.5Å
1069	F	89.1	Confident	86.4	Confident	114 Å²	114	57.1 Å²	57.1	50%	0.5	28%	0.277	S	S	.	.	H	α-helix	trans	-59.8	-54.3	175.8	173.9	-100.4	0	0	0	111.8	Y1065 F1066 D1067 T1071 S1072 V1073	Y1065-F1069 PolarHBondContact O-N 2.87Å; Y1065-F1069 VanDerWaalsContact O-N 3.09Å; F1066-F1069 WeakPolarHBondContact O-CB 3.41Å; F1066-F1069 PolarHBondContact O-N 2.91Å; D1067-F1069 VanDerWaalsContact C-N 3.34Å; F1069-T1071 PolarHBondContact O-N 3.39Å; F1069-S1072 WeakPolarHBondContact O-CB 3.44Å; F1069-S1072 PolarHBondContact O-N 3.02Å; F1069-S1072 VanDerWaalsContact O-N 3.11Å; F1069-S1072 PolarHBondContact O-OG 3.19Å; F1069-V1073 HydrophobicContact CE1-CG2 4.13Å; F1069-V1073 HydrophobicContact CE2-CG2 4.25Å; F1069-V1073 HydrophobicContact CZ-CG2 3.97Å; F1069-V1073 WeakPolarHBondContact O-CG2 3.28Å; F1069-V1073 PolarHBondContact O-N 3.12Å
1070	F	87.8	Confident	86.5	Confident	12 Å²	12	53.8 Å²	53.8	5%	0.053	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-38.5	-179.7	-67.3	-52.7	0	0	0	112.7	C1039 V1042 M1046 F1066 S1072 V1073 F1074	C1039-F1070 HydrophobicContact CB-CD1 4.09Å; C1039-F1070 HydrophobicContact CB-CE1 4.3Å; V1042-F1070 HydrophobicContact CB-CE1 4.49Å; V1042-F1070 HydrophobicContact CB-CZ 3.98Å; V1042-F1070 HydrophobicContact CG1-CE1 4.48Å; V1042-F1070 HydrophobicContact CG1-CE2 4.19Å; V1042-F1070 HydrophobicContact CG1-CZ 3.58Å; M1046-F1070 HydrophobicContact CG-CE2 4.12Å; F1066-F1070 HydrophobicContact CB-CD2 4.37Å; F1066-F1070 HydrophobicContact CB-CE2 4.05Å; F1066-F1070 WeakPolarHBondContact O-CD2 3.34Å; F1066-F1070 WeakPolarHBondContact O-CG 3.37Å; F1066-F1070 PolarHBondContact O-N 3.26Å; F1070-S1072 VanDerWaalsContact C-N 3.31Å; F1070-S1072 PolarHBondContact O-N 3.4Å; F1070-V1073 PolarHBondContact O-N 2.98Å; F1070-F1074 HydrophobicContact CB-CD2 4.38Å; F1070-F1074 HydrophobicContact CB-CE2 3.92Å; F1070-F1074 WeakPolarHBondContact O-CD2 3.42Å; F1070-F1074 VanDerWaalsContact O-CG 3.3Å; F1070-F1074 WeakPolarHBondContact O-CG 3.29Å; F1070-F1074 PolarHBondContact O-N 2.91Å
1071	T	84.9	Confident	86.7	Confident	4 Å²	4	54.7 Å²	54.7	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-35	174.9	-62.4	0	0	0	0	111.4	D1067 F1069 T1075 I1111 Y1114	D1067-T1071 WeakPolarHBondContact O-CB 3.35Å; D1067-T1071 PolarHBondContact O-N 3.42Å; D1067-T1071 PolarHBondContact O-OG1 3.2Å; D1067-T1071 PolarHBondContact OD1-OG1 3.46Å; F1069-T1071 PolarHBondContact O-N 3.39Å; T1071-T1075 VanDerWaalsContact O-CB 3.28Å; T1071-T1075 WeakPolarHBondContact O-CB 3.42Å; T1071-T1075 PolarHBondContact O-N 3.17Å; T1071-T1075 PolarHBondContact O-OG1 2.85Å; T1071-I1111 HydrophobicContact CG2-CG1 4.24Å; T1071-Y1114 VanDerWaalsContact CB-OH 3.26Å; T1071-Y1114 WeakPolarHBondContact CB-OH 3.25Å; T1071-Y1114 HydrophobicContact CG2-CE2 3.97Å; T1071-Y1114 PolarHBondContact OG1-OH 3.35Å
1072	S	87.4	Confident	86.8	Confident	60 Å²	60	50.9 Å²	50.9	42%	0.42	25%	0.253	S	S	.	.	H	α-helix	trans	-63.8	-44.3	171.1	82.8	0	0	0	0	111.7	Y1068 F1069 F1070 F1074 T1075 V1076	Y1068-S1072 WeakPolarHBondContact O-CB 3.04Å; Y1068-S1072 PolarHBondContact O-N 3.25Å; F1069-S1072 WeakPolarHBondContact O-CB 3.44Å; F1069-S1072 PolarHBondContact O-N 3.02Å; F1069-S1072 VanDerWaalsContact O-N 3.11Å; F1069-S1072 PolarHBondContact O-OG 3.19Å; F1070-S1072 VanDerWaalsContact C-N 3.31Å; F1070-S1072 PolarHBondContact O-N 3.4Å; S1072-F1074 PolarHBondContact O-N 3.12Å; S1072-T1075 WeakPolarHBondContact O-CB 3.33Å; S1072-T1075 PolarHBondContact O-N 3.22Å; S1072-V1076 WeakPolarHBondContact O-CG2 3.4Å; S1072-V1076 PolarHBondContact O-N 3.28Å
1073	V	88.8	Confident	86.7	Confident	35 Å²	35	47 Å²	47	21%	0.212	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-45.3	177.2	173.3	0	0	0	0	111.4	F1069 F1070 T1075 V1076 E1077	F1069-V1073 HydrophobicContact CE1-CG2 4.13Å; F1069-V1073 HydrophobicContact CE2-CG2 4.25Å; F1069-V1073 HydrophobicContact CZ-CG2 3.97Å; F1069-V1073 WeakPolarHBondContact O-CG2 3.28Å; F1069-V1073 PolarHBondContact O-N 3.12Å; F1070-V1073 PolarHBondContact O-N 2.98Å; V1073-T1075 VanDerWaalsContact C-N 3.34Å; V1073-T1075 PolarHBondContact O-N 3.33Å; V1073-V1076 PolarHBondContact O-N 3.28Å; V1073-E1077 WeakPolarHBondContact O-CB 3.37Å; V1073-E1077 PolarHBondContact O-N 3.33Å
1074	F	87.6	Confident	86.7	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-70.3	-28.4	176.4	-58.6	-45.8	0	0	0	112.7	C1039 I1040 F1070 S1072 E1077 I1078 V1107	C1039-F1074 HydrophobicContact CB-CE1 4.04Å; C1039-F1074 HydrophobicContact CB-CZ 4.13Å; I1040-F1074 HydrophobicContact CG1-CE1 3.88Å; I1040-F1074 HydrophobicContact CG1-CZ 3.95Å; F1070-F1074 HydrophobicContact CB-CD2 4.38Å; F1070-F1074 HydrophobicContact CB-CE2 3.92Å; F1070-F1074 WeakPolarHBondContact O-CD2 3.42Å; F1070-F1074 VanDerWaalsContact O-CG 3.3Å; F1070-F1074 WeakPolarHBondContact O-CG 3.29Å; F1070-F1074 PolarHBondContact O-N 2.91Å; S1072-F1074 PolarHBondContact O-N 3.12Å; F1074-E1077 WeakPolarHBondContact CD1-OE2 3.39Å; F1074-E1077 WeakPolarHBondContact O-CB 3.28Å; F1074-I1078 WeakPolarHBondContact O-CB 3.32Å; F1074-I1078 VanDerWaalsContact O-CG1 3.32Å; F1074-I1078 WeakPolarHBondContact O-CG1 3.12Å; F1074-I1078 PolarHBondContact O-N 2.95Å; F1074-V1107 HydrophobicContact CB-CG2 3.46Å; F1074-V1107 VanDerWaalsContact CB-CG2 3.46Å
1075	T	88.4	Confident	86.8	Confident	45 Å²	45	45.6 Å²	45.6	28%	0.276	22%	0.223	S	C	.	.	H	α-helix	trans	-68.6	-41.2	171.8	-58.4	0	0	0	0	111.1	T1071 S1072 V1073 I1078 T1079 V1107 I1111	T1071-T1075 VanDerWaalsContact O-CB 3.28Å; T1071-T1075 WeakPolarHBondContact O-CB 3.42Å; T1071-T1075 PolarHBondContact O-N 3.17Å; T1071-T1075 PolarHBondContact O-OG1 2.85Å; S1072-T1075 WeakPolarHBondContact O-CB 3.33Å; S1072-T1075 PolarHBondContact O-N 3.22Å; V1073-T1075 VanDerWaalsContact C-N 3.34Å; V1073-T1075 PolarHBondContact O-N 3.33Å; T1075-I1078 PolarHBondContact O-N 2.96Å; T1075-T1079 VanDerWaalsContact O-CB 3.29Å; T1075-T1079 WeakPolarHBondContact O-CB 3.36Å; T1075-T1079 PolarHBondContact O-N 3.06Å; T1075-T1079 PolarHBondContact O-OG1 3.2Å; T1075-V1107 WeakPolarHBondContact OG1-CG1 3.11Å; T1075-I1111 HydrophobicContact CG2-CD1 4.49Å
1076	V	89.3	Confident	86.5	Confident	86 Å²	86	38.4 Å²	38.4	52%	0.521	20%	0.196	S	C	.	.	H	α-helix	trans	-64.7	-44.8	172.5	171.7	0	0	0	0	110.9	S1072 V1073 I1078 T1079 L1080	S1072-V1076 WeakPolarHBondContact O-CG2 3.4Å; S1072-V1076 PolarHBondContact O-N 3.28Å; V1073-V1076 PolarHBondContact O-N 3.28Å; V1076-I1078 VanDerWaalsContact C-N 3.33Å; V1076-I1078 PolarHBondContact O-N 3.05Å; V1076-T1079 PolarHBondContact O-N 3.24Å; V1076-L1080 HydrophobicContact CG1-CD1 3.9Å; V1076-L1080 HydrophobicContact CG1-CG 4.35Å; V1076-L1080 VanDerWaalsContact O-CG 3.31Å; V1076-L1080 WeakPolarHBondContact O-CG 3.24Å; V1076-L1080 PolarHBondContact O-N 3.38Å
1077	E	88.5	Confident	86.2	Confident	7 Å²	7	37.3 Å²	37.3	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-52	-51.5	174.8	-175.5	-155	168	0	0	111.3	F1032 V1036 V1073 F1074 K1081 R1137	F1032-E1077 HydrophobicContact CE1-CG 4.2Å; F1032-E1077 HydrophobicContact CZ-CB 4.24Å; F1032-E1077 HydrophobicContact CZ-CG 3.71Å; V1036-E1077 HydrophobicContact CG2-CG 3.9Å; V1073-E1077 WeakPolarHBondContact O-CB 3.37Å; V1073-E1077 PolarHBondContact O-N 3.33Å; F1074-E1077 WeakPolarHBondContact CD1-OE2 3.39Å; F1074-E1077 WeakPolarHBondContact O-CB 3.28Å; E1077-K1081 HydrophobicContact CG-CD 4.47Å; E1077-K1081 WeakPolarHBondContact O-CG 3.16Å; E1077-K1081 PolarHBondContact O-N 3.5Å; E1077-K1081 WeakPolarHBondContact OE1-CE 3.13Å; E1077-K1081 IonicContact OE1-NZ 2.72Å; E1077-K1081 PolarHBondContact OE1-NZ 3.18Å; E1077-R1137 IonicContact OE1-NH1 2.72Å; E1077-R1137 PolarHBondContact OE1-NH1 3.34Å; E1077-R1137 IonicContact OE2-CZ 2.7Å; E1077-R1137 IonicContact OE2-NH1 3.73Å; E1077-R1137 PolarHBondContact OE2-NH1 3Å; E1077-R1137 IonicContact OE2-NH2 3.56Å; E1077-R1137 PolarHBondContact OE2-NH2 2.91Å
1078	I	86.8	Confident	86.1	Confident	9 Å²	9	40.8 Å²	40.8	5%	0.046	22%	0.216	C	C	.	.	H	α-helix	trans	-69.2	-38.8	-179.2	-71.2	-178.4	0	0	0	111.4	F1074 T1075 V1076 L1080 K1081 I1082 F1094 D1103 F1104 V1107	F1074-I1078 WeakPolarHBondContact O-CB 3.32Å; F1074-I1078 VanDerWaalsContact O-CG1 3.32Å; F1074-I1078 WeakPolarHBondContact O-CG1 3.12Å; F1074-I1078 PolarHBondContact O-N 2.95Å; T1075-I1078 PolarHBondContact O-N 2.96Å; V1076-I1078 VanDerWaalsContact C-N 3.33Å; V1076-I1078 PolarHBondContact O-N 3.05Å; I1078-L1080 PolarHBondContact O-N 2.92Å; I1078-K1081 CarbonylContact O-C 3.51Å; I1078-K1081 PolarHBondContact O-N 2.98Å; I1078-I1082 HydrophobicContact CG2-CD1 3.48Å; I1078-I1082 VanDerWaalsContact CG2-CD1 3.48Å; I1078-I1082 HydrophobicContact CG2-CG1 4.15Å; I1078-I1082 VanDerWaalsContact O-CG1 3.27Å; I1078-I1082 WeakPolarHBondContact O-CG1 3.31Å; I1078-I1082 PolarHBondContact O-N 2.91Å; I1078-F1094 HydrophobicContact CB-CZ 4.35Å; I1078-F1094 HydrophobicContact CD1-CZ 4.43Å; I1078-F1094 HydrophobicContact CG1-CZ 4.05Å; I1078-F1094 HydrophobicContact CG2-CE1 3.93Å; I1078-F1094 HydrophobicContact CG2-CZ 3.78Å; I1078-D1103 HydrophobicContact CD1-CB 4.09Å; I1078-D1103 VanDerWaalsContact CD1-O 3.3Å; I1078-D1103 WeakPolarHBondContact CD1-O 3.17Å; I1078-F1104 HydrophobicContact CG2-CD2 4.39Å; I1078-V1107 HydrophobicContact CD1-CB 3.74Å; I1078-V1107 HydrophobicContact CD1-CG1 4.32Å; I1078-V1107 HydrophobicContact CD1-CG2 3.5Å
1079	T	87.7	Confident	85.5	Confident	68 Å²	68	41.9 Å²	41.9	42%	0.417	23%	0.229	S	C	.	.	H	α-helix	trans	-60.9	-46	176.9	-60.6	0	0	0	0	111.1	T1075 V1076 K1081 I1082 I1083	T1075-T1079 VanDerWaalsContact O-CB 3.29Å; T1075-T1079 WeakPolarHBondContact O-CB 3.36Å; T1075-T1079 PolarHBondContact O-N 3.06Å; T1075-T1079 PolarHBondContact O-OG1 3.2Å; V1076-T1079 PolarHBondContact O-N 3.24Å; T1079-K1081 PolarHBondContact O-N 2.92Å; T1079-I1082 PolarHBondContact O-N 3.22Å; T1079-I1083 HydrophobicContact CG2-CD1 3.81Å; T1079-I1083 WeakPolarHBondContact O-CD1 3.26Å; T1079-I1083 VanDerWaalsContact O-CG1 3.27Å; T1079-I1083 WeakPolarHBondContact O-CG1 3.19Å; T1079-I1083 PolarHBondContact O-N 3.45Å
1080	L	88.4	Confident	84.9	Confident	34 Å²	34	38.6 Å²	38.6	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-62.3	-42.1	174.5	-66.6	169.3	0	0	0	112	C1023 V1026 F1032 V1076 I1078 I1083 T1084	C1023-L1080 HydrophobicContact CB-CD2 4.11Å; C1023-L1080 VanDerWaalsContact SG-CD2 3.55Å; V1026-L1080 HydrophobicContact CG1-CD1 4.25Å; F1032-L1080 HydrophobicContact CE2-CD1 3.87Å; F1032-L1080 HydrophobicContact CZ-CD1 4.35Å; V1076-L1080 HydrophobicContact CG1-CD1 3.9Å; V1076-L1080 HydrophobicContact CG1-CG 4.35Å; V1076-L1080 VanDerWaalsContact O-CG 3.31Å; V1076-L1080 WeakPolarHBondContact O-CG 3.24Å; V1076-L1080 PolarHBondContact O-N 3.38Å; I1078-L1080 PolarHBondContact O-N 2.92Å; L1080-I1083 PolarHBondContact O-N 3.45Å; L1080-T1084 VanDerWaalsContact O-CG2 3.31Å; L1080-T1084 WeakPolarHBondContact O-CG2 3.28Å; L1080-T1084 PolarHBondContact O-N 2.81Å; L1080-T1084 VanDerWaalsContact O-N 3.14Å; L1080-T1084 PolarHBondContact O-OG1 3.02Å
1081	K	87.4	Confident	84	Confident	28 Å²	28	48 Å²	48	12%	0.122	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-36.9	174.2	-73.2	178.9	178.3	173.6	0	112.7	E1077 I1078 T1079 T1084 Y1085 F1094 N1100 D1103	E1077-K1081 HydrophobicContact CG-CD 4.47Å; E1077-K1081 WeakPolarHBondContact O-CG 3.16Å; E1077-K1081 PolarHBondContact O-N 3.5Å; E1077-K1081 WeakPolarHBondContact OE1-CE 3.13Å; E1077-K1081 IonicContact OE1-NZ 2.72Å; E1077-K1081 PolarHBondContact OE1-NZ 3.18Å; I1078-K1081 CarbonylContact O-C 3.51Å; I1078-K1081 PolarHBondContact O-N 2.98Å; T1079-K1081 PolarHBondContact O-N 2.92Å; K1081-T1084 WeakPolarHBondContact CA-OG1 3.31Å; K1081-T1084 PolarHBondContact O-OG1 2.89Å; K1081-Y1085 HydrophobicContact CB-CD2 4.46Å; K1081-Y1085 WeakPolarHBondContact O-CB 3.49Å; K1081-Y1085 VanDerWaalsContact O-CD2 3.29Å; K1081-Y1085 WeakPolarHBondContact O-CD2 3.33Å; K1081-Y1085 PolarHBondContact O-N 2.94Å; K1081-F1094 HydrophobicContact CB-CD2 3.76Å; K1081-F1094 HydrophobicContact CB-CE2 3.63Å; K1081-F1094 HydrophobicContact CD-CD2 4.41Å; K1081-F1094 HydrophobicContact CD-CE2 3.71Å; K1081-F1094 HydrophobicContact CG-CE2 4.33Å; K1081-N1100 PolarHBondContact NZ-OD1 3.37Å; K1081-D1103 IonicContact NZ-OD2 3.79Å; K1081-D1103 PolarHBondContact NZ-OD2 3.38Å
1082	I	86.6	Confident	83.2	Confident	15 Å²	15	49.5 Å²	49.5	8%	0.077	27%	0.273	C	S	.	.	H	α-helix	trans	-78.2	-34.1	178.7	-60.8	165	0	0	0	111.5	F1010 I1078 T1079 T1084 G1086 L1087 F1094	F1010-I1082 HydrophobicContact CE1-CG2 4.28Å; F1010-I1082 HydrophobicContact CE2-CG2 3.67Å; F1010-I1082 HydrophobicContact CZ-CB 4.43Å; F1010-I1082 HydrophobicContact CZ-CG2 3.38Å; I1078-I1082 HydrophobicContact CG2-CD1 3.48Å; I1078-I1082 VanDerWaalsContact CG2-CD1 3.48Å; I1078-I1082 HydrophobicContact CG2-CG1 4.15Å; I1078-I1082 VanDerWaalsContact O-CG1 3.27Å; I1078-I1082 WeakPolarHBondContact O-CG1 3.31Å; I1078-I1082 PolarHBondContact O-N 2.91Å; T1079-I1082 PolarHBondContact O-N 3.22Å; I1082-T1084 VanDerWaalsContact C-N 3.26Å; I1082-T1084 PolarHBondContact O-N 3.23Å; I1082-G1086 WeakPolarHBondContact O-CA 3.49Å; I1082-G1086 PolarHBondContact O-N 2.8Å; I1082-L1087 HydrophobicContact CD1-CD1 3.81Å; I1082-L1087 HydrophobicContact CG1-CD1 4.24Å; I1082-L1087 HydrophobicContact CG2-CB 4.17Å; I1082-L1087 HydrophobicContact CG2-CD1 3.93Å; I1082-F1094 HydrophobicContact CD1-CD1 3.99Å; I1082-F1094 HydrophobicContact CD1-CE1 3.98Å; I1082-F1094 HydrophobicContact CG1-CB 4.22Å; I1082-F1094 HydrophobicContact CG1-CD1 3.51Å; I1082-F1094 HydrophobicContact CG1-CD2 4.31Å; I1082-F1094 HydrophobicContact CG1-CE1 3.86Å; I1082-F1094 HydrophobicContact CG1-CG 3.78Å; I1082-F1094 HydrophobicContact CG1-CZ 4.41Å
1083	I	86.2	Confident	82.5	Confident	15 Å²	15	46.8 Å²	46.8	8%	0.077	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-36.8	172.4	-69.8	159.5	0	0	0	111	S1009 F1010 F1019 R1020 C1023 T1079 L1080	S1009-I1083 VanDerWaalsContact CB-O 3.29Å; S1009-I1083 WeakPolarHBondContact CB-O 3.44Å; S1009-I1083 PolarHBondContact OG-O 2.99Å; F1010-I1083 HydrophobicContact CE2-CG1 4.49Å; F1019-I1083 HydrophobicContact CD1-CG2 4.35Å; F1019-I1083 HydrophobicContact CE1-CD1 3.86Å; F1019-I1083 HydrophobicContact CE1-CG2 4.16Å; F1019-I1083 HydrophobicContact CZ-CD1 4.14Å; R1020-I1083 PolarHBondContact NE-O 3.31Å; C1023-I1083 HydrophobicContact CB-CG2 4.19Å; T1079-I1083 HydrophobicContact CG2-CD1 3.81Å; T1079-I1083 WeakPolarHBondContact O-CD1 3.26Å; T1079-I1083 VanDerWaalsContact O-CG1 3.27Å; T1079-I1083 WeakPolarHBondContact O-CG1 3.19Å; T1079-I1083 PolarHBondContact O-N 3.45Å; L1080-I1083 PolarHBondContact O-N 3.45Å
1084	T	84.4	Confident	82.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-80.3	-51.8	-178.8	49.7	0	0	0	0	112.7	R1020 C1023 H1024 L1080 K1081 I1082	R1020-T1084 PolarHBondContact NE-O 3.23Å; R1020-T1084 PolarHBondContact NH2-O 3.36Å; C1023-T1084 VanDerWaalsContact C-CG2 3.4Å; C1023-T1084 HydrophobicContact CB-CG2 3.58Å; H1024-T1084 VanDerWaalsContact CA-CG2 3.47Å; H1024-T1084 HydrophobicContact CB-CG2 3.83Å; H1024-T1084 VanDerWaalsContact N-CG2 3.28Å; L1080-T1084 VanDerWaalsContact O-CG2 3.31Å; L1080-T1084 WeakPolarHBondContact O-CG2 3.28Å; L1080-T1084 PolarHBondContact O-N 2.81Å; L1080-T1084 VanDerWaalsContact O-N 3.14Å; L1080-T1084 PolarHBondContact O-OG1 3.02Å; K1081-T1084 WeakPolarHBondContact CA-OG1 3.31Å; K1081-T1084 PolarHBondContact O-OG1 2.89Å; I1082-T1084 VanDerWaalsContact C-N 3.26Å; I1082-T1084 PolarHBondContact O-N 3.23Å
1085	Y	82.6	Confident	81.7	Confident	41 Å²	41	46.9 Å²	46.9	16%	0.161	26%	0.256	C	S	.	.	H	α-helix	trans	-95.6	-13.6	-174	-61.9	-69.1	0	0	0	115.2	K1081 H1090 A1093	K1081-Y1085 HydrophobicContact CB-CD2 4.46Å; K1081-Y1085 WeakPolarHBondContact O-CB 3.49Å; K1081-Y1085 VanDerWaalsContact O-CD2 3.29Å; K1081-Y1085 WeakPolarHBondContact O-CD2 3.33Å; K1081-Y1085 PolarHBondContact O-N 2.94Å; Y1085-H1090 PolarHBondContact O-CE1 3.11Å; Y1085-H1090 PolarHBondContact O-NE2 3.1Å; Y1085-A1093 WeakPolarHBondContact O-CA 3.01Å
1086	G	80.6	Confident	81.2	Confident	3 Å²	3	54.2 Å²	54.2	3%	0.031	28%	0.278	C	S	.	.			trans	71	162.1	-174.8	0	0	0	0	0	114.1	I1082 F1094	I1082-G1086 WeakPolarHBondContact O-CA 3.49Å; I1082-G1086 PolarHBondContact O-N 2.8Å; G1086-F1094 WeakPolarHBondContact O-CB 2.95Å; G1086-F1094 PolarHBondContact O-N 2.8Å
1087	L	81	Confident	80.5	Confident	74 Å²	74	52.3 Å²	52.3	39%	0.387	27%	0.269	S	S	.	.	S	Bend	trans	-78	-65.6	-168	-163.2	73.7	0	0	0	114.4	I1082 C1095	I1082-L1087 HydrophobicContact CD1-CD1 3.81Å; I1082-L1087 HydrophobicContact CG1-CD1 4.24Å; I1082-L1087 HydrophobicContact CG2-CB 4.17Å; I1082-L1087 HydrophobicContact CG2-CD1 3.93Å; L1087-C1095 WeakPolarHBondContact O-CB 3.49Å; L1087-C1095 PolarHBondContact O-N 3.18Å; L1087-C1095 VanDerWaalsContact O-N 3.16Å; L1087-C1095 PolarHBondContact O-SG 3.48Å; L1087-C1095 VanDerWaalsContact O-SG 3.41Å
1088	V	81.1	Confident	79.7	Confident	88 Å²	88	55.4 Å²	55.4	53%	0.533	30%	0.296	S	S	.	.	S	Bend	trans	-132	-33.6	-174.2	-173.1	0	0	0	0	114.2	H1090 C1095	V1088-H1090 VanDerWaalsContact C-N 3.29Å; V1088-H1090 PolarHBondContact O-N 2.75Å; V1088-C1095 HydrophobicContact CG2-CB 4.49Å
1089	L	71.6	Confident	78.9	Confident	141 Å²	141	58.7 Å²	58.7	74%	0.738	31%	0.313	S	S	*	.	S	Bend	trans	-72.7	2.3	-154.9	-67.9	168.2	0	0	0	117.8	F1011	F1011-L1089 HydrophobicContact CE1-CD1 4.46Å; F1011-L1089 HydrophobicContact CE2-CD1 3.63Å; F1011-L1089 HydrophobicContact CZ-CD1 3.48Å; F1011-L1089 VanDerWaalsContact CZ-CD1 3.48Å
1090	H	76.4	Confident	78.3	Confident	45 Å²	45	56.9 Å²	56.9	21%	0.208	30%	0.301	C	S	.	.	S	Bend	trans	-148	166	178.4	67.2	-82.2	0	0	0	113	P1005 Y1085 V1088 G1092 A1093	P1005-H1090 WeakPolarHBondContact CB-NE2 3.45Å; P1005-H1090 WeakPolarHBondContact CG-NE2 3.43Å; Y1085-H1090 PolarHBondContact O-CE1 3.11Å; Y1085-H1090 PolarHBondContact O-NE2 3.1Å; V1088-H1090 VanDerWaalsContact C-N 3.29Å; V1088-H1090 PolarHBondContact O-N 2.75Å; H1090-G1092 PolarHBondContact CD2-N 2.94Å; H1090-G1092 PolarHBondContact O-N 2.85Å; H1090-A1093 WeakPolarHBondContact O-CB 3.29Å; H1090-A1093 PolarHBondContact O-N 3.02Å
1091	K	68.6	Low	77.9	Confident	208 Å²	208	60 Å²	60	90%	0.904	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.4	-175.6	-67.6	-176.7	179.7	177.7	0	114.6
1092	G	68.2	Low	77.3	Confident	37 Å²	37	60.8 Å²	60.8	38%	0.381	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	4	175	0	0	0	0	0	115.1	H1090	H1090-G1092 PolarHBondContact CD2-N 2.94Å; H1090-G1092 PolarHBondContact O-N 2.85Å
1093	A	72	Confident	76.7	Confident	3 Å²	3	60.4 Å²	60.4	3%	0.025	32%	0.32	C	S	.	.			trans	-65.4	145.9	-171.5	0	0	0	0	0	114.1	Y1085 H1090 C1095 R1096	Y1085-A1093 WeakPolarHBondContact O-CA 3.01Å; H1090-A1093 WeakPolarHBondContact O-CB 3.29Å; H1090-A1093 PolarHBondContact O-N 3.02Å; A1093-C1095 PolarHBondContact O-N 3.36Å; A1093-R1096 WeakPolarHBondContact O-CB 3.36Å; A1093-R1096 PolarHBondContact O-N 3.47Å; A1093-R1096 VanDerWaalsContact O-N 3.07Å
1094	F	81.2	Confident	76.5	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-49.3	-54.1	-177.8	176.9	-107.4	0	0	0	112.6	I1078 K1081 I1082 G1086 R1096 S1097 N1100 F1104	I1078-F1094 HydrophobicContact CB-CZ 4.35Å; I1078-F1094 HydrophobicContact CD1-CZ 4.43Å; I1078-F1094 HydrophobicContact CG1-CZ 4.05Å; I1078-F1094 HydrophobicContact CG2-CE1 3.93Å; I1078-F1094 HydrophobicContact CG2-CZ 3.78Å; K1081-F1094 HydrophobicContact CB-CD2 3.76Å; K1081-F1094 HydrophobicContact CB-CE2 3.63Å; K1081-F1094 HydrophobicContact CD-CD2 4.41Å; K1081-F1094 HydrophobicContact CD-CE2 3.71Å; K1081-F1094 HydrophobicContact CG-CE2 4.33Å; I1082-F1094 HydrophobicContact CD1-CD1 3.99Å; I1082-F1094 HydrophobicContact CD1-CE1 3.98Å; I1082-F1094 HydrophobicContact CG1-CB 4.22Å; I1082-F1094 HydrophobicContact CG1-CD1 3.51Å; I1082-F1094 HydrophobicContact CG1-CD2 4.31Å; I1082-F1094 HydrophobicContact CG1-CE1 3.86Å; I1082-F1094 HydrophobicContact CG1-CG 3.78Å; I1082-F1094 HydrophobicContact CG1-CZ 4.41Å; G1086-F1094 WeakPolarHBondContact O-CB 2.95Å; G1086-F1094 PolarHBondContact O-N 2.8Å; F1094-R1096 PolarHBondContact O-N 3.06Å; F1094-S1097 PolarHBondContact O-N 3.36Å; F1094-S1097 PolarHBondContact O-OG 3.21Å; F1094-N1100 HydrophobicContact CD2-CB 3.63Å; F1094-N1100 HydrophobicContact CE1-CB 4.42Å; F1094-N1100 HydrophobicContact CE2-CB 3.43Å; F1094-N1100 VanDerWaalsContact CE2-CB 3.43Å; F1094-N1100 WeakPolarHBondContact CE2-OD1 3.49Å; F1094-N1100 HydrophobicContact CG-CB 4.19Å; F1094-N1100 HydrophobicContact CZ-CB 3.86Å; F1094-N1100 WeakPolarHBondContact CZ-O 3.49Å; F1094-N1100 WeakPolarHBondContact O-CB 3.4Å; F1094-F1104 HydrophobicContact CE1-CB 3.96Å; F1094-F1104 HydrophobicContact CE1-CD2 4.12Å; F1094-F1104 HydrophobicContact CE1-CG 4.33Å; F1094-F1104 HydrophobicContact CZ-CB 4.49Å
1095	C	78.7	Confident	76.1	Confident	37 Å²	37	67 Å²	67	25%	0.25	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-70.3	-10	-176.8	-59.7	0	0	0	0	114.7	L1087 V1088 A1093 S1097	L1087-C1095 WeakPolarHBondContact O-CB 3.49Å; L1087-C1095 PolarHBondContact O-N 3.18Å; L1087-C1095 VanDerWaalsContact O-N 3.16Å; L1087-C1095 PolarHBondContact O-SG 3.48Å; L1087-C1095 VanDerWaalsContact O-SG 3.41Å; V1088-C1095 HydrophobicContact CG2-CB 4.49Å; A1093-C1095 PolarHBondContact O-N 3.36Å; C1095-S1097 PolarHBondContact O-N 3.39Å
1096	R	78.1	Confident	75.7	Confident	198 Å²	198	65.2 Å²	65.2	75%	0.747	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-76.9	-4	175	-89.7	-78.5	-178.2	136.2	-2.8	113.7	A1093 F1094	A1093-R1096 WeakPolarHBondContact O-CB 3.36Å; A1093-R1096 PolarHBondContact O-N 3.47Å; A1093-R1096 VanDerWaalsContact O-N 3.07Å; F1094-R1096 PolarHBondContact O-N 3.06Å
1097	S	74.6	Confident	75.8	Confident	47 Å²	47	65.4 Å²	65.4	33%	0.329	34%	0.344	S	S	.	.	S	Bend	trans	-117.8	121.8	-177.5	56.7	0	0	0	0	111.6	F1094 C1095 N1099 N1100 M1101	F1094-S1097 PolarHBondContact O-N 3.36Å; F1094-S1097 PolarHBondContact O-OG 3.21Å; C1095-S1097 PolarHBondContact O-N 3.39Å; S1097-N1099 VanDerWaalsContact C-N 3.28Å; S1097-N1099 PolarHBondContact O-N 3Å; S1097-N1099 VanDerWaalsContact O-N 3.16Å; S1097-N1100 PolarHBondContact O-N 2.98Å; S1097-N1100 VanDerWaalsContact O-N 3.08Å; S1097-N1100 WeakPolarHBondContact OG-CB 3.41Å; S1097-N1100 PolarHBondContact OG-ND2 3.24Å; S1097-M1101 PolarHBondContact O-N 3.03Å
1098	A	72.1	Confident	75.8	Confident	72 Å²	72	64.9 Å²	64.9	60%	0.595	34%	0.341	S	S	*	.	H	α-helix	trans	-55.9	-37.3	-169.6	0	0	0	0	0	114.2	M1101 L1102	A1098-M1101 WeakPolarHBondContact O-CB 3.45Å; A1098-M1101 PolarHBondContact O-N 3.04Å; A1098-L1102 PolarHBondContact O-N 3.41Å
1099	N	69.6	Low	75.5	Confident	78 Å²	78	61.6 Å²	61.6	42%	0.417	32%	0.321	S	S	.	.	H	α-helix	trans	-63.9	-49.2	177.1	-62.3	-16.2	0	0	0	111.6	S1097 M1101 L1102 D1103 N1140	S1097-N1099 VanDerWaalsContact C-N 3.28Å; S1097-N1099 PolarHBondContact O-N 3Å; S1097-N1099 VanDerWaalsContact O-N 3.16Å; N1099-M1101 PolarHBondContact O-N 2.99Å; N1099-L1102 WeakPolarHBondContact O-CB 3.37Å; N1099-L1102 PolarHBondContact O-N 2.93Å; N1099-D1103 PolarHBondContact O-N 3.06Å; N1099-D1103 VanDerWaalsContact O-OD1 3.08Å; N1099-N1140 PolarHBondContact ND2-ND2 2.86Å; N1099-N1140 PolarHBondContact ND2-OD1 3.09Å; N1099-N1140 PolarHBondContact OD1-ND2 3.05Å
1100	N	75.8	Confident	75.7	Confident	29 Å²	29	54.9 Å²	54.9	16%	0.155	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-25.3	175.4	-75.2	-34.3	0	0	0	112.3	K1081 F1094 S1097 D1103 F1104	K1081-N1100 PolarHBondContact NZ-OD1 3.37Å; F1094-N1100 HydrophobicContact CD2-CB 3.63Å; F1094-N1100 HydrophobicContact CE1-CB 4.42Å; F1094-N1100 HydrophobicContact CE2-CB 3.43Å; F1094-N1100 VanDerWaalsContact CE2-CB 3.43Å; F1094-N1100 WeakPolarHBondContact CE2-OD1 3.49Å; F1094-N1100 HydrophobicContact CG-CB 4.19Å; F1094-N1100 HydrophobicContact CZ-CB 3.86Å; F1094-N1100 WeakPolarHBondContact CZ-O 3.49Å; F1094-N1100 WeakPolarHBondContact O-CB 3.4Å; S1097-N1100 PolarHBondContact O-N 2.98Å; S1097-N1100 VanDerWaalsContact O-N 3.08Å; S1097-N1100 WeakPolarHBondContact OG-CB 3.41Å; S1097-N1100 PolarHBondContact OG-ND2 3.24Å; N1100-D1103 WeakPolarHBondContact O-CB 3.49Å; N1100-F1104 VanDerWaalsContact O-CB 3.31Å; N1100-F1104 WeakPolarHBondContact O-CB 3.39Å; N1100-F1104 PolarHBondContact O-N 3.07Å
1101	M	79.3	Confident	75.9	Confident	99 Å²	99	56.5 Å²	56.5	49%	0.488	30%	0.296	S	S	.	.	H	α-helix	trans	-72.4	-40.3	173.6	-169.4	-178.6	75.8	0	0	111.9	S1097 A1098 N1099 F1104 M1105	S1097-M1101 PolarHBondContact O-N 3.03Å; A1098-M1101 WeakPolarHBondContact O-CB 3.45Å; A1098-M1101 PolarHBondContact O-N 3.04Å; N1099-M1101 PolarHBondContact O-N 2.99Å; M1101-F1104 PolarHBondContact O-N 2.7Å; M1101-M1105 VanDerWaalsContact O-CG 3.29Å; M1101-M1105 WeakPolarHBondContact O-CG 3.3Å; M1101-M1105 PolarHBondContact O-N 3Å
1102	L	73.9	Confident	76.3	Confident	46 Å²	46	49.9 Å²	49.9	24%	0.241	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-47.4	169	-176.4	161	0	0	0	110.1	A1098 N1099 F1104 M1105 V1106 L1136	A1098-L1102 PolarHBondContact O-N 3.41Å; N1099-L1102 WeakPolarHBondContact O-CB 3.37Å; N1099-L1102 PolarHBondContact O-N 2.93Å; L1102-F1104 VanDerWaalsContact C-N 3.3Å; L1102-F1104 PolarHBondContact O-N 3Å; L1102-M1105 PolarHBondContact O-N 2.83Å; L1102-V1106 HydrophobicContact CD2-CG2 3.94Å; L1102-V1106 WeakPolarHBondContact O-CG2 3.48Å; L1102-V1106 PolarHBondContact O-N 3.29Å; L1102-L1136 HydrophobicContact CD1-CB 4.44Å; L1102-L1136 HydrophobicContact CD1-CD1 4.26Å
1103	D	75	Confident	76.4	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-53.6	-48.7	176.4	-63.4	-5.8	0	0	0	111.2	I1078 K1081 N1099 N1100 V1106 V1107 R1137	I1078-D1103 HydrophobicContact CD1-CB 4.09Å; I1078-D1103 VanDerWaalsContact CD1-O 3.3Å; I1078-D1103 WeakPolarHBondContact CD1-O 3.17Å; K1081-D1103 IonicContact NZ-OD2 3.79Å; K1081-D1103 PolarHBondContact NZ-OD2 3.38Å; N1099-D1103 PolarHBondContact O-N 3.06Å; N1099-D1103 VanDerWaalsContact O-OD1 3.08Å; N1100-D1103 WeakPolarHBondContact O-CB 3.49Å; D1103-V1106 PolarHBondContact O-N 3.15Å; D1103-V1107 PolarHBondContact O-N 3.16Å; D1103-V1107 VanDerWaalsContact O-N 3.14Å; D1103-R1137 VanDerWaalsContact CB-NH2 3.28Å; D1103-R1137 VanDerWaalsContact CG-CZ 3.45Å; D1103-R1137 IonicContact OD1-CZ 3.27Å; D1103-R1137 VanDerWaalsContact OD1-CZ 3.22Å; D1103-R1137 IonicContact OD1-NE 3.32Å; D1103-R1137 PolarHBondContact OD1-NE 3.08Å; D1103-R1137 IonicContact OD1-NH2 2.98Å; D1103-R1137 PolarHBondContact OD1-NH2 2.93Å; D1103-R1137 IonicContact OD2-CZ 2.68Å; D1103-R1137 IonicContact OD2-NE 3.65Å; D1103-R1137 IonicContact OD2-NH2 3.52Å
1104	F	81.8	Confident	76.4	Confident	63 Å²	63	51.7 Å²	51.7	28%	0.276	27%	0.266	S	S	.	.	H	α-helix	trans	-61.8	-47.6	177.9	-173.9	-110.7	0	0	0	112.7	I1078 F1094 N1100 M1101 L1102 V1106 V1107 L1108	I1078-F1104 HydrophobicContact CG2-CD2 4.39Å; F1094-F1104 HydrophobicContact CE1-CB 3.96Å; F1094-F1104 HydrophobicContact CE1-CD2 4.12Å; F1094-F1104 HydrophobicContact CE1-CG 4.33Å; F1094-F1104 HydrophobicContact CZ-CB 4.49Å; N1100-F1104 VanDerWaalsContact O-CB 3.31Å; N1100-F1104 WeakPolarHBondContact O-CB 3.39Å; N1100-F1104 PolarHBondContact O-N 3.07Å; M1101-F1104 PolarHBondContact O-N 2.7Å; L1102-F1104 VanDerWaalsContact C-N 3.3Å; L1102-F1104 PolarHBondContact O-N 3Å; F1104-V1106 PolarHBondContact O-N 2.9Å; F1104-V1107 PolarHBondContact O-N 2.77Å; F1104-L1108 HydrophobicContact CE1-CD2 4.13Å; F1104-L1108 WeakPolarHBondContact O-CB 3.23Å; F1104-L1108 PolarHBondContact O-N 3.15Å
1105	M	76	Confident	76	Confident	90 Å²	90	56.7 Å²	56.7	44%	0.443	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-42.4	178.4	-72.1	-70.2	103	0	0	112.2	M1101 L1102 L1108 T1109	M1101-M1105 VanDerWaalsContact O-CG 3.29Å; M1101-M1105 WeakPolarHBondContact O-CG 3.3Å; M1101-M1105 PolarHBondContact O-N 3Å; L1102-M1105 PolarHBondContact O-N 2.83Å; M1105-L1108 HydrophobicContact CE-CD2 3.76Å; M1105-T1109 VanDerWaalsContact O-CB 3.26Å; M1105-T1109 WeakPolarHBondContact O-CB 3.36Å; M1105-T1109 PolarHBondContact O-N 3.31Å; M1105-T1109 PolarHBondContact O-OG1 3.18Å
1106	V	73.8	Confident	75.3	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.024	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-44.2	179	168.3	0	0	0	0	111.7	L1102 D1103 F1104 S1110 R1134	L1102-V1106 HydrophobicContact CD2-CG2 3.94Å; L1102-V1106 WeakPolarHBondContact O-CG2 3.48Å; L1102-V1106 PolarHBondContact O-N 3.29Å; D1103-V1106 PolarHBondContact O-N 3.15Å; F1104-V1106 PolarHBondContact O-N 2.9Å; V1106-S1110 WeakPolarHBondContact O-CB 3.48Å; V1106-S1110 PolarHBondContact O-N 2.84Å; V1106-S1110 PolarHBondContact O-OG 2.82Å; V1106-R1134 HydrophobicContact CG1-CG 3.71Å
1107	V	83	Confident	74.3	Confident	6 Å²	6	55.7 Å²	55.7	4%	0.036	31%	0.305	C	S	.	.	H	α-helix	trans	-71.7	-43.2	178.9	173.8	0	0	0	0	111.3	F1074 T1075 I1078 D1103 F1104 T1109 S1110 I1111	F1074-V1107 HydrophobicContact CB-CG2 3.46Å; F1074-V1107 VanDerWaalsContact CB-CG2 3.46Å; T1075-V1107 WeakPolarHBondContact OG1-CG1 3.11Å; I1078-V1107 HydrophobicContact CD1-CB 3.74Å; I1078-V1107 HydrophobicContact CD1-CG1 4.32Å; I1078-V1107 HydrophobicContact CD1-CG2 3.5Å; D1103-V1107 PolarHBondContact O-N 3.16Å; D1103-V1107 VanDerWaalsContact O-N 3.14Å; F1104-V1107 PolarHBondContact O-N 2.77Å; V1107-T1109 VanDerWaalsContact C-N 3.31Å; V1107-T1109 PolarHBondContact O-N 3.39Å; V1107-S1110 WeakPolarHBondContact O-CB 3.45Å; V1107-S1110 PolarHBondContact O-N 3.29Å; V1107-S1110 VanDerWaalsContact O-N 3.11Å; V1107-I1111 HydrophobicContact CG1-CD1 3.87Å; V1107-I1111 HydrophobicContact CG1-CG1 4.43Å; V1107-I1111 WeakPolarHBondContact O-CG1 2.93Å; V1107-I1111 PolarHBondContact O-N 3.41Å
1108	L	80.8	Confident	73.3	Confident	63 Å²	63	57.7 Å²	57.7	33%	0.33	31%	0.311	S	S	.	.	H	α-helix	trans	-56.9	-45.8	174.9	179.2	62	0	0	0	111.2	F1104 M1105 S1110 I1111 I1112	F1104-L1108 HydrophobicContact CE1-CD2 4.13Å; F1104-L1108 WeakPolarHBondContact O-CB 3.23Å; F1104-L1108 PolarHBondContact O-N 3.15Å; M1105-L1108 HydrophobicContact CE-CD2 3.76Å; L1108-S1110 VanDerWaalsContact C-N 3.31Å; L1108-S1110 PolarHBondContact O-N 2.88Å; L1108-I1111 PolarHBondContact O-N 2.9Å; L1108-I1112 HydrophobicContact CD1-CD1 3.92Å; L1108-I1112 HydrophobicContact CD1-CG1 4.33Å; L1108-I1112 HydrophobicContact CG-CD1 3.8Å; L1108-I1112 WeakPolarHBondContact O-CB 3.47Å; L1108-I1112 VanDerWaalsContact O-CG1 3.26Å; L1108-I1112 WeakPolarHBondContact O-CG1 3.33Å; L1108-I1112 PolarHBondContact O-N 3.49Å
1109	T	74.7	Confident	72.4	Confident	19 Å²	19	60.1 Å²	60.1	12%	0.117	31%	0.314	C	S	.	.	H	α-helix	trans	-65.1	-35.9	177.3	-54.6	0	0	0	0	112	M1105 V1107 I1112 S1113 L1127 S1130	M1105-T1109 VanDerWaalsContact O-CB 3.26Å; M1105-T1109 WeakPolarHBondContact O-CB 3.36Å; M1105-T1109 PolarHBondContact O-N 3.31Å; M1105-T1109 PolarHBondContact O-OG1 3.18Å; V1107-T1109 VanDerWaalsContact C-N 3.31Å; V1107-T1109 PolarHBondContact O-N 3.39Å; T1109-I1112 PolarHBondContact O-N 2.89Å; T1109-S1113 WeakPolarHBondContact O-CB 3.48Å; T1109-S1113 PolarHBondContact O-N 2.81Å; T1109-S1113 PolarHBondContact O-OG 2.83Å; T1109-L1127 HydrophobicContact CG2-CB 3.61Å; T1109-L1127 HydrophobicContact CG2-CD2 3.79Å; T1109-L1127 HydrophobicContact CG2-CG 4.2Å; T1109-L1127 WeakPolarHBondContact CG2-O 3.23Å; T1109-S1130 WeakPolarHBondContact CG2-OG 3.37Å
1110	S	75.9	Confident	71.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.1	-41.6	175.6	-52.6	0	0	0	0	111.5	V1106 V1107 L1108 S1113 Y1114 R1131 R1134	V1106-S1110 WeakPolarHBondContact O-CB 3.48Å; V1106-S1110 PolarHBondContact O-N 2.84Å; V1106-S1110 PolarHBondContact O-OG 2.82Å; V1107-S1110 WeakPolarHBondContact O-CB 3.45Å; V1107-S1110 PolarHBondContact O-N 3.29Å; V1107-S1110 VanDerWaalsContact O-N 3.11Å; L1108-S1110 VanDerWaalsContact C-N 3.31Å; L1108-S1110 PolarHBondContact O-N 2.88Å; S1110-S1113 PolarHBondContact O-N 3.25Å; S1110-S1113 PolarHBondContact O-OG 2.91Å; S1110-Y1114 WeakPolarHBondContact O-CD2 3.2Å; S1110-Y1114 VanDerWaalsContact O-CE2 3.29Å; S1110-Y1114 WeakPolarHBondContact O-CE2 3.34Å; S1110-R1131 PolarHBondContact OG-NE 3.15Å; S1110-R1134 PolarHBondContact OG-NH2 3.05Å
1111	I	81	Confident	70.3	Confident	79 Å²	79	64.5 Å²	64.5	41%	0.405	34%	0.341	S	S	.	.	H	α-helix	trans	-66.3	-42	174.9	-66.2	167.7	0	0	0	111.4	T1071 T1075 V1107 L1108 S1113 Y1114 P1115	T1071-I1111 HydrophobicContact CG2-CG1 4.24Å; T1075-I1111 HydrophobicContact CG2-CD1 4.49Å; V1107-I1111 HydrophobicContact CG1-CD1 3.87Å; V1107-I1111 HydrophobicContact CG1-CG1 4.43Å; V1107-I1111 WeakPolarHBondContact O-CG1 2.93Å; V1107-I1111 PolarHBondContact O-N 3.41Å; L1108-I1111 PolarHBondContact O-N 2.9Å; I1111-S1113 PolarHBondContact O-N 2.97Å; I1111-Y1114 PolarHBondContact O-N 3.34Å; I1111-P1115 WeakPolarHBondContact O-CD 3.31Å
1112	I	76.3	Confident	69.1	Low	70 Å²	70	63.9 Å²	63.9	36%	0.359	35%	0.346	S	S	.	.	H	α-helix	trans	-63.8	-28.2	176.4	-71.9	169.8	0	0	0	111.8	L1108 T1109 Y1114 P1115 I1116	L1108-I1112 HydrophobicContact CD1-CD1 3.92Å; L1108-I1112 HydrophobicContact CD1-CG1 4.33Å; L1108-I1112 HydrophobicContact CG-CD1 3.8Å; L1108-I1112 WeakPolarHBondContact O-CB 3.47Å; L1108-I1112 VanDerWaalsContact O-CG1 3.26Å; L1108-I1112 WeakPolarHBondContact O-CG1 3.33Å; L1108-I1112 PolarHBondContact O-N 3.49Å; T1109-I1112 PolarHBondContact O-N 2.89Å; I1112-Y1114 PolarHBondContact O-N 3.31Å; I1112-P1115 WeakPolarHBondContact O-CD 3.27Å; I1112-I1116 HydrophobicContact CG2-CD1 3.77Å; I1112-I1116 WeakPolarHBondContact O-CD1 3.33Å; I1112-I1116 WeakPolarHBondContact O-CG1 3.34Å
1113	S	71.2	Confident	68.4	Low	7 Å²	7	65.4 Å²	65.4	5%	0.049	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-1.7	-179.5	67.5	0	0	0	0	115.7	T1109 S1110 I1111 R1131	T1109-S1113 WeakPolarHBondContact O-CB 3.48Å; T1109-S1113 PolarHBondContact O-N 2.81Å; T1109-S1113 PolarHBondContact O-OG 2.83Å; S1110-S1113 PolarHBondContact O-N 3.25Å; S1110-S1113 PolarHBondContact O-OG 2.91Å; I1111-S1113 PolarHBondContact O-N 2.97Å; S1113-R1131 PolarHBondContact OG-NH2 3.09Å
1114	Y	72.8	Confident	67.7	Low	71 Å²	71	65.9 Å²	65.9	28%	0.278	36%	0.361	S	S	.	.	S	Bend	trans	-96.6	-45.8	179.3	-53.4	-40.5	0	0	0	115.3	D1067 Y1068 T1071 S1110 I1111 I1112 I1116	D1067-Y1114 PolarHBondContact O-OH 3.01Å; D1067-Y1114 PolarHBondContact OD2-OH 3.22Å; D1067-Y1114 VanDerWaalsContact OD2-OH 3.08Å; Y1068-Y1114 HydrophobicContact CD1-CD1 4.19Å; Y1068-Y1114 AromaticContact CD1-CE1 3.59Å; Y1068-Y1114 HydrophobicContact CD1-CE1 3.59Å; Y1068-Y1114 HydrophobicContact CD1-CE2 4.42Å; Y1068-Y1114 AromaticContact CD1-CZ 3.72Å; Y1068-Y1114 AromaticContact CE1-CD1 3.73Å; Y1068-Y1114 HydrophobicContact CE1-CD1 3.73Å; Y1068-Y1114 AromaticContact CE1-CE1 3.5Å; Y1068-Y1114 HydrophobicContact CE1-CE1 3.5Å; T1071-Y1114 VanDerWaalsContact CB-OH 3.26Å; T1071-Y1114 WeakPolarHBondContact CB-OH 3.25Å; T1071-Y1114 HydrophobicContact CG2-CE2 3.97Å; T1071-Y1114 PolarHBondContact OG1-OH 3.35Å; S1110-Y1114 WeakPolarHBondContact O-CD2 3.2Å; S1110-Y1114 VanDerWaalsContact O-CE2 3.29Å; S1110-Y1114 WeakPolarHBondContact O-CE2 3.34Å; I1111-Y1114 PolarHBondContact O-N 3.34Å; I1112-Y1114 PolarHBondContact O-N 3.31Å; Y1114-I1116 PolarHBondContact O-N 3.15Å
1115	P	71.1	Confident	66.6	Low	105 Å²	105	67.8 Å²	67.8	68%	0.682	37%	0.369	S	S	*	.	S	Bend	trans	-81.6	12.7	179.6	34.2	-38.3	0	0	0	114.2	I1111 I1112	I1111-P1115 WeakPolarHBondContact O-CD 3.31Å; I1112-P1115 WeakPolarHBondContact O-CD 3.27Å
1116	I	64.9	Low	65.9	Low	56 Å²	56	67.7 Å²	67.7	29%	0.287	37%	0.369	S	S	.	.			trans	-121	74.4	-175	-52.2	-179.1	0	0	0	109.5	I1112 Y1114 I1118 V1124	I1112-I1116 HydrophobicContact CG2-CD1 3.77Å; I1112-I1116 WeakPolarHBondContact O-CD1 3.33Å; I1112-I1116 WeakPolarHBondContact O-CG1 3.34Å; Y1114-I1116 PolarHBondContact O-N 3.15Å; I1116-I1118 HydrophobicContact CG2-CB 3.85Å; I1116-I1118 HydrophobicContact CG2-CD1 4.01Å; I1116-I1118 HydrophobicContact CG2-CG1 3.8Å; I1116-I1118 PolarHBondContact O-N 3.39Å; I1116-V1124 HydrophobicContact CG2-CG2 4.01Å
1117	D	56.9	Low	65.5	Low	159 Å²	159	70.7 Å²	70.7	85%	0.85	39%	0.385	S	S	*	.			trans	-74	35	169.5	-65.3	-43.8	0	0	0	112.2	D1119	D1117-D1119 PolarHBondContact O-N 2.9Å
1118	I	53.8	Low	64.6	Low	89 Å²	89	74 Å²	74	46%	0.456	40%	0.397	S	S	.	.			trans	-93.7	83.6	-176.9	-53.7	-177	0	0	0	109	I1116 T1120 I1121	I1116-I1118 HydrophobicContact CG2-CB 3.85Å; I1116-I1118 HydrophobicContact CG2-CD1 4.01Å; I1116-I1118 HydrophobicContact CG2-CG1 3.8Å; I1116-I1118 PolarHBondContact O-N 3.39Å; I1118-T1120 WeakPolarHBondContact CG2-OG1 3.37Å; I1118-T1120 PolarHBondContact O-N 2.88Å; I1118-I1121 HydrophobicContact CB-CD1 4.4Å; I1118-I1121 HydrophobicContact CG2-CD1 3.81Å; I1118-I1121 HydrophobicContact CG2-CG1 3.89Å; I1118-I1121 PolarHBondContact O-N 3.1Å
1119	D	53.1	Low	64	Low	122 Å²	122	72.2 Å²	72.2	65%	0.652	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-19.6	179.8	-125.5	-22.9	0	0	0	114.7	D1117 K1560	D1117-D1119 PolarHBondContact O-N 2.9Å; D1119-K1560 IonicContact OD1-NZ 3.31Å; D1119-K1560 PolarHBondContact OD1-NZ 3.39Å; D1119-K1560 IonicContact OD2-NZ 3.35Å; D1119-K1560 PolarHBondContact OD2-NZ 3.38Å
1120	T	48.4	Very low	63.7	Low	127 Å²	127	72.6 Å²	72.6	78%	0.779	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-7.4	-176.5	57.5	0	0	0	0	114.7	I1118	I1118-T1120 WeakPolarHBondContact CG2-OG1 3.37Å; I1118-T1120 PolarHBondContact O-N 2.88Å
1121	I	52.3	Low	63.6	Low	73 Å²	73	73.1 Å²	73.1	37%	0.374	39%	0.393	S	S	.	.			trans	-107.7	97.9	-175.5	-59.6	176.8	0	0	0	110.7	I1118 V1123 V1124	I1118-I1121 HydrophobicContact CB-CD1 4.4Å; I1118-I1121 HydrophobicContact CG2-CD1 3.81Å; I1118-I1121 HydrophobicContact CG2-CG1 3.89Å; I1118-I1121 PolarHBondContact O-N 3.1Å; I1121-V1123 HydrophobicContact CG2-CB 3.68Å; I1121-V1123 HydrophobicContact CG2-CG2 3.97Å; I1121-V1123 PolarHBondContact O-N 3.3Å; I1121-V1123 VanDerWaalsContact O-N 3.11Å; I1121-V1124 HydrophobicContact CB-CG2 4.11Å; I1121-V1124 HydrophobicContact CG2-CG2 4.03Å; I1121-V1124 PolarHBondContact O-N 2.92Å
1122	S	55.4	Low	63.2	Low	85 Å²	85	69.4 Å²	69.4	59%	0.594	38%	0.375	S	S	*	.	H	α-helix	trans	-53.8	-29.8	173.5	57.1	0	0	0	0	113.3	V1124 K1125 I1126	S1122-V1124 PolarHBondContact O-N 3.3Å; S1122-K1125 WeakPolarHBondContact O-CB 3.37Å; S1122-K1125 PolarHBondContact O-N 3.21Å; S1122-I1126 PolarHBondContact O-N 3.27Å
1123	V	57.8	Low	63.1	Low	78 Å²	78	69.2 Å²	69.2	47%	0.473	37%	0.374	S	S	.	.	H	α-helix	trans	-57.6	-28.5	175.5	-166.8	0	0	0	0	112.4	I1121 K1125 I1126 L1127	I1121-V1123 HydrophobicContact CG2-CB 3.68Å; I1121-V1123 HydrophobicContact CG2-CG2 3.97Å; I1121-V1123 PolarHBondContact O-N 3.3Å; I1121-V1123 VanDerWaalsContact O-N 3.11Å; V1123-K1125 VanDerWaalsContact C-N 3.33Å; V1123-K1125 PolarHBondContact O-N 3.01Å; V1123-I1126 CarbonylContact O-C 2.9Å; V1123-I1126 PolarHBondContact O-N 3.03Å; V1123-L1127 HydrophobicContact CG1-CG 4.42Å; V1123-L1127 WeakPolarHBondContact O-CB 3.45Å; V1123-L1127 VanDerWaalsContact O-CG 3.29Å; V1123-L1127 WeakPolarHBondContact O-CG 3.28Å; V1123-L1127 PolarHBondContact O-N 2.99Å
1124	V	59.7	Low	63.3	Low	18 Å²	18	69 Å²	69	11%	0.109	37%	0.372	C	S	.	.	H	α-helix	trans	-67.3	-34.6	176.1	-178.2	0	0	0	0	111.3	I1116 I1121 S1122 L1127 R1128	I1116-V1124 HydrophobicContact CG2-CG2 4.01Å; I1121-V1124 HydrophobicContact CB-CG2 4.11Å; I1121-V1124 HydrophobicContact CG2-CG2 4.03Å; I1121-V1124 PolarHBondContact O-N 2.92Å; S1122-V1124 PolarHBondContact O-N 3.3Å; V1124-L1127 PolarHBondContact O-N 2.87Å; V1124-R1128 PolarHBondContact O-N 2.8Å
1125	K	60.7	Low	63.2	Low	103 Å²	103	66.5 Å²	66.5	45%	0.448	36%	0.364	S	S	.	.	H	α-helix	trans	-69.2	-43.9	172.3	-60.7	-171.1	178.6	-171.8	0	110.7	S1122 V1123 L1127 R1128 V1129	S1122-K1125 WeakPolarHBondContact O-CB 3.37Å; S1122-K1125 PolarHBondContact O-N 3.21Å; V1123-K1125 VanDerWaalsContact C-N 3.33Å; V1123-K1125 PolarHBondContact O-N 3.01Å; K1125-L1127 PolarHBondContact O-N 3.22Å; K1125-R1128 WeakPolarHBondContact O-CB 3.47Å; K1125-R1128 PolarHBondContact O-N 3.21Å; K1125-V1129 PolarHBondContact O-N 3.04Å
1126	I	61.3	Low	63.2	Low	87 Å²	87	63.4 Å²	63.4	45%	0.446	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-32.8	173.7	-59.2	171.7	0	0	0	111.6	S1122 V1123 V1129 M1498	S1122-I1126 PolarHBondContact O-N 3.27Å; V1123-I1126 CarbonylContact O-C 2.9Å; V1123-I1126 PolarHBondContact O-N 3.03Å; I1126-V1129 VanDerWaalsContact O-CB 3.23Å; I1126-V1129 WeakPolarHBondContact O-CB 3.36Å; I1126-V1129 PolarHBondContact O-N 3.13Å; I1126-M1498 HydrophobicContact CG1-SD 4.37Å
1127	L	64.4	Low	63.5	Low	68 Å²	68	62.3 Å²	62.3	36%	0.356	33%	0.334	S	S	.	.	H	α-helix	trans	-69.7	-32.9	174	-76.9	173.6	0	0	0	112.4	T1109 V1123 V1124 K1125 V1129 S1130	T1109-L1127 HydrophobicContact CG2-CB 3.61Å; T1109-L1127 HydrophobicContact CG2-CD2 3.79Å; T1109-L1127 HydrophobicContact CG2-CG 4.2Å; T1109-L1127 WeakPolarHBondContact CG2-O 3.23Å; V1123-L1127 HydrophobicContact CG1-CG 4.42Å; V1123-L1127 WeakPolarHBondContact O-CB 3.45Å; V1123-L1127 VanDerWaalsContact O-CG 3.29Å; V1123-L1127 WeakPolarHBondContact O-CG 3.28Å; V1123-L1127 PolarHBondContact O-N 2.99Å; V1124-L1127 PolarHBondContact O-N 2.87Å; K1125-L1127 PolarHBondContact O-N 3.22Å; L1127-V1129 VanDerWaalsContact C-N 3.3Å; L1127-V1129 PolarHBondContact O-N 3.36Å; L1127-S1130 WeakPolarHBondContact O-CB 3.22Å; L1127-S1130 PolarHBondContact O-N 2.91Å; L1127-S1130 PolarHBondContact O-OG 2.9Å
1128	R	65.2	Low	64.1	Low	76 Å²	76	56.4 Å²	56.4	29%	0.287	31%	0.308	S	S	.	.	H	α-helix	trans	-64.6	-33	171.7	-65.7	176.6	-174.7	-171.9	1.1	112	V1124 K1125 S1130 R1131	V1124-R1128 PolarHBondContact O-N 2.8Å; K1125-R1128 WeakPolarHBondContact O-CB 3.47Å; K1125-R1128 PolarHBondContact O-N 3.21Å; R1128-S1130 PolarHBondContact O-N 3.28Å; R1128-S1130 VanDerWaalsContact O-N 3.13Å; R1128-R1131 VanDerWaalsContact O-CB 3.28Å; R1128-R1131 WeakPolarHBondContact O-CB 3.35Å; R1128-R1131 WeakPolarHBondContact O-CD 3.45Å; R1128-R1131 WeakPolarHBondContact O-CG 3.47Å; R1128-R1131 PolarHBondContact O-N 3.25Å; R1128-R1131 VanDerWaalsContact O-N 3.08Å
1129	V	66.6	Low	64.9	Low	25 Å²	25	53.5 Å²	53.5	15%	0.152	29%	0.293	C	S	.	.	H	α-helix	trans	-53.2	-33.2	172.5	-178.3	0	0	0	0	112.1	K1125 I1126 L1127 R1131 V1132 I1494 Q1497	K1125-V1129 PolarHBondContact O-N 3.04Å; I1126-V1129 VanDerWaalsContact O-CB 3.23Å; I1126-V1129 WeakPolarHBondContact O-CB 3.36Å; I1126-V1129 PolarHBondContact O-N 3.13Å; L1127-V1129 VanDerWaalsContact C-N 3.3Å; L1127-V1129 PolarHBondContact O-N 3.36Å; V1129-R1131 PolarHBondContact O-N 3.04Å; V1129-V1132 WeakPolarHBondContact O-CB 3.47Å; V1129-V1132 VanDerWaalsContact O-CG2 3.25Å; V1129-V1132 WeakPolarHBondContact O-CG2 3.21Å; V1129-V1132 PolarHBondContact O-N 3.16Å; V1129-I1494 HydrophobicContact CG1-CD1 4.27Å; V1129-I1494 HydrophobicContact CG1-CG1 3.57Å; V1129-Q1497 VanDerWaalsContact CG2-OE1 3.24Å
1130	S	68.3	Low	65.5	Low	26 Å²	26	51.9 Å²	51.9	18%	0.182	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-55.9	-24.3	179.6	71.1	0	0	0	0	113.7	T1109 L1127 R1128 V1132 L1133	T1109-S1130 WeakPolarHBondContact CG2-OG 3.37Å; L1127-S1130 WeakPolarHBondContact O-CB 3.22Å; L1127-S1130 PolarHBondContact O-N 2.91Å; L1127-S1130 PolarHBondContact O-OG 2.9Å; R1128-S1130 PolarHBondContact O-N 3.28Å; R1128-S1130 VanDerWaalsContact O-N 3.13Å; S1130-V1132 PolarHBondContact O-N 2.8Å; S1130-L1133 VanDerWaalsContact O-CB 3.29Å; S1130-L1133 WeakPolarHBondContact O-CB 3.36Å; S1130-L1133 WeakPolarHBondContact O-CG 3.43Å; S1130-L1133 PolarHBondContact O-N 2.82Å; S1130-L1133 VanDerWaalsContact O-N 3.13Å
1131	R	73.8	Confident	66.6	Low	11 Å²	11	51.9 Å²	51.9	4%	0.042	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-67.1	-23.7	176.7	-56.3	166.8	176.1	-161.6	-14.6	112.4	L1047 D1067 S1110 S1113 R1128 V1129 L1133 R1134	L1047-R1131 HydrophobicContact CD1-CB 3.86Å; D1067-R1131 IonicContact OD1-CZ 3.36Å; D1067-R1131 IonicContact OD1-NH1 2.62Å; D1067-R1131 IonicContact OD2-CZ 2.65Å; D1067-R1131 IonicContact OD2-NH1 2.63Å; D1067-R1131 PolarHBondContact OD2-NH1 2.97Å; D1067-R1131 IonicContact OD2-NH2 3.05Å; D1067-R1131 PolarHBondContact OD2-NH2 2.64Å; S1110-R1131 PolarHBondContact OG-NE 3.15Å; S1113-R1131 PolarHBondContact OG-NH2 3.09Å; R1128-R1131 VanDerWaalsContact O-CB 3.28Å; R1128-R1131 WeakPolarHBondContact O-CB 3.35Å; R1128-R1131 WeakPolarHBondContact O-CD 3.45Å; R1128-R1131 WeakPolarHBondContact O-CG 3.47Å; R1128-R1131 PolarHBondContact O-N 3.25Å; R1128-R1131 VanDerWaalsContact O-N 3.08Å; V1129-R1131 PolarHBondContact O-N 3.04Å; R1131-L1133 PolarHBondContact O-N 2.82Å; R1131-L1133 VanDerWaalsContact O-N 3.16Å; R1131-R1134 VanDerWaalsContact O-CB 3.24Å; R1131-R1134 WeakPolarHBondContact O-CB 3.37Å; R1131-R1134 WeakPolarHBondContact O-CD 3.34Å; R1131-R1134 WeakPolarHBondContact O-CG 3.28Å; R1131-R1134 PolarHBondContact O-N 2.96Å
1132	V	73.5	Confident	67.4	Low	2 Å²	2	49.4 Å²	49.4	1%	0.012	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-66.7	-10.7	174.1	-171.7	0	0	0	0	111.8	L1047 V1129 S1130 P1135 F1489 I1490 V1493	L1047-V1132 HydrophobicContact CD1-CG2 4.32Å; V1129-V1132 WeakPolarHBondContact O-CB 3.47Å; V1129-V1132 VanDerWaalsContact O-CG2 3.25Å; V1129-V1132 WeakPolarHBondContact O-CG2 3.21Å; V1129-V1132 PolarHBondContact O-N 3.16Å; S1130-V1132 PolarHBondContact O-N 2.8Å; V1132-P1135 WeakPolarHBondContact O-CD 3.46Å; V1132-F1489 HydrophobicContact CG1-CD1 4.42Å; V1132-F1489 HydrophobicContact CG1-CE1 4.13Å; V1132-I1490 HydrophobicContact CG1-CB 4.2Å; V1132-I1490 HydrophobicContact CG1-CG1 4.06Å; V1132-I1490 HydrophobicContact CG1-CG2 4.26Å; V1132-V1493 HydrophobicContact CG1-CB 4.19Å; V1132-V1493 HydrophobicContact CG2-CB 4.03Å; V1132-V1493 HydrophobicContact CG2-CG1 3.55Å
1133	L	74.7	Confident	68.1	Low	66 Å²	66	50.3 Å²	50.3	35%	0.346	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-81	-9.9	170.4	-53.6	177.5	0	0	0	113.6	S1130 R1131 P1135 L1136	S1130-L1133 VanDerWaalsContact O-CB 3.29Å; S1130-L1133 WeakPolarHBondContact O-CB 3.36Å; S1130-L1133 WeakPolarHBondContact O-CG 3.43Å; S1130-L1133 PolarHBondContact O-N 2.82Å; S1130-L1133 VanDerWaalsContact O-N 3.13Å; R1131-L1133 PolarHBondContact O-N 2.82Å; R1131-L1133 VanDerWaalsContact O-N 3.16Å; L1133-P1135 VanDerWaalsContact C-N 3.35Å; L1133-L1136 HydrophobicContact CB-CD1 4.13Å; L1133-L1136 HydrophobicContact CD2-CD1 3.8Å; L1133-L1136 WeakPolarHBondContact O-CB 3.34Å; L1133-L1136 WeakPolarHBondContact O-CG 3.28Å; L1133-L1136 PolarHBondContact O-N 2.96Å
1134	R	74.5	Confident	68.6	Low	1 Å²	1	46.7 Å²	46.7	0%	0.004	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-51.1	-43.2	178.6	-71.7	168.8	-175.9	176.8	4.1	112.4	I1040 S1043 D1067 V1106 S1110 R1131 L1136 R1137	I1040-R1134 HydrophobicContact CG2-CB 4.19Å; I1040-R1134 WeakPolarHBondContact CG2-O 3.36Å; S1043-R1134 PolarHBondContact OG-NH1 2.99Å; D1067-R1134 IonicContact OD1-CZ 2.8Å; D1067-R1134 IonicContact OD1-NH1 2.82Å; D1067-R1134 PolarHBondContact OD1-NH1 3.04Å; D1067-R1134 IonicContact OD1-NH2 3.44Å; D1067-R1134 PolarHBondContact OD1-NH2 3.25Å; V1106-R1134 HydrophobicContact CG1-CG 3.71Å; S1110-R1134 PolarHBondContact OG-NH2 3.05Å; R1131-R1134 VanDerWaalsContact O-CB 3.24Å; R1131-R1134 WeakPolarHBondContact O-CB 3.37Å; R1131-R1134 WeakPolarHBondContact O-CD 3.34Å; R1131-R1134 WeakPolarHBondContact O-CG 3.28Å; R1131-R1134 PolarHBondContact O-N 2.96Å; R1134-L1136 VanDerWaalsContact C-N 3.3Å; R1134-L1136 PolarHBondContact O-N 3.19Å; R1134-R1137 WeakPolarHBondContact O-CB 3.49Å; R1134-R1137 WeakPolarHBondContact O-CG 3.41Å; R1134-R1137 PolarHBondContact O-N 2.9Å
1135	P	71	Confident	69.1	Low	19 Å²	19	45.9 Å²	45.9	12%	0.123	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-56	-28	172.9	-30	36.9	0	0	0	116.8	S1044 V1132 L1133 R1137 A1138 F1489	S1044-P1135 WeakPolarHBondContact OG-CD 3.36Å; S1044-P1135 WeakPolarHBondContact OG-CG 3.28Å; V1132-P1135 WeakPolarHBondContact O-CD 3.46Å; L1133-P1135 VanDerWaalsContact C-N 3.35Å; P1135-R1137 PolarHBondContact O-N 3.4Å; P1135-A1138 VanDerWaalsContact O-CB 3.24Å; P1135-A1138 WeakPolarHBondContact O-CB 3.39Å; P1135-A1138 PolarHBondContact O-N 3.48Å; P1135-F1489 HydrophobicContact CG-CE1 4.12Å
1136	L	71.9	Confident	69.6	Low	40 Å²	40	44.2 Å²	44.2	21%	0.209	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-61.4	-22.2	-178	-60.6	-178.7	0	0	0	112.5	L1102 L1133 R1134 A1138 I1139 M1486 I1490	L1102-L1136 HydrophobicContact CD1-CB 4.44Å; L1102-L1136 HydrophobicContact CD1-CD1 4.26Å; L1133-L1136 HydrophobicContact CB-CD1 4.13Å; L1133-L1136 HydrophobicContact CD2-CD1 3.8Å; L1133-L1136 WeakPolarHBondContact O-CB 3.34Å; L1133-L1136 WeakPolarHBondContact O-CG 3.28Å; L1133-L1136 PolarHBondContact O-N 2.96Å; R1134-L1136 VanDerWaalsContact C-N 3.3Å; R1134-L1136 PolarHBondContact O-N 3.19Å; L1136-A1138 PolarHBondContact O-N 3.03Å; L1136-I1139 HydrophobicContact CB-CD1 4.28Å; L1136-I1139 HydrophobicContact CD2-CD1 3.72Å; L1136-I1139 WeakPolarHBondContact O-CB 3.42Å; L1136-I1139 PolarHBondContact O-N 3.24Å; L1136-M1486 HydrophobicContact CD2-CE 3.69Å; L1136-M1486 HydrophobicContact CD2-SD 3.72Å; L1136-I1490 HydrophobicContact CD2-CD1 4.09Å
1137	R	71.1	Confident	70	Confident	33 Å²	33	43.4 Å²	43.4	13%	0.125	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-55.2	-32.7	169.8	-67.8	175.8	171.2	-161.1	5.3	112.4	I1040 E1077 D1103 R1134 P1135 I1139 N1140	I1040-R1137 HydrophobicContact CD1-CB 4.06Å; I1040-R1137 HydrophobicContact CD1-CG 4.31Å; E1077-R1137 IonicContact OE1-NH1 2.72Å; E1077-R1137 PolarHBondContact OE1-NH1 3.34Å; E1077-R1137 IonicContact OE2-CZ 2.7Å; E1077-R1137 IonicContact OE2-NH1 3.73Å; E1077-R1137 PolarHBondContact OE2-NH1 3Å; E1077-R1137 IonicContact OE2-NH2 3.56Å; E1077-R1137 PolarHBondContact OE2-NH2 2.91Å; D1103-R1137 VanDerWaalsContact CB-NH2 3.28Å; D1103-R1137 VanDerWaalsContact CG-CZ 3.45Å; D1103-R1137 IonicContact OD1-CZ 3.27Å; D1103-R1137 VanDerWaalsContact OD1-CZ 3.22Å; D1103-R1137 IonicContact OD1-NE 3.32Å; D1103-R1137 PolarHBondContact OD1-NE 3.08Å; D1103-R1137 IonicContact OD1-NH2 2.98Å; D1103-R1137 PolarHBondContact OD1-NH2 2.93Å; D1103-R1137 IonicContact OD2-CZ 2.68Å; D1103-R1137 IonicContact OD2-NE 3.65Å; D1103-R1137 IonicContact OD2-NH2 3.52Å; R1134-R1137 WeakPolarHBondContact O-CB 3.49Å; R1134-R1137 WeakPolarHBondContact O-CG 3.41Å; R1134-R1137 PolarHBondContact O-N 2.9Å; P1135-R1137 PolarHBondContact O-N 3.4Å; R1137-I1139 VanDerWaalsContact C-N 3.34Å; R1137-I1139 PolarHBondContact O-N 3.07Å; R1137-N1140 PolarHBondContact O-N 2.97Å
1138	A	68.6	Low	70.3	Confident	35 Å²	35	41.4 Å²	41.4	29%	0.289	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-67	-30.6	-179.3	0	0	0	0	0	113.3	L1037 P1135 L1136 N1140 R1141 A1142	L1037-A1138 HydrophobicContact CD1-CB 4.27Å; P1135-A1138 VanDerWaalsContact O-CB 3.24Å; P1135-A1138 WeakPolarHBondContact O-CB 3.39Å; P1135-A1138 PolarHBondContact O-N 3.48Å; L1136-A1138 PolarHBondContact O-N 3.03Å; A1138-N1140 VanDerWaalsContact C-N 3.26Å; A1138-N1140 PolarHBondContact O-N 3.34Å; A1138-R1141 PolarHBondContact O-N 3.36Å; A1138-A1142 PolarHBondContact O-N 3.48Å
1139	I	70.4	Confident	70.8	Confident	29 Å²	29	40 Å²	40	15%	0.149	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-45	176.3	-63.4	168.5	0	0	0	111	L1136 R1137 R1141 A1142 L1145 V1149 M1486	L1136-I1139 HydrophobicContact CB-CD1 4.28Å; L1136-I1139 HydrophobicContact CD2-CD1 3.72Å; L1136-I1139 WeakPolarHBondContact O-CB 3.42Å; L1136-I1139 PolarHBondContact O-N 3.24Å; R1137-I1139 VanDerWaalsContact C-N 3.34Å; R1137-I1139 PolarHBondContact O-N 3.07Å; I1139-R1141 PolarHBondContact O-N 3.43Å; I1139-A1142 PolarHBondContact O-N 3.01Å; I1139-L1145 HydrophobicContact CB-CD2 4.31Å; I1139-L1145 HydrophobicContact CB-CG 4.37Å; I1139-L1145 HydrophobicContact CG1-CD2 3.84Å; I1139-L1145 HydrophobicContact CG1-CG 4.18Å; I1139-L1145 HydrophobicContact CG2-CG 4.1Å; I1139-V1149 HydrophobicContact CG2-CG2 4.37Å; I1139-M1486 HydrophobicContact CD1-CE 3.97Å; I1139-M1486 HydrophobicContact CD1-SD 3.94Å; I1139-M1486 HydrophobicContact CG1-SD 4.15Å
1140	N	65.7	Low	71.2	Confident	88 Å²	88	43.5 Å²	43.5	47%	0.471	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.8	-177.5	-72.9	-82.7	0	0	0	113.5	N1099 R1137 A1138	N1099-N1140 PolarHBondContact ND2-ND2 2.86Å; N1099-N1140 PolarHBondContact ND2-OD1 3.09Å; N1099-N1140 PolarHBondContact OD1-ND2 3.05Å; R1137-N1140 PolarHBondContact O-N 2.97Å; A1138-N1140 VanDerWaalsContact C-N 3.26Å; A1138-N1140 PolarHBondContact O-N 3.34Å
1141	R	71.2	Confident	71.5	Confident	127 Å²	127	43.1 Å²	43.1	48%	0.479	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-35.6	175.5	-179.2	174.7	166.5	143.6	1.4	111.7	N1033 N1034 A1138 I1139 K1143	N1033-R1141 PolarHBondContact O-NH1 2.94Å; N1034-R1141 VanDerWaalsContact OD1-CZ 3.32Å; N1034-R1141 PolarHBondContact OD1-NH1 2.83Å; N1034-R1141 PolarHBondContact OD1-NH2 3.35Å; A1138-R1141 PolarHBondContact O-N 3.36Å; I1139-R1141 PolarHBondContact O-N 3.43Å; R1141-K1143 PolarHBondContact O-N 2.84Å
1142	A	69.9	Low	71.6	Confident	21 Å²	21	43.5 Å²	43.5	17%	0.174	22%	0.219	C	C	.	.			trans	-75.8	86.9	174.9	0	0	0	0	0	110.6	A1138 I1139 G1144 L1145 K1146 Y1479	A1138-A1142 PolarHBondContact O-N 3.48Å; I1139-A1142 PolarHBondContact O-N 3.01Å; A1142-G1144 VanDerWaalsContact C-N 3.27Å; A1142-G1144 PolarHBondContact O-N 3.36Å; A1142-G1144 VanDerWaalsContact O-N 3.11Å; A1142-L1145 HydrophobicContact CB-CB 3.68Å; A1142-L1145 HydrophobicContact CB-CD2 4.29Å; A1142-L1145 WeakPolarHBondContact O-CA 3.38Å; A1142-L1145 VanDerWaalsContact O-CB 3.27Å; A1142-L1145 WeakPolarHBondContact O-CB 3.24Å; A1142-L1145 PolarHBondContact O-N 3.47Å; A1142-K1146 PolarHBondContact O-N 2.91Å; A1142-Y1479 HydrophobicContact CB-CD1 4.24Å; A1142-Y1479 HydrophobicContact CB-CE1 3.94Å
1143	K	69.7	Low	71.9	Confident	104 Å²	104	47 Å²	47	45%	0.452	24%	0.241	S	C	.	.	H	α-helix	trans	-38.3	-51.7	178.4	-61.6	174.5	153.4	-88.1	0	113.5	R1141 L1145 K1146 H1147 T2348 A2349 C2350 L2351	R1141-K1143 PolarHBondContact O-N 2.84Å; K1143-L1145 PolarHBondContact O-N 2.99Å; K1143-K1146 WeakPolarHBondContact O-CB 3.34Å; K1143-K1146 PolarHBondContact O-N 3.45Å; K1143-H1147 PolarHBondContact O-N 3.09Å; K1143-T2348 HydrophobicContact CB-CG2 3.74Å; K1143-T2348 HydrophobicContact CG-CG2 4.42Å; K1143-A2349 CarbonylContact C-O 3.56Å; K1143-A2349 VanDerWaalsContact C-O 3.28Å; K1143-A2349 WeakPolarHBondContact CB-O 3.43Å; K1143-C2350 CarbonylContact C-O 3.59Å; K1143-C2350 VanDerWaalsContact CB-O 3.28Å; K1143-C2350 WeakPolarHBondContact CB-O 3.18Å; K1143-L2351 WeakPolarHBondContact CB-O 3.45Å; K1143-L2351 WeakPolarHBondContact CD-O 3.3Å; K1143-L2351 VanDerWaalsContact CG-O 3.3Å; K1143-L2351 WeakPolarHBondContact CG-O 3.43Å; K1143-L2351 PolarHBondContact NZ-O 3.33Å
1144	G	68.7	Low	72	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-67.4	-28.5	178.5	0	0	0	0	0	115.1	A1142 H1147 V1148 Y1479 A2349	A1142-G1144 VanDerWaalsContact C-N 3.27Å; A1142-G1144 PolarHBondContact O-N 3.36Å; A1142-G1144 VanDerWaalsContact O-N 3.11Å; G1144-H1147 PolarHBondContact O-N 3.43Å; G1144-V1148 PolarHBondContact O-N 2.77Å; G1144-Y1479 VanDerWaalsContact C-CD2 3.44Å; G1144-A2349 WeakPolarHBondContact CA-O 3.31Å; G1144-A2349 PolarHBondContact N-O 3.22Å
1145	L	69.2	Low	72.1	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-69.3	-36.4	174.4	-162.3	40.1	0	0	0	110.9	I1139 A1142 K1143 H1147 V1148 V1149 Y1479 L1482 L1483	I1139-L1145 HydrophobicContact CB-CD2 4.31Å; I1139-L1145 HydrophobicContact CB-CG 4.37Å; I1139-L1145 HydrophobicContact CG1-CD2 3.84Å; I1139-L1145 HydrophobicContact CG1-CG 4.18Å; I1139-L1145 HydrophobicContact CG2-CG 4.1Å; A1142-L1145 HydrophobicContact CB-CB 3.68Å; A1142-L1145 HydrophobicContact CB-CD2 4.29Å; A1142-L1145 WeakPolarHBondContact O-CA 3.38Å; A1142-L1145 VanDerWaalsContact O-CB 3.27Å; A1142-L1145 WeakPolarHBondContact O-CB 3.24Å; A1142-L1145 PolarHBondContact O-N 3.47Å; K1143-L1145 PolarHBondContact O-N 2.99Å; L1145-H1147 VanDerWaalsContact C-N 3.29Å; L1145-H1147 PolarHBondContact O-N 3.46Å; L1145-V1148 PolarHBondContact O-N 3.38Å; L1145-V1149 HydrophobicContact CD1-CG2 4.22Å; L1145-V1149 HydrophobicContact CG-CG2 4.5Å; L1145-V1149 WeakPolarHBondContact O-CB 3.46Å; L1145-V1149 VanDerWaalsContact O-CG2 3.25Å; L1145-V1149 WeakPolarHBondContact O-CG2 3.43Å; L1145-V1149 PolarHBondContact O-N 3.14Å; L1145-Y1479 HydrophobicContact CB-CD1 3.52Å; L1145-Y1479 HydrophobicContact CB-CE1 4.42Å; L1145-Y1479 HydrophobicContact CB-CG 3.94Å; L1145-Y1479 HydrophobicContact CD1-CD1 4.35Å; L1145-Y1479 HydrophobicContact CD1-CG 4.41Å; L1145-Y1479 HydrophobicContact CD2-CD1 4.29Å; L1145-Y1479 HydrophobicContact CG-CD1 4.24Å; L1145-Y1479 VanDerWaalsContact N-CG 3.34Å; L1145-L1482 HydrophobicContact CD2-CD2 3.8Å; L1145-L1483 HydrophobicContact CD1-CB 4.04Å; L1145-L1483 HydrophobicContact CD1-CD1 4.06Å; L1145-L1483 HydrophobicContact CD1-CG 4.27Å
1146	K	72.8	Confident	72.5	Confident	68 Å²	68	49.3 Å²	49.3	30%	0.296	26%	0.257	S	S	.	.	H	α-helix	trans	-56.6	-44.4	169.8	-178.7	-174.1	170.1	171.9	0	111	A1142 K1143 Q1150 P2352 D2353	A1142-K1146 PolarHBondContact O-N 2.91Å; K1143-K1146 WeakPolarHBondContact O-CB 3.34Å; K1143-K1146 PolarHBondContact O-N 3.45Å; K1146-Q1150 VanDerWaalsContact O-CB 3.26Å; K1146-Q1150 WeakPolarHBondContact O-CB 3.41Å; K1146-Q1150 PolarHBondContact O-N 3.26Å; K1146-P2352 HydrophobicContact CD-CB 3.94Å; K1146-D2353 IonicContact NZ-OD2 2.64Å; K1146-D2353 PolarHBondContact NZ-OD2 2.95Å
1147	H	68.9	Low	72.8	Confident	69 Å²	69	55.1 Å²	55.1	32%	0.319	28%	0.281	S	S	.	.	H	α-helix	trans	-66.6	-47.6	-179.5	-167.9	-85.1	0	0	0	112.1	K1143 G1144 L1145 V1149 Q1150 C1151 C2350	K1143-H1147 PolarHBondContact O-N 3.09Å; G1144-H1147 PolarHBondContact O-N 3.43Å; L1145-H1147 VanDerWaalsContact C-N 3.29Å; L1145-H1147 PolarHBondContact O-N 3.46Å; H1147-V1149 PolarHBondContact O-N 2.96Å; H1147-Q1150 WeakPolarHBondContact O-CB 3.48Å; H1147-Q1150 PolarHBondContact O-N 3.4Å; H1147-Q1150 VanDerWaalsContact O-N 3.13Å; H1147-C1151 PolarHBondContact O-N 2.86Å; H1147-C1151 PolarHBondContact O-SG 3.42Å; H1147-C2350 HydrophobicContact CB-CB 3.64Å; H1147-C2350 WeakPolarHBondContact CD2-CB 3.47Å; H1147-C2350 PolarHBondContact CD2-SG 3.49Å
1148	V	71.5	Confident	72.9	Confident	27 Å²	27	54.7 Å²	54.7	16%	0.164	28%	0.283	C	S	.	.	H	α-helix	trans	-56.2	-50.1	174.4	167.4	0	0	0	0	111.1	G1144 L1145 Q1150 C1151 V1152 V1480 L1483	G1144-V1148 PolarHBondContact O-N 2.77Å; L1145-V1148 PolarHBondContact O-N 3.38Å; V1148-Q1150 VanDerWaalsContact C-N 3.28Å; V1148-Q1150 PolarHBondContact O-N 2.91Å; V1148-C1151 PolarHBondContact O-N 3.17Å; V1148-V1152 HydrophobicContact CG1-CG2 4.45Å; V1148-V1152 WeakPolarHBondContact O-CB 3.37Å; V1148-V1152 VanDerWaalsContact O-CG2 3.28Å; V1148-V1152 WeakPolarHBondContact O-CG2 3.37Å; V1148-V1152 PolarHBondContact O-N 2.95Å; V1148-V1480 HydrophobicContact CG1-CG2 3.74Å; V1148-V1480 HydrophobicContact CG2-CG2 3.99Å; V1148-L1483 HydrophobicContact CG1-CD1 4.2Å
1149	V	74.8	Confident	73.4	Confident	47 Å²	47	53.4 Å²	53.4	29%	0.285	27%	0.271	S	S	.	.	H	α-helix	trans	-62.2	-35.2	177.7	171.6	0	0	0	0	111.6	I1139 L1145 H1147 V1153 L1483	I1139-V1149 HydrophobicContact CG2-CG2 4.37Å; L1145-V1149 HydrophobicContact CD1-CG2 4.22Å; L1145-V1149 HydrophobicContact CG-CG2 4.5Å; L1145-V1149 WeakPolarHBondContact O-CB 3.46Å; L1145-V1149 VanDerWaalsContact O-CG2 3.25Å; L1145-V1149 WeakPolarHBondContact O-CG2 3.43Å; L1145-V1149 PolarHBondContact O-N 3.14Å; H1147-V1149 PolarHBondContact O-N 2.96Å; V1149-V1153 HydrophobicContact CG1-CG2 4.38Å; V1149-V1153 WeakPolarHBondContact O-CB 3.37Å; V1149-V1153 VanDerWaalsContact O-CG2 3.25Å; V1149-V1153 WeakPolarHBondContact O-CG2 3.29Å; V1149-V1153 PolarHBondContact O-N 3.39Å; V1149-L1483 HydrophobicContact CG2-CD1 3.9Å
1150	Q	75.6	Confident	73.7	Confident	98 Å²	98	53.4 Å²	53.4	46%	0.458	28%	0.279	S	S	.	.	H	α-helix	trans	-66.6	-46.6	175.5	-177.8	173.7	-32	0	0	112	K1146 H1147 V1148 V1152 V1153 V1154	K1146-Q1150 VanDerWaalsContact O-CB 3.26Å; K1146-Q1150 WeakPolarHBondContact O-CB 3.41Å; K1146-Q1150 PolarHBondContact O-N 3.26Å; H1147-Q1150 WeakPolarHBondContact O-CB 3.48Å; H1147-Q1150 PolarHBondContact O-N 3.4Å; H1147-Q1150 VanDerWaalsContact O-N 3.13Å; V1148-Q1150 VanDerWaalsContact C-N 3.28Å; V1148-Q1150 PolarHBondContact O-N 2.91Å; Q1150-V1152 VanDerWaalsContact C-N 3.35Å; Q1150-V1152 PolarHBondContact O-N 3.45Å; Q1150-V1153 PolarHBondContact O-N 3.08Å; Q1150-V1154 WeakPolarHBondContact O-CG2 3.35Å; Q1150-V1154 PolarHBondContact O-N 3.11Å
1151	C	73.6	Confident	74.1	Confident	17 Å²	17	54.1 Å²	54.1	12%	0.115	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-44.4	174.7	-61.7	0	0	0	0	111.3	H1147 V1148 V1153 V1154 A1155 F1299	H1147-C1151 PolarHBondContact O-N 2.86Å; H1147-C1151 PolarHBondContact O-SG 3.42Å; V1148-C1151 PolarHBondContact O-N 3.17Å; C1151-V1153 PolarHBondContact O-N 3.06Å; C1151-V1154 WeakPolarHBondContact O-CB 3.49Å; C1151-V1154 PolarHBondContact O-N 3.3Å; C1151-A1155 PolarHBondContact O-N 3.24Å; C1151-F1299 HydrophobicContact CB-CE1 4.48Å
1152	V	76.4	Confident	74.4	Confident	19 Å²	19	48.6 Å²	48.6	12%	0.115	26%	0.257	C	S	.	.	H	α-helix	trans	-59.8	-44	175.5	170.6	0	0	0	0	111.4	V1148 Q1150 V1154 A1155 V1156 F1770	V1148-V1152 HydrophobicContact CG1-CG2 4.45Å; V1148-V1152 WeakPolarHBondContact O-CB 3.37Å; V1148-V1152 VanDerWaalsContact O-CG2 3.28Å; V1148-V1152 WeakPolarHBondContact O-CG2 3.37Å; V1148-V1152 PolarHBondContact O-N 2.95Å; Q1150-V1152 VanDerWaalsContact C-N 3.35Å; Q1150-V1152 PolarHBondContact O-N 3.45Å; V1152-V1154 VanDerWaalsContact C-N 3.32Å; V1152-V1154 PolarHBondContact O-N 3.17Å; V1152-A1155 PolarHBondContact O-N 2.69Å; V1152-V1156 HydrophobicContact CG1-CG2 4.39Å; V1152-V1156 VanDerWaalsContact O-CG2 3.29Å; V1152-V1156 WeakPolarHBondContact O-CG2 3.43Å; V1152-V1156 PolarHBondContact O-N 3.27Å; V1152-F1770 HydrophobicContact CG1-CE1 3.6Å; V1152-F1770 HydrophobicContact CG1-CZ 3.99Å
1153	V	78.9	Confident	74.9	Confident	76 Å²	76	51 Å²	51	46%	0.461	27%	0.266	S	S	.	.	H	α-helix	trans	-67.5	-29.1	176.8	166.7	0	0	0	0	112.9	V1149 Q1150 C1151 K1157	V1149-V1153 HydrophobicContact CG1-CG2 4.38Å; V1149-V1153 WeakPolarHBondContact O-CB 3.37Å; V1149-V1153 VanDerWaalsContact O-CG2 3.25Å; V1149-V1153 WeakPolarHBondContact O-CG2 3.29Å; V1149-V1153 PolarHBondContact O-N 3.39Å; Q1150-V1153 PolarHBondContact O-N 3.08Å; C1151-V1153 PolarHBondContact O-N 3.06Å; V1153-K1157 WeakPolarHBondContact O-CG 3.47Å
1154	V	77.4	Confident	75.2	Confident	61 Å²	61	50.9 Å²	50.9	37%	0.37	27%	0.268	S	S	.	.	H	α-helix	trans	-67.7	-51.4	170.1	170.7	0	0	0	0	109.9	Q1150 C1151 V1152 V1156 K1157 S1158	Q1150-V1154 WeakPolarHBondContact O-CG2 3.35Å; Q1150-V1154 PolarHBondContact O-N 3.11Å; C1151-V1154 WeakPolarHBondContact O-CB 3.49Å; C1151-V1154 PolarHBondContact O-N 3.3Å; V1152-V1154 VanDerWaalsContact C-N 3.32Å; V1152-V1154 PolarHBondContact O-N 3.17Å; V1154-V1156 PolarHBondContact O-N 2.97Å; V1154-K1157 PolarHBondContact O-N 3.41Å; V1154-S1158 PolarHBondContact O-OG 3.25Å
1155	A	76.3	Confident	75.7	Confident	2 Å²	2	51.3 Å²	51.3	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-56.9	-48.4	179.5	0	0	0	0	0	112.4	C1151 V1152 K1157 S1158 I1159	C1151-A1155 PolarHBondContact O-N 3.24Å; V1152-A1155 PolarHBondContact O-N 2.69Å; A1155-K1157 VanDerWaalsContact C-N 3.29Å; A1155-K1157 PolarHBondContact O-N 3.21Å; A1155-S1158 PolarHBondContact O-N 2.9Å; A1155-S1158 VanDerWaalsContact O-N 3.15Å; A1155-S1158 PolarHBondContact O-OG 3.46Å; A1155-I1159 HydrophobicContact CB-CD1 4.02Å; A1155-I1159 WeakPolarHBondContact O-CB 3.1Å; A1155-I1159 WeakPolarHBondContact O-CD1 3.43Å; A1155-I1159 WeakPolarHBondContact O-CG1 3.39Å; A1155-I1159 PolarHBondContact O-N 3.44Å
1156	V	79.2	Confident	76.3	Confident	72 Å²	72	52.3 Å²	52.3	44%	0.436	28%	0.277	S	S	.	.	H	α-helix	trans	-54.6	-40.2	179.2	168.7	0	0	0	0	112.6	V1152 V1154 S1158 I1159 G1160 F1770	V1152-V1156 HydrophobicContact CG1-CG2 4.39Å; V1152-V1156 VanDerWaalsContact O-CG2 3.29Å; V1152-V1156 WeakPolarHBondContact O-CG2 3.43Å; V1152-V1156 PolarHBondContact O-N 3.27Å; V1154-V1156 PolarHBondContact O-N 2.97Å; V1156-S1158 VanDerWaalsContact C-N 3.32Å; V1156-S1158 PolarHBondContact O-N 3.49Å; V1156-I1159 PolarHBondContact O-N 3.2Å; V1156-G1160 PolarHBondContact O-N 3.39Å; V1156-F1770 HydrophobicContact CG2-CD1 4.4Å; V1156-F1770 HydrophobicContact CG2-CE1 3.33Å; V1156-F1770 HydrophobicContact CG2-CZ 3.46Å; V1156-F1770 VanDerWaalsContact CG2-CZ 3.46Å
1157	K	79.7	Confident	76.8	Confident	161 Å²	161	53 Å²	53	70%	0.7	28%	0.28	S	S	*	.	H	α-helix	trans	-63.5	-37.9	-178.9	-76.4	175.3	177.3	-176.5	0	113	V1153 V1154 A1155	V1153-K1157 WeakPolarHBondContact O-CG 3.47Å; V1154-K1157 PolarHBondContact O-N 3.41Å; A1155-K1157 VanDerWaalsContact C-N 3.29Å; A1155-K1157 PolarHBondContact O-N 3.21Å
1158	S	73.1	Confident	77.4	Confident	25 Å²	25	51.3 Å²	51.3	18%	0.175	27%	0.273	C	S	.	.	H	α-helix	trans	-82.5	-40.1	178.6	33.5	0	0	0	0	112.1	V1154 A1155 V1156 G1160 K1161 F1294	V1154-S1158 PolarHBondContact O-OG 3.25Å; A1155-S1158 PolarHBondContact O-N 2.9Å; A1155-S1158 VanDerWaalsContact O-N 3.15Å; A1155-S1158 PolarHBondContact O-OG 3.46Å; V1156-S1158 VanDerWaalsContact C-N 3.32Å; V1156-S1158 PolarHBondContact O-N 3.49Å; S1158-G1160 PolarHBondContact O-N 3.24Å; S1158-K1161 WeakPolarHBondContact O-CB 3.17Å; S1158-K1161 PolarHBondContact O-N 3.11Å; S1158-K1161 VanDerWaalsContact O-N 3.15Å; S1158-F1294 WeakPolarHBondContact OG-CE1 3.39Å
1159	I	78.6	Confident	78	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.036	27%	0.271	C	S	.	.	H	α-helix	trans	-56.1	-39	171.7	-72.8	165	0	0	0	111.3	A1155 V1156 K1161 I1162 M1163 F1291 F1294 V1295 F1770	A1155-I1159 HydrophobicContact CB-CD1 4.02Å; A1155-I1159 WeakPolarHBondContact O-CB 3.1Å; A1155-I1159 WeakPolarHBondContact O-CD1 3.43Å; A1155-I1159 WeakPolarHBondContact O-CG1 3.39Å; A1155-I1159 PolarHBondContact O-N 3.44Å; V1156-I1159 PolarHBondContact O-N 3.2Å; I1159-K1161 PolarHBondContact O-N 3.24Å; I1159-I1162 WeakPolarHBondContact O-CA 3.5Å; I1159-I1162 PolarHBondContact O-N 3.03Å; I1159-M1163 PolarHBondContact O-N 3.11Å; I1159-F1291 HydrophobicContact CD1-CE1 3.96Å; I1159-F1291 HydrophobicContact CD1-CZ 4.07Å; I1159-F1291 HydrophobicContact CG1-CE1 4.48Å; I1159-F1291 HydrophobicContact CG1-CZ 4.5Å; I1159-F1291 HydrophobicContact CG2-CD2 3.79Å; I1159-F1291 HydrophobicContact CG2-CE1 4.27Å; I1159-F1291 HydrophobicContact CG2-CE2 3.24Å; I1159-F1291 HydrophobicContact CG2-CZ 3.53Å; I1159-F1294 HydrophobicContact CG1-CD1 4.27Å; I1159-V1295 HydrophobicContact CD1-CG2 3.74Å; I1159-V1295 HydrophobicContact CG1-CG2 4.41Å; I1159-F1770 HydrophobicContact CD1-CD2 4.48Å; I1159-F1770 HydrophobicContact CD1-CE2 3.57Å; I1159-F1770 HydrophobicContact CD1-CZ 4.09Å
1160	G	77.3	Confident	78.6	Confident	30 Å²	30	49.4 Å²	49.4	31%	0.309	26%	0.26	S	S	.	.	H	α-helix	trans	-55.7	-26.5	178.9	0	0	0	0	0	114.3	V1156 S1158 M1164	V1156-G1160 PolarHBondContact O-N 3.39Å; S1158-G1160 PolarHBondContact O-N 3.24Å; G1160-M1164 PolarHBondContact O-N 2.8Å
1161	K	72.7	Confident	79.2	Confident	102 Å²	102	47.1 Å²	47.1	44%	0.443	25%	0.248	S	C	.	.	H	α-helix	trans	-65.8	-42.1	171.6	-60.3	-179.4	-177.3	174.6	0	111.9	S1158 I1159 V1165	S1158-K1161 WeakPolarHBondContact O-CB 3.17Å; S1158-K1161 PolarHBondContact O-N 3.11Å; S1158-K1161 VanDerWaalsContact O-N 3.15Å; I1159-K1161 PolarHBondContact O-N 3.24Å; K1161-V1165 WeakPolarHBondContact O-CG2 3.33Å
1162	I	78.1	Confident	79.7	Confident	11 Å²	11	46.9 Å²	46.9	6%	0.056	25%	0.246	C	C	.	.	H	α-helix	trans	-78.4	-45.4	-177.4	-59.5	168.9	0	0	0	110.2	L725 I1159 M1164 V1165 T1166 I1290 F1294	L725-I1162 HydrophobicContact CD1-CG1 4.33Å; I1159-I1162 WeakPolarHBondContact O-CA 3.5Å; I1159-I1162 PolarHBondContact O-N 3.03Å; I1162-M1164 PolarHBondContact O-N 3.29Å; I1162-V1165 WeakPolarHBondContact O-CA 3.26Å; I1162-V1165 WeakPolarHBondContact O-CB 3.39Å; I1162-V1165 PolarHBondContact O-N 3.45Å; I1162-T1166 PolarHBondContact O-N 3.21Å; I1162-T1166 VanDerWaalsContact O-N 3.12Å; I1162-T1166 PolarHBondContact O-OG1 3.01Å; I1162-I1290 HydrophobicContact CD1-CG2 4.29Å; I1162-I1290 HydrophobicContact CG2-CG2 4.06Å; I1162-F1294 HydrophobicContact CD1-CB 3.74Å; I1162-F1294 HydrophobicContact CD1-CD1 4.26Å; I1162-F1294 HydrophobicContact CD1-CD2 3.88Å; I1162-F1294 HydrophobicContact CD1-CG 3.65Å
1163	M	79.7	Confident	80.4	Confident	73 Å²	73	47.7 Å²	47.7	36%	0.36	25%	0.248	S	C	.	.	H	α-helix	trans	-56.6	-36.5	-180	-173.2	179.4	73.5	0	0	112.4	I1159 V1165 T1166 F1167	I1159-M1163 PolarHBondContact O-N 3.11Å; M1163-V1165 VanDerWaalsContact C-N 3.29Å; M1163-V1165 PolarHBondContact O-N 3.36Å; M1163-T1166 PolarHBondContact O-N 3.45Å; M1163-F1167 HydrophobicContact CE-CE2 4.08Å; M1163-F1167 HydrophobicContact CG-CD2 3.98Å; M1163-F1167 HydrophobicContact CG-CE2 3.55Å; M1163-F1167 HydrophobicContact CG-CZ 4.29Å; M1163-F1167 VanDerWaalsContact O-CD2 3.28Å; M1163-F1167 WeakPolarHBondContact O-CD2 3.16Å; M1163-F1167 PolarHBondContact O-N 2.78Å; M1163-F1167 HydrophobicContact SD-CE2 4Å
1164	M	76.9	Confident	80.9	Confident	100 Å²	100	44.1 Å²	44.1	49%	0.493	23%	0.226	S	C	.	.	H	α-helix	trans	-70.6	-21.2	174.1	-175.6	160	167.2	0	0	113.7	W719 G1160 I1162 L1168	W719-M1164 HydrophobicContact CH2-CE 3.67Å; W719-M1164 HydrophobicContact CH2-CG 4.12Å; W719-M1164 HydrophobicContact CH2-SD 3.37Å; W719-M1164 WeakPolarHBondContact CH2-SD 3.4Å; W719-M1164 HydrophobicContact CZ2-CE 3.67Å; W719-M1164 HydrophobicContact CZ2-SD 4.01Å; W719-M1164 HydrophobicContact CZ3-CB 4.48Å; W719-M1164 HydrophobicContact CZ3-CG 4.33Å; W719-M1164 HydrophobicContact CZ3-SD 4.13Å; G1160-M1164 PolarHBondContact O-N 2.8Å; I1162-M1164 PolarHBondContact O-N 3.29Å; M1164-L1168 WeakPolarHBondContact O-CB 3.44Å; M1164-L1168 PolarHBondContact O-N 2.89Å
1165	V	78.4	Confident	81.4	Confident	10 Å²	10	41.2 Å²	41.2	6%	0.061	21%	0.209	C	C	.	.	H	α-helix	trans	-73.7	-44	169.3	-173.2	0	0	0	0	110.1	L722 K1161 I1162 M1163 L1168 L1169 M1287	L722-V1165 HydrophobicContact CB-CG2 4.49Å; L722-V1165 HydrophobicContact CD1-CB 4.31Å; L722-V1165 HydrophobicContact CD1-CG1 3.54Å; L722-V1165 HydrophobicContact CD1-CG2 3.74Å; L722-V1165 HydrophobicContact CD2-CG2 4.29Å; L722-V1165 HydrophobicContact CG-CG2 4.4Å; K1161-V1165 WeakPolarHBondContact O-CG2 3.33Å; I1162-V1165 WeakPolarHBondContact O-CA 3.26Å; I1162-V1165 WeakPolarHBondContact O-CB 3.39Å; I1162-V1165 PolarHBondContact O-N 3.45Å; M1163-V1165 VanDerWaalsContact C-N 3.29Å; M1163-V1165 PolarHBondContact O-N 3.36Å; V1165-L1168 PolarHBondContact O-N 3.45Å; V1165-L1169 HydrophobicContact CG1-CD1 4.25Å; V1165-L1169 WeakPolarHBondContact O-CG 3.48Å; V1165-L1169 PolarHBondContact O-N 3.02Å; V1165-M1287 HydrophobicContact CG1-SD 4.4Å
1166	T	82.4	Confident	81.9	Confident	24 Å²	24	43 Å²	43	15%	0.147	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-52	176.5	-46	0	0	0	0	110.7	I1162 M1163 L1168 L1169 E1170 I1283 M1287	I1162-T1166 PolarHBondContact O-N 3.21Å; I1162-T1166 VanDerWaalsContact O-N 3.12Å; I1162-T1166 PolarHBondContact O-OG1 3.01Å; M1163-T1166 PolarHBondContact O-N 3.45Å; T1166-L1168 VanDerWaalsContact C-N 3.27Å; T1166-L1168 PolarHBondContact O-N 2.86Å; T1166-L1169 PolarHBondContact O-N 2.91Å; T1166-L1169 VanDerWaalsContact O-N 3.09Å; T1166-E1170 WeakPolarHBondContact O-CB 3.47Å; T1166-E1170 PolarHBondContact O-N 3.28Å; T1166-I1283 HydrophobicContact CG2-CD1 4.43Å; T1166-I1283 HydrophobicContact CG2-CG2 4.1Å; T1166-M1287 HydrophobicContact CG2-CB 4.13Å
1167	F	84.3	Confident	82.4	Confident	83 Å²	83	39.6 Å²	39.6	36%	0.364	20%	0.197	S	C	.	.	H	α-helix	trans	-60.3	-32.7	176.8	-72.5	-49.8	0	0	0	113.5	M1163 E1170 F1171	M1163-F1167 HydrophobicContact CE-CE2 4.08Å; M1163-F1167 HydrophobicContact CG-CD2 3.98Å; M1163-F1167 HydrophobicContact CG-CE2 3.55Å; M1163-F1167 HydrophobicContact CG-CZ 4.29Å; M1163-F1167 VanDerWaalsContact O-CD2 3.28Å; M1163-F1167 WeakPolarHBondContact O-CD2 3.16Å; M1163-F1167 PolarHBondContact O-N 2.78Å; M1163-F1167 HydrophobicContact SD-CE2 4Å; F1167-E1170 VanDerWaalsContact CD1-OE2 3.31Å; F1167-E1170 WeakPolarHBondContact CD1-OE2 3.31Å; F1167-F1171 WeakPolarHBondContact O-CB 3.25Å; F1167-F1171 PolarHBondContact O-N 3.18Å
1168	L	80.6	Confident	82.9	Confident	33 Å²	33	32.2 Å²	32.2	17%	0.173	17%	0.165	C	C	.	.	H	α-helix	trans	-68.5	-40.2	175.4	-177.2	154.4	0	0	0	111.6	V712 F713 M1164 V1165 T1166 M1172	V712-L1168 HydrophobicContact CG1-CD1 4.04Å; V712-L1168 HydrophobicContact CG1-CD2 4.14Å; V712-L1168 HydrophobicContact CG1-CG 4.12Å; F713-L1168 HydrophobicContact CD1-CD2 4.28Å; F713-L1168 HydrophobicContact CE1-CD2 3.98Å; M1164-L1168 WeakPolarHBondContact O-CB 3.44Å; M1164-L1168 PolarHBondContact O-N 2.89Å; V1165-L1168 PolarHBondContact O-N 3.45Å; T1166-L1168 VanDerWaalsContact C-N 3.27Å; T1166-L1168 PolarHBondContact O-N 2.86Å; L1168-M1172 HydrophobicContact CD2-SD 3.79Å; L1168-M1172 WeakPolarHBondContact O-CG 3.48Å; L1168-M1172 PolarHBondContact O-N 2.97Å
1169	L	83.4	Confident	83.5	Confident	22 Å²	22	31.9 Å²	31.9	12%	0.115	16%	0.161	C	C	.	.	H	α-helix	trans	-71.4	-44.9	177.2	-68.6	171.6	0	0	0	111.6	F713 V1165 T1166 F1171 M1172 F1173 I1283 M1287	F713-L1169 HydrophobicContact CE1-CD2 3.8Å; F713-L1169 HydrophobicContact CZ-CD2 3.78Å; V1165-L1169 HydrophobicContact CG1-CD1 4.25Å; V1165-L1169 WeakPolarHBondContact O-CG 3.48Å; V1165-L1169 PolarHBondContact O-N 3.02Å; T1166-L1169 PolarHBondContact O-N 2.91Å; T1166-L1169 VanDerWaalsContact O-N 3.09Å; L1169-F1171 VanDerWaalsContact C-N 3.34Å; L1169-F1171 PolarHBondContact O-N 3.43Å; L1169-M1172 WeakPolarHBondContact O-CB 3.14Å; L1169-M1172 PolarHBondContact O-N 3.45Å; L1169-M1172 VanDerWaalsContact O-N 3.08Å; L1169-F1173 WeakPolarHBondContact O-CD2 3.08Å; L1169-F1173 PolarHBondContact O-N 2.9Å; L1169-I1283 HydrophobicContact CB-CD1 3.72Å; L1169-I1283 HydrophobicContact CD1-CD1 4.41Å; L1169-M1287 HydrophobicContact CD1-CE 3.66Å; L1169-M1287 HydrophobicContact CD1-CG 4.07Å; L1169-M1287 HydrophobicContact CD1-SD 3.96Å
1170	E	89	Confident	83.8	Confident	12 Å²	12	34.1 Å²	34.1	6%	0.056	17%	0.172	C	C	.	.	H	α-helix	trans	-53.8	-49.6	172.5	-178	-169.6	154.4	0	0	111.1	T1166 F1167 M1172 F1173 A1174 M1235	T1166-E1170 WeakPolarHBondContact O-CB 3.47Å; T1166-E1170 PolarHBondContact O-N 3.28Å; F1167-E1170 VanDerWaalsContact CD1-OE2 3.31Å; F1167-E1170 WeakPolarHBondContact CD1-OE2 3.31Å; E1170-M1172 VanDerWaalsContact C-N 3.34Å; E1170-M1172 PolarHBondContact O-N 3.27Å; E1170-F1173 CarbonylContact O-C 3.25Å; E1170-F1173 PolarHBondContact O-N 3.49Å; E1170-A1174 WeakPolarHBondContact O-CB 3.48Å; E1170-A1174 PolarHBondContact O-N 2.92Å; E1170-M1235 HydrophobicContact CG-CE 4.48Å
1171	F	88.1	Confident	84.5	Confident	49 Å²	49	32.9 Å²	32.9	22%	0.215	16%	0.159	C	C	.	.	H	α-helix	trans	-58.1	-40.5	173.6	167.7	-94.8	0	0	0	113.1	T623 T627 F1167 L1169 A1174 V1175 V1231 M1235	T623-F1171 HydrophobicContact CG2-CE1 3.75Å; T623-F1171 HydrophobicContact CG2-CZ 3.72Å; T627-F1171 HydrophobicContact CG2-CE2 3.5Å; T627-F1171 VanDerWaalsContact CG2-CE2 3.5Å; T627-F1171 HydrophobicContact CG2-CZ 3.36Å; F1167-F1171 WeakPolarHBondContact O-CB 3.25Å; F1167-F1171 PolarHBondContact O-N 3.18Å; L1169-F1171 VanDerWaalsContact C-N 3.34Å; L1169-F1171 PolarHBondContact O-N 3.43Å; F1171-A1174 PolarHBondContact O-N 2.93Å; F1171-V1175 HydrophobicContact CE2-CG2 4.41Å; F1171-V1175 HydrophobicContact CZ-CG2 4.37Å; F1171-V1175 PolarHBondContact O-N 3.17Å; F1171-V1175 VanDerWaalsContact O-N 3.11Å; F1171-V1231 HydrophobicContact CD2-CG1 4.24Å; F1171-V1231 HydrophobicContact CE2-CG1 4.23Å; F1171-M1235 HydrophobicContact CB-CE 4.4Å; F1171-M1235 HydrophobicContact CB-SD 4.3Å; F1171-M1235 HydrophobicContact CD2-SD 4.14Å
1172	M	84.2	Confident	85.3	Confident	12 Å²	12	28.6 Å²	28.6	6%	0.059	14%	0.142	C	C	.	.	H	α-helix	trans	-65.6	-42.2	175.2	-75.7	-179.6	63.8	0	0	112	L709 L710 V712 F713 L1168 L1169 E1170 A1174 I1176	L709-M1172 HydrophobicContact CB-CE 4.17Å; L710-M1172 HydrophobicContact CD2-CE 4.34Å; V712-M1172 HydrophobicContact CB-SD 4.28Å; V712-M1172 HydrophobicContact CG1-SD 4.42Å; F713-M1172 HydrophobicContact CD1-SD 4.11Å; F713-M1172 HydrophobicContact CD2-CE 4.19Å; F713-M1172 HydrophobicContact CE1-CE 4.09Å; F713-M1172 HydrophobicContact CE1-SD 3.58Å; F713-M1172 VanDerWaalsContact CE1-SD 3.58Å; F713-M1172 HydrophobicContact CE2-CE 3.66Å; F713-M1172 HydrophobicContact CE2-SD 4.27Å; F713-M1172 HydrophobicContact CZ-CE 3.6Å; F713-M1172 HydrophobicContact CZ-SD 3.67Å; L1168-M1172 HydrophobicContact CD2-SD 3.79Å; L1168-M1172 WeakPolarHBondContact O-CG 3.48Å; L1168-M1172 PolarHBondContact O-N 2.97Å; L1169-M1172 WeakPolarHBondContact O-CB 3.14Å; L1169-M1172 PolarHBondContact O-N 3.45Å; L1169-M1172 VanDerWaalsContact O-N 3.08Å; E1170-M1172 VanDerWaalsContact C-N 3.34Å; E1170-M1172 PolarHBondContact O-N 3.27Å; M1172-A1174 VanDerWaalsContact C-N 3.32Å; M1172-I1176 VanDerWaalsContact O-CG1 3.28Å; M1172-I1176 WeakPolarHBondContact O-CG1 3.2Å; M1172-I1176 PolarHBondContact O-N 2.74Å
1173	F	89.3	Confident	85.7	Confident	37 Å²	37	28.1 Å²	28.1	16%	0.162	14%	0.14	C	C	.	.	H	α-helix	trans	-67.2	-31.4	173.2	-82.4	-81.2	0	0	0	112.5	L1169 E1170 I1176 G1177 L1238 F1275 Y1279 V1282	L1169-F1173 WeakPolarHBondContact O-CD2 3.08Å; L1169-F1173 PolarHBondContact O-N 2.9Å; E1170-F1173 CarbonylContact O-C 3.25Å; E1170-F1173 PolarHBondContact O-N 3.49Å; F1173-I1176 PolarHBondContact O-N 2.65Å; F1173-G1177 PolarHBondContact O-N 3.31Å; F1173-L1238 HydrophobicContact CB-CD1 3.78Å; F1173-F1275 HydrophobicContact CD1-CD2 4.46Å; F1173-F1275 AromaticContact CD1-CE2 3.92Å; F1173-F1275 HydrophobicContact CD1-CE2 3.92Å; F1173-Y1279 HydrophobicContact CB-CD2 3.69Å; F1173-Y1279 HydrophobicContact CB-CE2 3.83Å; F1173-Y1279 AromaticContact CD1-CD2 3.81Å; F1173-Y1279 HydrophobicContact CD1-CD2 3.81Å; F1173-Y1279 AromaticContact CD2-CD2 3.66Å; F1173-Y1279 HydrophobicContact CD2-CD2 3.66Å; F1173-Y1279 HydrophobicContact CD2-CE2 4.07Å; F1173-Y1279 HydrophobicContact CE1-CD2 4.29Å; F1173-Y1279 HydrophobicContact CE2-CD2 4.16Å; F1173-Y1279 AromaticContact CG-CD2 3.47Å; F1173-Y1279 HydrophobicContact CG-CD2 3.47Å; F1173-Y1279 VanDerWaalsContact CG-CD2 3.47Å; F1173-Y1279 HydrophobicContact CG-CE2 4.02Å; F1173-Y1279 HydrophobicContact CZ-CD2 4.45Å; F1173-V1282 HydrophobicContact CE2-CB 4.33Å; F1173-V1282 HydrophobicContact CE2-CG1 4.1Å; F1173-V1282 HydrophobicContact CZ-CB 4.44Å
1174	A	91.3	Very high	86.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.9	-46.6	176.7	0	0	0	0	0	111.8	E1170 F1171 M1172 I1176 G1177 V1178 V1231 A1234 M1235 L1238	E1170-A1174 WeakPolarHBondContact O-CB 3.48Å; E1170-A1174 PolarHBondContact O-N 2.92Å; F1171-A1174 PolarHBondContact O-N 2.93Å; M1172-A1174 VanDerWaalsContact C-N 3.32Å; A1174-I1176 VanDerWaalsContact C-N 3.32Å; A1174-I1176 PolarHBondContact O-N 2.86Å; A1174-G1177 WeakPolarHBondContact O-CA 3.31Å; A1174-G1177 PolarHBondContact O-N 3.43Å; A1174-G1177 VanDerWaalsContact O-N 3.11Å; A1174-V1178 WeakPolarHBondContact O-CG2 3.19Å; A1174-V1178 PolarHBondContact O-N 3.01Å; A1174-V1231 HydrophobicContact CB-CG1 4.26Å; A1174-A1234 HydrophobicContact CB-CB 3.96Å; A1174-M1235 HydrophobicContact CB-CB 4.46Å; A1174-M1235 HydrophobicContact CB-CG 3.51Å; A1174-L1238 VanDerWaalsContact CA-CD1 3.47Å; A1174-L1238 HydrophobicContact CB-CD1 4.02Å; A1174-L1238 VanDerWaalsContact N-CD1 3.32Å
1175	V	87.5	Confident	87	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-66.1	-35.3	175.9	-174.5	0	0	0	0	111.5	T627 L709 F1171 G1177 V1178 Q1179 V1231	T627-V1175 HydrophobicContact CG2-CG2 4.03Å; L709-V1175 HydrophobicContact CD1-CB 3.86Å; L709-V1175 HydrophobicContact CD1-CG1 3.95Å; L709-V1175 HydrophobicContact CD2-CB 4.06Å; L709-V1175 HydrophobicContact CD2-CG1 3.87Å; L709-V1175 HydrophobicContact CD2-CG2 4.44Å; L709-V1175 HydrophobicContact CG-CG1 4.47Å; F1171-V1175 HydrophobicContact CE2-CG2 4.41Å; F1171-V1175 HydrophobicContact CZ-CG2 4.37Å; F1171-V1175 PolarHBondContact O-N 3.17Å; F1171-V1175 VanDerWaalsContact O-N 3.11Å; V1175-G1177 VanDerWaalsContact C-N 3.34Å; V1175-V1178 PolarHBondContact O-N 3.27Å; V1175-Q1179 WeakPolarHBondContact O-CB 3.28Å; V1175-Q1179 WeakPolarHBondContact O-CG 3.33Å; V1175-Q1179 PolarHBondContact O-N 2.72Å; V1175-V1231 HydrophobicContact CG2-CG1 3.94Å; V1175-V1231 HydrophobicContact CG2-CG2 3.99Å
1176	I	87	Confident	87.6	Confident	40 Å²	40	21.9 Å²	21.9	21%	0.205	11%	0.107	C	C	.	.	H	α-helix	trans	-62.3	-42.6	170.6	-65.1	167.5	0	0	0	110.7	C706 L709 M1172 F1173 A1174 Q1179 L1180 F1275	C706-I1176 HydrophobicContact CB-CG1 4.06Å; L709-I1176 HydrophobicContact CD1-CD1 4.46Å; L709-I1176 HydrophobicContact CD1-CG1 3.71Å; M1172-I1176 VanDerWaalsContact O-CG1 3.28Å; M1172-I1176 WeakPolarHBondContact O-CG1 3.2Å; M1172-I1176 PolarHBondContact O-N 2.74Å; F1173-I1176 PolarHBondContact O-N 2.65Å; A1174-I1176 VanDerWaalsContact C-N 3.32Å; A1174-I1176 PolarHBondContact O-N 2.86Å; I1176-Q1179 PolarHBondContact O-N 2.93Å; I1176-L1180 HydrophobicContact CG2-CD1 3.89Å; I1176-L1180 HydrophobicContact CG2-CG 4.42Å; I1176-L1180 VanDerWaalsContact O-CG 3.31Å; I1176-L1180 WeakPolarHBondContact O-CG 3.34Å; I1176-L1180 PolarHBondContact O-N 2.99Å; I1176-F1275 HydrophobicContact CB-CE2 4.24Å; I1176-F1275 HydrophobicContact CG2-CD2 4.14Å; I1176-F1275 HydrophobicContact CG2-CE2 3.73Å
1177	G	89.5	Confident	87.9	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.3	-44.3	177.1	0	0	0	0	0	112.6	F1173 A1174 V1175 L1180 F1181	F1173-G1177 PolarHBondContact O-N 3.31Å; A1174-G1177 WeakPolarHBondContact O-CA 3.31Å; A1174-G1177 PolarHBondContact O-N 3.43Å; A1174-G1177 VanDerWaalsContact O-N 3.11Å; V1175-G1177 VanDerWaalsContact C-N 3.34Å; G1177-L1180 PolarHBondContact O-N 3.22Å; G1177-F1181 WeakPolarHBondContact O-CB 3.49Å; G1177-F1181 WeakPolarHBondContact O-CD2 3.41Å; G1177-F1181 PolarHBondContact O-N 3.12Å
1178	V	90.3	Very high	88.3	Confident	5 Å²	5	17.2 Å²	17.2	3%	0.03	9%	0.086	C	C	.	.	H	α-helix	trans	-58.5	-50.3	172.3	177.5	0	0	0	0	110.5	A1174 V1175 L1180 F1181 A1182 F1228 V1231 A1234	A1174-V1178 WeakPolarHBondContact O-CG2 3.19Å; A1174-V1178 PolarHBondContact O-N 3.01Å; V1175-V1178 PolarHBondContact O-N 3.27Å; V1178-L1180 PolarHBondContact O-N 3.03Å; V1178-L1180 VanDerWaalsContact O-N 3.11Å; V1178-F1181 PolarHBondContact O-N 3.46Å; V1178-A1182 HydrophobicContact CG1-CB 4.07Å; V1178-A1182 WeakPolarHBondContact O-CB 3.47Å; V1178-A1182 PolarHBondContact O-N 3.48Å; V1178-F1228 WeakPolarHBondContact CA-O 3.22Å; V1178-F1228 WeakPolarHBondContact CG2-O 3.23Å; V1178-V1231 HydrophobicContact CG2-CG2 4.06Å; V1178-A1234 HydrophobicContact CG2-CB 3.73Å
1179	Q	85.3	Confident	88.7	Confident	19 Å²	19	15.6 Å²	15.6	9%	0.089	8%	0.078	C	C	.	.	H	α-helix	trans	-63.2	-17	179.7	-73.4	178.2	-5.5	0	0	114.3	E629 C706 V1175 I1176	E629-Q1179 VanDerWaalsContact OE2-CG 3.25Å; E629-Q1179 WeakPolarHBondContact OE2-CG 3.41Å; E629-Q1179 PolarHBondContact OE2-NE2 2.83Å; C706-Q1179 PolarHBondContact SG-OE1 3.26Å; V1175-Q1179 WeakPolarHBondContact O-CB 3.28Å; V1175-Q1179 WeakPolarHBondContact O-CG 3.33Å; V1175-Q1179 PolarHBondContact O-N 2.72Å; I1176-Q1179 PolarHBondContact O-N 2.93Å
1180	L	85.5	Confident	88.9	Confident	53 Å²	53	14.7 Å²	14.7	28%	0.277	7%	0.073	S	C	.	.	H	α-helix	trans	-96.9	-46	174.3	-68.7	174	0	0	0	112.8	I1176 G1177 V1178 K1184 F1275	I1176-L1180 HydrophobicContact CG2-CD1 3.89Å; I1176-L1180 HydrophobicContact CG2-CG 4.42Å; I1176-L1180 VanDerWaalsContact O-CG 3.31Å; I1176-L1180 WeakPolarHBondContact O-CG 3.34Å; I1176-L1180 PolarHBondContact O-N 2.99Å; G1177-L1180 PolarHBondContact O-N 3.22Å; V1178-L1180 PolarHBondContact O-N 3.03Å; V1178-L1180 VanDerWaalsContact O-N 3.11Å; L1180-K1184 VanDerWaalsContact O-CD 3.24Å; L1180-K1184 WeakPolarHBondContact O-CD 3.5Å; L1180-K1184 PolarHBondContact O-NZ 3.11Å; L1180-F1275 HydrophobicContact CD1-CD2 4.06Å; L1180-F1275 HydrophobicContact CD1-CE2 4.42Å; L1180-F1275 HydrophobicContact CD1-CG 4.47Å
1181	F	90.4	Very high	88.7	Confident	5 Å²	5	16.4 Å²	16.4	2%	0.022	9%	0.086	C	C	.	.	H	α-helix	trans	-119	-6.8	-159.9	-54.6	-59.6	0	0	0	116.2	G1177 V1178 G1183 K1184 F1185 F1228 V1272 F1275	G1177-F1181 WeakPolarHBondContact O-CB 3.49Å; G1177-F1181 WeakPolarHBondContact O-CD2 3.41Å; G1177-F1181 PolarHBondContact O-N 3.12Å; V1178-F1181 PolarHBondContact O-N 3.46Å; F1181-G1183 PolarHBondContact O-N 3.23Å; F1181-K1184 WeakPolarHBondContact O-CB 3.25Å; F1181-K1184 PolarHBondContact O-N 2.96Å; F1181-F1185 HydrophobicContact CB-CD1 4.36Å; F1181-F1185 HydrophobicContact CB-CE1 3.77Å; F1181-F1185 HydrophobicContact CB-CZ 4.15Å; F1181-F1185 HydrophobicContact CD1-CE1 4.04Å; F1181-F1185 AromaticContact CG-CE1 3.97Å; F1181-F1185 HydrophobicContact CG-CE1 3.97Å; F1181-F1185 HydrophobicContact CG-CZ 4.25Å; F1181-F1228 HydrophobicContact CB-CB 3.79Å; F1181-F1228 HydrophobicContact CB-CD2 4Å; F1181-F1228 HydrophobicContact CB-CG 4.04Å; F1181-F1228 HydrophobicContact CD2-CD2 4.12Å; F1181-F1228 HydrophobicContact CD2-CE2 4.3Å; F1181-F1228 HydrophobicContact CD2-CG 4.23Å; F1181-F1228 HydrophobicContact CG-CD2 4.41Å; F1181-V1272 HydrophobicContact CE1-CG1 3.79Å; F1181-V1272 HydrophobicContact CE1-CG2 3.84Å; F1181-V1272 HydrophobicContact CZ-CB 4.46Å; F1181-V1272 HydrophobicContact CZ-CG1 3.56Å; F1181-V1272 HydrophobicContact CZ-CG2 4.11Å; F1181-F1275 AromaticContact CE2-CD1 3.91Å; F1181-F1275 HydrophobicContact CE2-CD1 3.91Å; F1181-F1275 AromaticContact CE2-CE1 3.98Å; F1181-F1275 HydrophobicContact CE2-CE1 3.98Å; F1181-F1275 HydrophobicContact CE2-CG 4.4Å; F1181-F1275 HydrophobicContact CZ-CD1 4.49Å
1182	A	89.2	Confident	88.6	Confident	12 Å²	12	17 Å²	17	10%	0.099	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	133.8	175.8	0	0	0	0	0	111.4	V1178 K1184 E1260	V1178-A1182 HydrophobicContact CG1-CB 4.07Å; V1178-A1182 WeakPolarHBondContact O-CB 3.47Å; V1178-A1182 PolarHBondContact O-N 3.48Å; A1182-K1184 PolarHBondContact O-N 2.97Å; A1182-K1184 PolarHBondContact O-NZ 3.19Å; A1182-E1260 VanDerWaalsContact O-CG 3.29Å; A1182-E1260 WeakPolarHBondContact O-CG 3.41Å
1183	G	88.5	Confident	88.9	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	-11.6	-178	0	0	0	0	0	116	F1181 H1186 D1229	F1181-G1183 PolarHBondContact O-N 3.23Å; G1183-H1186 PolarHBondContact O-ND1 3.28Å; G1183-D1229 PolarHBondContact N-OD1 3.04Å
1184	K	90.7	Very high	88.8	Confident	25 Å²	25	22 Å²	22	11%	0.109	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	2.7	-165.9	-63.7	147.9	-174.7	130.2	0	115.2	L1180 F1181 A1182 A1259 E1260	L1180-K1184 VanDerWaalsContact O-CD 3.24Å; L1180-K1184 WeakPolarHBondContact O-CD 3.5Å; L1180-K1184 PolarHBondContact O-NZ 3.11Å; F1181-K1184 WeakPolarHBondContact O-CB 3.25Å; F1181-K1184 PolarHBondContact O-N 2.96Å; A1182-K1184 PolarHBondContact O-N 2.97Å; A1182-K1184 PolarHBondContact O-NZ 3.19Å; K1184-A1259 VanDerWaalsContact CG-C 3.49Å; K1184-E1260 WeakPolarHBondContact CE-OE1 3.4Å; K1184-E1260 HydrophobicContact CG-CG 4.33Å; K1184-E1260 IonicContact NZ-OE1 3.15Å; K1184-E1260 PolarHBondContact NZ-OE1 2.95Å
1185	F	92.2	Very high	88.8	Confident	10 Å²	10	23.7 Å²	23.7	4%	0.044	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	14.2	176.7	-78.2	18.3	0	0	0	112.4	F1181 N1224 F1228 L1250 S1254	F1181-F1185 HydrophobicContact CB-CD1 4.36Å; F1181-F1185 HydrophobicContact CB-CE1 3.77Å; F1181-F1185 HydrophobicContact CB-CZ 4.15Å; F1181-F1185 HydrophobicContact CD1-CE1 4.04Å; F1181-F1185 AromaticContact CG-CE1 3.97Å; F1181-F1185 HydrophobicContact CG-CE1 3.97Å; F1181-F1185 HydrophobicContact CG-CZ 4.25Å; F1185-N1224 HydrophobicContact CB-CB 4.28Å; F1185-N1224 HydrophobicContact CD2-CB 4.36Å; F1185-N1224 PolarHBondContact O-N 3.38Å; F1185-F1228 HydrophobicContact CD2-CD2 4.28Å; F1185-F1228 HydrophobicContact CE1-CD2 4.45Å; F1185-F1228 AromaticContact CE2-CD2 3.43Å; F1185-F1228 HydrophobicContact CE2-CD2 3.43Å; F1185-F1228 VanDerWaalsContact CE2-CD2 3.43Å; F1185-F1228 AromaticContact CE2-CE2 3.69Å; F1185-F1228 HydrophobicContact CE2-CE2 3.69Å; F1185-F1228 AromaticContact CZ-CD2 3.52Å; F1185-F1228 HydrophobicContact CZ-CD2 3.52Å; F1185-F1228 AromaticContact CZ-CE2 3.71Å; F1185-F1228 HydrophobicContact CZ-CE2 3.71Å; F1185-L1250 HydrophobicContact CD2-CD1 4.43Å; F1185-L1250 HydrophobicContact CE2-CD1 3.76Å; F1185-L1250 HydrophobicContact CE2-CG 4.31Å; F1185-S1254 WeakPolarHBondContact CZ-OG 3.43Å
1186	H	90.5	Very high	88.9	Confident	17 Å²	17	25.4 Å²	25.4	8%	0.079	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	153.8	173	-65.6	94.2	0	0	0	112	Y631 G1183 W1221 L1222	Y631-H1186 AromaticContact CE1-CE1 3.42Å; Y631-H1186 VanDerWaalsContact CE1-CE1 3.42Å; Y631-H1186 WeakPolarHBondContact CE1-CE1 3.45Å; Y631-H1186 AromaticContact CE1-NE2 3.93Å; Y631-H1186 AromaticContact CZ-CE1 3.66Å; G1183-H1186 PolarHBondContact O-ND1 3.28Å; H1186-W1221 HydrophobicContact CB-CH2 4.47Å; H1186-W1221 HydrophobicContact CB-CZ2 3.5Å; H1186-W1221 VanDerWaalsContact CB-CZ2 3.5Å; H1186-W1221 AromaticContact CD2-CD1 3.96Å; H1186-W1221 AromaticContact CD2-NE1 3.48Å; H1186-W1221 PolarHBondContact CD2-NE1 3.42Å; H1186-W1221 AromaticContact CG-NE1 3.6Å; H1186-L1222 CarbonylContact C-O 3.56Å; H1186-L1222 WeakPolarHBondContact CA-O 3.42Å; H1186-L1222 WeakPolarHBondContact CB-O 3.46Å; H1186-L1222 PolarHBondContact CD2-O 3.05Å
1187	S	89.6	Confident	89.1	Confident	7 Å²	7	27.8 Å²	27.8	5%	0.049	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	166.6	172.6	47.9	0	0	0	0	111.3	L1222 S2446	S1187-L1222 PolarHBondContact N-O 2.74Å; S1187-L1222 VanDerWaalsContact N-O 3.08Å; S1187-L1222 PolarHBondContact O-N 3.43Å; S1187-S2446 VanDerWaalsContact CB-CB 3.43Å; S1187-S2446 WeakPolarHBondContact OG-CB 3.37Å; S1187-S2446 PolarHBondContact OG-OG 3.22Å
1188	C	91.8	Very high	89.1	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.014	18%	0.18	C	C	.	.			trans	-90.1	-175.3	171.9	-166.8	0	0	0	0	110.1	D1190 R1193 C1199 W1221 S2446	C1188-D1190 WeakPolarHBondContact CB-O 3.28Å; C1188-D1190 PolarHBondContact SG-N 2.77Å; C1188-R1193 HydrophobicContact CB-CB 4.33Å; C1188-R1193 WeakPolarHBondContact CB-O 3.23Å; C1188-C1199 WeakPolarHBondContact CA-SG 3.43Å; C1188-C1199 HydrophobicContact CB-CB 3.89Å; C1188-C1199 WeakPolarHBondContact CB-SG 3.48Å; C1188-C1199 WeakPolarHBondContact SG-CA 3.31Å; C1188-C1199 WeakPolarHBondContact SG-CB 3.37Å; C1188-C1199 CovalentContact SG-SG 2.03Å; C1188-C1199 PolarHBondContact SG-SG 2.74Å; C1188-W1221 HydrophobicContact CB-CE3 4.04Å; C1188-W1221 HydrophobicContact CB-CZ3 4.17Å; C1188-S2446 WeakPolarHBondContact O-CA 3.34Å; C1188-S2446 WeakPolarHBondContact O-CB 3.18Å
1189	T	89.2	Confident	89.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-99.6	1.5	157.3	64.6	0	0	0	0	112.7	Y1203 A1218 R1219 V1220 L1222 P2445 D2448	T1189-Y1203 VanDerWaalsContact CB-CE1 3.49Å; T1189-Y1203 VanDerWaalsContact O-CE1 3.28Å; T1189-Y1203 WeakPolarHBondContact O-CE1 3.26Å; T1189-Y1203 WeakPolarHBondContact O-CE2 3.27Å; T1189-Y1203 PolarHBondContact O-OH 3.29Å; T1189-Y1203 WeakPolarHBondContact OG1-CE1 3.36Å; T1189-A1218 PolarHBondContact OG1-O 3.16Å; T1189-R1219 VanDerWaalsContact OG1-CA 3.25Å; T1189-R1219 WeakPolarHBondContact OG1-CA 3.27Å; T1189-V1220 PolarHBondContact N-O 2.89Å; T1189-V1220 PolarHBondContact OG1-N 3.09Å; T1189-L1222 HydrophobicContact CG2-CD1 3.85Å; T1189-P2445 WeakPolarHBondContact CA-O 3.36Å; T1189-P2445 HydrophobicContact CG2-CB 3.94Å; T1189-P2445 HydrophobicContact CG2-CG 3.83Å; T1189-P2445 VanDerWaalsContact CG2-O 3.25Å; T1189-P2445 WeakPolarHBondContact CG2-O 3.26Å; T1189-D2448 VanDerWaalsContact CA-OD1 3.31Å; T1189-D2448 WeakPolarHBondContact CA-OD1 3.44Å; T1189-D2448 PolarHBondContact N-OD1 3.48Å
1190	D	88.5	Confident	89.3	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.011	20%	0.203	C	C	.	.	S	Bend	trans	-126.6	117.3	166.7	176.9	-16.6	0	0	0	112.5	C1188 S1192 R1193 Y1203 R1219 D2448 P2449	C1188-D1190 WeakPolarHBondContact CB-O 3.28Å; C1188-D1190 PolarHBondContact SG-N 2.77Å; D1190-S1192 VanDerWaalsContact C-N 3.28Å; D1190-S1192 PolarHBondContact O-N 3.24Å; D1190-S1192 WeakPolarHBondContact OD1-CB 3.46Å; D1190-S1192 PolarHBondContact OD1-N 2.83Å; D1190-S1192 PolarHBondContact OD1-OG 3.29Å; D1190-S1192 PolarHBondContact OD2-OG 3.17Å; D1190-R1193 HydrophobicContact CB-CG 3.93Å; D1190-R1193 WeakPolarHBondContact O-CA 3.3Å; D1190-R1193 WeakPolarHBondContact O-CB 3.26Å; D1190-R1193 PolarHBondContact O-N 2.85Å; D1190-R1193 IonicContact OD2-NE 3.55Å; D1190-Y1203 HydrophobicContact CB-CD2 4.49Å; D1190-Y1203 HydrophobicContact CB-CG 4.09Å; D1190-R1219 HydrophobicContact CB-CG 4Å; D1190-R1219 IonicContact OD2-CZ 2.77Å; D1190-R1219 IonicContact OD2-NE 3.48Å; D1190-R1219 PolarHBondContact OD2-NE 3.14Å; D1190-R1219 IonicContact OD2-NH2 2.7Å; D1190-R1219 PolarHBondContact OD2-NH2 3.31Å; D1190-D2448 WeakPolarHBondContact CA-OD1 3.11Å; D1190-D2448 PolarHBondContact N-OD1 2.85Å; D1190-P2449 HydrophobicContact CB-CG 4.34Å; D1190-P2449 WeakPolarHBondContact OD1-CD 3.49Å
1191	S	83.4	Confident	89.4	Confident	48 Å²	48	37.1 Å²	37.1	34%	0.336	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-17.8	-169.8	68.5	0	0	0	0	113.9	R1193 D2448 P2449	S1191-R1193 PolarHBondContact O-N 2.79Å; S1191-R1193 VanDerWaalsContact O-N 3.13Å; S1191-D2448 WeakPolarHBondContact CA-OD2 3.3Å; S1191-D2448 VanDerWaalsContact CB-C 3.41Å; S1191-D2448 WeakPolarHBondContact CB-O 3.44Å; S1191-D2448 WeakPolarHBondContact CB-OD2 3.21Å; S1191-D2448 VanDerWaalsContact N-C 3.32Å; S1191-D2448 PolarHBondContact N-OD1 2.79Å; S1191-D2448 PolarHBondContact N-OD2 3.02Å; S1191-D2448 PolarHBondContact OG-O 3.21Å; S1191-P2449 VanDerWaalsContact N-CD 3.28Å
1192	S	86.6	Confident	89.4	Confident	61 Å²	61	43.4 Å²	43.4	43%	0.427	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.2	167.1	74.6	0	0	0	0	111.8	D1190	D1190-S1192 VanDerWaalsContact C-N 3.28Å; D1190-S1192 PolarHBondContact O-N 3.24Å; D1190-S1192 WeakPolarHBondContact OD1-CB 3.46Å; D1190-S1192 PolarHBondContact OD1-N 2.83Å; D1190-S1192 PolarHBondContact OD1-OG 3.29Å; D1190-S1192 PolarHBondContact OD2-OG 3.17Å
1193	R	89.9	Confident	89.5	Confident	90 Å²	90	43.2 Å²	43.2	34%	0.34	24%	0.242	S	C	.	.			trans	-115.3	67.6	-174.9	-46.3	-60.2	154.8	-173	-0.2	112.1	C1188 D1190 S1191 V1195 Q1198	C1188-R1193 HydrophobicContact CB-CB 4.33Å; C1188-R1193 WeakPolarHBondContact CB-O 3.23Å; D1190-R1193 HydrophobicContact CB-CG 3.93Å; D1190-R1193 WeakPolarHBondContact O-CA 3.3Å; D1190-R1193 WeakPolarHBondContact O-CB 3.26Å; D1190-R1193 PolarHBondContact O-N 2.85Å; D1190-R1193 IonicContact OD2-NE 3.55Å; S1191-R1193 PolarHBondContact O-N 2.79Å; S1191-R1193 VanDerWaalsContact O-N 3.13Å; R1193-V1195 PolarHBondContact O-N 3.49Å; R1193-Q1198 HydrophobicContact CB-CB 4.07Å; R1193-Q1198 HydrophobicContact CG-CB 4.42Å
1194	L	88.5	Confident	89.4	Confident	64 Å²	64	46.5 Å²	46.5	34%	0.335	26%	0.259	S	S	.	.			trans	-62.7	5.1	175.4	-60.3	178	0	0	0	115.7	Y1262 G1263 V1265	L1194-Y1262 CarbonylContact O-C 3.59Å; L1194-Y1262 VanDerWaalsContact O-CA 3.23Å; L1194-Y1262 WeakPolarHBondContact O-CA 3.29Å; L1194-G1263 PolarHBondContact O-N 2.72Å; L1194-V1265 HydrophobicContact CD1-CG2 4.03Å; L1194-V1265 HydrophobicContact CD2-CG2 4.05Å
1195	V	90.7	Very high	89	Confident	36 Å²	36	46.9 Å²	46.9	22%	0.218	26%	0.263	C	S	.	.	S	Bend	trans	-139	135.3	-172.1	-178.9	0	0	0	0	109.8	R1193 S1197 Q1198 C1199 Y1262	R1193-V1195 PolarHBondContact O-N 3.49Å; V1195-S1197 VanDerWaalsContact C-N 3.29Å; V1195-S1197 PolarHBondContact O-N 2.92Å; V1195-Q1198 HydrophobicContact CB-CG 4.37Å; V1195-Q1198 PolarHBondContact O-N 2.81Å; V1195-C1199 PolarHBondContact O-N 3.39Å; V1195-Y1262 HydrophobicContact CG2-CD1 4.08Å; V1195-Y1262 HydrophobicContact CG2-CE1 3.89Å
1196	P	90	Very high	88.5	Confident	37 Å²	37	48.9 Å²	48.9	24%	0.24	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-57.5	-37.9	-173.6	18.5	-31.1	0	0	0	113.4	Q1198 C1199 W1221 D1261	P1196-Q1198 PolarHBondContact O-N 2.99Å; P1196-Q1198 VanDerWaalsContact O-N 3.17Å; P1196-C1199 WeakPolarHBondContact O-CB 3.33Å; P1196-C1199 PolarHBondContact O-N 3.25Å; P1196-W1221 HydrophobicContact CB-CB 4.47Å; P1196-W1221 HydrophobicContact CB-CD2 3.68Å; P1196-W1221 HydrophobicContact CB-CE3 4.16Å; P1196-W1221 HydrophobicContact CB-CG 3.83Å; P1196-W1221 HydrophobicContact CB-CZ2 4.26Å; P1196-W1221 HydrophobicContact CG-CZ2 4.22Å; P1196-D1261 WeakPolarHBondContact CD-O 3.28Å; P1196-D1261 HydrophobicContact CG-CB 4.35Å
1197	S	89.9	Confident	87.5	Confident	91 Å²	91	51.9 Å²	51.9	64%	0.636	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-67.3	-12.8	178.3	68.8	0	0	0	0	114.5	V1195	V1195-S1197 VanDerWaalsContact C-N 3.29Å; V1195-S1197 PolarHBondContact O-N 2.92Å
1198	Q	90.5	Very high	86.1	Confident	91 Å²	91	51.9 Å²	51.9	43%	0.425	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-99.7	-12.2	171.5	-57.1	-168.4	27.3	0	0	112.4	R1193 V1195 P1196 H1200	R1193-Q1198 HydrophobicContact CB-CB 4.07Å; R1193-Q1198 HydrophobicContact CG-CB 4.42Å; V1195-Q1198 HydrophobicContact CB-CG 4.37Å; V1195-Q1198 PolarHBondContact O-N 2.81Å; P1196-Q1198 PolarHBondContact O-N 2.99Å; P1196-Q1198 VanDerWaalsContact O-N 3.17Å; Q1198-H1200 PolarHBondContact O-N 3.19Å
1199	C	91	Very high	84.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.283	C	S	.	.			trans	-85.1	55.7	-175.1	-166.6	0	0	0	0	112.1	C1188 V1195 P1196 V1220 W1221	C1188-C1199 WeakPolarHBondContact CA-SG 3.43Å; C1188-C1199 HydrophobicContact CB-CB 3.89Å; C1188-C1199 WeakPolarHBondContact CB-SG 3.48Å; C1188-C1199 WeakPolarHBondContact SG-CA 3.31Å; C1188-C1199 WeakPolarHBondContact SG-CB 3.37Å; C1188-C1199 CovalentContact SG-SG 2.03Å; C1188-C1199 PolarHBondContact SG-SG 2.74Å; V1195-C1199 PolarHBondContact O-N 3.39Å; P1196-C1199 WeakPolarHBondContact O-CB 3.33Å; P1196-C1199 PolarHBondContact O-N 3.25Å; C1199-V1220 PolarHBondContact SG-O 3.23Å; C1199-W1221 HydrophobicContact CB-CB 4.3Å; C1199-W1221 HydrophobicContact CB-CE3 3.81Å
1200	H	87.8	Confident	84	Confident	128 Å²	128	54.6 Å²	54.6	59%	0.593	30%	0.298	S	S	*	.			trans	-135.3	161.6	-177.4	-63.3	-26.6	0	0	0	112.2	Q1198 R1219	Q1198-H1200 PolarHBondContact O-N 3.19Å; H1200-R1219 WeakPolarHBondContact O-CD 3.48Å; H1200-R1219 PolarHBondContact O-NH1 2.78Å
1201	G	89.2	Confident	83.7	Confident	53 Å²	53	58.7 Å²	58.7	55%	0.546	32%	0.319	S	S	.	.	S	Bend	trans	80	-145.3	-177.2	0	0	0	0	0	113	R1219	G1201-R1219 PolarHBondContact O-N 3.47Å
1202	Q	89.6	Confident	83.4	Confident	138 Å²	138	59.9 Å²	59.9	65%	0.645	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	145.5	-177.4	-71.3	169.5	-26.2	0	0	111.6	V1216 L1217 R1219	Q1202-V1216 HydrophobicContact CB-CG1 3.78Å; Q1202-V1216 HydrophobicContact CG-CG1 4.03Å; Q1202-L1217 CarbonylContact C-O 3.39Å; Q1202-L1217 VanDerWaalsContact CA-O 3.3Å; Q1202-L1217 WeakPolarHBondContact CA-O 3.48Å; Q1202-R1219 PolarHBondContact O-NH1 3.24Å; Q1202-R1219 PolarHBondContact O-NH2 3.07Å
1203	Y	90.6	Very high	82.7	Confident	8 Å²	8	60.1 Å²	60.1	3%	0.031	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	164.3	170.9	79.3	-80.6	0	0	0	110.1	T1189 D1190 V1216 L1217 R1219 P2449	T1189-Y1203 VanDerWaalsContact CB-CE1 3.49Å; T1189-Y1203 VanDerWaalsContact O-CE1 3.28Å; T1189-Y1203 WeakPolarHBondContact O-CE1 3.26Å; T1189-Y1203 WeakPolarHBondContact O-CE2 3.27Å; T1189-Y1203 PolarHBondContact O-OH 3.29Å; T1189-Y1203 WeakPolarHBondContact OG1-CE1 3.36Å; D1190-Y1203 HydrophobicContact CB-CD2 4.49Å; D1190-Y1203 HydrophobicContact CB-CG 4.09Å; Y1203-V1216 WeakPolarHBondContact O-CA 3.19Å; Y1203-L1217 HydrophobicContact CD1-CB 3.98Å; Y1203-L1217 VanDerWaalsContact CD1-O 3.3Å; Y1203-L1217 WeakPolarHBondContact CD1-O 3.45Å; Y1203-L1217 HydrophobicContact CE1-CB 3.34Å; Y1203-L1217 HydrophobicContact CE1-CD1 4.47Å; Y1203-L1217 HydrophobicContact CE2-CB 4.39Å; Y1203-L1217 PolarHBondContact N-O 2.96Å; Y1203-L1217 PolarHBondContact O-N 3.25Å; Y1203-L1217 WeakPolarHBondContact OH-CD1 3.39Å; Y1203-R1219 HydrophobicContact CD1-CG 4.03Å; Y1203-P2449 HydrophobicContact CD2-CB 3.75Å; Y1203-P2449 HydrophobicContact CD2-CG 3.75Å; Y1203-P2449 HydrophobicContact CE2-CB 3.97Å; Y1203-P2449 HydrophobicContact CE2-CG 4.39Å
1204	I	87.8	Confident	82.4	Confident	69 Å²	69	59.3 Å²	59.3	35%	0.354	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	108.6	176.7	-55.2	177	0	0	0	107	Y1206 P1214 V1215	I1204-Y1206 HydrophobicContact CB-CE1 4.4Å; I1204-Y1206 HydrophobicContact CG2-CD1 3.73Å; I1204-Y1206 HydrophobicContact CG2-CE1 3.43Å; I1204-Y1206 VanDerWaalsContact CG2-CE1 3.43Å; I1204-P1214 HydrophobicContact CG2-CB 3.49Å; I1204-P1214 VanDerWaalsContact CG2-CB 3.49Å; I1204-V1215 WeakPolarHBondContact CA-O 3.38Å
1205	T	82.2	Confident	82	Confident	32 Å²	32	58 Å²	58	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	166.2	157.7	-159.5	0	0	0	0	108.9	V1215 L1217	T1205-V1215 HydrophobicContact CG2-CB 3.85Å; T1205-V1215 HydrophobicContact CG2-CG1 4.35Å; T1205-V1215 PolarHBondContact N-O 2.92Å; T1205-V1215 PolarHBondContact O-N 3.42Å; T1205-L1217 HydrophobicContact CG2-CD1 3.53Å; T1205-L1217 HydrophobicContact CG2-CG 4.07Å
1206	Y	81.5	Confident	81.8	Confident	52 Å²	52	60.1 Å²	60.1	20%	0.204	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.6	179.2	-60.7	-47.7	0	0	0	107.2	I1204 R1213 P1214 H2450 P2452 A2453 K2560	I1204-Y1206 HydrophobicContact CB-CE1 4.4Å; I1204-Y1206 HydrophobicContact CG2-CD1 3.73Å; I1204-Y1206 HydrophobicContact CG2-CE1 3.43Å; I1204-Y1206 VanDerWaalsContact CG2-CE1 3.43Å; Y1206-R1213 WeakPolarHBondContact CA-O 3.44Å; Y1206-P1214 HydrophobicContact CD1-CB 4.12Å; Y1206-P1214 HydrophobicContact CE1-CB 4.17Å; Y1206-H2450 HydrophobicContact CE2-CB 4.02Å; Y1206-H2450 AromaticContact CE2-ND1 3.33Å; Y1206-H2450 VanDerWaalsContact CE2-ND1 3.33Å; Y1206-H2450 WeakPolarHBondContact CE2-ND1 3.28Å; Y1206-H2450 AromaticContact CZ-ND1 3.47Å; Y1206-H2450 PolarHBondContact OH-ND1 3.02Å; Y1206-H2450 VanDerWaalsContact OH-ND1 3.12Å; Y1206-P2452 VanDerWaalsContact CB-CB 3.42Å; Y1206-P2452 HydrophobicContact CD2-CB 3.63Å; Y1206-P2452 HydrophobicContact CG-CB 3.94Å; Y1206-A2453 WeakPolarHBondContact O-CA 3.37Å; Y1206-A2453 PolarHBondContact O-N 2.86Å; Y1206-K2560 HydrophobicContact CD1-CD 4.11Å; Y1206-K2560 HydrophobicContact CD2-CD 3.7Å; Y1206-K2560 VanDerWaalsContact CE1-CE 3.48Å; Y1206-K2560 HydrophobicContact CE2-CD 4.2Å; Y1206-K2560 HydrophobicContact CG-CD 3.6Å
1207	E	69.7	Low	81.5	Confident	81 Å²	81	61.6 Å²	61.6	38%	0.379	34%	0.338	S	S	.	.	S	Bend	trans	-125.4	126.2	-161.7	173.9	-155.9	-104.8	0	0	110	G1209 R1213 V1215	E1207-G1209 VanDerWaalsContact C-CA 3.41Å; E1207-G1209 WeakPolarHBondContact O-CA 3.29Å; E1207-G1209 PolarHBondContact O-N 2.92Å; E1207-R1213 PolarHBondContact N-O 3.2Å; E1207-R1213 WeakPolarHBondContact O-CB 3.3Å; E1207-R1213 VanDerWaalsContact O-CD 3.28Å; E1207-R1213 WeakPolarHBondContact O-CD 3.09Å; E1207-V1215 HydrophobicContact CB-CB 4.42Å; E1207-V1215 HydrophobicContact CB-CG2 3.48Å; E1207-V1215 VanDerWaalsContact CB-CG2 3.48Å; E1207-V1215 VanDerWaalsContact CD-CG2 3.45Å; E1207-V1215 HydrophobicContact CG-CG2 4.05Å; E1207-V1215 WeakPolarHBondContact OE1-CG2 3.5Å
1208	L	59.2	Low	81.5	Confident	7 Å²	7	59.9 Å²	59.9	4%	0.037	33%	0.33	C	S	.	.	S	Bend	trans	49	3	-145.7	-131.9	-176	0	0	0	114.1	D1210 R1213 A2453 F2561 Y2563	L1208-D1210 PolarHBondContact O-N 2.91Å; L1208-R1213 VanDerWaalsContact CD1-NH1 3.3Å; L1208-A2453 VanDerWaalsContact CA-CB 3.45Å; L1208-F2561 HydrophobicContact CD2-CD1 3.33Å; L1208-F2561 HydrophobicContact CD2-CE1 3.17Å; L1208-F2561 HydrophobicContact CD2-CG 4.21Å; L1208-F2561 HydrophobicContact CD2-CZ 3.92Å; L1208-F2561 HydrophobicContact CG-CE1 4.49Å; L1208-F2561 WeakPolarHBondContact O-CA 3.29Å; L1208-Y2563 HydrophobicContact CB-CE1 4.19Å; L1208-Y2563 HydrophobicContact CD1-CE2 4.2Å; L1208-Y2563 HydrophobicContact CD2-CD1 3.9Å; L1208-Y2563 HydrophobicContact CD2-CD2 3.73Å; L1208-Y2563 HydrophobicContact CD2-CE1 4.01Å; L1208-Y2563 HydrophobicContact CD2-CE2 3.82Å; L1208-Y2563 HydrophobicContact CD2-CG 3.74Å; L1208-Y2563 HydrophobicContact CG-CD1 3.97Å; L1208-Y2563 HydrophobicContact CG-CD2 4.19Å; L1208-Y2563 HydrophobicContact CG-CE1 3.57Å; L1208-Y2563 HydrophobicContact CG-CE2 3.8Å; L1208-Y2563 HydrophobicContact CG-CG 4.25Å; L1208-Y2563 VanDerWaalsContact CG-CZ 3.42Å
1209	G	66.3	Low	81.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.318	C	S	.	.				-44.5	99.1	-123.7	0	0	0	0	0	114.5	E1207 P2452 K2560 F2561	E1207-G1209 VanDerWaalsContact C-CA 3.41Å; E1207-G1209 WeakPolarHBondContact O-CA 3.29Å; E1207-G1209 PolarHBondContact O-N 2.92Å; G1209-P2452 CarbonylContact C-O 3.49Å; G1209-P2452 WeakPolarHBondContact CA-O 3.21Å; G1209-P2452 PolarHBondContact N-O 3.01Å; G1209-K2560 CarbonylContact O-C 3.48Å; G1209-K2560 VanDerWaalsContact O-CA 3.25Å; G1209-K2560 WeakPolarHBondContact O-CA 3.37Å; G1209-K2560 WeakPolarHBondContact O-CB 3.33Å; G1209-K2560 WeakPolarHBondContact O-CD 3.35Å; G1209-F2561 WeakPolarHBondContact O-CA 3.13Å; G1209-F2561 PolarHBondContact O-N 3.35Å
1210	D	71.7	Confident	81.3	Confident	59 Å²	59	59.4 Å²	59.4	32%	0.316	33%	0.328	S	S	.	.			trans	-67.7	156.9	143.5	176.2	42.4	0	0	0	109.4	L1208 S1212 R1213 K2560 F2561	L1208-D1210 PolarHBondContact O-N 2.91Å; D1210-S1212 WeakPolarHBondContact CB-OG 3.43Å; D1210-S1212 PolarHBondContact O-N 3.47Å; D1210-S1212 WeakPolarHBondContact OD2-CB 3.45Å; D1210-S1212 PolarHBondContact OD2-OG 3.36Å; D1210-R1213 PolarHBondContact O-N 3.29Å; D1210-K2560 VanDerWaalsContact CA-O 3.27Å; D1210-K2560 WeakPolarHBondContact CA-O 3.47Å; D1210-K2560 PolarHBondContact O-NZ 3.25Å; D1210-F2561 HydrophobicContact CB-CD2 4.39Å
1211	I	81.2	Confident	81.5	Confident	87 Å²	87	55.8 Å²	55.8	45%	0.446	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.6	-164.5	-153.1	168.8	0	0	0	110.2	R1213 K2560	I1211-R1213 VanDerWaalsContact C-N 3.34Å; I1211-R1213 PolarHBondContact O-N 3.37Å; I1211-K2560 VanDerWaalsContact CA-CB 3.48Å; I1211-K2560 VanDerWaalsContact CA-CE 3.48Å; I1211-K2560 HydrophobicContact CB-CB 3.8Å; I1211-K2560 HydrophobicContact CB-CG 4.03Å; I1211-K2560 HydrophobicContact CG1-CB 4.37Å; I1211-K2560 HydrophobicContact CG1-CD 4.5Å; I1211-K2560 HydrophobicContact CG1-CG 4.03Å; I1211-K2560 PolarHBondContact O-NZ 2.99Å
1212	S	78	Confident	81.4	Confident	73 Å²	73	53.9 Å²	53.9	51%	0.51	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-25.6	164.2	63.7	0	0	0	0	118.5	D1210 P1214	D1210-S1212 WeakPolarHBondContact CB-OG 3.43Å; D1210-S1212 PolarHBondContact O-N 3.47Å; D1210-S1212 WeakPolarHBondContact OD2-CB 3.45Å; D1210-S1212 PolarHBondContact OD2-OG 3.36Å; S1212-P1214 WeakPolarHBondContact O-CD 3.49Å
1213	R	71.8	Confident	81.4	Confident	67 Å²	67	50 Å²	50	25%	0.253	27%	0.27	S	S	.	.			trans	-109	86.7	-176.2	-59.8	-177.6	-153.7	-153.8	3.4	113	E345 Y1206 E1207 L1208 D1210 I1211 K2560	E345-R1213 IonicContact OE1-CZ 3.3Å; E345-R1213 IonicContact OE1-NH2 2.75Å; E345-R1213 PolarHBondContact OE1-NH2 3.27Å; E345-R1213 IonicContact OE2-CZ 3.91Å; E345-R1213 VanDerWaalsContact OE2-CZ 3.22Å; E345-R1213 IonicContact OE2-NH1 2.67Å; E345-R1213 PolarHBondContact OE2-NH1 3.43Å; E345-R1213 IonicContact OE2-NH2 3.03Å; E345-R1213 PolarHBondContact OE2-NH2 2.63Å; Y1206-R1213 WeakPolarHBondContact CA-O 3.44Å; E1207-R1213 PolarHBondContact N-O 3.2Å; E1207-R1213 WeakPolarHBondContact O-CB 3.3Å; E1207-R1213 VanDerWaalsContact O-CD 3.28Å; E1207-R1213 WeakPolarHBondContact O-CD 3.09Å; L1208-R1213 VanDerWaalsContact CD1-NH1 3.3Å; D1210-R1213 PolarHBondContact O-N 3.29Å; I1211-R1213 VanDerWaalsContact C-N 3.34Å; I1211-R1213 PolarHBondContact O-N 3.37Å; R1213-K2560 PolarHBondContact O-NZ 3.21Å
1214	P	84.2	Confident	81.3	Confident	72 Å²	72	50.6 Å²	50.6	47%	0.468	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.3	167.3	35.3	-30.7	0	0	0	112.2	I1204 Y1206 S1212	I1204-P1214 HydrophobicContact CG2-CB 3.49Å; I1204-P1214 VanDerWaalsContact CG2-CB 3.49Å; Y1206-P1214 HydrophobicContact CD1-CB 4.12Å; Y1206-P1214 HydrophobicContact CE1-CB 4.17Å; S1212-P1214 WeakPolarHBondContact O-CD 3.49Å
1215	V	79.4	Confident	81.2	Confident	37 Å²	37	51 Å²	51	22%	0.224	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.6	173.6	178.9	0	0	0	0	109.3	I1204 T1205 E1207 L1217	I1204-V1215 WeakPolarHBondContact CA-O 3.38Å; T1205-V1215 HydrophobicContact CG2-CB 3.85Å; T1205-V1215 HydrophobicContact CG2-CG1 4.35Å; T1205-V1215 PolarHBondContact N-O 2.92Å; T1205-V1215 PolarHBondContact O-N 3.42Å; E1207-V1215 HydrophobicContact CB-CB 4.42Å; E1207-V1215 HydrophobicContact CB-CG2 3.48Å; E1207-V1215 VanDerWaalsContact CB-CG2 3.48Å; E1207-V1215 VanDerWaalsContact CD-CG2 3.45Å; E1207-V1215 HydrophobicContact CG-CG2 4.05Å; E1207-V1215 WeakPolarHBondContact OE1-CG2 3.5Å; V1215-L1217 HydrophobicContact CG1-CD2 3.91Å; V1215-L1217 HydrophobicContact CG1-CG 4.04Å; V1215-L1217 PolarHBondContact O-N 2.95Å
1216	V	86.1	Confident	81.6	Confident	81 Å²	81	50.3 Å²	50.3	49%	0.491	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	110.4	-178.1	-175.4	0	0	0	0	109.3	Q1202 Y1203	Q1202-V1216 HydrophobicContact CB-CG1 3.78Å; Q1202-V1216 HydrophobicContact CG-CG1 4.03Å; Y1203-V1216 WeakPolarHBondContact O-CA 3.19Å
1217	L	84.8	Confident	82.1	Confident	67 Å²	67	48.5 Å²	48.5	35%	0.351	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	157.7	-179.2	-65.8	-178.1	0	0	0	111.2	Q1202 Y1203 T1205 V1215	Q1202-L1217 CarbonylContact C-O 3.39Å; Q1202-L1217 VanDerWaalsContact CA-O 3.3Å; Q1202-L1217 WeakPolarHBondContact CA-O 3.48Å; Y1203-L1217 HydrophobicContact CD1-CB 3.98Å; Y1203-L1217 VanDerWaalsContact CD1-O 3.3Å; Y1203-L1217 WeakPolarHBondContact CD1-O 3.45Å; Y1203-L1217 HydrophobicContact CE1-CB 3.34Å; Y1203-L1217 HydrophobicContact CE1-CD1 4.47Å; Y1203-L1217 HydrophobicContact CE2-CB 4.39Å; Y1203-L1217 PolarHBondContact N-O 2.96Å; Y1203-L1217 PolarHBondContact O-N 3.25Å; Y1203-L1217 WeakPolarHBondContact OH-CD1 3.39Å; T1205-L1217 HydrophobicContact CG2-CD1 3.53Å; T1205-L1217 HydrophobicContact CG2-CG 4.07Å; V1215-L1217 HydrophobicContact CG1-CD2 3.91Å; V1215-L1217 HydrophobicContact CG1-CG 4.04Å; V1215-L1217 PolarHBondContact O-N 2.95Å
1218	A	88.4	Confident	83.2	Confident	55 Å²	55	44.6 Å²	44.6	46%	0.455	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	139	-179.9	0	0	0	0	0	112	T1189	T1189-A1218 PolarHBondContact OG1-O 3.16Å
1219	R	89.5	Confident	84.8	Confident	46 Å²	46	44.6 Å²	44.6	17%	0.174	25%	0.251	C	S	.	.			trans	-76.5	121.5	167	-69.5	-162.6	-162.4	71.1	17.5	111.1	T1189 D1190 H1200 G1201 Q1202 Y1203	T1189-R1219 VanDerWaalsContact OG1-CA 3.25Å; T1189-R1219 WeakPolarHBondContact OG1-CA 3.27Å; D1190-R1219 HydrophobicContact CB-CG 4Å; D1190-R1219 IonicContact OD2-CZ 2.77Å; D1190-R1219 IonicContact OD2-NE 3.48Å; D1190-R1219 PolarHBondContact OD2-NE 3.14Å; D1190-R1219 IonicContact OD2-NH2 2.7Å; D1190-R1219 PolarHBondContact OD2-NH2 3.31Å; H1200-R1219 WeakPolarHBondContact O-CD 3.48Å; H1200-R1219 PolarHBondContact O-NH1 2.78Å; G1201-R1219 PolarHBondContact O-N 3.47Å; Q1202-R1219 PolarHBondContact O-NH1 3.24Å; Q1202-R1219 PolarHBondContact O-NH2 3.07Å; Y1203-R1219 HydrophobicContact CD1-CG 4.03Å
1220	V	87.8	Confident	86	Confident	35 Å²	35	47.7 Å²	47.7	21%	0.212	27%	0.268	C	S	.	.			trans	-138.6	142.2	173.4	-173.7	0	0	0	0	108.8	T1189 C1199 L1222 Q2443	T1189-V1220 PolarHBondContact N-O 2.89Å; T1189-V1220 PolarHBondContact OG1-N 3.09Å; C1199-V1220 PolarHBondContact SG-O 3.23Å; V1220-L1222 HydrophobicContact CB-CD2 4.2Å; V1220-L1222 HydrophobicContact CG1-CD2 3.89Å; V1220-Q2443 VanDerWaalsContact CB-OE1 3.27Å; V1220-Q2443 VanDerWaalsContact CG2-OE1 3.25Å
1221	W	91.6	Very high	86.9	Confident	52 Å²	52	45.5 Å²	45.5	20%	0.197	26%	0.256	C	S	.	.			trans	-90.2	131.6	176.4	-172.1	-102.8	0	0	0	110.3	H1186 C1188 P1196 C1199	H1186-W1221 HydrophobicContact CB-CH2 4.47Å; H1186-W1221 HydrophobicContact CB-CZ2 3.5Å; H1186-W1221 VanDerWaalsContact CB-CZ2 3.5Å; H1186-W1221 AromaticContact CD2-CD1 3.96Å; H1186-W1221 AromaticContact CD2-NE1 3.48Å; H1186-W1221 PolarHBondContact CD2-NE1 3.42Å; H1186-W1221 AromaticContact CG-NE1 3.6Å; C1188-W1221 HydrophobicContact CB-CE3 4.04Å; C1188-W1221 HydrophobicContact CB-CZ3 4.17Å; P1196-W1221 HydrophobicContact CB-CB 4.47Å; P1196-W1221 HydrophobicContact CB-CD2 3.68Å; P1196-W1221 HydrophobicContact CB-CE3 4.16Å; P1196-W1221 HydrophobicContact CB-CG 3.83Å; P1196-W1221 HydrophobicContact CB-CZ2 4.26Å; P1196-W1221 HydrophobicContact CG-CZ2 4.22Å; C1199-W1221 HydrophobicContact CB-CB 4.3Å; C1199-W1221 HydrophobicContact CB-CE3 3.81Å
1222	L	88.3	Confident	87.4	Confident	13 Å²	13	45.8 Å²	45.8	7%	0.068	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	159.2	-162.1	-53.3	173.9	0	0	0	110.7	H1186 S1187 T1189 V1220 Q2443 P2445	H1186-L1222 CarbonylContact C-O 3.56Å; H1186-L1222 WeakPolarHBondContact CA-O 3.42Å; H1186-L1222 WeakPolarHBondContact CB-O 3.46Å; H1186-L1222 PolarHBondContact CD2-O 3.05Å; S1187-L1222 PolarHBondContact N-O 2.74Å; S1187-L1222 VanDerWaalsContact N-O 3.08Å; S1187-L1222 PolarHBondContact O-N 3.43Å; T1189-L1222 HydrophobicContact CG2-CD1 3.85Å; V1220-L1222 HydrophobicContact CB-CD2 4.2Å; V1220-L1222 HydrophobicContact CG1-CD2 3.89Å; L1222-Q2443 HydrophobicContact CD1-CB 3.9Å; L1222-Q2443 WeakPolarHBondContact CD1-O 3.44Å; L1222-Q2443 HydrophobicContact CD2-CB 3.38Å; L1222-Q2443 HydrophobicContact CD2-CG 4.38Å; L1222-Q2443 HydrophobicContact CG-CB 4.28Å; L1222-P2445 WeakPolarHBondContact CD1-O 3.11Å
1223	N	89.8	Confident	88	Confident	57 Å²	57	45.3 Å²	45.3	31%	0.305	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.2	171.2	-169	-2	0	0	0	108.6	D1229	N1223-D1229 PolarHBondContact ND2-OD2 3.47Å
1224	N	89.1	Confident	89	Confident	21 Å²	21	42.1 Å²	42.1	11%	0.112	24%	0.244	C	C	.	.			trans	-64.2	134.4	173.7	-160.8	53.7	0	0	0	110.3	F1185 L1226 N1227 R1253	F1185-N1224 HydrophobicContact CB-CB 4.28Å; F1185-N1224 HydrophobicContact CD2-CB 4.36Å; F1185-N1224 PolarHBondContact O-N 3.38Å; N1224-L1226 PolarHBondContact ND2-O 2.77Å; N1224-L1226 PolarHBondContact O-N 2.65Å; N1224-N1227 WeakPolarHBondContact O-CB 3.42Å; N1224-N1227 PolarHBondContact O-ND2 2.99Å; N1224-R1253 PolarHBondContact OD1-NH1 3.02Å
1225	P	85.4	Confident	89.4	Confident	76 Å²	76	41.1 Å²	41.1	49%	0.494	23%	0.233	S	C	.	.	S	Bend	trans	-59.3	-28.4	176.7	20.1	-32.4	0	0	0	113.3	L1541	P1225-L1541 HydrophobicContact CB-CD1 3.85Å; P1225-L1541 HydrophobicContact CB-CD2 3.77Å; P1225-L1541 HydrophobicContact CB-CG 4.46Å; P1225-L1541 HydrophobicContact CG-CD1 3.87Å
1226	L	90.2	Very high	90	Very high	18 Å²	18	40.9 Å²	40.9	9%	0.094	23%	0.231	C	C	.	.	S	Bend	trans	-99.2	96.7	168.3	-61.2	179.4	0	0	0	109.5	N1224 L1236 T1237 A1240 L1250 Q1537	N1224-L1226 PolarHBondContact ND2-O 2.77Å; N1224-L1226 PolarHBondContact O-N 2.65Å; L1226-L1236 HydrophobicContact CD2-CD2 4.42Å; L1226-L1236 HydrophobicContact CD2-CG 4.32Å; L1226-T1237 WeakPolarHBondContact CA-OG1 3.24Å; L1226-T1237 HydrophobicContact CB-CG2 4.07Å; L1226-A1240 HydrophobicContact CD1-CB 4.39Å; L1226-L1250 HydrophobicContact CB-CD1 4.22Å; L1226-Q1537 HydrophobicContact CD1-CG 4.31Å
1227	N	91.8	Very high	90.3	Very high	14 Å²	14	37.1 Å²	37.1	8%	0.075	21%	0.208	C	C	.	.			trans	-125.7	162.4	-175.3	56.2	66.8	0	0	0	113.3	N1224 D1229 N1233 A1234 T1237	N1224-N1227 WeakPolarHBondContact O-CB 3.42Å; N1224-N1227 PolarHBondContact O-ND2 2.99Å; N1227-D1229 PolarHBondContact OD1-OD2 2.88Å; N1227-N1233 CarbonylContact O-C 3.56Å; N1227-N1233 WeakPolarHBondContact O-CB 3.34Å; N1227-N1233 WeakPolarHBondContact OD1-CB 3.07Å; N1227-N1233 PolarHBondContact OD1-ND2 2.73Å; N1227-A1234 PolarHBondContact O-N 2.99Å; N1227-T1237 PolarHBondContact N-OG1 3.28Å; N1227-T1237 PolarHBondContact O-OG1 3.14Å
1228	F	93.3	Very high	90.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.191	C	C	.	.			trans	-104.4	24.7	178.2	-71.6	-90.3	0	0	0	112.7	V1178 F1181 F1185 N1230 A1234 T1237 L1238 L1250 F1275 Y1276	V1178-F1228 WeakPolarHBondContact CA-O 3.22Å; V1178-F1228 WeakPolarHBondContact CG2-O 3.23Å; F1181-F1228 HydrophobicContact CB-CB 3.79Å; F1181-F1228 HydrophobicContact CB-CD2 4Å; F1181-F1228 HydrophobicContact CB-CG 4.04Å; F1181-F1228 HydrophobicContact CD2-CD2 4.12Å; F1181-F1228 HydrophobicContact CD2-CE2 4.3Å; F1181-F1228 HydrophobicContact CD2-CG 4.23Å; F1181-F1228 HydrophobicContact CG-CD2 4.41Å; F1185-F1228 HydrophobicContact CD2-CD2 4.28Å; F1185-F1228 HydrophobicContact CE1-CD2 4.45Å; F1185-F1228 AromaticContact CE2-CD2 3.43Å; F1185-F1228 HydrophobicContact CE2-CD2 3.43Å; F1185-F1228 VanDerWaalsContact CE2-CD2 3.43Å; F1185-F1228 AromaticContact CE2-CE2 3.69Å; F1185-F1228 HydrophobicContact CE2-CE2 3.69Å; F1185-F1228 AromaticContact CZ-CD2 3.52Å; F1185-F1228 HydrophobicContact CZ-CD2 3.52Å; F1185-F1228 AromaticContact CZ-CE2 3.71Å; F1185-F1228 HydrophobicContact CZ-CE2 3.71Å; F1228-N1230 VanDerWaalsContact C-N 3.29Å; F1228-N1230 PolarHBondContact O-N 3.12Å; F1228-A1234 HydrophobicContact CB-CB 4.47Å; F1228-A1234 HydrophobicContact CD1-CB 3.52Å; F1228-A1234 HydrophobicContact CE1-CB 4.15Å; F1228-A1234 HydrophobicContact CG-CB 4.32Å; F1228-T1237 HydrophobicContact CD2-CG2 4.3Å; F1228-T1237 HydrophobicContact CE2-CG2 3.6Å; F1228-T1237 HydrophobicContact CZ-CG2 3.73Å; F1228-L1238 HydrophobicContact CE1-CD1 4.21Å; F1228-L1238 HydrophobicContact CE1-CD2 4.06Å; F1228-L1238 HydrophobicContact CE1-CG 3.82Å; F1228-L1238 HydrophobicContact CZ-CD2 4.02Å; F1228-L1238 HydrophobicContact CZ-CG 4.17Å; F1228-L1250 HydrophobicContact CE2-CD2 4.37Å; F1228-F1275 HydrophobicContact CZ-CE1 4.4Å; F1228-Y1276 WeakPolarHBondContact CE2-OH 3.49Å
1229	D	92.5	Very high	90.8	Very high	7 Å²	7	32.1 Å²	32.1	4%	0.037	17%	0.173	C	C	.	.	S	Bend	trans	-74.4	-21.9	-174.1	-64.4	-36.4	0	0	0	113.8	H630 Y631 G1183 N1223 N1227	H630-D1229 WeakPolarHBondContact CA-O 3.26Å; H630-D1229 WeakPolarHBondContact CB-O 3.02Å; Y631-D1229 PolarHBondContact N-O 2.69Å; G1183-D1229 PolarHBondContact N-OD1 3.04Å; N1223-D1229 PolarHBondContact ND2-OD2 3.47Å; N1227-D1229 PolarHBondContact OD1-OD2 2.88Å
1230	N	91.2	Very high	90.9	Very high	65 Å²	65	30 Å²	30	35%	0.348	17%	0.166	S	C	.	.	S	Bend	trans	-143.3	146.8	-179	-66.6	-89.2	0	0	0	109.2	H630 F1228 N1233 A1234	H630-N1230 WeakPolarHBondContact CB-OD1 3.08Å; F1228-N1230 VanDerWaalsContact C-N 3.29Å; F1228-N1230 PolarHBondContact O-N 3.12Å; N1230-N1233 PolarHBondContact O-N 3.02Å; N1230-A1234 WeakPolarHBondContact O-CB 3.45Å; N1230-A1234 PolarHBondContact O-N 2.75Å
1231	V	91	Very high	91	Very high	12 Å²	12	28.4 Å²	28.4	7%	0.073	16%	0.156	C	C	.	.	H	α-helix	trans	-54.7	-40.6	-178.9	-174.9	0	0	0	0	113.6	T627 F1171 A1174 V1175 V1178 A1234 M1235	T627-V1231 HydrophobicContact CG2-CG2 4.44Å; F1171-V1231 HydrophobicContact CD2-CG1 4.24Å; F1171-V1231 HydrophobicContact CE2-CG1 4.23Å; A1174-V1231 HydrophobicContact CB-CG1 4.26Å; V1175-V1231 HydrophobicContact CG2-CG1 3.94Å; V1175-V1231 HydrophobicContact CG2-CG2 3.99Å; V1178-V1231 HydrophobicContact CG2-CG2 4.06Å; V1231-A1234 PolarHBondContact O-N 3Å; V1231-M1235 WeakPolarHBondContact O-CG 3.21Å; V1231-M1235 PolarHBondContact O-N 3.44Å
1232	P	90.4	Very high	90.9	Very high	93 Å²	93	26.3 Å²	26.3	60%	0.604	15%	0.149	S	C	*	.	H	α-helix	trans	-66.1	-35.9	175.8	-23.3	36.1	0	0	0	114.1	M1235 L1236	P1232-M1235 PolarHBondContact O-N 2.88Å; P1232-L1236 PolarHBondContact O-N 3.47Å
1233	N	91.1	Very high	90.9	Very high	64 Å²	64	25.9 Å²	25.9	34%	0.342	15%	0.147	S	C	.	.	H	α-helix	trans	-71.4	-38.9	175.8	-64.5	12.2	0	0	0	110.6	N1227 N1230 M1235 L1236 T1237	N1227-N1233 CarbonylContact O-C 3.56Å; N1227-N1233 WeakPolarHBondContact O-CB 3.34Å; N1227-N1233 WeakPolarHBondContact OD1-CB 3.07Å; N1227-N1233 PolarHBondContact OD1-ND2 2.73Å; N1230-N1233 PolarHBondContact O-N 3.02Å; N1233-M1235 VanDerWaalsContact C-N 3.33Å; N1233-L1236 PolarHBondContact O-N 3.44Å; N1233-T1237 VanDerWaalsContact O-CB 3.27Å; N1233-T1237 WeakPolarHBondContact O-CB 3.45Å; N1233-T1237 PolarHBondContact O-N 3.2Å; N1233-T1237 PolarHBondContact O-OG1 2.92Å
1234	A	93.3	Very high	90.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.4	-38.5	172.2	0	0	0	0	0	111.8	A1174 V1178 N1227 F1228 N1230 V1231 L1238	A1174-A1234 HydrophobicContact CB-CB 3.96Å; V1178-A1234 HydrophobicContact CG2-CB 3.73Å; N1227-A1234 PolarHBondContact O-N 2.99Å; F1228-A1234 HydrophobicContact CB-CB 4.47Å; F1228-A1234 HydrophobicContact CD1-CB 3.52Å; F1228-A1234 HydrophobicContact CE1-CB 4.15Å; F1228-A1234 HydrophobicContact CG-CB 4.32Å; N1230-A1234 WeakPolarHBondContact O-CB 3.45Å; N1230-A1234 PolarHBondContact O-N 2.75Å; V1231-A1234 PolarHBondContact O-N 3Å; A1234-L1238 VanDerWaalsContact O-CB 3.24Å; A1234-L1238 WeakPolarHBondContact O-CB 3.38Å; A1234-L1238 VanDerWaalsContact O-CG 3.29Å; A1234-L1238 WeakPolarHBondContact O-CG 3.34Å; A1234-L1238 PolarHBondContact O-N 2.82Å
1235	M	92	Very high	90.8	Very high	50 Å²	50	23 Å²	23	25%	0.246	13%	0.131	C	C	.	.	H	α-helix	trans	-65.9	-45.6	171.7	-74.6	-174.1	71.2	0	0	111.8	E1170 F1171 A1174 V1231 P1232 N1233 T1237 L1238 F1239	E1170-M1235 HydrophobicContact CG-CE 4.48Å; F1171-M1235 HydrophobicContact CB-CE 4.4Å; F1171-M1235 HydrophobicContact CB-SD 4.3Å; F1171-M1235 HydrophobicContact CD2-SD 4.14Å; A1174-M1235 HydrophobicContact CB-CB 4.46Å; A1174-M1235 HydrophobicContact CB-CG 3.51Å; V1231-M1235 WeakPolarHBondContact O-CG 3.21Å; V1231-M1235 PolarHBondContact O-N 3.44Å; P1232-M1235 PolarHBondContact O-N 2.88Å; N1233-M1235 VanDerWaalsContact C-N 3.33Å; M1235-T1237 VanDerWaalsContact C-N 3.3Å; M1235-T1237 PolarHBondContact O-N 3.3Å; M1235-L1238 CarbonylContact O-C 3.52Å; M1235-L1238 PolarHBondContact O-N 3.26Å; M1235-F1239 VanDerWaalsContact O-CB 3.28Å; M1235-F1239 WeakPolarHBondContact O-CB 3.18Å; M1235-F1239 PolarHBondContact O-N 2.99Å
1236	L	91.9	Very high	90.7	Very high	33 Å²	33	19.8 Å²	19.8	17%	0.173	11%	0.112	C	C	.	.	H	α-helix	trans	-58.7	-43	174.7	178.2	63.3	0	0	0	112.2	L1226 P1232 N1233 F1239 A1240 M1540 Y1758 I1762	L1226-L1236 HydrophobicContact CD2-CD2 4.42Å; L1226-L1236 HydrophobicContact CD2-CG 4.32Å; P1232-L1236 PolarHBondContact O-N 3.47Å; N1233-L1236 PolarHBondContact O-N 3.44Å; L1236-F1239 WeakPolarHBondContact O-CB 3.44Å; L1236-F1239 PolarHBondContact O-N 3.21Å; L1236-A1240 PolarHBondContact O-N 3.47Å; L1236-A1240 VanDerWaalsContact O-N 3.09Å; L1236-M1540 HydrophobicContact CD1-CE 4.3Å; L1236-Y1758 HydrophobicContact CD1-CD1 4.43Å; L1236-Y1758 HydrophobicContact CD2-CD1 3.67Å; L1236-Y1758 HydrophobicContact CD2-CE1 3.56Å; L1236-I1762 HydrophobicContact CD1-CD1 3.61Å
1237	T	93	Very high	90.8	Very high	1 Å²	1	19 Å²	19	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-66.6	-42.5	178.8	-60	0	0	0	0	111.4	L1226 N1227 F1228 N1233 M1235 A1240 V1241 L1250	L1226-T1237 WeakPolarHBondContact CA-OG1 3.24Å; L1226-T1237 HydrophobicContact CB-CG2 4.07Å; N1227-T1237 PolarHBondContact N-OG1 3.28Å; N1227-T1237 PolarHBondContact O-OG1 3.14Å; F1228-T1237 HydrophobicContact CD2-CG2 4.3Å; F1228-T1237 HydrophobicContact CE2-CG2 3.6Å; F1228-T1237 HydrophobicContact CZ-CG2 3.73Å; N1233-T1237 VanDerWaalsContact O-CB 3.27Å; N1233-T1237 WeakPolarHBondContact O-CB 3.45Å; N1233-T1237 PolarHBondContact O-N 3.2Å; N1233-T1237 PolarHBondContact O-OG1 2.92Å; M1235-T1237 VanDerWaalsContact C-N 3.3Å; M1235-T1237 PolarHBondContact O-N 3.3Å; T1237-A1240 PolarHBondContact O-N 3.43Å; T1237-V1241 WeakPolarHBondContact O-CG2 3.44Å; T1237-V1241 PolarHBondContact O-N 3.28Å; T1237-L1250 HydrophobicContact CG2-CD1 4.12Å; T1237-L1250 HydrophobicContact CG2-CD2 3.41Å; T1237-L1250 VanDerWaalsContact CG2-CD2 3.41Å; T1237-L1250 HydrophobicContact CG2-CG 4.39Å
1238	L	93.4	Very high	90.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-75.2	-24.9	175.4	-74.2	179.7	0	0	0	113.5	F1173 A1174 F1228 A1234 M1235 S1242 F1275 Y1279	F1173-L1238 HydrophobicContact CB-CD1 3.78Å; A1174-L1238 VanDerWaalsContact CA-CD1 3.47Å; A1174-L1238 HydrophobicContact CB-CD1 4.02Å; A1174-L1238 VanDerWaalsContact N-CD1 3.32Å; F1228-L1238 HydrophobicContact CE1-CD1 4.21Å; F1228-L1238 HydrophobicContact CE1-CD2 4.06Å; F1228-L1238 HydrophobicContact CE1-CG 3.82Å; F1228-L1238 HydrophobicContact CZ-CD2 4.02Å; F1228-L1238 HydrophobicContact CZ-CG 4.17Å; A1234-L1238 VanDerWaalsContact O-CB 3.24Å; A1234-L1238 WeakPolarHBondContact O-CB 3.38Å; A1234-L1238 VanDerWaalsContact O-CG 3.29Å; A1234-L1238 WeakPolarHBondContact O-CG 3.34Å; A1234-L1238 PolarHBondContact O-N 2.82Å; M1235-L1238 CarbonylContact O-C 3.52Å; M1235-L1238 PolarHBondContact O-N 3.26Å; L1238-S1242 VanDerWaalsContact O-CB 3.31Å; L1238-S1242 WeakPolarHBondContact O-CB 3.22Å; L1238-S1242 PolarHBondContact O-N 3.39Å; L1238-F1275 HydrophobicContact CD2-CE1 4.08Å; L1238-F1275 HydrophobicContact CD2-CZ 4.22Å; L1238-Y1279 HydrophobicContact CB-CE1 4.21Å; L1238-Y1279 HydrophobicContact CB-CE2 4.33Å; L1238-Y1279 HydrophobicContact CD1-CE2 4.29Å; L1238-Y1279 HydrophobicContact CD2-CD1 4.05Å; L1238-Y1279 HydrophobicContact CD2-CD2 4.37Å; L1238-Y1279 HydrophobicContact CD2-CE1 3.93Å; L1238-Y1279 HydrophobicContact CD2-CE2 4.26Å; L1238-Y1279 HydrophobicContact CD2-CG 4.26Å; L1238-Y1279 VanDerWaalsContact O-CE1 3.27Å; L1238-Y1279 WeakPolarHBondContact O-CE1 3.21Å; L1238-Y1279 PolarHBondContact O-OH 3.2Å
1239	F	91.2	Very high	90.5	Very high	17 Å²	17	20.4 Å²	20.4	8%	0.075	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-53.8	168.5	-179.3	-98.5	0	0	0	108.9	M1235 L1236 V1241 S1242 T1243 W1536 I1762 M1766	M1235-F1239 VanDerWaalsContact O-CB 3.28Å; M1235-F1239 WeakPolarHBondContact O-CB 3.18Å; M1235-F1239 PolarHBondContact O-N 2.99Å; L1236-F1239 WeakPolarHBondContact O-CB 3.44Å; L1236-F1239 PolarHBondContact O-N 3.21Å; F1239-V1241 PolarHBondContact O-N 3.49Å; F1239-S1242 WeakPolarHBondContact O-CA 3.22Å; F1239-S1242 WeakPolarHBondContact O-CB 3.26Å; F1239-S1242 PolarHBondContact O-N 3.21Å; F1239-S1242 PolarHBondContact O-OG 3.33Å; F1239-T1243 WeakPolarHBondContact O-CG2 3.3Å; F1239-W1536 AromaticContact CD1-CH2 3.86Å; F1239-W1536 HydrophobicContact CD1-CH2 3.86Å; F1239-W1536 HydrophobicContact CD1-CZ2 4.08Å; F1239-W1536 AromaticContact CE1-CH2 3.63Å; F1239-W1536 HydrophobicContact CE1-CH2 3.63Å; F1239-W1536 AromaticContact CE1-CZ2 3.72Å; F1239-W1536 HydrophobicContact CE1-CZ2 3.72Å; F1239-I1762 HydrophobicContact CD1-CG1 4.4Å; F1239-I1762 HydrophobicContact CD1-CG2 4.49Å; F1239-I1762 HydrophobicContact CE1-CB 4.47Å; F1239-I1762 HydrophobicContact CE1-CG1 4.17Å; F1239-I1762 HydrophobicContact CE1-CG2 3.95Å; F1239-I1762 HydrophobicContact CZ-CG2 3.98Å; F1239-M1766 HydrophobicContact CE2-CG 4.2Å; F1239-M1766 HydrophobicContact CE2-SD 3.81Å; F1239-M1766 HydrophobicContact CZ-CG 3.93Å; F1239-M1766 HydrophobicContact CZ-SD 3.96Å
1240	A	89.8	Confident	90.5	Very high	3 Å²	3	20.5 Å²	20.5	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-56	-45.6	173.9	0	0	0	0	0	112.7	L1226 L1236 T1237 S1242 T1243 F1244 E1245	L1226-A1240 HydrophobicContact CD1-CB 4.39Å; L1236-A1240 PolarHBondContact O-N 3.47Å; L1236-A1240 VanDerWaalsContact O-N 3.09Å; T1237-A1240 PolarHBondContact O-N 3.43Å; A1240-S1242 PolarHBondContact O-N 3.01Å; A1240-T1243 PolarHBondContact O-N 3.39Å; A1240-T1243 PolarHBondContact O-OG1 3.43Å; A1240-F1244 PolarHBondContact O-N 3.14Å; A1240-F1244 VanDerWaalsContact O-N 3.11Å; A1240-E1245 WeakPolarHBondContact O-CA 3.45Å
1241	V	91.8	Very high	90.6	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-65.6	-25.1	176.3	174.6	0	0	0	0	112.8	T1237 F1239 T1243 F1244 W1247 L1250 Y1276 Y1279 I1280	T1237-V1241 WeakPolarHBondContact O-CG2 3.44Å; T1237-V1241 PolarHBondContact O-N 3.28Å; F1239-V1241 PolarHBondContact O-N 3.49Å; V1241-T1243 PolarHBondContact O-N 3.29Å; V1241-F1244 WeakPolarHBondContact O-CD1 3.09Å; V1241-W1247 HydrophobicContact CG1-CB 4.39Å; V1241-W1247 HydrophobicContact CG2-CB 4.34Å; V1241-L1250 HydrophobicContact CG2-CD2 3.36Å; V1241-Y1276 HydrophobicContact CG1-CD1 3.75Å; V1241-Y1276 HydrophobicContact CG1-CE1 4.01Å; V1241-Y1276 HydrophobicContact CG2-CD1 4.47Å; V1241-Y1276 HydrophobicContact CG2-CE1 3.96Å; V1241-Y1279 HydrophobicContact CB-CD1 4.48Å; V1241-Y1279 HydrophobicContact CB-CE1 4.23Å; V1241-Y1279 HydrophobicContact CG1-CD1 3.77Å; V1241-Y1279 HydrophobicContact CG1-CE1 4Å; V1241-I1280 HydrophobicContact CG1-CG1 4.48Å
1242	S	89.5	Confident	90.6	Very high	8 Å²	8	17.8 Å²	17.8	6%	0.056	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-4.7	175.2	76.5	0	0	0	0	113.2	L1238 F1239 A1240 A1284 I2467	L1238-S1242 VanDerWaalsContact O-CB 3.31Å; L1238-S1242 WeakPolarHBondContact O-CB 3.22Å; L1238-S1242 PolarHBondContact O-N 3.39Å; F1239-S1242 WeakPolarHBondContact O-CA 3.22Å; F1239-S1242 WeakPolarHBondContact O-CB 3.26Å; F1239-S1242 PolarHBondContact O-N 3.21Å; F1239-S1242 PolarHBondContact O-OG 3.33Å; A1240-S1242 PolarHBondContact O-N 3.01Å; S1242-A1284 WeakPolarHBondContact O-CB 3.39Å; S1242-I2467 WeakPolarHBondContact O-CD1 3.34Å
1243	T	87.9	Confident	90.7	Very high	4 Å²	4	17.5 Å²	17.5	3%	0.025	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-20.9	-176.5	71.5	0	0	0	0	113.8	F1239 A1240 V1241 T2464 P2466 I2467	F1239-T1243 WeakPolarHBondContact O-CG2 3.3Å; A1240-T1243 PolarHBondContact O-N 3.39Å; A1240-T1243 PolarHBondContact O-OG1 3.43Å; V1241-T1243 PolarHBondContact O-N 3.29Å; T1243-T2464 WeakPolarHBondContact O-CG2 3.42Å; T1243-P2466 VanDerWaalsContact CB-CB 3.5Å; T1243-P2466 WeakPolarHBondContact CB-O 3.46Å; T1243-P2466 HydrophobicContact CG2-CB 4.08Å; T1243-P2466 VanDerWaalsContact CG2-O 3.31Å; T1243-P2466 WeakPolarHBondContact CG2-O 2.98Å; T1243-I2467 WeakPolarHBondContact O-CG1 3.44Å
1244	F	87.7	Confident	90.7	Very high	15 Å²	15	14.4 Å²	14.4	7%	0.066	8%	0.079	C	C	.	.			trans	75.3	57.4	172.8	-40.9	-22.9	0	0	0	117.7	T789 E791 A1240 V1241 W1247 I1280 A1284 F1285 F2463 T2464 I2467	T789-F1244 HydrophobicContact CG2-CD2 3.81Å; T789-F1244 HydrophobicContact CG2-CE2 3.62Å; T789-F1244 HydrophobicContact CG2-CG 4.37Å; T789-F1244 HydrophobicContact CG2-CZ 4.07Å; E791-F1244 VanDerWaalsContact OE1-C 3.3Å; A1240-F1244 PolarHBondContact O-N 3.14Å; A1240-F1244 VanDerWaalsContact O-N 3.11Å; V1241-F1244 WeakPolarHBondContact O-CD1 3.09Å; F1244-W1247 VanDerWaalsContact CA-CD1 3.49Å; F1244-W1247 VanDerWaalsContact CB-CD1 3.47Å; F1244-W1247 HydrophobicContact CB-CG 4.47Å; F1244-I1280 HydrophobicContact CD1-CD1 4.22Å; F1244-I1280 HydrophobicContact CD1-CG1 4.27Å; F1244-I1280 HydrophobicContact CE1-CB 4.13Å; F1244-I1280 HydrophobicContact CE1-CD1 4.01Å; F1244-I1280 HydrophobicContact CE1-CG1 3.72Å; F1244-I1280 HydrophobicContact CE1-CG2 3.56Å; F1244-I1280 HydrophobicContact CZ-CG2 3.56Å; F1244-A1284 HydrophobicContact CE1-CB 3.37Å; F1244-A1284 HydrophobicContact CZ-CB 3.5Å; F1244-F1285 HydrophobicContact CZ-CE2 4.33Å; F1244-F2463 CarbonylContact C-O 3.38Å; F1244-T2464 VanDerWaalsContact C-CG2 3.43Å; F1244-T2464 VanDerWaalsContact O-CG2 3.29Å; F1244-T2464 WeakPolarHBondContact O-CG2 3.01Å; F1244-I2467 HydrophobicContact CD1-CD1 3.89Å; F1244-I2467 HydrophobicContact CD2-CD1 3.62Å; F1244-I2467 HydrophobicContact CD2-CG1 4.36Å; F1244-I2467 HydrophobicContact CE1-CD1 3.61Å; F1244-I2467 HydrophobicContact CE2-CD1 3.38Å; F1244-I2467 HydrophobicContact CE2-CG1 4.39Å; F1244-I2467 HydrophobicContact CG-CD1 3.87Å; F1244-I2467 HydrophobicContact CZ-CD1 3.37Å
1245	E	87.8	Confident	90.7	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.009	8%	0.079	C	C	.	.			cis	102.1	40.5	-0.3	60.5	-171.6	-76.1	0	0	113	E791 A1240 W1247 A1535 W1536 Q1537 F2463 T2464	E791-E1245 PolarHBondContact OE1-N 2.86Å; A1240-E1245 WeakPolarHBondContact O-CA 3.45Å; E1245-W1247 PolarHBondContact O-N 3.25Å; E1245-A1535 WeakPolarHBondContact OE2-CA 3.33Å; E1245-A1535 PolarHBondContact OE2-N 3.22Å; E1245-W1536 PolarHBondContact OE1-NE1 3.12Å; E1245-W1536 PolarHBondContact OE2-N 3.25Å; E1245-Q1537 HydrophobicContact CB-CG 4.25Å; E1245-Q1537 WeakPolarHBondContact OE1-CA 3.24Å; E1245-Q1537 WeakPolarHBondContact OE1-CB 3.45Å; E1245-Q1537 WeakPolarHBondContact OE1-CG 3.22Å; E1245-Q1537 PolarHBondContact OE1-N 2.82Å; E1245-Q1537 PolarHBondContact OE1-OE1 2.72Å; E1245-Q1537 PolarHBondContact OE2-OE1 3.12Å; E1245-F2463 WeakPolarHBondContact CB-O 3.44Å; E1245-F2463 WeakPolarHBondContact CG-O 3.37Å; E1245-F2463 PolarHBondContact N-O 3.37Å; E1245-T2464 HydrophobicContact CB-CG2 4.37Å; E1245-T2464 HydrophobicContact CG-CG2 3.48Å; E1245-T2464 VanDerWaalsContact CG-CG2 3.48Å; E1245-T2464 WeakPolarHBondContact CG-OG1 3.26Å; E1245-T2464 PolarHBondContact OE2-OG1 2.99Å
1246	G	84.4	Confident	90.8	Very high	8 Å²	8	12.4 Å²	12.4	8%	0.082	7%	0.07	C	C	.	.	S	Bend	trans	59.3	21.6	171.7	0	0	0	0	0	112	E791 G1249 L1250 S2462	E791-G1246 WeakPolarHBondContact OE1-CA 3.38Å; E791-G1246 PolarHBondContact OE1-N 3.01Å; G1246-G1249 PolarHBondContact O-N 3.42Å; G1246-L1250 WeakPolarHBondContact O-CB 3.49Å; G1246-L1250 PolarHBondContact O-N 3.49Å; G1246-S2462 WeakPolarHBondContact CA-OG 3.39Å
1247	W	92.3	Very high	90.7	Very high	2 Å²	2	10.9 Å²	10.9	1%	0.008	6%	0.062	C	C	.	.	H	α-helix	trans	-79.4	-26.6	-162.5	86	-89.7	0	0	0	112.3	F785 Q786 T789 E791 V1241 F1244 E1245 L1251 I1280	F785-W1247 AromaticContact CD1-CH2 3.62Å; F785-W1247 HydrophobicContact CD1-CH2 3.62Å; F785-W1247 AromaticContact CD1-CZ2 4Å; F785-W1247 HydrophobicContact CD1-CZ2 4Å; F785-W1247 AromaticContact CE1-CH2 3.9Å; F785-W1247 HydrophobicContact CE1-CH2 3.9Å; F785-W1247 HydrophobicContact CE1-CZ2 4.17Å; Q786-W1247 HydrophobicContact CB-CZ2 4.31Å; T789-W1247 HydrophobicContact CG2-CZ2 4.1Å; T789-W1247 WeakPolarHBondContact OG1-CZ2 3.47Å; T789-W1247 PolarHBondContact OG1-NE1 2.88Å; E791-W1247 VanDerWaalsContact OE1-CD1 3.31Å; E791-W1247 PolarHBondContact OE1-N 3.48Å; E791-W1247 VanDerWaalsContact OE1-N 3.14Å; V1241-W1247 HydrophobicContact CG1-CB 4.39Å; V1241-W1247 HydrophobicContact CG2-CB 4.34Å; F1244-W1247 VanDerWaalsContact CA-CD1 3.49Å; F1244-W1247 VanDerWaalsContact CB-CD1 3.47Å; F1244-W1247 HydrophobicContact CB-CG 4.47Å; E1245-W1247 PolarHBondContact O-N 3.25Å; W1247-L1251 HydrophobicContact CE3-CB 4.4Å; W1247-L1251 HydrophobicContact CZ3-CB 4.43Å; W1247-L1251 HydrophobicContact CZ3-CD2 3.92Å; W1247-L1251 WeakPolarHBondContact O-CA 3.44Å; W1247-L1251 WeakPolarHBondContact O-CB 3.25Å; W1247-L1251 PolarHBondContact O-N 3.28Å; W1247-I1280 HydrophobicContact CD2-CD1 3.91Å; W1247-I1280 HydrophobicContact CE3-CD1 3.82Å; W1247-I1280 HydrophobicContact CZ3-CD1 4.15Å
1248	P	90.4	Very high	90.5	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.019	8%	0.081	C	C	.	.	H	α-helix	trans	-67.7	-45.1	166.5	-16.3	31.8	0	0	0	110.2	Q786 E791 L1250 L1251 Y1252	Q786-P1248 HydrophobicContact CG-CB 4.5Å; Q786-P1248 HydrophobicContact CG-CG 3.88Å; E791-P1248 HydrophobicContact CG-CG 3.49Å; E791-P1248 VanDerWaalsContact CG-CG 3.49Å; E791-P1248 WeakPolarHBondContact OE1-CD 3.49Å; P1248-L1250 PolarHBondContact O-N 3.05Å; P1248-L1251 WeakPolarHBondContact O-CB 3.37Å; P1248-L1251 PolarHBondContact O-N 3.16Å; P1248-Y1252 HydrophobicContact CB-CD2 4.34Å; P1248-Y1252 HydrophobicContact CB-CE2 3.88Å; P1248-Y1252 WeakPolarHBondContact O-CD2 3.15Å; P1248-Y1252 PolarHBondContact O-N 3.24Å
1249	G	88	Confident	90.1	Very high	40 Å²	40	17.1 Å²	17.1	41%	0.412	9%	0.092	S	C	.	.	H	α-helix	trans	-56.9	-49.5	176.1	0	0	0	0	0	112.1	G1246 Y1252 R1253	G1246-G1249 PolarHBondContact O-N 3.42Å; G1249-Y1252 PolarHBondContact O-N 2.92Å; G1249-R1253 VanDerWaalsContact O-CG 3.29Å; G1249-R1253 WeakPolarHBondContact O-CG 3.26Å; G1249-R1253 PolarHBondContact O-N 3.33Å
1250	L	91.8	Very high	89.9	Confident	10 Å²	10	21.5 Å²	21.5	5%	0.052	11%	0.113	C	C	.	.	H	α-helix	trans	-65.3	-38.4	175.6	-163.7	79.1	0	0	0	112.4	F1185 L1226 F1228 T1237 V1241 G1246 P1248 R1253 S1254 Y1276	F1185-L1250 HydrophobicContact CD2-CD1 4.43Å; F1185-L1250 HydrophobicContact CE2-CD1 3.76Å; F1185-L1250 HydrophobicContact CE2-CG 4.31Å; L1226-L1250 HydrophobicContact CB-CD1 4.22Å; F1228-L1250 HydrophobicContact CE2-CD2 4.37Å; T1237-L1250 HydrophobicContact CG2-CD1 4.12Å; T1237-L1250 HydrophobicContact CG2-CD2 3.41Å; T1237-L1250 VanDerWaalsContact CG2-CD2 3.41Å; T1237-L1250 HydrophobicContact CG2-CG 4.39Å; V1241-L1250 HydrophobicContact CG2-CD2 3.36Å; G1246-L1250 WeakPolarHBondContact O-CB 3.49Å; G1246-L1250 PolarHBondContact O-N 3.49Å; P1248-L1250 PolarHBondContact O-N 3.05Å; L1250-R1253 PolarHBondContact O-N 3.17Å; L1250-S1254 WeakPolarHBondContact O-CB 3.37Å; L1250-S1254 PolarHBondContact O-N 3.1Å; L1250-S1254 PolarHBondContact O-OG 3.38Å; L1250-Y1276 HydrophobicContact CD2-CE1 3.89Å
1251	L	93.2	Very high	89.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.6	-50.4	173.9	172.6	72.7	0	0	0	110.7	I782 W1247 P1248 S1254 I1255 V1273 Y1276	I782-L1251 HydrophobicContact CG2-CD2 3.68Å; W1247-L1251 HydrophobicContact CE3-CB 4.4Å; W1247-L1251 HydrophobicContact CZ3-CB 4.43Å; W1247-L1251 HydrophobicContact CZ3-CD2 3.92Å; W1247-L1251 WeakPolarHBondContact O-CA 3.44Å; W1247-L1251 WeakPolarHBondContact O-CB 3.25Å; W1247-L1251 PolarHBondContact O-N 3.28Å; P1248-L1251 WeakPolarHBondContact O-CB 3.37Å; P1248-L1251 PolarHBondContact O-N 3.16Å; L1251-S1254 CarbonylContact O-C 3.57Å; L1251-S1254 WeakPolarHBondContact O-CA 3.14Å; L1251-S1254 WeakPolarHBondContact O-CB 3.41Å; L1251-S1254 PolarHBondContact O-N 3.28Å; L1251-I1255 HydrophobicContact CD1-CD1 4.05Å; L1251-I1255 HydrophobicContact CD1-CG1 4.24Å; L1251-I1255 HydrophobicContact CD2-CD1 4.2Å; L1251-I1255 HydrophobicContact CG-CD1 3.77Å; L1251-I1255 HydrophobicContact CG-CG1 4.32Å; L1251-I1255 WeakPolarHBondContact O-CG1 3.47Å; L1251-I1255 PolarHBondContact O-N 3.1Å; L1251-V1273 HydrophobicContact CD1-CB 4.32Å; L1251-V1273 HydrophobicContact CD1-CG2 3.91Å; L1251-V1273 HydrophobicContact CD2-CG2 4.44Å; L1251-Y1276 HydrophobicContact CD1-CD2 3.66Å; L1251-Y1276 HydrophobicContact CD1-CE2 4.4Å; L1251-Y1276 HydrophobicContact CD1-CG 4.01Å
1252	Y	92.4	Very high	89.7	Confident	19 Å²	19	29.5 Å²	29.5	8%	0.075	15%	0.148	C	C	.	.	H	α-helix	trans	-65.8	-39.2	-178.6	-64.2	-56.4	0	0	0	111.3	R771 Q779 P1248 G1249 S1254 I1255 D1256	R771-Y1252 HydrophobicContact CB-CD1 4.01Å; R771-Y1252 HydrophobicContact CB-CD2 3.74Å; R771-Y1252 HydrophobicContact CB-CE1 4Å; R771-Y1252 HydrophobicContact CB-CE2 3.75Å; R771-Y1252 HydrophobicContact CB-CG 3.92Å; R771-Y1252 HydrophobicContact CG-CD2 4.29Å; R771-Y1252 HydrophobicContact CG-CG 4.23Å; Q779-Y1252 PolarHBondContact NE2-OH 3.34Å; P1248-Y1252 HydrophobicContact CB-CD2 4.34Å; P1248-Y1252 HydrophobicContact CB-CE2 3.88Å; P1248-Y1252 WeakPolarHBondContact O-CD2 3.15Å; P1248-Y1252 PolarHBondContact O-N 3.24Å; G1249-Y1252 PolarHBondContact O-N 2.92Å; Y1252-S1254 VanDerWaalsContact C-N 3.26Å; Y1252-S1254 PolarHBondContact O-N 2.93Å; Y1252-I1255 HydrophobicContact CD1-CD1 4.07Å; Y1252-I1255 HydrophobicContact CE1-CD1 4.46Å; Y1252-I1255 PolarHBondContact O-N 3.14Å; Y1252-D1256 WeakPolarHBondContact O-CB 3.48Å; Y1252-D1256 PolarHBondContact O-N 3.09Å
1253	R	91.4	Very high	89.5	Confident	87 Å²	87	29.2 Å²	29.2	33%	0.328	15%	0.146	S	C	.	.	H	α-helix	trans	-56.5	-39.2	168	-68.3	-75.3	-171.6	85.4	18.2	112.1	N1224 G1249 L1250 S1257	N1224-R1253 PolarHBondContact OD1-NH1 3.02Å; G1249-R1253 VanDerWaalsContact O-CG 3.29Å; G1249-R1253 WeakPolarHBondContact O-CG 3.26Å; G1249-R1253 PolarHBondContact O-N 3.33Å; L1250-R1253 PolarHBondContact O-N 3.17Å; R1253-S1257 PolarHBondContact O-N 2.97Å
1254	S	92.5	Very high	89.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-75.2	-34.9	179.9	-51.9	0	0	0	0	113.4	F1185 L1250 L1251 Y1252 D1256 S1257 Y1276	F1185-S1254 WeakPolarHBondContact CZ-OG 3.43Å; L1250-S1254 WeakPolarHBondContact O-CB 3.37Å; L1250-S1254 PolarHBondContact O-N 3.1Å; L1250-S1254 PolarHBondContact O-OG 3.38Å; L1251-S1254 CarbonylContact O-C 3.57Å; L1251-S1254 WeakPolarHBondContact O-CA 3.14Å; L1251-S1254 WeakPolarHBondContact O-CB 3.41Å; L1251-S1254 PolarHBondContact O-N 3.28Å; Y1252-S1254 VanDerWaalsContact C-N 3.26Å; Y1252-S1254 PolarHBondContact O-N 2.93Å; S1254-D1256 VanDerWaalsContact C-N 3.35Å; S1254-S1257 WeakPolarHBondContact O-CB 3.31Å; S1254-S1257 PolarHBondContact O-N 3.06Å; S1254-S1257 PolarHBondContact O-OG 3.05Å; S1254-Y1276 PolarHBondContact OG-OH 3.5Å
1255	I	93	Very high	89.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-40.6	172.4	-72.9	170.3	0	0	0	110.3	L1251 Y1252 S1257 N1268 R1269 V1273	L1251-I1255 HydrophobicContact CD1-CD1 4.05Å; L1251-I1255 HydrophobicContact CD1-CG1 4.24Å; L1251-I1255 HydrophobicContact CD2-CD1 4.2Å; L1251-I1255 HydrophobicContact CG-CD1 3.77Å; L1251-I1255 HydrophobicContact CG-CG1 4.32Å; L1251-I1255 WeakPolarHBondContact O-CG1 3.47Å; L1251-I1255 PolarHBondContact O-N 3.1Å; Y1252-I1255 HydrophobicContact CD1-CD1 4.07Å; Y1252-I1255 HydrophobicContact CE1-CD1 4.46Å; Y1252-I1255 PolarHBondContact O-N 3.14Å; I1255-S1257 VanDerWaalsContact C-N 3.26Å; I1255-S1257 PolarHBondContact O-N 3.02Å; I1255-N1268 PolarHBondContact O-N 3.31Å; I1255-R1269 WeakPolarHBondContact O-CA 3.19Å; I1255-R1269 PolarHBondContact O-N 3.37Å; I1255-V1273 HydrophobicContact CD1-CG2 3.7Å; I1255-V1273 HydrophobicContact CG1-CG2 4.18Å
1256	D	92.6	Very high	89.7	Confident	8 Å²	8	38.1 Å²	38.1	4%	0.043	19%	0.19	C	C	.	.	S	Bend	trans	-78.7	-8.6	179.5	-67.5	-3.7	0	0	0	112.9	R771 Y1252 S1254 Y1258 V1265 Y1266 N1267	R771-D1256 IonicContact CZ-OD2 3.55Å; R771-D1256 IonicContact NH1-OD1 2.71Å; R771-D1256 PolarHBondContact NH1-OD1 2.98Å; R771-D1256 VanDerWaalsContact NH1-OD1 3.16Å; R771-D1256 IonicContact NH1-OD2 2.74Å; R771-D1256 PolarHBondContact NH1-OD2 3.34Å; R771-D1256 IonicContact NH2-OD2 3.44Å; R771-D1256 PolarHBondContact NH2-OD2 3.3Å; Y1252-D1256 WeakPolarHBondContact O-CB 3.48Å; Y1252-D1256 PolarHBondContact O-N 3.09Å; S1254-D1256 VanDerWaalsContact C-N 3.35Å; D1256-Y1258 PolarHBondContact O-N 3.01Å; D1256-V1265 VanDerWaalsContact CA-O 3.25Å; D1256-V1265 WeakPolarHBondContact CA-O 3.48Å; D1256-V1265 PolarHBondContact O-N 3.13Å; D1256-Y1266 WeakPolarHBondContact OD1-CA 3.27Å; D1256-N1267 PolarHBondContact OD1-N 3.05Å
1257	S	91.3	Very high	89.9	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.007	20%	0.197	C	C	.	.			trans	-64.9	128	-176.2	74.6	0	0	0	0	113.4	R1253 S1254 I1255 N1268 R1269	R1253-S1257 PolarHBondContact O-N 2.97Å; S1254-S1257 WeakPolarHBondContact O-CB 3.31Å; S1254-S1257 PolarHBondContact O-N 3.06Å; S1254-S1257 PolarHBondContact O-OG 3.05Å; I1255-S1257 VanDerWaalsContact C-N 3.26Å; I1255-S1257 PolarHBondContact O-N 3.02Å; S1257-N1268 PolarHBondContact O-ND2 3.44Å; S1257-R1269 PolarHBondContact O-NH1 2.89Å
1258	Y	87.3	Confident	89.8	Confident	103 Å²	103	42.3 Å²	42.3	40%	0.404	21%	0.211	S	C	.	.			trans	-105.1	-77.4	-177.1	-177.2	-107	0	0	0	114.2	D1256 Y1262 R1269	D1256-Y1258 PolarHBondContact O-N 3.01Å; Y1258-Y1262 HydrophobicContact CD1-CD1 4.02Å; Y1258-Y1262 HydrophobicContact CD1-CD2 4.33Å; Y1258-Y1262 AromaticContact CD1-CG 3.8Å; Y1258-Y1262 HydrophobicContact CD1-CG 3.8Å; Y1258-Y1262 HydrophobicContact CE1-CD1 4.21Å; Y1258-Y1262 HydrophobicContact CE1-CE1 4.48Å; Y1258-Y1262 HydrophobicContact CE1-CG 4.24Å; Y1258-R1269 PolarHBondContact O-NH1 3.18Å; Y1258-R1269 PolarHBondContact O-NH2 3.22Å
1259	A	85.9	Confident	89.7	Confident	28 Å²	28	44.8 Å²	44.8	23%	0.231	22%	0.22	C	C	.	.	S	Bend	trans	-144	165.3	-177	0	0	0	0	0	110.3	K1184 D1261 Y1262	K1184-A1259 VanDerWaalsContact CG-C 3.49Å; A1259-D1261 PolarHBondContact O-N 2.76Å; A1259-Y1262 HydrophobicContact CB-CD2 3.62Å; A1259-Y1262 HydrophobicContact CB-CE2 4.29Å; A1259-Y1262 HydrophobicContact CB-CG 4.21Å; A1259-Y1262 PolarHBondContact O-N 2.76Å; A1259-Y1262 VanDerWaalsContact O-N 3.09Å
1260	E	86.2	Confident	89.8	Confident	110 Å²	110	45.2 Å²	45.2	51%	0.514	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	135.6	170.3	-70.6	127.9	-118.9	0	0	109.1	A1182 K1184 Y1262	A1182-E1260 VanDerWaalsContact O-CG 3.29Å; A1182-E1260 WeakPolarHBondContact O-CG 3.41Å; K1184-E1260 WeakPolarHBondContact CE-OE1 3.4Å; K1184-E1260 HydrophobicContact CG-CG 4.33Å; K1184-E1260 IonicContact NZ-OE1 3.15Å; K1184-E1260 PolarHBondContact NZ-OE1 2.95Å; E1260-Y1262 VanDerWaalsContact O-CD2 3.32Å; E1260-Y1262 WeakPolarHBondContact O-CD2 3.26Å; E1260-Y1262 PolarHBondContact O-N 2.79Å
1261	D	87.3	Confident	89.6	Confident	73 Å²	73	50.4 Å²	50.4	39%	0.39	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	17.7	-172.5	-51.7	-21.5	0	0	0	115.7	Y631 P1196 A1259	Y631-D1261 WeakPolarHBondContact CE2-OD1 3.35Å; Y631-D1261 PolarHBondContact OH-OD1 3.01Å; Y631-D1261 VanDerWaalsContact OH-OD1 3.04Å; P1196-D1261 WeakPolarHBondContact CD-O 3.28Å; P1196-D1261 HydrophobicContact CG-CB 4.35Å; A1259-D1261 PolarHBondContact O-N 2.76Å
1262	Y	90.1	Very high	89.5	Confident	99 Å²	99	51.2 Å²	51.2	39%	0.388	25%	0.247	S	C	.	.			trans	-118.4	143.7	172.5	-72.7	-99.1	0	0	0	113.4	L1194 V1195 Y1258 A1259 E1260	L1194-Y1262 CarbonylContact O-C 3.59Å; L1194-Y1262 VanDerWaalsContact O-CA 3.23Å; L1194-Y1262 WeakPolarHBondContact O-CA 3.29Å; V1195-Y1262 HydrophobicContact CG2-CD1 4.08Å; V1195-Y1262 HydrophobicContact CG2-CE1 3.89Å; Y1258-Y1262 HydrophobicContact CD1-CD1 4.02Å; Y1258-Y1262 HydrophobicContact CD1-CD2 4.33Å; Y1258-Y1262 AromaticContact CD1-CG 3.8Å; Y1258-Y1262 HydrophobicContact CD1-CG 3.8Å; Y1258-Y1262 HydrophobicContact CE1-CD1 4.21Å; Y1258-Y1262 HydrophobicContact CE1-CE1 4.48Å; Y1258-Y1262 HydrophobicContact CE1-CG 4.24Å; A1259-Y1262 HydrophobicContact CB-CD2 3.62Å; A1259-Y1262 HydrophobicContact CB-CE2 4.29Å; A1259-Y1262 HydrophobicContact CB-CG 4.21Å; A1259-Y1262 PolarHBondContact O-N 2.76Å; A1259-Y1262 VanDerWaalsContact O-N 3.09Å; E1260-Y1262 VanDerWaalsContact O-CD2 3.32Å; E1260-Y1262 WeakPolarHBondContact O-CD2 3.26Å; E1260-Y1262 PolarHBondContact O-N 2.79Å
1263	G	86.9	Confident	89.4	Confident	2 Å²	2	51.3 Å²	51.3	2%	0.021	25%	0.249	C	C	.	.			trans	-70.8	170.5	175.8	0	0	0	0	0	113.9	L1194	L1194-G1263 PolarHBondContact O-N 2.72Å
1264	S	88.5	Confident	89.3	Confident	32 Å²	32	52.5 Å²	52.5	22%	0.224	26%	0.261	C	S	.	.			trans	-62.1	132.1	176.2	41.2	0	0	0	0	113.1
1265	V	89.7	Confident	89.2	Confident	50 Å²	50	53.7 Å²	53.7	30%	0.303	27%	0.266	S	S	.	.			trans	-122.3	115.3	176.1	179	0	0	0	0	109.1	L1194 D1256 N1267 N1268	L1194-V1265 HydrophobicContact CD1-CG2 4.03Å; L1194-V1265 HydrophobicContact CD2-CG2 4.05Å; D1256-V1265 VanDerWaalsContact CA-O 3.25Å; D1256-V1265 WeakPolarHBondContact CA-O 3.48Å; D1256-V1265 PolarHBondContact O-N 3.13Å; V1265-N1267 PolarHBondContact O-N 2.94Å; V1265-N1268 HydrophobicContact CB-CB 4.15Å; V1265-N1268 HydrophobicContact CG1-CB 4.31Å; V1265-N1268 WeakPolarHBondContact O-CB 3.18Å; V1265-N1268 PolarHBondContact O-N 3.32Å; V1265-N1268 VanDerWaalsContact O-N 3.16Å
1266	Y	88.7	Confident	89.2	Confident	125 Å²	125	53.7 Å²	53.7	49%	0.49	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	122	-173	-173.8	-89.8	0	0	0	114	D1256 N1268	D1256-Y1266 WeakPolarHBondContact OD1-CA 3.27Å; Y1266-N1268 VanDerWaalsContact C-N 3.25Å; Y1266-N1268 PolarHBondContact O-N 2.98Å
1267	N	88.6	Confident	89	Confident	43 Å²	43	55.1 Å²	55.1	23%	0.23	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	28.4	177.6	-89.4	-58	0	0	0	115.5	Y778 D1256 V1265 R1269 P1270	Y778-N1267 PolarHBondContact OH-OD1 2.95Å; D1256-N1267 PolarHBondContact OD1-N 3.05Å; V1265-N1267 PolarHBondContact O-N 2.94Å; N1267-R1269 PolarHBondContact O-N 3.29Å; N1267-P1270 WeakPolarHBondContact O-CD 3.47Å
1268	N	89.8	Confident	88.8	Confident	56 Å²	56	56.9 Å²	56.9	30%	0.299	29%	0.29	S	S	.	.	S	Bend	trans	-63.1	-35.8	180	174.5	61.3	0	0	0	114.5	I1255 S1257 V1265 Y1266	I1255-N1268 PolarHBondContact O-N 3.31Å; S1257-N1268 PolarHBondContact O-ND2 3.44Å; V1265-N1268 HydrophobicContact CB-CB 4.15Å; V1265-N1268 HydrophobicContact CG1-CB 4.31Å; V1265-N1268 WeakPolarHBondContact O-CB 3.18Å; V1265-N1268 PolarHBondContact O-N 3.32Å; V1265-N1268 VanDerWaalsContact O-N 3.16Å; Y1266-N1268 VanDerWaalsContact C-N 3.25Å; Y1266-N1268 PolarHBondContact O-N 2.98Å
1269	R	89.6	Confident	89	Confident	55 Å²	55	52 Å²	52	21%	0.208	27%	0.271	C	S	.	.			trans	-138.7	65.8	-176	-73.7	179.7	-177.1	137.9	6.6	114.3	I1255 S1257 Y1258 N1267 I1271 V1272	I1255-R1269 WeakPolarHBondContact O-CA 3.19Å; I1255-R1269 PolarHBondContact O-N 3.37Å; S1257-R1269 PolarHBondContact O-NH1 2.89Å; Y1258-R1269 PolarHBondContact O-NH1 3.18Å; Y1258-R1269 PolarHBondContact O-NH2 3.22Å; N1267-R1269 PolarHBondContact O-N 3.29Å; R1269-I1271 HydrophobicContact CB-CG2 4.48Å; R1269-I1271 PolarHBondContact O-N 3.16Å; R1269-V1272 HydrophobicContact CB-CG2 3.9Å; R1269-V1272 WeakPolarHBondContact O-CB 3.38Å; R1269-V1272 PolarHBondContact O-N 3.1Å
1270	P	88.9	Confident	89.1	Confident	49 Å²	49	50.7 Å²	50.7	32%	0.318	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-58.9	-18.9	173.5	25	-35.5	0	0	0	113.9	Y778 N1267 V1272 V1273	Y778-P1270 HydrophobicContact CD2-CB 4.26Å; Y778-P1270 HydrophobicContact CE2-CB 3.75Å; N1267-P1270 WeakPolarHBondContact O-CD 3.47Å; P1270-V1272 PolarHBondContact O-N 2.81Å; P1270-V1273 WeakPolarHBondContact O-CB 3.28Å; P1270-V1273 WeakPolarHBondContact O-CG2 3.41Å; P1270-V1273 PolarHBondContact O-N 3.4Å
1271	I	88.4	Confident	88.9	Confident	119 Å²	119	47.8 Å²	47.8	61%	0.61	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-61	-23.2	174.5	-167.4	61.1	0	0	0	113.7	R1269 V1273 I1274	R1269-I1271 HydrophobicContact CB-CG2 4.48Å; R1269-I1271 PolarHBondContact O-N 3.16Å; I1271-V1273 PolarHBondContact O-N 2.99Å; I1271-I1274 HydrophobicContact CD1-CD1 3.66Å; I1271-I1274 HydrophobicContact CD1-CG1 4.49Å; I1271-I1274 PolarHBondContact O-N 3.37Å
1272	V	89.7	Confident	88.6	Confident	16 Å²	16	46.6 Å²	46.6	10%	0.097	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62.3	-24.9	-180	164.7	0	0	0	0	112.8	F1181 R1269 P1270 I1274 F1275 Y1276	F1181-V1272 HydrophobicContact CE1-CG1 3.79Å; F1181-V1272 HydrophobicContact CE1-CG2 3.84Å; F1181-V1272 HydrophobicContact CZ-CB 4.46Å; F1181-V1272 HydrophobicContact CZ-CG1 3.56Å; F1181-V1272 HydrophobicContact CZ-CG2 4.11Å; R1269-V1272 HydrophobicContact CB-CG2 3.9Å; R1269-V1272 WeakPolarHBondContact O-CB 3.38Å; R1269-V1272 PolarHBondContact O-N 3.1Å; P1270-V1272 PolarHBondContact O-N 2.81Å; V1272-I1274 PolarHBondContact O-N 3.41Å; V1272-F1275 WeakPolarHBondContact O-CB 3.5Å; V1272-F1275 PolarHBondContact O-N 2.86Å; V1272-Y1276 HydrophobicContact CG1-CD2 4.08Å; V1272-Y1276 HydrophobicContact CG1-CE2 3.92Å
1273	V	91	Very high	88.3	Confident	22 Å²	22	42 Å²	42	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-48.8	-35.8	174.9	175.6	0	0	0	0	112.5	I782 L1251 I1255 P1270 I1271 F1275 Y1276 V1277	I782-V1273 HydrophobicContact CD1-CB 4.49Å; I782-V1273 HydrophobicContact CD1-CG1 4.18Å; I782-V1273 HydrophobicContact CD1-CG2 3.51Å; I782-V1273 HydrophobicContact CG1-CG1 3.9Å; I782-V1273 HydrophobicContact CG1-CG2 4.15Å; L1251-V1273 HydrophobicContact CD1-CB 4.32Å; L1251-V1273 HydrophobicContact CD1-CG2 3.91Å; L1251-V1273 HydrophobicContact CD2-CG2 4.44Å; I1255-V1273 HydrophobicContact CD1-CG2 3.7Å; I1255-V1273 HydrophobicContact CG1-CG2 4.18Å; P1270-V1273 WeakPolarHBondContact O-CB 3.28Å; P1270-V1273 WeakPolarHBondContact O-CG2 3.41Å; P1270-V1273 PolarHBondContact O-N 3.4Å; I1271-V1273 PolarHBondContact O-N 2.99Å; V1273-F1275 VanDerWaalsContact C-N 3.29Å; V1273-F1275 PolarHBondContact O-N 3.26Å; V1273-Y1276 PolarHBondContact O-N 3.38Å; V1273-V1277 HydrophobicContact CG1-CG2 3.84Å; V1273-V1277 WeakPolarHBondContact O-CG2 3.37Å; V1273-V1277 PolarHBondContact O-N 3.01Å
1274	I	89.6	Confident	87.8	Confident	111 Å²	111	42 Å²	42	57%	0.569	22%	0.224	S	C	*	.	H	α-helix	trans	-63.7	-33.2	-178.9	-59.1	-177.7	0	0	0	111.9	I1271 V1272 A1278	I1271-I1274 HydrophobicContact CD1-CD1 3.66Å; I1271-I1274 HydrophobicContact CD1-CG1 4.49Å; I1271-I1274 PolarHBondContact O-N 3.37Å; V1272-I1274 PolarHBondContact O-N 3.41Å; I1274-A1278 WeakPolarHBondContact O-CB 3.2Å; I1274-A1278 PolarHBondContact O-N 3.41Å
1275	F	91	Very high	86.9	Confident	25 Å²	25	41.4 Å²	41.4	11%	0.11	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-50.2	176	173.3	-99.9	0	0	0	110.9	F1173 I1176 L1180 F1181 F1228 L1238 V1272 V1273 A1278 Y1279	F1173-F1275 HydrophobicContact CD1-CD2 4.46Å; F1173-F1275 AromaticContact CD1-CE2 3.92Å; F1173-F1275 HydrophobicContact CD1-CE2 3.92Å; I1176-F1275 HydrophobicContact CB-CE2 4.24Å; I1176-F1275 HydrophobicContact CG2-CD2 4.14Å; I1176-F1275 HydrophobicContact CG2-CE2 3.73Å; L1180-F1275 HydrophobicContact CD1-CD2 4.06Å; L1180-F1275 HydrophobicContact CD1-CE2 4.42Å; L1180-F1275 HydrophobicContact CD1-CG 4.47Å; F1181-F1275 AromaticContact CE2-CD1 3.91Å; F1181-F1275 HydrophobicContact CE2-CD1 3.91Å; F1181-F1275 AromaticContact CE2-CE1 3.98Å; F1181-F1275 HydrophobicContact CE2-CE1 3.98Å; F1181-F1275 HydrophobicContact CE2-CG 4.4Å; F1181-F1275 HydrophobicContact CZ-CD1 4.49Å; F1228-F1275 HydrophobicContact CZ-CE1 4.4Å; L1238-F1275 HydrophobicContact CD2-CE1 4.08Å; L1238-F1275 HydrophobicContact CD2-CZ 4.22Å; V1272-F1275 WeakPolarHBondContact O-CB 3.5Å; V1272-F1275 PolarHBondContact O-N 2.86Å; V1273-F1275 VanDerWaalsContact C-N 3.29Å; V1273-F1275 PolarHBondContact O-N 3.26Å; F1275-A1278 PolarHBondContact O-N 3.49Å; F1275-Y1279 VanDerWaalsContact O-CB 3.28Å; F1275-Y1279 WeakPolarHBondContact O-CB 3.06Å; F1275-Y1279 PolarHBondContact O-N 3.43Å
1276	Y	92.5	Very high	86.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-50.3	179.1	-75.5	-83.2	0	0	0	112.2	F1228 V1241 L1250 L1251 S1254 V1272 V1273 A1278 Y1279 I1280	F1228-Y1276 WeakPolarHBondContact CE2-OH 3.49Å; V1241-Y1276 HydrophobicContact CG1-CD1 3.75Å; V1241-Y1276 HydrophobicContact CG1-CE1 4.01Å; V1241-Y1276 HydrophobicContact CG2-CD1 4.47Å; V1241-Y1276 HydrophobicContact CG2-CE1 3.96Å; L1250-Y1276 HydrophobicContact CD2-CE1 3.89Å; L1251-Y1276 HydrophobicContact CD1-CD2 3.66Å; L1251-Y1276 HydrophobicContact CD1-CE2 4.4Å; L1251-Y1276 HydrophobicContact CD1-CG 4.01Å; S1254-Y1276 PolarHBondContact OG-OH 3.5Å; V1272-Y1276 HydrophobicContact CG1-CD2 4.08Å; V1272-Y1276 HydrophobicContact CG1-CE2 3.92Å; V1273-Y1276 PolarHBondContact O-N 3.38Å; Y1276-A1278 VanDerWaalsContact C-N 3.34Å; Y1276-A1278 PolarHBondContact O-N 3.07Å; Y1276-Y1279 PolarHBondContact O-N 2.99Å; Y1276-I1280 WeakPolarHBondContact O-CB 3.39Å; Y1276-I1280 VanDerWaalsContact O-CG1 3.24Å; Y1276-I1280 WeakPolarHBondContact O-CG1 3.41Å; Y1276-I1280 PolarHBondContact O-N 3.43Å
1277	V	88	Confident	85.4	Confident	38 Å²	38	35.3 Å²	35.3	23%	0.23	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-39.8	179.2	174.4	0	0	0	0	111.5	F785 V1273 I1281	F785-V1277 HydrophobicContact CD1-CG2 4.19Å; F785-V1277 HydrophobicContact CE1-CG2 3.95Å; F785-V1277 HydrophobicContact CE2-CG1 4.42Å; F785-V1277 HydrophobicContact CZ-CG1 4.21Å; F785-V1277 HydrophobicContact CZ-CG2 4.34Å; V1273-V1277 HydrophobicContact CG1-CG2 3.84Å; V1273-V1277 WeakPolarHBondContact O-CG2 3.37Å; V1273-V1277 PolarHBondContact O-N 3.01Å; V1277-I1281 HydrophobicContact CG1-CD1 3.79Å; V1277-I1281 WeakPolarHBondContact O-CB 3.21Å; V1277-I1281 VanDerWaalsContact O-CG1 3.23Å; V1277-I1281 WeakPolarHBondContact O-CG1 3.36Å; V1277-I1281 PolarHBondContact O-N 2.91Å
1278	A	86.6	Confident	84.6	Confident	39 Å²	39	34.1 Å²	34.1	32%	0.322	18%	0.184	S	C	.	.	H	α-helix	trans	-68.5	-40.8	176.1	0	0	0	0	0	112.6	I1274 F1275 Y1276 I1281 V1282	I1274-A1278 WeakPolarHBondContact O-CB 3.2Å; I1274-A1278 PolarHBondContact O-N 3.41Å; F1275-A1278 PolarHBondContact O-N 3.49Å; Y1276-A1278 VanDerWaalsContact C-N 3.34Å; Y1276-A1278 PolarHBondContact O-N 3.07Å; A1278-I1281 PolarHBondContact O-N 2.92Å; A1278-V1282 WeakPolarHBondContact O-CB 3.42Å; A1278-V1282 VanDerWaalsContact O-CG2 3.31Å; A1278-V1282 WeakPolarHBondContact O-CG2 3.49Å; A1278-V1282 PolarHBondContact O-N 3Å
1279	Y	91.7	Very high	83.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-48.3	175.8	178.7	-106	0	0	0	111.5	F1173 L1238 V1241 F1275 Y1276 I1281 V1282 I1283	F1173-Y1279 HydrophobicContact CB-CD2 3.69Å; F1173-Y1279 HydrophobicContact CB-CE2 3.83Å; F1173-Y1279 AromaticContact CD1-CD2 3.81Å; F1173-Y1279 HydrophobicContact CD1-CD2 3.81Å; F1173-Y1279 AromaticContact CD2-CD2 3.66Å; F1173-Y1279 HydrophobicContact CD2-CD2 3.66Å; F1173-Y1279 HydrophobicContact CD2-CE2 4.07Å; F1173-Y1279 HydrophobicContact CE1-CD2 4.29Å; F1173-Y1279 HydrophobicContact CE2-CD2 4.16Å; F1173-Y1279 AromaticContact CG-CD2 3.47Å; F1173-Y1279 HydrophobicContact CG-CD2 3.47Å; F1173-Y1279 VanDerWaalsContact CG-CD2 3.47Å; F1173-Y1279 HydrophobicContact CG-CE2 4.02Å; F1173-Y1279 HydrophobicContact CZ-CD2 4.45Å; L1238-Y1279 HydrophobicContact CB-CE1 4.21Å; L1238-Y1279 HydrophobicContact CB-CE2 4.33Å; L1238-Y1279 HydrophobicContact CD1-CE2 4.29Å; L1238-Y1279 HydrophobicContact CD2-CD1 4.05Å; L1238-Y1279 HydrophobicContact CD2-CD2 4.37Å; L1238-Y1279 HydrophobicContact CD2-CE1 3.93Å; L1238-Y1279 HydrophobicContact CD2-CE2 4.26Å; L1238-Y1279 HydrophobicContact CD2-CG 4.26Å; L1238-Y1279 VanDerWaalsContact O-CE1 3.27Å; L1238-Y1279 WeakPolarHBondContact O-CE1 3.21Å; L1238-Y1279 PolarHBondContact O-OH 3.2Å; V1241-Y1279 HydrophobicContact CB-CD1 4.48Å; V1241-Y1279 HydrophobicContact CB-CE1 4.23Å; V1241-Y1279 HydrophobicContact CG1-CD1 3.77Å; V1241-Y1279 HydrophobicContact CG1-CE1 4Å; F1275-Y1279 VanDerWaalsContact O-CB 3.28Å; F1275-Y1279 WeakPolarHBondContact O-CB 3.06Å; F1275-Y1279 PolarHBondContact O-N 3.43Å; Y1276-Y1279 PolarHBondContact O-N 2.99Å; Y1279-I1281 PolarHBondContact O-N 3.17Å; Y1279-V1282 PolarHBondContact O-N 2.97Å; Y1279-I1283 HydrophobicContact CD2-CG1 3.88Å; Y1279-I1283 HydrophobicContact CE2-CB 4.26Å; Y1279-I1283 HydrophobicContact CE2-CG1 3.45Å; Y1279-I1283 VanDerWaalsContact CE2-CG1 3.45Å; Y1279-I1283 PolarHBondContact O-N 2.91Å
1280	I	88.6	Confident	82.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.7	-46	176.3	-72.2	175.6	0	0	0	110.8	F785 V1241 F1244 W1247 Y1276 V1282 A1284 F1285	F785-I1280 HydrophobicContact CE1-CD1 4.16Å; F785-I1280 HydrophobicContact CE1-CG2 4.31Å; F785-I1280 HydrophobicContact CZ-CG2 3.81Å; V1241-I1280 HydrophobicContact CG1-CG1 4.48Å; F1244-I1280 HydrophobicContact CD1-CD1 4.22Å; F1244-I1280 HydrophobicContact CD1-CG1 4.27Å; F1244-I1280 HydrophobicContact CE1-CB 4.13Å; F1244-I1280 HydrophobicContact CE1-CD1 4.01Å; F1244-I1280 HydrophobicContact CE1-CG1 3.72Å; F1244-I1280 HydrophobicContact CE1-CG2 3.56Å; F1244-I1280 HydrophobicContact CZ-CG2 3.56Å; W1247-I1280 HydrophobicContact CD2-CD1 3.91Å; W1247-I1280 HydrophobicContact CE3-CD1 3.82Å; W1247-I1280 HydrophobicContact CZ3-CD1 4.15Å; Y1276-I1280 WeakPolarHBondContact O-CB 3.39Å; Y1276-I1280 VanDerWaalsContact O-CG1 3.24Å; Y1276-I1280 WeakPolarHBondContact O-CG1 3.41Å; Y1276-I1280 PolarHBondContact O-N 3.43Å; I1280-V1282 VanDerWaalsContact C-N 3.35Å; I1280-V1282 PolarHBondContact O-N 2.92Å; I1280-A1284 HydrophobicContact CG2-CB 4.48Å; I1280-A1284 WeakPolarHBondContact O-CB 3.33Å; I1280-A1284 PolarHBondContact O-N 2.99Å; I1280-F1285 HydrophobicContact CG2-CD2 3.6Å; I1280-F1285 HydrophobicContact CG2-CE2 3.53Å; I1280-F1285 WeakPolarHBondContact O-CD2 3.49Å; I1280-F1285 PolarHBondContact O-N 3.47Å
1281	I	81.4	Confident	81.8	Confident	50 Å²	50	27.5 Å²	27.5	26%	0.256	15%	0.149	S	C	.	.	I	π-helix	trans	-64.4	-35.9	177.8	-70.8	169.1	0	0	0	112.4	L740 V1277 A1278 Y1279 F1285 F1286	L740-I1281 HydrophobicContact CD2-CG2 4.41Å; V1277-I1281 HydrophobicContact CG1-CD1 3.79Å; V1277-I1281 WeakPolarHBondContact O-CB 3.21Å; V1277-I1281 VanDerWaalsContact O-CG1 3.23Å; V1277-I1281 WeakPolarHBondContact O-CG1 3.36Å; V1277-I1281 PolarHBondContact O-N 2.91Å; A1278-I1281 PolarHBondContact O-N 2.92Å; Y1279-I1281 PolarHBondContact O-N 3.17Å; I1281-F1285 HydrophobicContact CG1-CD2 4.39Å; I1281-F1286 WeakPolarHBondContact O-CB 3.35Å; I1281-F1286 PolarHBondContact O-N 2.92Å
1282	V	81.4	Confident	80.9	Confident	48 Å²	48	21.8 Å²	21.8	29%	0.291	12%	0.12	S	C	.	.	I	π-helix	trans	-84.2	-41.6	-176.5	173.1	0	0	0	0	113.3	F1173 A1278 Y1279 I1280 F1286 M1287	F1173-V1282 HydrophobicContact CE2-CB 4.33Å; F1173-V1282 HydrophobicContact CE2-CG1 4.1Å; F1173-V1282 HydrophobicContact CZ-CB 4.44Å; A1278-V1282 WeakPolarHBondContact O-CB 3.42Å; A1278-V1282 VanDerWaalsContact O-CG2 3.31Å; A1278-V1282 WeakPolarHBondContact O-CG2 3.49Å; A1278-V1282 PolarHBondContact O-N 3Å; Y1279-V1282 PolarHBondContact O-N 2.97Å; I1280-V1282 VanDerWaalsContact C-N 3.35Å; I1280-V1282 PolarHBondContact O-N 2.92Å; V1282-F1286 WeakPolarHBondContact O-CB 3.28Å; V1282-M1287 WeakPolarHBondContact O-CG 3.05Å; V1282-M1287 PolarHBondContact O-N 3.48Å
1283	I	84.4	Confident	79.9	Confident	2 Å²	2	21 Å²	21	1%	0.01	12%	0.115	C	C	.	.	I	π-helix	trans	-92.1	-71.8	-178.7	-57.8	-56.8	0	0	0	110.4	T1166 L1169 Y1279 F1285 M1287 I1288	T1166-I1283 HydrophobicContact CG2-CD1 4.43Å; T1166-I1283 HydrophobicContact CG2-CG2 4.1Å; L1169-I1283 HydrophobicContact CB-CD1 3.72Å; L1169-I1283 HydrophobicContact CD1-CD1 4.41Å; Y1279-I1283 HydrophobicContact CD2-CG1 3.88Å; Y1279-I1283 HydrophobicContact CE2-CB 4.26Å; Y1279-I1283 HydrophobicContact CE2-CG1 3.45Å; Y1279-I1283 VanDerWaalsContact CE2-CG1 3.45Å; Y1279-I1283 PolarHBondContact O-N 2.91Å; I1283-F1285 PolarHBondContact O-N 2.77Å; I1283-M1287 HydrophobicContact CD1-CG 4.26Å; I1283-M1287 PolarHBondContact O-N 3.2Å; I1283-I1288 PolarHBondContact O-N 3Å
1284	A	74.9	Confident	78.9	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.008	12%	0.12	C	C	.	.	I	π-helix	trans	-61.1	-44.9	-169.1	0	0	0	0	0	112.9	S1242 F1244 I1280 I2467 W2469	S1242-A1284 WeakPolarHBondContact O-CB 3.39Å; F1244-A1284 HydrophobicContact CE1-CB 3.37Å; F1244-A1284 HydrophobicContact CZ-CB 3.5Å; I1280-A1284 HydrophobicContact CG2-CB 4.48Å; I1280-A1284 WeakPolarHBondContact O-CB 3.33Å; I1280-A1284 PolarHBondContact O-N 2.99Å; A1284-I2467 HydrophobicContact CB-CD1 3.71Å; A1284-W2469 PolarHBondContact O-NE1 3.3Å
1285	F	71.1	Confident	77.9	Confident	20 Å²	20	17.4 Å²	17.4	9%	0.088	9%	0.093	C	C	.	.	I	π-helix	trans	-75.1	-60.9	173	-78	-75.9	0	0	0	111.8	F785 L829 F832 F1244 I1280 I1281 I1283 N1289 W2469	F785-F1285 HydrophobicContact CZ-CE2 4.44Å; L829-F1285 HydrophobicContact CD1-CE1 3.92Å; L829-F1285 HydrophobicContact CG-CE1 3.99Å; F832-F1285 HydrophobicContact CD1-CD1 4.34Å; F832-F1285 HydrophobicContact CE1-CB 3.78Å; F832-F1285 HydrophobicContact CE1-CD1 4.38Å; F832-F1285 WeakPolarHBondContact CE1-O 3.45Å; F832-F1285 HydrophobicContact CZ-CB 4.43Å; F1244-F1285 HydrophobicContact CZ-CE2 4.33Å; I1280-F1285 HydrophobicContact CG2-CD2 3.6Å; I1280-F1285 HydrophobicContact CG2-CE2 3.53Å; I1280-F1285 WeakPolarHBondContact O-CD2 3.49Å; I1280-F1285 PolarHBondContact O-N 3.47Å; I1281-F1285 HydrophobicContact CG1-CD2 4.39Å; I1283-F1285 PolarHBondContact O-N 2.77Å; F1285-N1289 WeakPolarHBondContact O-CB 3.1Å; F1285-N1289 PolarHBondContact O-N 2.88Å; F1285-N1289 PolarHBondContact O-ND2 3.08Å; F1285-N1289 PolarHBondContact O-OD1 2.97Å; F1285-W2469 HydrophobicContact CB-CZ2 4.48Å; F1285-W2469 AromaticContact CD1-CH2 3.75Å; F1285-W2469 HydrophobicContact CD1-CH2 3.75Å; F1285-W2469 AromaticContact CD1-CZ2 3.61Å; F1285-W2469 HydrophobicContact CD1-CZ2 3.61Å; F1285-W2469 HydrophobicContact CE1-CH2 4.26Å; F1285-W2469 HydrophobicContact CE1-CZ2 4.22Å; F1285-W2469 HydrophobicContact CG-CZ2 4.35Å
1286	F	72.7	Confident	76.8	Confident	39 Å²	39	16.8 Å²	16.8	17%	0.171	9%	0.091	C	C	.	.	I	π-helix	trans	-84.7	-48.1	-163	179.9	-125.8	0	0	0	114.8	L729 I736 F832 I1281 V1282 I1290	L729-F1286 HydrophobicContact CB-CZ 3.94Å; L729-F1286 HydrophobicContact CD1-CE1 3.72Å; L729-F1286 HydrophobicContact CD1-CZ 3.63Å; L729-F1286 HydrophobicContact CD2-CE1 4.45Å; L729-F1286 HydrophobicContact CD2-CE2 3.86Å; L729-F1286 HydrophobicContact CD2-CZ 3.57Å; L729-F1286 HydrophobicContact CG-CE1 4.44Å; L729-F1286 HydrophobicContact CG-CZ 3.86Å; I736-F1286 HydrophobicContact CD1-CD2 4.35Å; I736-F1286 HydrophobicContact CD1-CE2 3.62Å; I736-F1286 HydrophobicContact CD1-CZ 4.37Å; F832-F1286 HydrophobicContact CZ-CB 4.19Å; F832-F1286 HydrophobicContact CZ-CD2 4.11Å; I1281-F1286 WeakPolarHBondContact O-CB 3.35Å; I1281-F1286 PolarHBondContact O-N 2.92Å; V1282-F1286 WeakPolarHBondContact O-CB 3.28Å; F1286-I1290 HydrophobicContact CD1-CD1 4.33Å; F1286-I1290 HydrophobicContact CD2-CD1 4.15Å; F1286-I1290 HydrophobicContact CE1-CD1 4.32Å; F1286-I1290 HydrophobicContact CE2-CD1 4.11Å; F1286-I1290 HydrophobicContact CG-CD1 4.29Å; F1286-I1290 HydrophobicContact CZ-CD1 4.24Å; F1286-I1290 VanDerWaalsContact O-CD1 3.3Å; F1286-I1290 WeakPolarHBondContact O-CD1 3.25Å; F1286-I1290 VanDerWaalsContact O-CG1 3.28Å; F1286-I1290 WeakPolarHBondContact O-CG1 3.04Å; F1286-I1290 PolarHBondContact O-N 3.28Å
1287	M	73.4	Confident	75.6	Confident	8 Å²	8	17.6 Å²	17.6	4%	0.039	10%	0.096	C	C	.	.	I	π-helix	trans	-69.2	-37.8	-178.9	-73.5	-70.1	140	0	0	112.8	L729 V1165 T1166 L1169 V1282 I1283 I1290 F1291	L729-M1287 HydrophobicContact CD1-CE 4.14Å; V1165-M1287 HydrophobicContact CG1-SD 4.4Å; T1166-M1287 HydrophobicContact CG2-CB 4.13Å; L1169-M1287 HydrophobicContact CD1-CE 3.66Å; L1169-M1287 HydrophobicContact CD1-CG 4.07Å; L1169-M1287 HydrophobicContact CD1-SD 3.96Å; V1282-M1287 WeakPolarHBondContact O-CG 3.05Å; V1282-M1287 PolarHBondContact O-N 3.48Å; I1283-M1287 HydrophobicContact CD1-CG 4.26Å; I1283-M1287 PolarHBondContact O-N 3.2Å; M1287-I1290 HydrophobicContact CE-CD1 4.11Å; M1287-I1290 WeakPolarHBondContact O-CB 3.24Å; M1287-I1290 PolarHBondContact O-N 3.25Å; M1287-I1290 VanDerWaalsContact O-N 3.17Å; M1287-I1290 HydrophobicContact SD-CD1 4.29Å; M1287-F1291 PolarHBondContact O-N 3.36Å; M1287-F1291 VanDerWaalsContact O-N 3.12Å
1288	I	71.1	Confident	74.7	Confident	19 Å²	19	16.4 Å²	16.4	10%	0.097	9%	0.089	C	C	.	.	H	α-helix	trans	-72.8	-32.3	-179.5	-51.3	-178	0	0	0	111.1	I1283 I1290 F1291 V1292 I2467 M2468 W2469	I1283-I1288 PolarHBondContact O-N 3Å; I1288-I1290 VanDerWaalsContact C-N 3.25Å; I1288-I1290 PolarHBondContact O-N 2.95Å; I1288-F1291 WeakPolarHBondContact O-CB 3.39Å; I1288-F1291 PolarHBondContact O-N 3.05Å; I1288-V1292 PolarHBondContact O-N 2.79Å; I1288-I2467 HydrophobicContact CB-CG2 4.46Å; I1288-I2467 HydrophobicContact CD1-CB 4.19Å; I1288-I2467 HydrophobicContact CD1-CG2 3.69Å; I1288-I2467 HydrophobicContact CG2-CG2 4.26Å; I1288-M2468 HydrophobicContact CG2-CB 4.25Å; I1288-M2468 HydrophobicContact CG2-CE 3.7Å; I1288-M2468 HydrophobicContact CG2-CG 3.44Å; I1288-M2468 VanDerWaalsContact CG2-CG 3.44Å; I1288-M2468 HydrophobicContact CG2-SD 3.63Å; I1288-W2469 VanDerWaalsContact CG2-CD1 3.47Å; I1288-W2469 HydrophobicContact CG2-CG 4.4Å
1289	N	69.2	Low	73.7	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.4	-36.6	167.8	-78	6	0	0	0	113.5	F832 L833 A836 F1285 V1292 G1293 W2469	F832-N1289 WeakPolarHBondContact CD1-ND2 3.32Å; F832-N1289 WeakPolarHBondContact CE1-ND2 3.5Å; L833-N1289 WeakPolarHBondContact CA-ND2 3.04Å; L833-N1289 HydrophobicContact CD2-CB 4.3Å; L833-N1289 HydrophobicContact CG-CB 4.37Å; A836-N1289 HydrophobicContact CB-CB 3.74Å; F1285-N1289 WeakPolarHBondContact O-CB 3.1Å; F1285-N1289 PolarHBondContact O-N 2.88Å; F1285-N1289 PolarHBondContact O-ND2 3.08Å; F1285-N1289 PolarHBondContact O-OD1 2.97Å; N1289-V1292 PolarHBondContact O-N 3.04Å; N1289-G1293 PolarHBondContact O-N 3.37Å; N1289-W2469 WeakPolarHBondContact ND2-CH2 3.26Å; N1289-W2469 WeakPolarHBondContact ND2-CZ3 3.29Å; N1289-W2469 WeakPolarHBondContact OD1-CH2 3.18Å; N1289-W2469 VanDerWaalsContact OD1-CZ2 3.3Å; N1289-W2469 WeakPolarHBondContact OD1-CZ2 3.36Å; N1289-W2469 WeakPolarHBondContact OD1-CZ3 3.48Å
1290	I	71.5	Confident	72.5	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-69.5	-38.1	178.7	-65.5	158.3	0	0	0	110.7	L725 L729 L840 I1162 F1286 M1287 I1288 F1294	L725-I1290 HydrophobicContact CD1-CG2 3.97Å; L729-I1290 HydrophobicContact CD1-CD1 3.88Å; L729-I1290 HydrophobicContact CD2-CD1 3.62Å; L729-I1290 HydrophobicContact CD2-CG1 4.25Å; L729-I1290 HydrophobicContact CG-CD1 4.38Å; L840-I1290 HydrophobicContact CD1-CB 4.03Å; L840-I1290 HydrophobicContact CD1-CG1 3.97Å; L840-I1290 HydrophobicContact CD1-CG2 3.97Å; L840-I1290 HydrophobicContact CD2-CG1 4.47Å; L840-I1290 HydrophobicContact CD2-CG2 3.92Å; I1162-I1290 HydrophobicContact CD1-CG2 4.29Å; I1162-I1290 HydrophobicContact CG2-CG2 4.06Å; F1286-I1290 HydrophobicContact CD1-CD1 4.33Å; F1286-I1290 HydrophobicContact CD2-CD1 4.15Å; F1286-I1290 HydrophobicContact CE1-CD1 4.32Å; F1286-I1290 HydrophobicContact CE2-CD1 4.11Å; F1286-I1290 HydrophobicContact CG-CD1 4.29Å; F1286-I1290 HydrophobicContact CZ-CD1 4.24Å; F1286-I1290 VanDerWaalsContact O-CD1 3.3Å; F1286-I1290 WeakPolarHBondContact O-CD1 3.25Å; F1286-I1290 VanDerWaalsContact O-CG1 3.28Å; F1286-I1290 WeakPolarHBondContact O-CG1 3.04Å; F1286-I1290 PolarHBondContact O-N 3.28Å; M1287-I1290 HydrophobicContact CE-CD1 4.11Å; M1287-I1290 WeakPolarHBondContact O-CB 3.24Å; M1287-I1290 PolarHBondContact O-N 3.25Å; M1287-I1290 VanDerWaalsContact O-N 3.17Å; M1287-I1290 HydrophobicContact SD-CD1 4.29Å; I1288-I1290 VanDerWaalsContact C-N 3.25Å; I1288-I1290 PolarHBondContact O-N 2.95Å; I1290-F1294 VanDerWaalsContact O-CB 3.25Å; I1290-F1294 WeakPolarHBondContact O-CB 3.29Å; I1290-F1294 PolarHBondContact O-N 3.17Å; I1290-F1294 VanDerWaalsContact O-N 3.11Å
1291	F	70.8	Confident	71.6	Confident	19 Å²	19	21.1 Å²	21.1	8%	0.083	10%	0.103	C	C	.	.	H	α-helix	trans	-58.5	-54.5	170.1	-169.9	-63.2	0	0	0	110.9	I1159 M1287 I1288 F1294 V1295 F1770 I1773 M2468	I1159-F1291 HydrophobicContact CD1-CE1 3.96Å; I1159-F1291 HydrophobicContact CD1-CZ 4.07Å; I1159-F1291 HydrophobicContact CG1-CE1 4.48Å; I1159-F1291 HydrophobicContact CG1-CZ 4.5Å; I1159-F1291 HydrophobicContact CG2-CD2 3.79Å; I1159-F1291 HydrophobicContact CG2-CE1 4.27Å; I1159-F1291 HydrophobicContact CG2-CE2 3.24Å; I1159-F1291 HydrophobicContact CG2-CZ 3.53Å; M1287-F1291 PolarHBondContact O-N 3.36Å; M1287-F1291 VanDerWaalsContact O-N 3.12Å; I1288-F1291 WeakPolarHBondContact O-CB 3.39Å; I1288-F1291 PolarHBondContact O-N 3.05Å; F1291-F1294 WeakPolarHBondContact O-CB 3.27Å; F1291-F1294 PolarHBondContact O-N 2.69Å; F1291-F1294 VanDerWaalsContact O-N 3.17Å; F1291-V1295 HydrophobicContact CD1-CG2 3.7Å; F1291-V1295 HydrophobicContact CE1-CG2 3.69Å; F1291-V1295 WeakPolarHBondContact O-CG2 3.39Å; F1291-V1295 PolarHBondContact O-N 3.34Å; F1291-F1770 AromaticContact CE1-CD2 3.88Å; F1291-F1770 HydrophobicContact CE1-CD2 3.88Å; F1291-F1770 HydrophobicContact CE1-CE2 4.25Å; F1291-F1770 AromaticContact CZ-CD2 3.8Å; F1291-F1770 HydrophobicContact CZ-CD2 3.8Å; F1291-F1770 HydrophobicContact CZ-CE2 4.28Å; F1291-I1773 HydrophobicContact CE1-CD1 4.24Å; F1291-M2468 HydrophobicContact CB-SD 4.18Å; F1291-M2468 HydrophobicContact CD1-CE 4.21Å; F1291-M2468 HydrophobicContact CD1-SD 3.28Å; F1291-M2468 WeakPolarHBondContact CD1-SD 3.31Å; F1291-M2468 HydrophobicContact CD2-CE 4.3Å; F1291-M2468 HydrophobicContact CD2-SD 4.33Å; F1291-M2468 HydrophobicContact CE1-CE 4.2Å; F1291-M2468 HydrophobicContact CE1-SD 3.55Å; F1291-M2468 VanDerWaalsContact CE1-SD 3.55Å; F1291-M2468 HydrophobicContact CE2-CE 4.27Å; F1291-M2468 HydrophobicContact CG-CE 4.27Å; F1291-M2468 HydrophobicContact CG-SD 3.72Å; F1291-M2468 HydrophobicContact CZ-CE 4.22Å; F1291-M2468 HydrophobicContact CZ-SD 4.18Å
1292	V	68.2	Low	70.9	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.9	-41.3	-175.9	173.9	0	0	0	0	112.7	L833 I1288 N1289 F1294 V1295 I1296 I1773 M2468 W2469	L833-V1292 HydrophobicContact CD1-CG1 4.07Å; L833-V1292 HydrophobicContact CD2-CG1 4.49Å; I1288-V1292 PolarHBondContact O-N 2.79Å; N1289-V1292 PolarHBondContact O-N 3.04Å; V1292-F1294 PolarHBondContact O-N 2.86Å; V1292-V1295 PolarHBondContact O-N 2.71Å; V1292-V1295 VanDerWaalsContact O-N 3.17Å; V1292-I1296 HydrophobicContact CG1-CD1 3.84Å; V1292-I1296 HydrophobicContact CG1-CG1 4.35Å; V1292-I1296 WeakPolarHBondContact O-CG1 2.53Å; V1292-I1296 PolarHBondContact O-N 2.64Å; V1292-I1773 HydrophobicContact CG1-CG2 4.19Å; V1292-I1773 HydrophobicContact CG2-CG2 4.07Å; V1292-M2468 HydrophobicContact CG2-CG 3.35Å; V1292-M2468 HydrophobicContact CG2-SD 3.68Å; V1292-W2469 HydrophobicContact CB-CB 4.36Å; V1292-W2469 WeakPolarHBondContact CG1-O 3.39Å; V1292-W2469 HydrophobicContact CG2-CB 3.7Å; V1292-W2469 WeakPolarHBondContact CG2-O 3.3Å
1293	G	68.8	Low	70.1	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.6	-36.4	173.9	0	0	0	0	0	112.3	N1289 V1297	N1289-G1293 PolarHBondContact O-N 3.37Å; G1293-V1297 VanDerWaalsContact O-CG2 3.31Å; G1293-V1297 WeakPolarHBondContact O-CG2 3.45Å; G1293-V1297 PolarHBondContact O-N 2.93Å
1294	F	70.4	Confident	69.1	Low	56 Å²	56	26 Å²	26	25%	0.246	13%	0.132	C	C	.	.	H	α-helix	trans	-71.9	-37.8	174.9	-166.7	-82.3	0	0	0	113.1	S1158 I1159 I1162 I1290 F1291 V1292 V1297 T1298	S1158-F1294 WeakPolarHBondContact OG-CE1 3.39Å; I1159-F1294 HydrophobicContact CG1-CD1 4.27Å; I1162-F1294 HydrophobicContact CD1-CB 3.74Å; I1162-F1294 HydrophobicContact CD1-CD1 4.26Å; I1162-F1294 HydrophobicContact CD1-CD2 3.88Å; I1162-F1294 HydrophobicContact CD1-CG 3.65Å; I1290-F1294 VanDerWaalsContact O-CB 3.25Å; I1290-F1294 WeakPolarHBondContact O-CB 3.29Å; I1290-F1294 PolarHBondContact O-N 3.17Å; I1290-F1294 VanDerWaalsContact O-N 3.11Å; F1291-F1294 WeakPolarHBondContact O-CB 3.27Å; F1291-F1294 PolarHBondContact O-N 2.69Å; F1291-F1294 VanDerWaalsContact O-N 3.17Å; V1292-F1294 PolarHBondContact O-N 2.86Å; F1294-V1297 PolarHBondContact O-N 3.06Å; F1294-T1298 HydrophobicContact CD1-CG2 4.09Å; F1294-T1298 HydrophobicContact CE1-CG2 3.36Å; F1294-T1298 HydrophobicContact CZ-CG2 3.73Å; F1294-T1298 PolarHBondContact O-N 2.9Å; F1294-T1298 PolarHBondContact O-OG1 3.18Å
1295	V	68.8	Low	68.7	Low	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.2	-48.1	170.5	175	0	0	0	0	110.3	I1159 F1291 V1292 V1297 T1298 F1299 I1773 V1777	I1159-V1295 HydrophobicContact CD1-CG2 3.74Å; I1159-V1295 HydrophobicContact CG1-CG2 4.41Å; F1291-V1295 HydrophobicContact CD1-CG2 3.7Å; F1291-V1295 HydrophobicContact CE1-CG2 3.69Å; F1291-V1295 WeakPolarHBondContact O-CG2 3.39Å; F1291-V1295 PolarHBondContact O-N 3.34Å; V1292-V1295 PolarHBondContact O-N 2.71Å; V1292-V1295 VanDerWaalsContact O-N 3.17Å; V1295-V1297 PolarHBondContact O-N 3.37Å; V1295-T1298 PolarHBondContact O-N 3.4Å; V1295-T1298 PolarHBondContact O-OG1 3.13Å; V1295-T1298 VanDerWaalsContact O-OG1 3.12Å; V1295-F1299 HydrophobicContact CG1-CD2 3.76Å; V1295-F1299 HydrophobicContact CG1-CE2 3.99Å; V1295-F1299 WeakPolarHBondContact O-CD2 3.49Å; V1295-F1299 PolarHBondContact O-N 3.35Å; V1295-I1773 HydrophobicContact CG1-CG2 4.42Å; V1295-V1777 HydrophobicContact CG1-CB 4.34Å; V1295-V1777 HydrophobicContact CG1-CG1 4.37Å; V1295-V1777 HydrophobicContact CG1-CG2 4.03Å
1296	I	67.3	Low	68.2	Low	13 Å²	13	34.8 Å²	34.8	7%	0.067	17%	0.173	C	C	.	.	H	α-helix	trans	-57.6	-49.5	177.3	-70.4	166.8	0	0	0	110.8	V837 V1292 T1298 F1299 Q1300 V1777	V837-I1296 HydrophobicContact CG2-CD1 4.04Å; V1292-I1296 HydrophobicContact CG1-CD1 3.84Å; V1292-I1296 HydrophobicContact CG1-CG1 4.35Å; V1292-I1296 WeakPolarHBondContact O-CG1 2.53Å; V1292-I1296 PolarHBondContact O-N 2.64Å; I1296-T1298 PolarHBondContact O-N 2.86Å; I1296-F1299 PolarHBondContact O-N 2.93Å; I1296-Q1300 HydrophobicContact CG2-CG 4.4Å; I1296-Q1300 WeakPolarHBondContact O-CB 3.38Å; I1296-Q1300 VanDerWaalsContact O-CG 3.25Å; I1296-Q1300 WeakPolarHBondContact O-CG 3.42Å; I1296-Q1300 PolarHBondContact O-N 2.67Å; I1296-V1777 HydrophobicContact CD1-CG2 4.47Å; I1296-V1777 HydrophobicContact CG1-CG1 4.1Å; I1296-V1777 HydrophobicContact CG1-CG2 3.6Å
1297	V	67.4	Low	67.6	Low	16 Å²	16	36.3 Å²	36.3	10%	0.097	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-38.1	-179.2	169.6	0	0	0	0	112.1	A841 G1293 F1294 V1295 Q1300 Q1301	A841-V1297 HydrophobicContact CB-CG2 3.94Å; G1293-V1297 VanDerWaalsContact O-CG2 3.31Å; G1293-V1297 WeakPolarHBondContact O-CG2 3.45Å; G1293-V1297 PolarHBondContact O-N 2.93Å; F1294-V1297 PolarHBondContact O-N 3.06Å; V1295-V1297 PolarHBondContact O-N 3.37Å; V1297-Q1300 WeakPolarHBondContact O-CB 3.43Å; V1297-Q1300 PolarHBondContact O-N 3.43Å; V1297-Q1301 WeakPolarHBondContact O-CG 3.34Å; V1297-Q1301 PolarHBondContact O-N 3.04Å
1298	T	68.6	Low	66.9	Low	13 Å²	13	42 Å²	42	8%	0.08	20%	0.199	C	C	.	.	H	α-helix	trans	-72.9	-37.9	177.5	45	0	0	0	0	113.2	F1294 V1295 I1296 Q1300 Q1301 E1302	F1294-T1298 HydrophobicContact CD1-CG2 4.09Å; F1294-T1298 HydrophobicContact CE1-CG2 3.36Å; F1294-T1298 HydrophobicContact CZ-CG2 3.73Å; F1294-T1298 PolarHBondContact O-N 2.9Å; F1294-T1298 PolarHBondContact O-OG1 3.18Å; V1295-T1298 PolarHBondContact O-N 3.4Å; V1295-T1298 PolarHBondContact O-OG1 3.13Å; V1295-T1298 VanDerWaalsContact O-OG1 3.12Å; I1296-T1298 PolarHBondContact O-N 2.86Å; T1298-Q1300 VanDerWaalsContact C-N 3.31Å; T1298-Q1301 PolarHBondContact O-N 3.03Å; T1298-E1302 PolarHBondContact O-N 2.87Å
1299	F	66.7	Low	66.4	Low	38 Å²	38	45.6 Å²	45.6	17%	0.167	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-29.7	170.1	-87.3	-87.4	0	0	0	112.6	C1151 V1295 I1296 G1303 N1774 V1777 M1781	C1151-F1299 HydrophobicContact CB-CE1 4.48Å; V1295-F1299 HydrophobicContact CG1-CD2 3.76Å; V1295-F1299 HydrophobicContact CG1-CE2 3.99Å; V1295-F1299 WeakPolarHBondContact O-CD2 3.49Å; V1295-F1299 PolarHBondContact O-N 3.35Å; I1296-F1299 PolarHBondContact O-N 2.93Å; F1299-G1303 PolarHBondContact O-N 2.73Å; F1299-N1774 HydrophobicContact CE2-CB 4.4Å; F1299-N1774 VanDerWaalsContact CE2-OD1 3.31Å; F1299-N1774 WeakPolarHBondContact CE2-OD1 3.38Å; F1299-N1774 HydrophobicContact CZ-CB 4.27Å; F1299-V1777 HydrophobicContact CB-CG1 3.65Å; F1299-V1777 HydrophobicContact CD2-CG1 4.08Å; F1299-V1777 HydrophobicContact CG-CG1 3.94Å; F1299-M1781 HydrophobicContact CB-CG 4.48Å
1300	Q	66.6	Low	66.1	Low	45 Å²	45	46.6 Å²	46.6	21%	0.21	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-50.2	168.3	-77.7	172.4	-8.9	0	0	111.3	I1296 V1297 T1298 E1302 G1303 E1304 M1781	I1296-Q1300 HydrophobicContact CG2-CG 4.4Å; I1296-Q1300 WeakPolarHBondContact O-CB 3.38Å; I1296-Q1300 VanDerWaalsContact O-CG 3.25Å; I1296-Q1300 WeakPolarHBondContact O-CG 3.42Å; I1296-Q1300 PolarHBondContact O-N 2.67Å; V1297-Q1300 WeakPolarHBondContact O-CB 3.43Å; V1297-Q1300 PolarHBondContact O-N 3.43Å; T1298-Q1300 VanDerWaalsContact C-N 3.31Å; Q1300-E1302 PolarHBondContact O-N 2.84Å; Q1300-G1303 PolarHBondContact O-N 3.3Å; Q1300-E1304 WeakPolarHBondContact O-CB 3.48Å; Q1300-E1304 WeakPolarHBondContact O-CG 3.28Å; Q1300-E1304 PolarHBondContact O-N 2.73Å; Q1300-M1781 HydrophobicContact CB-CE 4.32Å; Q1300-M1781 HydrophobicContact CB-SD 4.42Å; Q1300-M1781 HydrophobicContact CG-CE 3.77Å; Q1300-M1781 HydrophobicContact CG-SD 3.36Å; Q1300-M1781 WeakPolarHBondContact CG-SD 3.29Å
1301	Q	69	Low	65.9	Low	55 Å²	55	50.2 Å²	50.2	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-60.7	-45.3	178.7	-75	169.7	-37.5	0	0	112.6	E848 V1297 T1298 Q1305	E848-Q1301 PolarHBondContact OE1-NE2 2.82Å; V1297-Q1301 WeakPolarHBondContact O-CG 3.34Å; V1297-Q1301 PolarHBondContact O-N 3.04Å; T1298-Q1301 PolarHBondContact O-N 3.03Å; Q1301-Q1305 PolarHBondContact O-N 3.34Å; Q1301-Q1305 VanDerWaalsContact O-N 3.14Å
1302	E	67.7	Low	66	Low	76 Å²	76	50.1 Å²	50.1	36%	0.355	24%	0.242	S	C	.	.	H	α-helix	trans	-68.6	-37.7	176.4	-71.9	-67.7	132.4	0	0	112.2	T1298 Q1300 Q1305	T1298-E1302 PolarHBondContact O-N 2.87Å; Q1300-E1302 PolarHBondContact O-N 2.84Å; E1302-Q1305 WeakPolarHBondContact O-CB 3.27Å; E1302-Q1305 PolarHBondContact O-N 2.84Å
1303	G	64.1	Low	66	Low	36 Å²	36	53.8 Å²	53.8	37%	0.371	26%	0.262	S	S	.	.	H	α-helix	trans	-69.4	-33.5	175.6	0	0	0	0	0	113.9	F1299 Q1300 Q1305 Y1307	F1299-G1303 PolarHBondContact O-N 2.73Å; Q1300-G1303 PolarHBondContact O-N 3.3Å; G1303-Q1305 VanDerWaalsContact C-N 3.31Å; G1303-Y1307 WeakPolarHBondContact O-CD2 3.4Å
1304	E	63.8	Low	66.2	Low	92 Å²	92	56.2 Å²	56.2	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-78.9	-11.8	173.6	-73	-170.5	173.1	0	0	113.4	Q1300 E1306 Y1307 R1308	Q1300-E1304 WeakPolarHBondContact O-CB 3.48Å; Q1300-E1304 WeakPolarHBondContact O-CG 3.28Å; Q1300-E1304 PolarHBondContact O-N 2.73Å; E1304-E1306 VanDerWaalsContact C-N 3.27Å; E1304-E1306 PolarHBondContact O-N 3.39Å; E1304-Y1307 CarbonylContact O-C 3.58Å; E1304-Y1307 WeakPolarHBondContact O-CA 3.28Å; E1304-Y1307 WeakPolarHBondContact O-CB 3.48Å; E1304-Y1307 PolarHBondContact O-N 3.23Å; E1304-R1308 PolarHBondContact O-N 3.38Å
1305	Q	66.1	Low	66.3	Low	57 Å²	57	56.5 Å²	56.5	27%	0.266	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-32.5	-178	-152.7	74.2	-85.8	0	0	112.8	Q1301 E1302 G1303 Y1307	Q1301-Q1305 PolarHBondContact O-N 3.34Å; Q1301-Q1305 VanDerWaalsContact O-N 3.14Å; E1302-Q1305 WeakPolarHBondContact O-CB 3.27Å; E1302-Q1305 PolarHBondContact O-N 2.84Å; G1303-Q1305 VanDerWaalsContact C-N 3.31Å; Q1305-Y1307 PolarHBondContact O-N 3.37Å
1306	E	59.4	Low	66.8	Low	147 Å²	147	57.9 Å²	57.9	69%	0.687	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-15.6	172.4	-169.4	171.2	-163.6	0	0	112.7	E1304	E1304-E1306 VanDerWaalsContact C-N 3.27Å; E1304-E1306 PolarHBondContact O-N 3.39Å
1307	Y	60.8	Low	67.4	Low	72 Å²	72	58.2 Å²	58.2	28%	0.282	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-33.6	-176	-61.5	-94.6	0	0	0	113.8	G1303 E1304 Q1305 N1309 C1310 K1314 R1317	G1303-Y1307 WeakPolarHBondContact O-CD2 3.4Å; E1304-Y1307 CarbonylContact O-C 3.58Å; E1304-Y1307 WeakPolarHBondContact O-CA 3.28Å; E1304-Y1307 WeakPolarHBondContact O-CB 3.48Å; E1304-Y1307 PolarHBondContact O-N 3.23Å; Q1305-Y1307 PolarHBondContact O-N 3.37Å; Y1307-N1309 PolarHBondContact O-N 3.21Å; Y1307-C1310 PolarHBondContact O-N 3.2Å; Y1307-K1314 HydrophobicContact CD1-CG 4.46Å; Y1307-K1314 HydrophobicContact CE1-CG 4.23Å; Y1307-R1317 VanDerWaalsContact CD1-CZ 3.43Å
1308	R	58.8	Low	67.9	Low	127 Å²	127	61.4 Å²	61.4	48%	0.479	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-24	-176	-86.5	-167.8	174.1	-158.4	-0.4	115	E848 E1304	E848-R1308 IonicContact OE1-NH2 3.75Å; E848-R1308 PolarHBondContact OE1-NH2 2.94Å; E848-R1308 IonicContact OE2-CZ 2.68Å; E848-R1308 IonicContact OE2-NH1 3.2Å; E848-R1308 PolarHBondContact OE2-NH1 2.96Å; E848-R1308 IonicContact OE2-NH2 3.35Å; E848-R1308 PolarHBondContact OE2-NH2 3.31Å; E1304-R1308 PolarHBondContact O-N 3.38Å
1309	N	60.8	Low	68.6	Low	94 Å²	94	61.2 Å²	61.2	50%	0.503	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	19.7	-178	-61.5	-72.1	0	0	0	115.1	Y1307	Y1307-N1309 PolarHBondContact O-N 3.21Å
1310	C	63.2	Low	69.3	Low	22 Å²	22	59.5 Å²	59.5	15%	0.149	29%	0.288	C	S	.	.			trans	-135.5	126.7	-171.2	-62.2	0	0	0	0	113.6	Y1307 L1312 R1317 V2304 Y2305	Y1307-C1310 PolarHBondContact O-N 3.2Å; C1310-L1312 VanDerWaalsContact C-N 3.31Å; C1310-L1312 PolarHBondContact O-N 3.4Å; C1310-R1317 PolarHBondContact SG-NH2 3.36Å; C1310-R1317 VanDerWaalsContact SG-NH2 3.42Å; C1310-V2304 HydrophobicContact CB-CG2 3.84Å; C1310-Y2305 HydrophobicContact CB-CE2 4.02Å; C1310-Y2305 VanDerWaalsContact SG-CE2 3.56Å
1311	E	67.1	Low	70.1	Confident	77 Å²	77	60.1 Å²	60.1	36%	0.36	29%	0.291	S	S	.	.	S	Bend	trans	-71	17.7	-170.9	-37.2	97.9	-154.8	0	0	118.6	V1885 K1888 T2303 V2304	E1311-V1885 VanDerWaalsContact OE2-CG1 3.24Å; E1311-V1885 WeakPolarHBondContact OE2-CG1 3.45Å; E1311-K1888 IonicContact OE1-NZ 2.75Å; E1311-T2303 WeakPolarHBondContact O-CA 3.4Å; E1311-T2303 VanDerWaalsContact O-CG2 3.29Å; E1311-T2303 WeakPolarHBondContact O-CG2 3.46Å; E1311-T2303 PolarHBondContact O-N 2.88Å; E1311-V2304 HydrophobicContact CB-CG2 4.19Å; E1311-V2304 PolarHBondContact OE2-N 2.94Å
1312	L	71.7	Confident	70.8	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.084	29%	0.289	C	S	.	.	S	Bend	trans	-136.3	141.1	-169.1	176.5	95	0	0	0	111	C1310 Q1316 R1317 I1320 I1877 T2303 V2304	C1310-L1312 VanDerWaalsContact C-N 3.31Å; C1310-L1312 PolarHBondContact O-N 3.4Å; L1312-Q1316 HydrophobicContact CD1-CB 3.26Å; L1312-Q1316 HydrophobicContact CD1-CG 4.15Å; L1312-Q1316 HydrophobicContact CD2-CB 4.23Å; L1312-Q1316 HydrophobicContact CG-CB 3.64Å; L1312-R1317 HydrophobicContact CD2-CB 3.6Å; L1312-R1317 HydrophobicContact CD2-CG 4.08Å; L1312-I1320 HydrophobicContact CD1-CD1 4.06Å; L1312-I1320 HydrophobicContact CD2-CD1 4.25Å; L1312-I1877 HydrophobicContact CD1-CD1 4.37Å; L1312-T2303 HydrophobicContact CB-CG2 4.23Å; L1312-T2303 HydrophobicContact CD1-CG2 4.01Å; L1312-T2303 VanDerWaalsContact CD1-OG1 3.28Å; L1312-T2303 WeakPolarHBondContact CD1-OG1 3.46Å; L1312-V2304 HydrophobicContact CB-CB 3.14Å; L1312-V2304 HydrophobicContact CB-CG1 3.61Å; L1312-V2304 HydrophobicContact CB-CG2 3.2Å; L1312-V2304 HydrophobicContact CD1-CB 4.45Å; L1312-V2304 HydrophobicContact CD2-CB 3.49Å; L1312-V2304 VanDerWaalsContact CD2-CB 3.49Å; L1312-V2304 HydrophobicContact CD2-CG1 3.21Å; L1312-V2304 HydrophobicContact CD2-CG2 4.46Å; L1312-V2304 HydrophobicContact CG-CB 3.82Å; L1312-V2304 HydrophobicContact CG-CG1 4Å; L1312-V2304 HydrophobicContact CG-CG2 4.39Å
1313	D	69	Low	71.6	Confident	77 Å²	77	56.2 Å²	56.2	41%	0.412	27%	0.272	S	S	.	.			trans	-59.7	149.3	174.9	172.5	51.9	0	0	0	112.4	N1315 Q1316 R1317	D1313-N1315 PolarHBondContact O-N 3.24Å; D1313-N1315 WeakPolarHBondContact OD2-CA 3.32Å; D1313-N1315 WeakPolarHBondContact OD2-CB 3.34Å; D1313-N1315 PolarHBondContact OD2-N 3.19Å; D1313-N1315 PolarHBondContact OD2-ND2 3.39Å; D1313-Q1316 HydrophobicContact CB-CG 4.08Å; D1313-Q1316 VanDerWaalsContact N-OE1 3.12Å; D1313-Q1316 PolarHBondContact O-N 3.39Å; D1313-R1317 PolarHBondContact O-N 3.21Å
1314	K	72.9	Confident	72.4	Confident	52 Å²	52	54.8 Å²	54.8	23%	0.226	26%	0.256	C	S	.	.	H	α-helix	trans	-56.2	-37.9	179.5	-139.7	173.8	-167.6	-176.1	0	111.7	Y1307 R1317 K1318 D1785	Y1307-K1314 HydrophobicContact CD1-CG 4.46Å; Y1307-K1314 HydrophobicContact CE1-CG 4.23Å; K1314-R1317 PolarHBondContact O-N 2.8Å; K1314-K1318 WeakPolarHBondContact O-CG 3.18Å; K1314-K1318 PolarHBondContact O-N 3.11Å; K1314-K1318 VanDerWaalsContact O-N 3.13Å; K1314-D1785 WeakPolarHBondContact CD-OD1 3.44Å; K1314-D1785 WeakPolarHBondContact CD-OD2 3.48Å; K1314-D1785 VanDerWaalsContact CE-OD1 3.26Å; K1314-D1785 WeakPolarHBondContact CE-OD1 3.38Å; K1314-D1785 WeakPolarHBondContact CE-OD2 3.32Å; K1314-D1785 IonicContact NZ-OD1 3.34Å; K1314-D1785 PolarHBondContact NZ-OD1 2.97Å; K1314-D1785 IonicContact NZ-OD2 3.99Å; K1314-D1785 PolarHBondContact NZ-OD2 2.66Å
1315	N	71.9	Confident	73.4	Confident	61 Å²	61	56.7 Å²	56.7	33%	0.326	26%	0.263	S	S	.	.	H	α-helix	trans	-73.1	-44.5	178.9	-55.2	-75.9	0	0	0	111.7	D1313 R1317 K1318 C1319 R1789	D1313-N1315 PolarHBondContact O-N 3.24Å; D1313-N1315 WeakPolarHBondContact OD2-CA 3.32Å; D1313-N1315 WeakPolarHBondContact OD2-CB 3.34Å; D1313-N1315 PolarHBondContact OD2-N 3.19Å; D1313-N1315 PolarHBondContact OD2-ND2 3.39Å; N1315-R1317 PolarHBondContact O-N 3.42Å; N1315-K1318 PolarHBondContact O-N 2.69Å; N1315-C1319 WeakPolarHBondContact O-CB 3.23Å; N1315-C1319 PolarHBondContact O-N 2.99Å; N1315-C1319 PolarHBondContact O-SG 3.15Å; N1315-R1789 WeakPolarHBondContact OD1-CD 3.35Å; N1315-R1789 WeakPolarHBondContact OD1-CG 3.49Å
1316	Q	80.4	Confident	74.3	Confident	30 Å²	30	54.5 Å²	54.5	14%	0.14	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-37.4	175.5	-55.3	170.9	-55.7	0	0	110.2	L1312 D1313 K1318 C1319 I1320 L1875 I1877	L1312-Q1316 HydrophobicContact CD1-CB 3.26Å; L1312-Q1316 HydrophobicContact CD1-CG 4.15Å; L1312-Q1316 HydrophobicContact CD2-CB 4.23Å; L1312-Q1316 HydrophobicContact CG-CB 3.64Å; D1313-Q1316 HydrophobicContact CB-CG 4.08Å; D1313-Q1316 VanDerWaalsContact N-OE1 3.12Å; D1313-Q1316 PolarHBondContact O-N 3.39Å; Q1316-K1318 PolarHBondContact O-N 2.98Å; Q1316-C1319 PolarHBondContact O-N 3.48Å; Q1316-I1320 WeakPolarHBondContact O-CB 3.47Å; Q1316-I1320 WeakPolarHBondContact O-CG1 3.22Å; Q1316-I1320 PolarHBondContact O-N 3.06Å; Q1316-L1875 HydrophobicContact CB-CD1 4.28Å; Q1316-L1875 HydrophobicContact CG-CD1 4.24Å; Q1316-I1877 HydrophobicContact CB-CD1 4.2Å; Q1316-I1877 HydrophobicContact CG-CD1 4.45Å
1317	R	80.6	Confident	75.5	Confident	19 Å²	19	55 Å²	55	7%	0.072	25%	0.25	C	C	.	.	H	α-helix	trans	-58.9	-48.2	174.5	-162.2	-171.6	-72.4	-161.4	1	111.3	Y1307 C1310 L1312 D1313 K1314 N1315 I1320 E1321 W1890 V2304	Y1307-R1317 VanDerWaalsContact CD1-CZ 3.43Å; C1310-R1317 PolarHBondContact SG-NH2 3.36Å; C1310-R1317 VanDerWaalsContact SG-NH2 3.42Å; L1312-R1317 HydrophobicContact CD2-CB 3.6Å; L1312-R1317 HydrophobicContact CD2-CG 4.08Å; D1313-R1317 PolarHBondContact O-N 3.21Å; K1314-R1317 PolarHBondContact O-N 2.8Å; N1315-R1317 PolarHBondContact O-N 3.42Å; R1317-I1320 PolarHBondContact O-N 3.43Å; R1317-E1321 VanDerWaalsContact O-CB 3.3Å; R1317-E1321 WeakPolarHBondContact O-CB 3.32Å; R1317-E1321 PolarHBondContact O-N 3.2Å; R1317-W1890 HydrophobicContact CG-CH2 3.58Å; R1317-W1890 HydrophobicContact CG-CZ3 4.03Å; R1317-V2304 HydrophobicContact CG-CG1 4.42Å
1318	K	77.1	Confident	76.8	Confident	84 Å²	84	53.3 Å²	53.3	37%	0.365	25%	0.247	S	C	.	.	H	α-helix	trans	-70.3	-36.8	-178.8	-69.3	-178.9	-175.2	-166	0	112.9	K1314 N1315 Q1316 E1321 F1322 D1785	K1314-K1318 WeakPolarHBondContact O-CG 3.18Å; K1314-K1318 PolarHBondContact O-N 3.11Å; K1314-K1318 VanDerWaalsContact O-N 3.13Å; N1315-K1318 PolarHBondContact O-N 2.69Å; Q1316-K1318 PolarHBondContact O-N 2.98Å; K1318-E1321 PolarHBondContact O-N 3.16Å; K1318-F1322 VanDerWaalsContact O-CB 3.32Å; K1318-F1322 WeakPolarHBondContact O-CB 3.49Å; K1318-F1322 PolarHBondContact O-N 2.65Å; K1318-D1785 WeakPolarHBondContact CE-OD2 3.34Å; K1318-D1785 VanDerWaalsContact NZ-CB 3.26Å; K1318-D1785 VanDerWaalsContact NZ-CG 3.34Å; K1318-D1785 IonicContact NZ-OD2 2.93Å; K1318-D1785 PolarHBondContact NZ-OD2 3.19Å
1319	C	82.5	Confident	78	Confident	9 Å²	9	51.3 Å²	51.3	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-39.9	175.9	-66.5	0	0	0	0	111.9	N1315 Q1316 A1323 V1871 L1875	N1315-C1319 WeakPolarHBondContact O-CB 3.23Å; N1315-C1319 PolarHBondContact O-N 2.99Å; N1315-C1319 PolarHBondContact O-SG 3.15Å; Q1316-C1319 PolarHBondContact O-N 3.48Å; C1319-A1323 WeakPolarHBondContact O-CB 3.32Å; C1319-A1323 PolarHBondContact O-N 3.42Å; C1319-A1323 VanDerWaalsContact O-N 3.09Å; C1319-V1871 HydrophobicContact CB-CG1 3.8Å; C1319-L1875 HydrophobicContact CB-CD1 3.7Å
1320	I	82.8	Confident	79	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-59.9	-57	167.9	-74.7	175.9	0	0	0	108.9	L1312 Q1316 R1317 F1322 A1323 L1324 I1877 L1882	L1312-I1320 HydrophobicContact CD1-CD1 4.06Å; L1312-I1320 HydrophobicContact CD2-CD1 4.25Å; Q1316-I1320 WeakPolarHBondContact O-CB 3.47Å; Q1316-I1320 WeakPolarHBondContact O-CG1 3.22Å; Q1316-I1320 PolarHBondContact O-N 3.06Å; R1317-I1320 PolarHBondContact O-N 3.43Å; I1320-F1322 VanDerWaalsContact C-N 3.25Å; I1320-F1322 PolarHBondContact O-N 3.37Å; I1320-F1322 VanDerWaalsContact O-N 3.13Å; I1320-A1323 PolarHBondContact O-N 3.11Å; I1320-L1324 HydrophobicContact CG2-CD1 3.54Å; I1320-L1324 HydrophobicContact CG2-CG 4.36Å; I1320-L1324 WeakPolarHBondContact O-CD1 3.42Å; I1320-L1324 WeakPolarHBondContact O-CG 3.31Å; I1320-L1324 PolarHBondContact O-N 2.82Å; I1320-I1877 HydrophobicContact CD1-CD1 3.98Å; I1320-I1877 HydrophobicContact CG1-CD1 4.38Å; I1320-L1882 HydrophobicContact CD1-CD1 4.09Å
1321	E	83.4	Confident	79.6	Confident	58 Å²	58	57.8 Å²	57.8	27%	0.271	27%	0.267	S	S	.	.	H	α-helix	trans	-49.4	-44.3	-179.1	-168.2	159	-166.7	0	0	113.8	R1317 K1318 K1325 W1890	R1317-E1321 VanDerWaalsContact O-CB 3.3Å; R1317-E1321 WeakPolarHBondContact O-CB 3.32Å; R1317-E1321 PolarHBondContact O-N 3.2Å; K1318-E1321 PolarHBondContact O-N 3.16Å; E1321-K1325 HydrophobicContact CG-CD 3.9Å; E1321-K1325 WeakPolarHBondContact O-CB 3.49Å; E1321-K1325 WeakPolarHBondContact O-CG 3.48Å; E1321-K1325 PolarHBondContact O-N 3.47Å; E1321-K1325 VanDerWaalsContact O-N 3.13Å; E1321-K1325 VanDerWaalsContact OE1-CE 3.31Å; E1321-K1325 WeakPolarHBondContact OE1-CE 3.32Å; E1321-K1325 IonicContact OE1-NZ 2.67Å; E1321-K1325 PolarHBondContact OE1-NZ 2.86Å; E1321-W1890 HydrophobicContact CB-CH2 4.47Å; E1321-W1890 HydrophobicContact CB-CZ2 3.58Å; E1321-W1890 HydrophobicContact CG-CZ2 3.79Å
1322	F	83.1	Confident	80.3	Confident	48 Å²	48	57.5 Å²	57.5	21%	0.211	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-53.2	176.9	-169	-75.1	0	0	0	111.7	K1318 I1320 L1324 K1325 A1326 P1796 L1799 D1800 I1803 L1867	K1318-F1322 VanDerWaalsContact O-CB 3.32Å; K1318-F1322 WeakPolarHBondContact O-CB 3.49Å; K1318-F1322 PolarHBondContact O-N 2.65Å; I1320-F1322 VanDerWaalsContact C-N 3.25Å; I1320-F1322 PolarHBondContact O-N 3.37Å; I1320-F1322 VanDerWaalsContact O-N 3.13Å; F1322-L1324 PolarHBondContact O-N 2.7Å; F1322-K1325 PolarHBondContact O-N 3.13Å; F1322-A1326 HydrophobicContact CD1-CB 4.23Å; F1322-A1326 HydrophobicContact CE1-CB 4.11Å; F1322-A1326 WeakPolarHBondContact O-CB 3.43Å; F1322-A1326 PolarHBondContact O-N 2.92Å; F1322-P1796 HydrophobicContact CE2-CB 4.44Å; F1322-L1799 HydrophobicContact CB-CD1 3.91Å; F1322-L1799 HydrophobicContact CD1-CB 3.58Å; F1322-L1799 HydrophobicContact CD1-CD1 3.56Å; F1322-L1799 HydrophobicContact CD1-CG 4.17Å; F1322-L1799 HydrophobicContact CD2-CD1 4.42Å; F1322-L1799 HydrophobicContact CE1-CB 3.29Å; F1322-L1799 HydrophobicContact CE1-CD1 4.19Å; F1322-L1799 HydrophobicContact CE1-CG 4.35Å; F1322-L1799 HydrophobicContact CG-CB 4.34Å; F1322-L1799 HydrophobicContact CG-CD1 3.7Å; F1322-L1799 HydrophobicContact CZ-CB 3.82Å; F1322-D1800 WeakPolarHBondContact CZ-OD1 3.35Å; F1322-I1803 HydrophobicContact CE1-CD1 3.65Å; F1322-I1803 HydrophobicContact CZ-CD1 3.69Å; F1322-L1867 HydrophobicContact CD1-CD2 4.47Å
1323	A	83.7	Confident	80.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-18	-176.5	0	0	0	0	0	114.3	C1319 I1320 L1867 F1868 V1871	C1319-A1323 WeakPolarHBondContact O-CB 3.32Å; C1319-A1323 PolarHBondContact O-N 3.42Å; C1319-A1323 VanDerWaalsContact O-N 3.09Å; I1320-A1323 PolarHBondContact O-N 3.11Å; A1323-L1867 HydrophobicContact CB-CD2 4.34Å; A1323-L1867 HydrophobicContact CB-CG 4.03Å; A1323-F1868 HydrophobicContact CB-CD2 4.42Å; A1323-V1871 HydrophobicContact CB-CG2 4.37Å
1324	L	82.6	Confident	81.6	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-95.8	-41.9	179.8	-59.5	162.6	0	0	0	113.6	I1320 F1322 F1868 L1901 T2306 S2307	I1320-L1324 HydrophobicContact CG2-CD1 3.54Å; I1320-L1324 HydrophobicContact CG2-CG 4.36Å; I1320-L1324 WeakPolarHBondContact O-CD1 3.42Å; I1320-L1324 WeakPolarHBondContact O-CG 3.31Å; I1320-L1324 PolarHBondContact O-N 2.82Å; F1322-L1324 PolarHBondContact O-N 2.7Å; L1324-F1868 HydrophobicContact CD2-CD2 4.48Å; L1324-L1901 HydrophobicContact CD2-CD1 3.45Å; L1324-L1901 VanDerWaalsContact CD2-CD1 3.45Å; L1324-T2306 WeakPolarHBondContact CD1-O 3.33Å; L1324-S2307 VanDerWaalsContact CB-O 3.31Å; L1324-S2307 WeakPolarHBondContact CB-O 3.38Å; L1324-S2307 VanDerWaalsContact CD2-C 3.43Å; L1324-S2307 WeakPolarHBondContact CD2-O 3.34Å
1325	K	83.3	Confident	82	Confident	132 Å²	132	63.2 Å²	63.2	57%	0.574	29%	0.287	S	S	*	.	H	α-helix	trans	-79.7	-23.5	179.4	-73.9	-179.4	173	177.1	0	112.2	E1321 F1322	E1321-K1325 HydrophobicContact CG-CD 3.9Å; E1321-K1325 WeakPolarHBondContact O-CB 3.49Å; E1321-K1325 WeakPolarHBondContact O-CG 3.48Å; E1321-K1325 PolarHBondContact O-N 3.47Å; E1321-K1325 VanDerWaalsContact O-N 3.13Å; E1321-K1325 VanDerWaalsContact OE1-CE 3.31Å; E1321-K1325 WeakPolarHBondContact OE1-CE 3.32Å; E1321-K1325 IonicContact OE1-NZ 2.67Å; E1321-K1325 PolarHBondContact OE1-NZ 2.86Å; F1322-K1325 PolarHBondContact O-N 3.13Å
1326	A	84.6	Confident	82.7	Confident	11 Å²	11	66.5 Å²	66.5	9%	0.091	30%	0.301	C	S	.	.			trans	-54.3	149.6	178.9	0	0	0	0	0	112.2	F1322 I1803 F1863 N1864 L1867	F1322-A1326 HydrophobicContact CD1-CB 4.23Å; F1322-A1326 HydrophobicContact CE1-CB 4.11Å; F1322-A1326 WeakPolarHBondContact O-CB 3.43Å; F1322-A1326 PolarHBondContact O-N 2.92Å; A1326-I1803 HydrophobicContact CB-CD1 4.19Å; A1326-F1863 HydrophobicContact CB-CE1 3.77Å; A1326-F1863 HydrophobicContact CB-CZ 3.91Å; A1326-N1864 PolarHBondContact O-OD1 3.44Å; A1326-L1867 HydrophobicContact CB-CD2 3.83Å
1327	R	85.6	Confident	83	Confident	158 Å²	158	71.4 Å²	71.4	60%	0.596	33%	0.328	S	S	*	.			trans	-141.5	149.7	176.3	-62.5	-174.8	-177.6	-160.5	-1.1	108.7	V1329	R1327-V1329 PolarHBondContact O-N 3.08Å
1328	P	87.9	Confident	83.2	Confident	35 Å²	35	78.1 Å²	78.1	23%	0.227	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-61.9	130.3	171.6	28.9	-36.5	0	0	0	109.8	A1813	P1328-A1813 HydrophobicContact CB-CB 4.01Å; P1328-A1813 HydrophobicContact CG-CB 4.17Å
1329	V	83.6	Confident	83.7	Confident	85 Å²	85	76 Å²	76	52%	0.515	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-88.3	130.6	177.2	173.7	0	0	0	0	109.3	R1327 I1803 S1807	R1327-V1329 PolarHBondContact O-N 3.08Å; V1329-I1803 HydrophobicContact CB-CG2 4.03Å; V1329-I1803 HydrophobicContact CG2-CG2 3.52Å; V1329-S1807 VanDerWaalsContact O-CB 3.29Å; V1329-S1807 WeakPolarHBondContact O-CB 3.29Å
1330	K	81.4	Confident	84	Confident	149 Å²	149	80.4 Å²	80.4	65%	0.648	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-79.2	128.6	177.9	-174.6	-179.3	178.2	176.2	0	110.6	P1811 A1813	K1330-P1811 WeakPolarHBondContact CG-O 3.45Å; K1330-A1813 HydrophobicContact CB-CB 3.9Å
1331	R	77.2	Confident	84.4	Confident	103 Å²	103	89.4 Å²	89.4	39%	0.389	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-92.9	125.6	172.6	-170.1	170.3	-179.3	163.2	-0.3	109.4	I1333 E1808 P1811	R1331-I1333 HydrophobicContact CG-CG1 4.31Å; R1331-I1333 PolarHBondContact O-N 3.07Å; R1331-E1808 IonicContact NH1-OE1 4Å; R1331-P1811 HydrophobicContact CB-CB 4.46Å; R1331-P1811 PolarHBondContact N-O 3.02Å
1332	Y	80.9	Confident	84.8	Confident	72 Å²	72	88.2 Å²	88.2	28%	0.282	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-74.9	124.6	170.9	-178.6	-100.9	0	0	0	109.8	P1334 Q1339 W1343 F1403 N1407	Y1332-P1334 HydrophobicContact CE1-CB 4.02Å; Y1332-P1334 HydrophobicContact CE1-CG 4.41Å; Y1332-Q1339 PolarHBondContact OH-NE2 2.99Å; Y1332-W1343 VanDerWaalsContact O-CZ2 3.28Å; Y1332-W1343 WeakPolarHBondContact O-CZ2 3.26Å; Y1332-W1343 PolarHBondContact O-NE1 3.34Å; Y1332-F1403 HydrophobicContact CD1-CD1 4.18Å; Y1332-N1407 WeakPolarHBondContact CD2-ND2 3.22Å; Y1332-N1407 WeakPolarHBondContact CE2-ND2 3.45Å
1333	I	83.7	Confident	85.1	Confident	73 Å²	73	86.8 Å²	86.8	37%	0.374	39%	0.387	S	S	.	.			trans	-131.5	121.6	170.9	-53	177.5	0	0	0	105.8	R1331 Y1340 W1343 P1811	R1331-I1333 HydrophobicContact CG-CG1 4.31Å; R1331-I1333 PolarHBondContact O-N 3.07Å; I1333-Y1340 HydrophobicContact CG2-CD2 4.11Å; I1333-Y1340 HydrophobicContact CG2-CE2 3.95Å; I1333-W1343 HydrophobicContact CB-CH2 4.44Å; I1333-W1343 HydrophobicContact CB-CZ2 4.42Å; I1333-W1343 HydrophobicContact CG1-CH2 4.01Å; I1333-W1343 HydrophobicContact CG1-CZ2 4Å; I1333-W1343 HydrophobicContact CG2-CH2 4.07Å; I1333-W1343 HydrophobicContact CG2-CZ2 4.46Å; I1333-W1343 HydrophobicContact CG2-CZ3 4.22Å; I1333-P1811 HydrophobicContact CD1-CB 3.97Å
1334	P	84.3	Confident	85.5	Confident	6 Å²	6	94.4 Å²	94.4	4%	0.039	42%	0.416	C	S	.	.			trans	-71.2	150	177.5	31.4	-36.9	0	0	0	111.1	Y1332 Q1339 Y1340 W1343	Y1332-P1334 HydrophobicContact CE1-CB 4.02Å; Y1332-P1334 HydrophobicContact CE1-CG 4.41Å; P1334-Q1339 HydrophobicContact CB-CB 3.97Å; P1334-Q1339 HydrophobicContact CB-CG 3.63Å; P1334-Q1339 VanDerWaalsContact CB-OE1 3.32Å; P1334-Q1339 HydrophobicContact CG-CB 4.45Å; P1334-Q1339 HydrophobicContact CG-CG 4.17Å; P1334-Y1340 HydrophobicContact CG-CD2 4.32Å; P1334-W1343 HydrophobicContact CG-CB 3.7Å; P1334-W1343 HydrophobicContact CG-CD2 4.15Å; P1334-W1343 HydrophobicContact CG-CG 3.79Å
1335	K	82.1	Confident	85.9	Confident	185 Å²	185	98.7 Å²	98.7	80%	0.804	44%	0.435	S	S	*	.			trans	-90.5	-27.5	179.4	-65.9	-171.4	176.6	-172.7	0	113.6
1336	E	86.3	Confident	86.2	Confident	131 Å²	131	92.8 Å²	92.8	61%	0.612	41%	0.409	S	S	*	.	S	Bend	trans	-77.9	130.5	-175.8	-64.2	-51	135.1	0	0	111.8	F1338 Q1339 Y1340	E1336-F1338 PolarHBondContact O-N 3.39Å; E1336-F1338 VanDerWaalsContact O-N 3.13Å; E1336-Q1339 HydrophobicContact CB-CB 4.03Å; E1336-Q1339 PolarHBondContact O-N 3.3Å; E1336-Q1339 VanDerWaalsContact O-N 3.1Å; E1336-Y1340 WeakPolarHBondContact O-CB 3.24Å; E1336-Y1340 PolarHBondContact O-N 3.14Å
1337	N	85.9	Confident	86.3	Confident	132 Å²	132	95 Å²	95	71%	0.706	42%	0.422	S	S	*	.	H	α-helix	trans	-55.9	-35.1	-175.3	-73.8	-32.9	0	0	0	113.7	R1341	N1337-R1341 WeakPolarHBondContact O-CG 3.15Å; N1337-R1341 PolarHBondContact O-N 3.19Å
1338	F	85.2	Confident	86.5	Confident	160 Å²	160	88.7 Å²	88.7	70%	0.702	40%	0.402	S	S	*	.	H	α-helix	trans	-71.1	-51	176.3	-178.4	-105.1	0	0	0	111.4	E1336 Y1340 R1341 I1342	E1336-F1338 PolarHBondContact O-N 3.39Å; E1336-F1338 VanDerWaalsContact O-N 3.13Å; F1338-Y1340 VanDerWaalsContact C-N 3.28Å; F1338-Y1340 PolarHBondContact O-N 3.39Å; F1338-R1341 PolarHBondContact O-N 3.18Å; F1338-I1342 HydrophobicContact CD1-CD1 4.09Å; F1338-I1342 HydrophobicContact CE1-CD1 3.55Å; F1338-I1342 HydrophobicContact CE2-CD1 4.45Å; F1338-I1342 HydrophobicContact CZ-CD1 3.76Å; F1338-I1342 PolarHBondContact O-N 2.85Å
1339	Q	88.9	Confident	86.5	Confident	39 Å²	39	93.1 Å²	93.1	18%	0.182	42%	0.42	C	S	.	.	H	α-helix	trans	-60.8	-37.8	178.3	-165.4	-173.1	8	0	0	111.7	Y1332 P1334 E1336 I1342 W1343 A1402	Y1332-Q1339 PolarHBondContact OH-NE2 2.99Å; P1334-Q1339 HydrophobicContact CB-CB 3.97Å; P1334-Q1339 HydrophobicContact CB-CG 3.63Å; P1334-Q1339 VanDerWaalsContact CB-OE1 3.32Å; P1334-Q1339 HydrophobicContact CG-CB 4.45Å; P1334-Q1339 HydrophobicContact CG-CG 4.17Å; E1336-Q1339 HydrophobicContact CB-CB 4.03Å; E1336-Q1339 PolarHBondContact O-N 3.3Å; E1336-Q1339 VanDerWaalsContact O-N 3.1Å; Q1339-I1342 PolarHBondContact O-N 2.69Å; Q1339-W1343 VanDerWaalsContact O-CB 3.24Å; Q1339-W1343 WeakPolarHBondContact O-CB 3.03Å; Q1339-W1343 PolarHBondContact O-N 2.81Å; Q1339-A1402 WeakPolarHBondContact CG-O 3.38Å; Q1339-A1402 PolarHBondContact NE2-O 3.38Å
1340	Y	88.4	Confident	86.7	Confident	102 Å²	102	93.6 Å²	93.6	40%	0.4	43%	0.425	S	S	.	.	H	α-helix	trans	-63.4	-39.1	176	-176.4	-91	0	0	0	113	I1333 P1334 E1336 F1338 W1343 W1344	I1333-Y1340 HydrophobicContact CG2-CD2 4.11Å; I1333-Y1340 HydrophobicContact CG2-CE2 3.95Å; P1334-Y1340 HydrophobicContact CG-CD2 4.32Å; E1336-Y1340 WeakPolarHBondContact O-CB 3.24Å; E1336-Y1340 PolarHBondContact O-N 3.14Å; F1338-Y1340 VanDerWaalsContact C-N 3.28Å; F1338-Y1340 PolarHBondContact O-N 3.39Å; Y1340-W1343 AromaticContact CD2-CE3 3.94Å; Y1340-W1343 HydrophobicContact CD2-CE3 3.94Å; Y1340-W1343 HydrophobicContact CD2-CZ3 4.11Å; Y1340-W1343 AromaticContact CE2-CE3 3.87Å; Y1340-W1343 HydrophobicContact CE2-CE3 3.87Å; Y1340-W1343 AromaticContact CE2-CZ3 3.58Å; Y1340-W1343 HydrophobicContact CE2-CZ3 3.58Å; Y1340-W1344 WeakPolarHBondContact O-CB 3.48Å; Y1340-W1344 PolarHBondContact O-N 2.93Å
1341	R	91	Very high	87.1	Confident	192 Å²	192	87.7 Å²	87.7	73%	0.725	40%	0.399	S	S	*	.	H	α-helix	trans	-63.4	-43.9	174.8	-74.2	174.3	179.2	-160.9	-0.3	111.9	N1337 F1338 F1345	N1337-R1341 WeakPolarHBondContact O-CG 3.15Å; N1337-R1341 PolarHBondContact O-N 3.19Å; F1338-R1341 PolarHBondContact O-N 3.18Å; R1341-F1345 PolarHBondContact O-N 3.01Å; R1341-F1345 VanDerWaalsContact O-N 3.13Å
1342	I	90.6	Very high	87.5	Confident	32 Å²	32	87 Å²	87	16%	0.164	40%	0.4	C	S	.	.	H	α-helix	trans	-67.5	-46.2	177.9	-56.5	177	0	0	0	110.3	F1338 Q1339 W1344 F1345 I1346 L1398 A1402	F1338-I1342 HydrophobicContact CD1-CD1 4.09Å; F1338-I1342 HydrophobicContact CE1-CD1 3.55Å; F1338-I1342 HydrophobicContact CE2-CD1 4.45Å; F1338-I1342 HydrophobicContact CZ-CD1 3.76Å; F1338-I1342 PolarHBondContact O-N 2.85Å; Q1339-I1342 PolarHBondContact O-N 2.69Å; I1342-W1344 PolarHBondContact O-N 3.49Å; I1342-F1345 PolarHBondContact O-N 3.29Å; I1342-I1346 HydrophobicContact CG2-CD1 3.77Å; I1342-I1346 HydrophobicContact CG2-CG1 4.37Å; I1342-I1346 WeakPolarHBondContact O-CG1 3.33Å; I1342-I1346 PolarHBondContact O-N 3.4Å; I1342-L1398 HydrophobicContact CG2-CD2 4.38Å; I1342-A1402 HydrophobicContact CG2-CB 4.02Å
1343	W	91.1	Very high	87.8	Confident	18 Å²	18	86.9 Å²	86.9	7%	0.068	40%	0.4	C	S	.	.	H	α-helix	trans	-59.4	-43.3	176.8	172.8	89.1	0	0	0	112.9	Y1332 I1333 P1334 Q1339 Y1340 F1345 I1346 T1347 A1402 F1403	Y1332-W1343 VanDerWaalsContact O-CZ2 3.28Å; Y1332-W1343 WeakPolarHBondContact O-CZ2 3.26Å; Y1332-W1343 PolarHBondContact O-NE1 3.34Å; I1333-W1343 HydrophobicContact CB-CH2 4.44Å; I1333-W1343 HydrophobicContact CB-CZ2 4.42Å; I1333-W1343 HydrophobicContact CG1-CH2 4.01Å; I1333-W1343 HydrophobicContact CG1-CZ2 4Å; I1333-W1343 HydrophobicContact CG2-CH2 4.07Å; I1333-W1343 HydrophobicContact CG2-CZ2 4.46Å; I1333-W1343 HydrophobicContact CG2-CZ3 4.22Å; P1334-W1343 HydrophobicContact CG-CB 3.7Å; P1334-W1343 HydrophobicContact CG-CD2 4.15Å; P1334-W1343 HydrophobicContact CG-CG 3.79Å; Q1339-W1343 VanDerWaalsContact O-CB 3.24Å; Q1339-W1343 WeakPolarHBondContact O-CB 3.03Å; Q1339-W1343 PolarHBondContact O-N 2.81Å; Y1340-W1343 AromaticContact CD2-CE3 3.94Å; Y1340-W1343 HydrophobicContact CD2-CE3 3.94Å; Y1340-W1343 HydrophobicContact CD2-CZ3 4.11Å; Y1340-W1343 AromaticContact CE2-CE3 3.87Å; Y1340-W1343 HydrophobicContact CE2-CE3 3.87Å; Y1340-W1343 AromaticContact CE2-CZ3 3.58Å; Y1340-W1343 HydrophobicContact CE2-CZ3 3.58Å; W1343-F1345 VanDerWaalsContact C-N 3.34Å; W1343-F1345 PolarHBondContact O-N 2.97Å; W1343-I1346 PolarHBondContact O-N 2.82Å; W1343-T1347 WeakPolarHBondContact O-CB 3.23Å; W1343-T1347 WeakPolarHBondContact O-CG2 3.4Å; W1343-T1347 PolarHBondContact O-N 3.18Å; W1343-T1347 PolarHBondContact O-OG1 2.81Å; W1343-A1402 HydrophobicContact CB-CB 4.09Å; W1343-F1403 AromaticContact CD1-CD1 3.87Å; W1343-F1403 AromaticContact CD1-CE1 3.61Å; W1343-F1403 AromaticContact NE1-CE1 3.79Å
1344	W	90.2	Very high	88.2	Confident	160 Å²	160	86.2 Å²	86.2	61%	0.606	40%	0.401	S	S	*	.	H	α-helix	trans	-63.5	-39.1	176.3	176.7	85.6	0	0	0	112.1	Y1340 I1342 S1348	Y1340-W1344 WeakPolarHBondContact O-CB 3.48Å; Y1340-W1344 PolarHBondContact O-N 2.93Å; I1342-W1344 PolarHBondContact O-N 3.49Å; W1344-S1348 PolarHBondContact O-N 3.44Å
1345	F	91.5	Very high	88.4	Confident	98 Å²	98	86.6 Å²	86.6	43%	0.43	40%	0.402	S	S	.	.	H	α-helix	trans	-66.5	-47	175.6	174.8	-109.6	0	0	0	112.2	R1341 I1342 W1343 S1348 F1351	R1341-F1345 PolarHBondContact O-N 3.01Å; R1341-F1345 VanDerWaalsContact O-N 3.13Å; I1342-F1345 PolarHBondContact O-N 3.29Å; W1343-F1345 VanDerWaalsContact C-N 3.34Å; W1343-F1345 PolarHBondContact O-N 2.97Å; F1345-S1348 VanDerWaalsContact O-CB 3.26Å; F1345-S1348 WeakPolarHBondContact O-CB 3.27Å; F1345-S1348 PolarHBondContact O-N 2.87Å; F1345-S1348 PolarHBondContact O-OG 2.91Å; F1345-F1351 HydrophobicContact CD1-CD2 4.13Å; F1345-F1351 AromaticContact CE1-CD2 3.44Å; F1345-F1351 HydrophobicContact CE1-CD2 3.44Å; F1345-F1351 VanDerWaalsContact CE1-CD2 3.44Å; F1345-F1351 AromaticContact CE1-CE2 3.79Å; F1345-F1351 HydrophobicContact CE1-CE2 3.79Å; F1345-F1351 HydrophobicContact CE1-CG 4.37Å; F1345-F1351 AromaticContact CZ-CD2 3.7Å; F1345-F1351 HydrophobicContact CZ-CD2 3.7Å; F1345-F1351 HydrophobicContact CZ-CE2 4.37Å; F1345-F1351 WeakPolarHBondContact O-CB 3.36Å
1346	I	90	Very high	88.6	Confident	7 Å²	7	79.7 Å²	79.7	4%	0.036	37%	0.373	C	S	.	.	H	α-helix	trans	-69.9	-36.3	-177.8	-66.5	176.3	0	0	0	112.4	I1342 W1343 S1348 F1351 L1398 K1399 A1402 F1403	I1342-I1346 HydrophobicContact CG2-CD1 3.77Å; I1342-I1346 HydrophobicContact CG2-CG1 4.37Å; I1342-I1346 WeakPolarHBondContact O-CG1 3.33Å; I1342-I1346 PolarHBondContact O-N 3.4Å; W1343-I1346 PolarHBondContact O-N 2.82Å; I1346-S1348 PolarHBondContact O-N 3.14Å; I1346-F1351 HydrophobicContact CB-CD1 4.33Å; I1346-F1351 HydrophobicContact CB-CE1 4.36Å; I1346-F1351 HydrophobicContact CG1-CE1 4.26Å; I1346-F1351 HydrophobicContact CG1-CZ 4.38Å; I1346-F1351 HydrophobicContact CG2-CD1 4.14Å; I1346-F1351 HydrophobicContact CG2-CE1 3.94Å; I1346-F1351 WeakPolarHBondContact O-CD1 3.34Å; I1346-L1398 HydrophobicContact CD1-CB 3.6Å; I1346-L1398 WeakPolarHBondContact CD1-O 3.03Å; I1346-L1398 HydrophobicContact CG1-CB 4.37Å; I1346-K1399 HydrophobicContact CG2-CG 3.94Å; I1346-A1402 HydrophobicContact CD1-CB 3.68Å; I1346-F1403 HydrophobicContact CG2-CE2 4.42Å
1347	T	86.8	Confident	88.7	Confident	58 Å²	58	78.1 Å²	78.1	36%	0.356	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	12.5	175.3	59.6	0	0	0	0	113	W1343 F1403	W1343-T1347 WeakPolarHBondContact O-CB 3.23Å; W1343-T1347 WeakPolarHBondContact O-CG2 3.4Å; W1343-T1347 PolarHBondContact O-N 3.18Å; W1343-T1347 PolarHBondContact O-OG1 2.81Å; T1347-F1403 HydrophobicContact CG2-CE1 4.13Å; T1347-F1403 HydrophobicContact CG2-CZ 4.02Å
1348	S	89.8	Confident	89	Confident	25 Å²	25	75.1 Å²	75.1	18%	0.175	35%	0.348	C	S	.	.	S	Bend	trans	-89.5	137.4	174.2	81	0	0	0	0	111.4	W1344 F1345 I1346 P1350 F1351 E1352	W1344-S1348 PolarHBondContact O-N 3.44Å; F1345-S1348 VanDerWaalsContact O-CB 3.26Å; F1345-S1348 WeakPolarHBondContact O-CB 3.27Å; F1345-S1348 PolarHBondContact O-N 2.87Å; F1345-S1348 PolarHBondContact O-OG 2.91Å; I1346-S1348 PolarHBondContact O-N 3.14Å; S1348-P1350 VanDerWaalsContact C-CD 3.42Å; S1348-P1350 VanDerWaalsContact C-N 3.31Å; S1348-F1351 WeakPolarHBondContact O-CB 3.45Å; S1348-F1351 PolarHBondContact O-N 3Å; S1348-E1352 PolarHBondContact O-N 3.3Å
1349	Q	87.3	Confident	89.2	Confident	128 Å²	128	67.5 Å²	67.5	60%	0.598	32%	0.315	S	S	*	.	H	α-helix	trans	-54.1	-37.4	178	-65.5	175.6	-36.2	0	0	113.8	F1351 E1352 Y1353	Q1349-F1351 VanDerWaalsContact C-N 3.32Å; Q1349-F1351 PolarHBondContact O-N 2.8Å; Q1349-E1352 PolarHBondContact O-N 3.23Å; Q1349-Y1353 HydrophobicContact CB-CD2 4.3Å; Q1349-Y1353 HydrophobicContact CB-CE2 4.06Å; Q1349-Y1353 WeakPolarHBondContact O-CD2 2.99Å; Q1349-Y1353 PolarHBondContact O-N 2.81Å
1350	P	88	Confident	89	Confident	96 Å²	96	70.1 Å²	70.1	62%	0.623	33%	0.329	S	S	*	.	H	α-helix	trans	-61.1	-34.6	174.7	-26.1	36.6	0	0	0	114.3	S1348 C1354	S1348-P1350 VanDerWaalsContact C-CD 3.42Å; S1348-P1350 VanDerWaalsContact C-N 3.31Å; P1350-C1354 VanDerWaalsContact O-CB 3.28Å; P1350-C1354 WeakPolarHBondContact O-CB 3.49Å; P1350-C1354 PolarHBondContact O-N 2.75Å; P1350-C1354 VanDerWaalsContact O-N 3.07Å
1351	F	89.9	Confident	89.1	Confident	24 Å²	24	69.1 Å²	69.1	11%	0.105	33%	0.33	C	S	.	.	H	α-helix	trans	-68.9	-45.7	175.8	-178.8	-97.1	0	0	0	111	F1345 I1346 S1348 Q1349 C1354 I1355 E1395 L1398	F1345-F1351 HydrophobicContact CD1-CD2 4.13Å; F1345-F1351 AromaticContact CE1-CD2 3.44Å; F1345-F1351 HydrophobicContact CE1-CD2 3.44Å; F1345-F1351 VanDerWaalsContact CE1-CD2 3.44Å; F1345-F1351 AromaticContact CE1-CE2 3.79Å; F1345-F1351 HydrophobicContact CE1-CE2 3.79Å; F1345-F1351 HydrophobicContact CE1-CG 4.37Å; F1345-F1351 AromaticContact CZ-CD2 3.7Å; F1345-F1351 HydrophobicContact CZ-CD2 3.7Å; F1345-F1351 HydrophobicContact CZ-CE2 4.37Å; F1345-F1351 WeakPolarHBondContact O-CB 3.36Å; I1346-F1351 HydrophobicContact CB-CD1 4.33Å; I1346-F1351 HydrophobicContact CB-CE1 4.36Å; I1346-F1351 HydrophobicContact CG1-CE1 4.26Å; I1346-F1351 HydrophobicContact CG1-CZ 4.38Å; I1346-F1351 HydrophobicContact CG2-CD1 4.14Å; I1346-F1351 HydrophobicContact CG2-CE1 3.94Å; I1346-F1351 WeakPolarHBondContact O-CD1 3.34Å; S1348-F1351 WeakPolarHBondContact O-CB 3.45Å; S1348-F1351 PolarHBondContact O-N 3Å; Q1349-F1351 VanDerWaalsContact C-N 3.32Å; Q1349-F1351 PolarHBondContact O-N 2.8Å; F1351-C1354 WeakPolarHBondContact O-CB 3.45Å; F1351-C1354 PolarHBondContact O-N 3.16Å; F1351-I1355 HydrophobicContact CD1-CG1 4.46Å; F1351-I1355 HydrophobicContact CE1-CG1 4.04Å; F1351-I1355 HydrophobicContact CZ-CD1 4.27Å; F1351-I1355 HydrophobicContact CZ-CG1 4.11Å; F1351-I1355 PolarHBondContact O-N 2.77Å; F1351-I1355 VanDerWaalsContact O-N 3.1Å; F1351-E1395 HydrophobicContact CE1-CG 4.36Å; F1351-E1395 HydrophobicContact CZ-CG 4.26Å; F1351-L1398 HydrophobicContact CE2-CD1 4.36Å
1352	E	85.6	Confident	89	Confident	88 Å²	88	60 Å²	60	41%	0.411	30%	0.296	S	S	.	.	H	α-helix	trans	-58.4	-50.1	175.8	-65.1	-175.4	163.9	0	0	111.8	S1348 Q1349 C1354 I1355 F1356	S1348-E1352 PolarHBondContact O-N 3.3Å; Q1349-E1352 PolarHBondContact O-N 3.23Å; E1352-C1354 VanDerWaalsContact C-N 3.3Å; E1352-C1354 PolarHBondContact O-N 2.74Å; E1352-I1355 PolarHBondContact O-N 3.3Å; E1352-F1356 HydrophobicContact CB-CD2 4.42Å; E1352-F1356 HydrophobicContact CB-CE2 4.12Å; E1352-F1356 WeakPolarHBondContact O-CD2 3.39Å; E1352-F1356 PolarHBondContact O-N 3.27Å
1353	Y	88.2	Confident	88.8	Confident	71 Å²	71	59.1 Å²	59.1	28%	0.278	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-36.7	177.8	-71.5	-53.7	0	0	0	112.7	Q1349 F1356 I1357 R1459 S2267	Q1349-Y1353 HydrophobicContact CB-CD2 4.3Å; Q1349-Y1353 HydrophobicContact CB-CE2 4.06Å; Q1349-Y1353 WeakPolarHBondContact O-CD2 2.99Å; Q1349-Y1353 PolarHBondContact O-N 2.81Å; Y1353-F1356 PolarHBondContact O-N 3.08Å; Y1353-I1357 VanDerWaalsContact O-CG1 3.29Å; Y1353-I1357 WeakPolarHBondContact O-CG1 3.43Å; Y1353-I1357 PolarHBondContact O-N 3.13Å; Y1353-R1459 PolarHBondContact OH-NH2 2.83Å; Y1353-S2267 WeakPolarHBondContact CE1-OG 3.48Å; Y1353-S2267 PolarHBondContact OH-OG 2.9Å
1354	C	90.4	Very high	88.6	Confident	59 Å²	59	62.5 Å²	62.5	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-46.7	175.7	-167.7	0	0	0	0	111.6	P1350 F1351 E1352 I1357 F1358	P1350-C1354 VanDerWaalsContact O-CB 3.28Å; P1350-C1354 WeakPolarHBondContact O-CB 3.49Å; P1350-C1354 PolarHBondContact O-N 2.75Å; P1350-C1354 VanDerWaalsContact O-N 3.07Å; F1351-C1354 WeakPolarHBondContact O-CB 3.45Å; F1351-C1354 PolarHBondContact O-N 3.16Å; E1352-C1354 VanDerWaalsContact C-N 3.3Å; E1352-C1354 PolarHBondContact O-N 2.74Å; C1354-I1357 PolarHBondContact O-N 3.46Å; C1354-F1358 WeakPolarHBondContact O-CD2 3.49Å; C1354-F1358 PolarHBondContact O-N 2.78Å; C1354-F1358 VanDerWaalsContact O-N 3.07Å; C1354-F1358 VanDerWaalsContact SG-CE2 3.53Å
1355	I	89.7	Confident	88.5	Confident	14 Å²	14	55 Å²	55	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-42.4	175.3	-64.8	-61.2	0	0	0	111.6	F1351 E1352 I1357 F1358 I1359 V1391 F1392 E1395	F1351-I1355 HydrophobicContact CD1-CG1 4.46Å; F1351-I1355 HydrophobicContact CE1-CG1 4.04Å; F1351-I1355 HydrophobicContact CZ-CD1 4.27Å; F1351-I1355 HydrophobicContact CZ-CG1 4.11Å; F1351-I1355 PolarHBondContact O-N 2.77Å; F1351-I1355 VanDerWaalsContact O-N 3.1Å; E1352-I1355 PolarHBondContact O-N 3.3Å; I1355-I1357 VanDerWaalsContact C-N 3.34Å; I1355-I1357 PolarHBondContact O-N 3.02Å; I1355-F1358 PolarHBondContact O-N 3.39Å; I1355-I1359 HydrophobicContact CG2-CD1 3.87Å; I1355-I1359 WeakPolarHBondContact O-CD1 3.47Å; I1355-I1359 WeakPolarHBondContact O-CG1 3.45Å; I1355-I1359 PolarHBondContact O-N 2.93Å; I1355-V1391 HydrophobicContact CD1-CG1 4.43Å; I1355-F1392 HydrophobicContact CG2-CE1 4.37Å; I1355-E1395 HydrophobicContact CD1-CB 3.99Å; I1355-E1395 HydrophobicContact CD1-CG 3.92Å; I1355-E1395 HydrophobicContact CG1-CG 4.18Å; I1355-E1395 WeakPolarHBondContact CG2-OE2 3.47Å
1356	F	86.3	Confident	88.3	Confident	40 Å²	40	50.5 Å²	50.5	18%	0.175	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-38	176.2	-71.1	-56.4	0	0	0	112.9	E1352 Y1353 I1359 L1360 L1456 R1459	E1352-F1356 HydrophobicContact CB-CD2 4.42Å; E1352-F1356 HydrophobicContact CB-CE2 4.12Å; E1352-F1356 WeakPolarHBondContact O-CD2 3.39Å; E1352-F1356 PolarHBondContact O-N 3.27Å; Y1353-F1356 PolarHBondContact O-N 3.08Å; F1356-I1359 HydrophobicContact CD1-CD1 4.33Å; F1356-I1359 PolarHBondContact O-N 2.96Å; F1356-L1360 PolarHBondContact O-N 3.29Å; F1356-L1456 HydrophobicContact CD1-CD2 3.99Å; F1356-R1459 HydrophobicContact CD2-CG 4.49Å; F1356-R1459 HydrophobicContact CE1-CB 4.1Å; F1356-R1459 HydrophobicContact CE2-CB 4.1Å; F1356-R1459 HydrophobicContact CE2-CG 4.05Å; F1356-R1459 HydrophobicContact CZ-CB 3.75Å; F1356-R1459 HydrophobicContact CZ-CG 4.23Å
1357	I	89	Confident	88.2	Confident	98 Å²	98	51.3 Å²	51.3	50%	0.503	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-43.9	174.3	-70.3	163.7	0	0	0	110.6	Y1353 C1354 I1355 I1359 L1360 I1361	Y1353-I1357 VanDerWaalsContact O-CG1 3.29Å; Y1353-I1357 WeakPolarHBondContact O-CG1 3.43Å; Y1353-I1357 PolarHBondContact O-N 3.13Å; C1354-I1357 PolarHBondContact O-N 3.46Å; I1355-I1357 VanDerWaalsContact C-N 3.34Å; I1355-I1357 PolarHBondContact O-N 3.02Å; I1357-I1359 VanDerWaalsContact C-N 3.33Å; I1357-I1359 PolarHBondContact O-N 3.04Å; I1357-L1360 PolarHBondContact O-N 2.97Å; I1357-I1361 HydrophobicContact CG2-CD1 3.78Å; I1357-I1361 HydrophobicContact CG2-CG1 4.4Å; I1357-I1361 WeakPolarHBondContact O-CG1 3.32Å; I1357-I1361 PolarHBondContact O-N 2.76Å
1358	F	91.2	Very high	88.2	Confident	68 Å²	68	51.8 Å²	51.8	30%	0.298	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-36.5	175.4	-73.5	-57.4	0	0	0	113.1	C1354 I1355 I1361 N1362 F1388 V1391 F1392	C1354-F1358 WeakPolarHBondContact O-CD2 3.49Å; C1354-F1358 PolarHBondContact O-N 2.78Å; C1354-F1358 VanDerWaalsContact O-N 3.07Å; C1354-F1358 VanDerWaalsContact SG-CE2 3.53Å; I1355-F1358 PolarHBondContact O-N 3.39Å; F1358-I1361 PolarHBondContact O-N 2.98Å; F1358-N1362 WeakPolarHBondContact O-CB 3.03Å; F1358-N1362 PolarHBondContact O-N 3.37Å; F1358-F1388 HydrophobicContact CD1-CD1 4.45Å; F1358-F1388 HydrophobicContact CD1-CE1 4.23Å; F1358-V1391 HydrophobicContact CD2-CG1 3.76Å; F1358-V1391 HydrophobicContact CE2-CG1 4.09Å; F1358-V1391 HydrophobicContact CG-CG1 4.13Å; F1358-F1392 HydrophobicContact CB-CZ 4.41Å
1359	I	89.2	Confident	88.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-40.2	174.3	-65.1	158.2	0	0	0	111	I1355 F1356 I1357 T1363 F1392 K1455 L1456	I1355-I1359 HydrophobicContact CG2-CD1 3.87Å; I1355-I1359 WeakPolarHBondContact O-CD1 3.47Å; I1355-I1359 WeakPolarHBondContact O-CG1 3.45Å; I1355-I1359 PolarHBondContact O-N 2.93Å; F1356-I1359 HydrophobicContact CD1-CD1 4.33Å; F1356-I1359 PolarHBondContact O-N 2.96Å; I1357-I1359 VanDerWaalsContact C-N 3.33Å; I1357-I1359 PolarHBondContact O-N 3.04Å; I1359-T1363 WeakPolarHBondContact O-CB 3.17Å; I1359-T1363 PolarHBondContact O-N 2.78Å; I1359-T1363 PolarHBondContact O-OG1 2.99Å; I1359-F1392 HydrophobicContact CD1-CE1 4.34Å; I1359-F1392 HydrophobicContact CG1-CE1 3.63Å; I1359-F1392 HydrophobicContact CG1-CZ 3.62Å; I1359-K1455 HydrophobicContact CD1-CB 3.86Å; I1359-K1455 HydrophobicContact CD1-CD 3.8Å; I1359-K1455 HydrophobicContact CD1-CG 4.42Å; I1359-L1456 HydrophobicContact CG2-CD1 4.16Å; I1359-L1456 HydrophobicContact CG2-CD2 4.29Å; I1359-L1456 HydrophobicContact CG2-CG 3.98Å
1360	L	86.1	Confident	88.1	Confident	94 Å²	94	49 Å²	49	49%	0.492	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-43.4	177	-174.9	64.5	0	0	0	111.9	F1356 I1357 T1363 I1364	F1356-L1360 PolarHBondContact O-N 3.29Å; I1357-L1360 PolarHBondContact O-N 2.97Å; L1360-T1363 WeakPolarHBondContact O-CB 3.31Å; L1360-T1363 PolarHBondContact O-N 3.12Å; L1360-I1364 HydrophobicContact CG-CD1 4.35Å; L1360-I1364 WeakPolarHBondContact O-CG1 2.95Å; L1360-I1364 PolarHBondContact O-N 3.2Å
1361	I	89.7	Confident	87.8	Confident	81 Å²	81	46.5 Å²	46.5	42%	0.415	24%	0.237	S	C	.	.	H	α-helix	trans	-68	-41.3	177.4	-57.6	165.9	0	0	0	110.6	I1357 F1358 T1363 I1364 S1365 F1388	I1357-I1361 HydrophobicContact CG2-CD1 3.78Å; I1357-I1361 HydrophobicContact CG2-CG1 4.4Å; I1357-I1361 WeakPolarHBondContact O-CG1 3.32Å; I1357-I1361 PolarHBondContact O-N 2.76Å; F1358-I1361 PolarHBondContact O-N 2.98Å; I1361-T1363 VanDerWaalsContact C-N 3.28Å; I1361-T1363 PolarHBondContact O-N 3.11Å; I1361-I1364 PolarHBondContact O-N 3.5Å; I1361-S1365 PolarHBondContact O-N 3.16Å; I1361-F1388 HydrophobicContact CB-CE1 4.39Å; I1361-F1388 HydrophobicContact CB-CZ 4.2Å; I1361-F1388 HydrophobicContact CG2-CE1 4.27Å; I1361-F1388 HydrophobicContact CG2-CZ 3.71Å
1362	N	88	Confident	87.2	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-40.4	171.7	177.8	110.7	0	0	0	111.6	F1358 S1365 L1366 F1388 R1452	F1358-N1362 WeakPolarHBondContact O-CB 3.03Å; F1358-N1362 PolarHBondContact O-N 3.37Å; N1362-S1365 WeakPolarHBondContact O-CB 3.35Å; N1362-S1365 PolarHBondContact O-N 3.45Å; N1362-L1366 WeakPolarHBondContact O-CG 3.18Å; N1362-L1366 PolarHBondContact O-N 2.85Å; N1362-L1366 VanDerWaalsContact O-N 3.1Å; N1362-F1388 HydrophobicContact CB-CB 4.37Å; N1362-F1388 HydrophobicContact CB-CD1 4.25Å; N1362-F1388 HydrophobicContact CB-CD2 3.71Å; N1362-F1388 HydrophobicContact CB-CE2 4.05Å; N1362-F1388 HydrophobicContact CB-CG 3.85Å; N1362-F1388 HydrophobicContact CB-CZ 4.47Å; N1362-F1388 WeakPolarHBondContact OD1-CB 3.12Å; N1362-F1388 WeakPolarHBondContact OD1-CD2 3.45Å; N1362-R1452 PolarHBondContact OD1-NH1 3.49Å
1363	T	86.4	Confident	87	Confident	14 Å²	14	46.1 Å²	46.1	9%	0.086	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-48.8	175.4	-60.1	0	0	0	0	111.5	I324 I1359 L1360 I1361 S1365 L1366 A1367 L1453	I324-T1363 HydrophobicContact CD1-CG2 4.06Å; I1359-T1363 WeakPolarHBondContact O-CB 3.17Å; I1359-T1363 PolarHBondContact O-N 2.78Å; I1359-T1363 PolarHBondContact O-OG1 2.99Å; L1360-T1363 WeakPolarHBondContact O-CB 3.31Å; L1360-T1363 PolarHBondContact O-N 3.12Å; I1361-T1363 VanDerWaalsContact C-N 3.28Å; I1361-T1363 PolarHBondContact O-N 3.11Å; T1363-S1365 PolarHBondContact O-N 2.97Å; T1363-L1366 PolarHBondContact O-N 3.16Å; T1363-L1366 VanDerWaalsContact O-N 3.16Å; T1363-A1367 PolarHBondContact O-N 3.48Å; T1363-L1453 HydrophobicContact CG2-CD1 4.3Å; T1363-L1453 HydrophobicContact CG2-CD2 3.61Å; T1363-L1453 HydrophobicContact CG2-CG 4.22Å; T1363-L1453 VanDerWaalsContact OG1-CD2 3.24Å; T1363-L1453 WeakPolarHBondContact OG1-CD2 3.48Å
1364	I	87.9	Confident	87	Confident	89 Å²	89	47.2 Å²	47.2	46%	0.456	27%	0.266	S	S	.	.	H	α-helix	trans	-61.9	-37.1	177.7	-64.5	163.1	0	0	0	110.2	L1360 I1361 L1366 A1367 M1368	L1360-I1364 HydrophobicContact CG-CD1 4.35Å; L1360-I1364 WeakPolarHBondContact O-CG1 2.95Å; L1360-I1364 PolarHBondContact O-N 3.2Å; I1361-I1364 PolarHBondContact O-N 3.5Å; I1364-L1366 PolarHBondContact O-N 2.93Å; I1364-A1367 PolarHBondContact O-N 2.89Å; I1364-M1368 HydrophobicContact CG2-CE 4.21Å; I1364-M1368 HydrophobicContact CG2-CG 4.35Å; I1364-M1368 HydrophobicContact CG2-SD 4.27Å; I1364-M1368 WeakPolarHBondContact O-CB 3.21Å; I1364-M1368 VanDerWaalsContact O-CG 3.27Å; I1364-M1368 WeakPolarHBondContact O-CG 3.48Å; I1364-M1368 PolarHBondContact O-N 2.84Å
1365	S	87.6	Confident	86.7	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-38.4	174.8	-154.9	0	0	0	0	113.2	I1361 N1362 T1363	I1361-S1365 PolarHBondContact O-N 3.16Å; N1362-S1365 WeakPolarHBondContact O-CB 3.35Å; N1362-S1365 PolarHBondContact O-N 3.45Å; T1363-S1365 PolarHBondContact O-N 2.97Å
1366	L	87.1	Confident	86.7	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-74.6	-38.7	176	-63.8	169.5	0	0	0	111.8	I324 N1362 T1363 I1364 M1368 R1449 V1450	I324-L1366 HydrophobicContact CG2-CB 3.92Å; N1362-L1366 WeakPolarHBondContact O-CG 3.18Å; N1362-L1366 PolarHBondContact O-N 2.85Å; N1362-L1366 VanDerWaalsContact O-N 3.1Å; T1363-L1366 PolarHBondContact O-N 3.16Å; T1363-L1366 VanDerWaalsContact O-N 3.16Å; I1364-L1366 PolarHBondContact O-N 2.93Å; L1366-M1368 PolarHBondContact O-N 3.46Å; L1366-R1449 HydrophobicContact CD1-CB 4.13Å; L1366-R1449 HydrophobicContact CD2-CB 4.15Å; L1366-V1450 HydrophobicContact CD1-CG2 4.39Å
1367	A	87.2	Confident	86.8	Confident	23 Å²	23	56.2 Å²	56.2	19%	0.19	32%	0.317	C	S	.	.	H	α-helix	trans	-73.4	-7.6	177.6	0	0	0	0	0	114.4	I324 F418 T1363 I1364	I324-A1367 HydrophobicContact CD1-CB 4.27Å; I324-A1367 HydrophobicContact CG1-CB 4.43Å; F418-A1367 HydrophobicContact CB-CB 4.36Å; F418-A1367 WeakPolarHBondContact CB-O 3.3Å; F418-A1367 HydrophobicContact CD1-CB 4.44Å; F418-A1367 HydrophobicContact CD2-CB 3.84Å; F418-A1367 HydrophobicContact CE2-CB 4.27Å; F418-A1367 HydrophobicContact CG-CB 3.94Å; T1363-A1367 PolarHBondContact O-N 3.48Å; I1364-A1367 PolarHBondContact O-N 2.89Å
1368	M	88.4	Confident	86.6	Confident	68 Å²	68	52.8 Å²	52.8	34%	0.335	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.4	177.4	-86.2	-168.6	-52.3	0	0	114.4	I1364 L1366 Y1377 L1381	I1364-M1368 HydrophobicContact CG2-CE 4.21Å; I1364-M1368 HydrophobicContact CG2-CG 4.35Å; I1364-M1368 HydrophobicContact CG2-SD 4.27Å; I1364-M1368 WeakPolarHBondContact O-CB 3.21Å; I1364-M1368 VanDerWaalsContact O-CG 3.27Å; I1364-M1368 WeakPolarHBondContact O-CG 3.48Å; I1364-M1368 PolarHBondContact O-N 2.84Å; L1366-M1368 PolarHBondContact O-N 3.46Å; M1368-Y1377 PolarHBondContact O-OH 2.86Å; M1368-L1381 HydrophobicContact CB-CD2 4.43Å; M1368-L1381 HydrophobicContact CE-CD2 4.23Å
1369	K	87.1	Confident	86.4	Confident	39 Å²	39	53.9 Å²	53.9	17%	0.17	31%	0.312	C	S	.	.			trans	-68.9	135.9	176.5	-177	-175.9	174.5	-164.4	0	111.7	L327 E328	L327-K1369 HydrophobicContact CD2-CB 4.26Å; L327-K1369 HydrophobicContact CG-CB 4.42Å; L327-K1369 HydrophobicContact CG-CD 4.39Å; L327-K1369 PolarHBondContact O-NZ 3.39Å; E328-K1369 IonicContact OE2-NZ 3.5Å; E328-K1369 PolarHBondContact OE2-NZ 2.87Å
1370	V	86.9	Confident	86.4	Confident	57 Å²	57	56.1 Å²	56.1	35%	0.345	33%	0.331	S	S	.	.			trans	-141	145.7	-176.3	178.7	0	0	0	0	111.2	N417 Q1373	N417-V1370 WeakPolarHBondContact OD1-CG1 3.4Å; V1370-Q1373 VanDerWaalsContact N-OE1 3.12Å; V1370-Q1373 WeakPolarHBondContact O-CB 3.4Å; V1370-Q1373 WeakPolarHBondContact O-CG 3.4Å; V1370-Q1373 PolarHBondContact O-N 2.73Å; V1370-Q1373 PolarHBondContact O-OE1 3.01Å
1371	E	82.8	Confident	86.4	Confident	42 Å²	42	52.4 Å²	52.4	20%	0.196	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	141.3	172.4	-148.6	-88.3	159.3	0	0	111.4	H335 K372 R404 D416 Q1373	H335-E1371 IonicContact CD2-OE1 3.58Å; H335-E1371 IonicContact NE2-OE2 3.42Å; K372-E1371 IonicContact NZ-OE1 2.96Å; K372-E1371 PolarHBondContact NZ-OE1 3.16Å; R404-E1371 IonicContact CZ-OE1 3.3Å; R404-E1371 IonicContact CZ-OE2 2.74Å; R404-E1371 IonicContact NH1-OE1 2.9Å; R404-E1371 IonicContact NH1-OE2 2.89Å; R404-E1371 PolarHBondContact NH1-OE2 3.16Å; R404-E1371 IonicContact NH2-OE1 2.79Å; R404-E1371 PolarHBondContact NH2-OE1 2.7Å; R404-E1371 IonicContact NH2-OE2 2.83Å; D416-E1371 HydrophobicContact CB-CB 4.01Å; D416-E1371 PolarHBondContact O-N 2.94Å; E1371-Q1373 PolarHBondContact O-N 3.33Å
1372	G	76.3	Confident	86	Confident	56 Å²	56	52.3 Å²	52.3	58%	0.577	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	13.6	-176.4	0	0	0	0	0	115.3
1373	Q	81.9	Confident	86	Confident	48 Å²	48	59.5 Å²	59.5	22%	0.224	34%	0.34	C	S	.	.			trans	-62.2	139	177.7	68.4	-176.2	20	0	0	112.4	V1370 E1371 Y1377	V1370-Q1373 VanDerWaalsContact N-OE1 3.12Å; V1370-Q1373 WeakPolarHBondContact O-CB 3.4Å; V1370-Q1373 WeakPolarHBondContact O-CG 3.4Å; V1370-Q1373 PolarHBondContact O-N 2.73Å; V1370-Q1373 PolarHBondContact O-OE1 3.01Å; E1371-Q1373 PolarHBondContact O-N 3.33Å; Q1373-Y1377 HydrophobicContact CB-CD1 3.93Å; Q1373-Y1377 HydrophobicContact CG-CD1 4.33Å
1374	P	87.6	Confident	86.2	Confident	94 Å²	94	62 Å²	62	61%	0.61	35%	0.352	S	S	*	.			trans	-61.4	144.9	178.9	-24.4	34.1	0	0	0	113.1	A1376 Y1377 A1378	P1374-A1376 VanDerWaalsContact C-N 3.31Å; P1374-A1376 PolarHBondContact O-N 2.9Å; P1374-Y1377 WeakPolarHBondContact O-CA 3.5Å; P1374-Y1377 VanDerWaalsContact O-CB 3.28Å; P1374-Y1377 WeakPolarHBondContact O-CB 3.4Å; P1374-Y1377 PolarHBondContact O-N 3.29Å; P1374-A1378 PolarHBondContact O-N 2.95Å; P1374-A1378 VanDerWaalsContact O-N 3.15Å
1375	N	84	Confident	86	Confident	132 Å²	132	58.1 Å²	58.1	71%	0.706	33%	0.333	S	S	*	.	H	α-helix	trans	-51.3	-45.7	-178.1	-65.1	-9.8	0	0	0	113.1	Y1377 A1378 D1379	N1375-Y1377 PolarHBondContact O-N 3.37Å; N1375-Y1377 VanDerWaalsContact O-N 3.13Å; N1375-A1378 WeakPolarHBondContact O-CA 3.31Å; N1375-A1378 WeakPolarHBondContact O-CB 3.25Å; N1375-A1378 PolarHBondContact O-N 2.93Å; N1375-D1379 VanDerWaalsContact O-CG 3.26Å; N1375-D1379 PolarHBondContact O-N 3.19Å
1376	A	89.3	Confident	85.9	Confident	78 Å²	78	63 Å²	63	65%	0.645	36%	0.356	S	S	*	.	H	α-helix	trans	-62.2	-22.7	178.6	0	0	0	0	0	114.3	P1374 A1380	P1374-A1376 VanDerWaalsContact C-N 3.31Å; P1374-A1376 PolarHBondContact O-N 2.9Å; A1376-A1380 WeakPolarHBondContact O-CB 3.38Å; A1376-A1380 PolarHBondContact O-N 3.46Å
1377	Y	89.1	Confident	86.1	Confident	92 Å²	92	67.7 Å²	67.7	36%	0.361	38%	0.38	S	S	.	.	H	α-helix	trans	-80.5	-40.3	172.1	-175.5	-100	0	0	0	111.2	M1368 Q1373 P1374 N1375 A1380 L1381	M1368-Y1377 PolarHBondContact O-OH 2.86Å; Q1373-Y1377 HydrophobicContact CB-CD1 3.93Å; Q1373-Y1377 HydrophobicContact CG-CD1 4.33Å; P1374-Y1377 WeakPolarHBondContact O-CA 3.5Å; P1374-Y1377 VanDerWaalsContact O-CB 3.28Å; P1374-Y1377 WeakPolarHBondContact O-CB 3.4Å; P1374-Y1377 PolarHBondContact O-N 3.29Å; N1375-Y1377 PolarHBondContact O-N 3.37Å; N1375-Y1377 VanDerWaalsContact O-N 3.13Å; Y1377-A1380 PolarHBondContact O-N 2.88Å; Y1377-L1381 HydrophobicContact CD1-CD1 3.95Å; Y1377-L1381 HydrophobicContact CD1-CG 4.46Å; Y1377-L1381 HydrophobicContact CE1-CD1 3.62Å; Y1377-L1381 HydrophobicContact CE1-CG 4.28Å; Y1377-L1381 WeakPolarHBondContact O-CG 3.33Å; Y1377-L1381 PolarHBondContact O-N 3.48Å
1378	A	84.1	Confident	86.2	Confident	27 Å²	27	67 Å²	67	22%	0.223	37%	0.373	C	S	.	.	H	α-helix	trans	-60.6	-48.1	172.7	0	0	0	0	0	111.6	P1374 N1375 A1380 L1381 D1382	P1374-A1378 PolarHBondContact O-N 2.95Å; P1374-A1378 VanDerWaalsContact O-N 3.15Å; N1375-A1378 WeakPolarHBondContact O-CA 3.31Å; N1375-A1378 WeakPolarHBondContact O-CB 3.25Å; N1375-A1378 PolarHBondContact O-N 2.93Å; A1378-A1380 VanDerWaalsContact C-N 3.31Å; A1378-A1380 PolarHBondContact O-N 2.98Å; A1378-L1381 PolarHBondContact O-N 2.97Å; A1378-L1381 VanDerWaalsContact O-N 3.14Å; A1378-D1382 PolarHBondContact O-N 2.97Å
1379	D	87.1	Confident	86.2	Confident	91 Å²	91	64.1 Å²	64.1	49%	0.487	36%	0.359	S	S	.	.	H	α-helix	trans	-56.8	-44.4	176.2	-63.1	-33.6	0	0	0	111.2	N1375 L1381 D1382 Y1383	N1375-D1379 VanDerWaalsContact O-CG 3.26Å; N1375-D1379 PolarHBondContact O-N 3.19Å; D1379-L1381 PolarHBondContact O-N 3.33Å; D1379-D1382 PolarHBondContact O-N 2.95Å; D1379-Y1383 HydrophobicContact CB-CE2 4.26Å; D1379-Y1383 WeakPolarHBondContact O-CD2 3.37Å; D1379-Y1383 PolarHBondContact O-N 3.36Å
1380	A	89	Confident	86.3	Confident	47 Å²	47	64 Å²	64	39%	0.388	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-39.9	177.4	0	0	0	0	0	112.9	A1376 Y1377 A1378 L1384	A1376-A1380 WeakPolarHBondContact O-CB 3.38Å; A1376-A1380 PolarHBondContact O-N 3.46Å; Y1377-A1380 PolarHBondContact O-N 2.88Å; A1378-A1380 VanDerWaalsContact C-N 3.31Å; A1378-A1380 PolarHBondContact O-N 2.98Å; A1380-L1384 WeakPolarHBondContact O-CG 3.46Å; A1380-L1384 PolarHBondContact O-N 3.39Å; A1380-L1384 VanDerWaalsContact O-N 3.07Å
1381	L	86.6	Confident	86.6	Confident	15 Å²	15	63 Å²	63	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-66.3	-39.3	174.8	-70.2	177	0	0	0	112	M1368 Y1377 A1378 D1379 L1384 N1385	M1368-L1381 HydrophobicContact CB-CD2 4.43Å; M1368-L1381 HydrophobicContact CE-CD2 4.23Å; Y1377-L1381 HydrophobicContact CD1-CD1 3.95Å; Y1377-L1381 HydrophobicContact CD1-CG 4.46Å; Y1377-L1381 HydrophobicContact CE1-CD1 3.62Å; Y1377-L1381 HydrophobicContact CE1-CG 4.28Å; Y1377-L1381 WeakPolarHBondContact O-CG 3.33Å; Y1377-L1381 PolarHBondContact O-N 3.48Å; A1378-L1381 PolarHBondContact O-N 2.97Å; A1378-L1381 VanDerWaalsContact O-N 3.14Å; D1379-L1381 PolarHBondContact O-N 3.33Å; L1381-L1384 WeakPolarHBondContact O-CB 3.24Å; L1381-L1384 PolarHBondContact O-N 3.08Å; L1381-N1385 PolarHBondContact O-N 3.04Å; L1381-N1385 PolarHBondContact O-ND2 3.2Å
1382	D	82.3	Confident	87	Confident	79 Å²	79	61.3 Å²	61.3	42%	0.422	36%	0.355	S	S	.	.	H	α-helix	trans	-73.8	-34	177.6	-93.3	-34	0	0	0	113.2	A1378 D1379 L1384 N1385 M1386 R1449	A1378-D1382 PolarHBondContact O-N 2.97Å; D1379-D1382 PolarHBondContact O-N 2.95Å; D1382-L1384 VanDerWaalsContact C-N 3.33Å; D1382-L1384 PolarHBondContact O-N 2.93Å; D1382-N1385 PolarHBondContact O-N 3.33Å; D1382-M1386 PolarHBondContact O-N 2.81Å; D1382-R1449 IonicContact OD1-CZ 3.66Å; D1382-R1449 IonicContact OD1-NH1 3.76Å; D1382-R1449 PolarHBondContact OD1-NH1 3.39Å; D1382-R1449 IonicContact OD1-NH2 2.85Å
1383	Y	88.5	Confident	87.7	Confident	152 Å²	152	60 Å²	60	60%	0.596	34%	0.336	S	S	*	.	H	α-helix	trans	-61.1	-40.5	167.8	-72.5	-52.2	0	0	0	112.1	D1379 M1386 I1387	D1379-Y1383 HydrophobicContact CB-CE2 4.26Å; D1379-Y1383 WeakPolarHBondContact O-CD2 3.37Å; D1379-Y1383 PolarHBondContact O-N 3.36Å; Y1383-M1386 HydrophobicContact CD1-CE 4.3Å; Y1383-M1386 PolarHBondContact O-N 2.82Å; Y1383-I1387 VanDerWaalsContact O-CG1 3.29Å; Y1383-I1387 WeakPolarHBondContact O-CG1 3.35Å; Y1383-I1387 PolarHBondContact O-N 3.21Å
1384	L	88.6	Confident	88.1	Confident	67 Å²	67	61.7 Å²	61.7	35%	0.351	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-45.6	173	-74.9	170	0	0	0	111.8	A1380 L1381 D1382 M1386 I1387 F1388	A1380-L1384 WeakPolarHBondContact O-CG 3.46Å; A1380-L1384 PolarHBondContact O-N 3.39Å; A1380-L1384 VanDerWaalsContact O-N 3.07Å; L1381-L1384 WeakPolarHBondContact O-CB 3.24Å; L1381-L1384 PolarHBondContact O-N 3.08Å; D1382-L1384 VanDerWaalsContact C-N 3.33Å; D1382-L1384 PolarHBondContact O-N 2.93Å; L1384-M1386 VanDerWaalsContact C-N 3.29Å; L1384-M1386 PolarHBondContact O-N 2.73Å; L1384-I1387 PolarHBondContact O-N 2.98Å; L1384-I1387 VanDerWaalsContact O-N 3.15Å; L1384-F1388 HydrophobicContact CB-CE2 3.99Å; L1384-F1388 WeakPolarHBondContact O-CD2 3.24Å; L1384-F1388 WeakPolarHBondContact O-CG 3.29Å; L1384-F1388 PolarHBondContact O-N 3.49Å
1385	N	83.9	Confident	88.3	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.043	32%	0.322	C	S	.	.	H	α-helix	trans	-58.9	-38.4	175.6	-77	-48.2	0	0	0	112.6	L1381 D1382 T1389 R1449	L1381-N1385 PolarHBondContact O-N 3.04Å; L1381-N1385 PolarHBondContact O-ND2 3.2Å; D1382-N1385 PolarHBondContact O-N 3.33Å; N1385-T1389 WeakPolarHBondContact O-CB 3.45Å; N1385-T1389 PolarHBondContact O-N 2.97Å; N1385-T1389 VanDerWaalsContact O-N 3.08Å; N1385-T1389 PolarHBondContact O-OG1 2.9Å; N1385-R1449 PolarHBondContact ND2-NH1 3.26Å
1386	M	85.9	Confident	88.6	Confident	106 Å²	106	53.1 Å²	53.1	52%	0.522	30%	0.296	S	S	.	.	H	α-helix	trans	-65.4	-45.4	173.6	-171.1	178.9	69.9	0	0	111.7	D1382 Y1383 L1384 F1388 T1389 G1390	D1382-M1386 PolarHBondContact O-N 2.81Å; Y1383-M1386 HydrophobicContact CD1-CE 4.3Å; Y1383-M1386 PolarHBondContact O-N 2.82Å; L1384-M1386 VanDerWaalsContact C-N 3.29Å; L1384-M1386 PolarHBondContact O-N 2.73Å; M1386-F1388 PolarHBondContact O-N 3.01Å; M1386-T1389 WeakPolarHBondContact O-CB 3.28Å; M1386-T1389 PolarHBondContact O-N 2.93Å; M1386-G1390 PolarHBondContact O-N 3.36Å
1387	I	90.8	Very high	88.8	Confident	100 Å²	100	52.9 Å²	52.9	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-48.3	176.9	-70.7	163.1	0	0	0	111	Y1383 L1384 T1389 G1390 V1391	Y1383-I1387 VanDerWaalsContact O-CG1 3.29Å; Y1383-I1387 WeakPolarHBondContact O-CG1 3.35Å; Y1383-I1387 PolarHBondContact O-N 3.21Å; L1384-I1387 PolarHBondContact O-N 2.98Å; L1384-I1387 VanDerWaalsContact O-N 3.15Å; I1387-T1389 VanDerWaalsContact C-N 3.3Å; I1387-T1389 PolarHBondContact O-N 3.35Å; I1387-G1390 WeakPolarHBondContact O-CA 3.43Å; I1387-G1390 PolarHBondContact O-N 3.08Å; I1387-G1390 VanDerWaalsContact O-N 3.12Å; I1387-V1391 PolarHBondContact O-N 3.27Å
1388	F	90.5	Very high	88.9	Confident	10 Å²	10	50.9 Å²	50.9	4%	0.044	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-38.2	177.3	-63.7	-51.8	0	0	0	112.1	F1358 I1361 N1362 L1384 M1386 G1390 V1391 F1392	F1358-F1388 HydrophobicContact CD1-CD1 4.45Å; F1358-F1388 HydrophobicContact CD1-CE1 4.23Å; I1361-F1388 HydrophobicContact CB-CE1 4.39Å; I1361-F1388 HydrophobicContact CB-CZ 4.2Å; I1361-F1388 HydrophobicContact CG2-CE1 4.27Å; I1361-F1388 HydrophobicContact CG2-CZ 3.71Å; N1362-F1388 HydrophobicContact CB-CB 4.37Å; N1362-F1388 HydrophobicContact CB-CD1 4.25Å; N1362-F1388 HydrophobicContact CB-CD2 3.71Å; N1362-F1388 HydrophobicContact CB-CE2 4.05Å; N1362-F1388 HydrophobicContact CB-CG 3.85Å; N1362-F1388 HydrophobicContact CB-CZ 4.47Å; N1362-F1388 WeakPolarHBondContact OD1-CB 3.12Å; N1362-F1388 WeakPolarHBondContact OD1-CD2 3.45Å; L1384-F1388 HydrophobicContact CB-CE2 3.99Å; L1384-F1388 WeakPolarHBondContact O-CD2 3.24Å; L1384-F1388 WeakPolarHBondContact O-CG 3.29Å; L1384-F1388 PolarHBondContact O-N 3.49Å; M1386-F1388 PolarHBondContact O-N 3.01Å; F1388-G1390 VanDerWaalsContact C-N 3.31Å; F1388-G1390 PolarHBondContact O-N 3.47Å; F1388-V1391 PolarHBondContact O-N 3.06Å; F1388-F1392 HydrophobicContact CB-CD2 4.46Å; F1388-F1392 HydrophobicContact CB-CE2 3.97Å; F1388-F1392 WeakPolarHBondContact O-CD2 3.34Å; F1388-F1392 WeakPolarHBondContact O-CG 3.49Å; F1388-F1392 PolarHBondContact O-N 3.36Å
1389	T	87.4	Confident	89.3	Confident	7 Å²	7	50.8 Å²	50.8	4%	0.043	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-37.9	174.9	-53.8	0	0	0	0	111.9	N1385 M1386 I1387 T1393 I1428 R1452	N1385-T1389 WeakPolarHBondContact O-CB 3.45Å; N1385-T1389 PolarHBondContact O-N 2.97Å; N1385-T1389 VanDerWaalsContact O-N 3.08Å; N1385-T1389 PolarHBondContact O-OG1 2.9Å; M1386-T1389 WeakPolarHBondContact O-CB 3.28Å; M1386-T1389 PolarHBondContact O-N 2.93Å; I1387-T1389 VanDerWaalsContact C-N 3.3Å; I1387-T1389 PolarHBondContact O-N 3.35Å; T1389-T1393 WeakPolarHBondContact O-CB 3.42Å; T1389-T1393 PolarHBondContact O-N 3.38Å; T1389-T1393 PolarHBondContact O-OG1 2.98Å; T1389-I1428 HydrophobicContact CG2-CD1 3.84Å; T1389-R1452 PolarHBondContact OG1-NH2 3.18Å
1390	G	90.1	Very high	89.5	Confident	36 Å²	36	48.6 Å²	48.6	37%	0.371	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-47.2	169.9	0	0	0	0	0	112.9	M1386 I1387 F1388 F1392 T1393 V1394	M1386-G1390 PolarHBondContact O-N 3.36Å; I1387-G1390 WeakPolarHBondContact O-CA 3.43Å; I1387-G1390 PolarHBondContact O-N 3.08Å; I1387-G1390 VanDerWaalsContact O-N 3.12Å; F1388-G1390 VanDerWaalsContact C-N 3.31Å; F1388-G1390 PolarHBondContact O-N 3.47Å; G1390-F1392 PolarHBondContact O-N 3.15Å; G1390-T1393 WeakPolarHBondContact O-CB 3.22Å; G1390-T1393 PolarHBondContact O-N 3.19Å; G1390-V1394 WeakPolarHBondContact O-CG2 3.25Å; G1390-V1394 PolarHBondContact O-N 2.76Å
1391	V	92	Very high	89.5	Confident	36 Å²	36	49.8 Å²	49.8	22%	0.218	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-46.4	178.4	173.9	0	0	0	0	111.9	I1355 F1358 I1387 F1388 T1393 V1394 E1395	I1355-V1391 HydrophobicContact CD1-CG1 4.43Å; F1358-V1391 HydrophobicContact CD2-CG1 3.76Å; F1358-V1391 HydrophobicContact CE2-CG1 4.09Å; F1358-V1391 HydrophobicContact CG-CG1 4.13Å; I1387-V1391 PolarHBondContact O-N 3.27Å; F1388-V1391 PolarHBondContact O-N 3.06Å; V1391-T1393 VanDerWaalsContact C-N 3.33Å; V1391-T1393 PolarHBondContact O-N 3.48Å; V1391-V1394 PolarHBondContact O-N 3.36Å; V1391-E1395 PolarHBondContact O-N 2.93Å
1392	F	91.4	Very high	89.7	Confident	6 Å²	6	49 Å²	49	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-70.4	-28.3	178.2	-59.5	-52.1	0	0	0	113	I1355 F1358 I1359 F1388 G1390 E1395 F1396 V1421 R1452	I1355-F1392 HydrophobicContact CG2-CE1 4.37Å; F1358-F1392 HydrophobicContact CB-CZ 4.41Å; I1359-F1392 HydrophobicContact CD1-CE1 4.34Å; I1359-F1392 HydrophobicContact CG1-CE1 3.63Å; I1359-F1392 HydrophobicContact CG1-CZ 3.62Å; F1388-F1392 HydrophobicContact CB-CD2 4.46Å; F1388-F1392 HydrophobicContact CB-CE2 3.97Å; F1388-F1392 WeakPolarHBondContact O-CD2 3.34Å; F1388-F1392 WeakPolarHBondContact O-CG 3.49Å; F1388-F1392 PolarHBondContact O-N 3.36Å; G1390-F1392 PolarHBondContact O-N 3.15Å; F1392-E1395 WeakPolarHBondContact CD1-OE2 3.31Å; F1392-E1395 WeakPolarHBondContact O-CB 3.39Å; F1392-E1395 PolarHBondContact O-N 3.12Å; F1392-F1396 PolarHBondContact O-N 2.98Å; F1392-V1421 HydrophobicContact CB-CG2 4.08Å; F1392-R1452 HydrophobicContact CE2-CG 4.46Å
1393	T	90.7	Very high	89.9	Confident	29 Å²	29	47 Å²	47	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-40.4	170	-57.3	0	0	0	0	111.3	T1389 G1390 V1391 F1396 V1397 F1425	T1389-T1393 WeakPolarHBondContact O-CB 3.42Å; T1389-T1393 PolarHBondContact O-N 3.38Å; T1389-T1393 PolarHBondContact O-OG1 2.98Å; G1390-T1393 WeakPolarHBondContact O-CB 3.22Å; G1390-T1393 PolarHBondContact O-N 3.19Å; V1391-T1393 VanDerWaalsContact C-N 3.33Å; V1391-T1393 PolarHBondContact O-N 3.48Å; T1393-F1396 PolarHBondContact O-N 3.05Å; T1393-V1397 WeakPolarHBondContact O-CG2 3.46Å; T1393-V1397 PolarHBondContact O-N 3.25Å; T1393-F1425 HydrophobicContact CG2-CE2 3.91Å; T1393-F1425 HydrophobicContact CG2-CZ 3.93Å; T1393-F1425 WeakPolarHBondContact OG1-CE2 3.19Å
1394	V	91.8	Very high	89.8	Confident	84 Å²	84	40.9 Å²	40.9	51%	0.509	23%	0.234	S	C	.	.	H	α-helix	trans	-66.7	-41.1	174.3	173.2	0	0	0	0	111.2	G1390 V1391 F1396 V1397 L1398	G1390-V1394 WeakPolarHBondContact O-CG2 3.25Å; G1390-V1394 PolarHBondContact O-N 2.76Å; V1391-V1394 PolarHBondContact O-N 3.36Å; V1394-F1396 VanDerWaalsContact C-N 3.34Å; V1394-F1396 PolarHBondContact O-N 3.39Å; V1394-V1397 PolarHBondContact O-N 2.83Å; V1394-L1398 HydrophobicContact CG1-CD1 3.68Å; V1394-L1398 HydrophobicContact CG1-CG 4.14Å; V1394-L1398 VanDerWaalsContact O-CB 3.26Å; V1394-L1398 WeakPolarHBondContact O-CB 3.28Å; V1394-L1398 WeakPolarHBondContact O-CG 3.26Å; V1394-L1398 PolarHBondContact O-N 2.97Å
1395	E	91.3	Very high	89.8	Confident	10 Å²	10	44.6 Å²	44.6	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-53.6	-50.1	171.5	-172	-164.2	167.1	0	0	111.1	F1351 I1355 V1391 F1392 L1398 K1399 K1455	F1351-E1395 HydrophobicContact CE1-CG 4.36Å; F1351-E1395 HydrophobicContact CZ-CG 4.26Å; I1355-E1395 HydrophobicContact CD1-CB 3.99Å; I1355-E1395 HydrophobicContact CD1-CG 3.92Å; I1355-E1395 HydrophobicContact CG1-CG 4.18Å; I1355-E1395 WeakPolarHBondContact CG2-OE2 3.47Å; V1391-E1395 PolarHBondContact O-N 2.93Å; F1392-E1395 WeakPolarHBondContact CD1-OE2 3.31Å; F1392-E1395 WeakPolarHBondContact O-CB 3.39Å; F1392-E1395 PolarHBondContact O-N 3.12Å; E1395-L1398 PolarHBondContact O-N 3.04Å; E1395-K1399 HydrophobicContact CG-CD 4.11Å; E1395-K1399 WeakPolarHBondContact O-CB 3.2Å; E1395-K1399 VanDerWaalsContact O-CG 3.3Å; E1395-K1399 WeakPolarHBondContact O-CG 3.32Å; E1395-K1399 PolarHBondContact O-N 3.47Å; E1395-K1399 WeakPolarHBondContact OE1-CE 3.47Å; E1395-K1399 IonicContact OE1-NZ 3.9Å; E1395-K1399 PolarHBondContact OE1-NZ 3.07Å; E1395-K1455 IonicContact OE1-NZ 2.67Å; E1395-K1455 PolarHBondContact OE1-NZ 2.76Å; E1395-K1455 IonicContact OE2-NZ 2.65Å; E1395-K1455 PolarHBondContact OE2-NZ 3.32Å
1396	F	91.1	Very high	90	Very high	36 Å²	36	52.8 Å²	52.8	16%	0.158	28%	0.283	C	S	.	.	H	α-helix	trans	-58.6	-52.8	178.1	160.2	-117.9	0	0	0	112.7	F1392 T1393 V1394 L1398 K1399 L1400 Y1408 F1418 V1421	F1392-F1396 PolarHBondContact O-N 2.98Å; T1393-F1396 PolarHBondContact O-N 3.05Å; V1394-F1396 VanDerWaalsContact C-N 3.34Å; V1394-F1396 PolarHBondContact O-N 3.39Å; F1396-L1398 VanDerWaalsContact C-N 3.33Å; F1396-L1398 PolarHBondContact O-N 3.08Å; F1396-K1399 PolarHBondContact O-N 3.35Å; F1396-L1400 HydrophobicContact CE2-CB 4.29Å; F1396-L1400 HydrophobicContact CE2-CD2 4Å; F1396-L1400 HydrophobicContact CZ-CD2 3.85Å; F1396-L1400 VanDerWaalsContact O-CB 3.32Å; F1396-L1400 WeakPolarHBondContact O-CB 3.39Å; F1396-L1400 PolarHBondContact O-N 2.97Å; F1396-Y1408 HydrophobicContact CD2-CE1 4.29Å; F1396-Y1408 HydrophobicContact CD2-CE2 4.27Å; F1396-Y1408 AromaticContact CD2-CZ 3.75Å; F1396-Y1408 WeakPolarHBondContact CD2-OH 3.49Å; F1396-Y1408 HydrophobicContact CE2-CE1 4.19Å; F1396-F1418 HydrophobicContact CD2-CD2 4.31Å; F1396-F1418 HydrophobicContact CE1-CD2 4.5Å; F1396-F1418 AromaticContact CE2-CD2 3.65Å; F1396-F1418 HydrophobicContact CE2-CD2 3.65Å; F1396-F1418 HydrophobicContact CE2-CE2 4.35Å; F1396-F1418 AromaticContact CZ-CD2 3.75Å; F1396-F1418 HydrophobicContact CZ-CD2 3.75Å; F1396-F1418 HydrophobicContact CZ-CE2 4.04Å; F1396-V1421 HydrophobicContact CB-CG2 4.31Å; F1396-V1421 HydrophobicContact CD1-CG1 4.47Å
1397	V	92.3	Very high	90	Very high	73 Å²	73	50.7 Å²	50.7	44%	0.442	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-40.3	-178	171.9	0	0	0	0	111.5	T1393 V1394 T1401	T1393-V1397 WeakPolarHBondContact O-CG2 3.46Å; T1393-V1397 PolarHBondContact O-N 3.25Å; V1394-V1397 PolarHBondContact O-N 2.83Å; V1397-T1401 WeakPolarHBondContact O-CG2 3.3Å; V1397-T1401 PolarHBondContact O-N 3.05Å; V1397-T1401 PolarHBondContact O-OG1 3.19Å
1398	L	92.2	Very high	90	Very high	49 Å²	49	45.9 Å²	45.9	26%	0.257	25%	0.249	S	C	.	.	H	α-helix	trans	-63.7	-48.8	175	-73.1	177.1	0	0	0	111	I1342 I1346 F1351 V1394 E1395 F1396 L1400 T1401 A1402	I1342-L1398 HydrophobicContact CG2-CD2 4.38Å; I1346-L1398 HydrophobicContact CD1-CB 3.6Å; I1346-L1398 WeakPolarHBondContact CD1-O 3.03Å; I1346-L1398 HydrophobicContact CG1-CB 4.37Å; F1351-L1398 HydrophobicContact CE2-CD1 4.36Å; V1394-L1398 HydrophobicContact CG1-CD1 3.68Å; V1394-L1398 HydrophobicContact CG1-CG 4.14Å; V1394-L1398 VanDerWaalsContact O-CB 3.26Å; V1394-L1398 WeakPolarHBondContact O-CB 3.28Å; V1394-L1398 WeakPolarHBondContact O-CG 3.26Å; V1394-L1398 PolarHBondContact O-N 2.97Å; E1395-L1398 PolarHBondContact O-N 3.04Å; F1396-L1398 VanDerWaalsContact C-N 3.33Å; F1396-L1398 PolarHBondContact O-N 3.08Å; L1398-L1400 PolarHBondContact O-N 3.37Å; L1398-T1401 PolarHBondContact O-N 2.86Å; L1398-T1401 PolarHBondContact O-OG1 3.38Å; L1398-A1402 WeakPolarHBondContact O-CB 3.41Å; L1398-A1402 PolarHBondContact O-N 3.39Å
1399	K	91.7	Very high	90	Very high	25 Å²	25	48.6 Å²	48.6	11%	0.109	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-42.5	177.9	-76.4	177	169.6	-167.6	0	112.1	I1346 E1395 F1396 T1401 A1402 F1403 Y1408 N1414 D1417	I1346-K1399 HydrophobicContact CG2-CG 3.94Å; E1395-K1399 HydrophobicContact CG-CD 4.11Å; E1395-K1399 WeakPolarHBondContact O-CB 3.2Å; E1395-K1399 VanDerWaalsContact O-CG 3.3Å; E1395-K1399 WeakPolarHBondContact O-CG 3.32Å; E1395-K1399 PolarHBondContact O-N 3.47Å; E1395-K1399 WeakPolarHBondContact OE1-CE 3.47Å; E1395-K1399 IonicContact OE1-NZ 3.9Å; E1395-K1399 PolarHBondContact OE1-NZ 3.07Å; F1396-K1399 PolarHBondContact O-N 3.35Å; K1399-T1401 PolarHBondContact O-N 3.4Å; K1399-A1402 PolarHBondContact O-N 2.88Å; K1399-F1403 HydrophobicContact CB-CD2 4.25Å; K1399-F1403 HydrophobicContact CB-CE2 4.31Å; K1399-F1403 HydrophobicContact CG-CE2 4.31Å; K1399-F1403 WeakPolarHBondContact O-CD2 3.38Å; K1399-F1403 PolarHBondContact O-N 3.05Å; K1399-Y1408 HydrophobicContact CB-CD2 3.87Å; K1399-Y1408 HydrophobicContact CB-CE2 3.54Å; K1399-Y1408 HydrophobicContact CD-CE2 4.21Å; K1399-N1414 WeakPolarHBondContact CD-OD1 3.44Å; K1399-N1414 PolarHBondContact NZ-OD1 3.03Å; K1399-D1417 IonicContact NZ-OD2 3.24Å; K1399-D1417 PolarHBondContact NZ-OD2 3.35Å
1400	L	91.2	Very high	90	Very high	46 Å²	46	52.8 Å²	52.8	24%	0.241	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-40.9	-179.8	-177.1	63.2	0	0	0	111.7	F1396 L1398 G1404 F1405 Y1408	F1396-L1400 HydrophobicContact CE2-CB 4.29Å; F1396-L1400 HydrophobicContact CE2-CD2 4Å; F1396-L1400 HydrophobicContact CZ-CD2 3.85Å; F1396-L1400 VanDerWaalsContact O-CB 3.32Å; F1396-L1400 WeakPolarHBondContact O-CB 3.39Å; F1396-L1400 PolarHBondContact O-N 2.97Å; L1398-L1400 PolarHBondContact O-N 3.37Å; L1400-G1404 VanDerWaalsContact O-CA 3.23Å; L1400-G1404 WeakPolarHBondContact O-CA 3.37Å; L1400-G1404 PolarHBondContact O-N 2.94Å; L1400-F1405 HydrophobicContact CD1-CB 4.43Å; L1400-F1405 HydrophobicContact CD1-CD2 4.41Å; L1400-Y1408 HydrophobicContact CB-CD2 4.36Å; L1400-Y1408 HydrophobicContact CD1-CD1 4.23Å; L1400-Y1408 HydrophobicContact CD1-CG 3.98Å
1401	T	89.8	Confident	89.7	Confident	71 Å²	71	53.9 Å²	53.9	44%	0.436	29%	0.287	S	S	.	.	H	α-helix	trans	-71.5	-35.6	175.9	50.9	0	0	0	0	112.8	V1397 L1398 K1399	V1397-T1401 WeakPolarHBondContact O-CG2 3.3Å; V1397-T1401 PolarHBondContact O-N 3.05Å; V1397-T1401 PolarHBondContact O-OG1 3.19Å; L1398-T1401 PolarHBondContact O-N 2.86Å; L1398-T1401 PolarHBondContact O-OG1 3.38Å; K1399-T1401 PolarHBondContact O-N 3.4Å
1402	A	89.3	Confident	89.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.8	-50.1	176.3	0	0	0	0	0	113.8	Q1339 I1342 W1343 I1346 L1398 K1399	Q1339-A1402 WeakPolarHBondContact CG-O 3.38Å; Q1339-A1402 PolarHBondContact NE2-O 3.38Å; I1342-A1402 HydrophobicContact CG2-CB 4.02Å; W1343-A1402 HydrophobicContact CB-CB 4.09Å; I1346-A1402 HydrophobicContact CD1-CB 3.68Å; L1398-A1402 WeakPolarHBondContact O-CB 3.41Å; L1398-A1402 PolarHBondContact O-N 3.39Å; K1399-A1402 PolarHBondContact O-N 2.88Å
1403	F	88.3	Confident	89.2	Confident	36 Å²	36	60 Å²	60	16%	0.158	32%	0.319	C	S	.	.	H	α-helix	trans	-86.6	-26.3	-175.3	-61.7	-58.6	0	0	0	113	Y1332 W1343 I1346 T1347 K1399 N1407 Y1408	Y1332-F1403 HydrophobicContact CD1-CD1 4.18Å; W1343-F1403 AromaticContact CD1-CD1 3.87Å; W1343-F1403 AromaticContact CD1-CE1 3.61Å; W1343-F1403 AromaticContact NE1-CE1 3.79Å; I1346-F1403 HydrophobicContact CG2-CE2 4.42Å; T1347-F1403 HydrophobicContact CG2-CE1 4.13Å; T1347-F1403 HydrophobicContact CG2-CZ 4.02Å; K1399-F1403 HydrophobicContact CB-CD2 4.25Å; K1399-F1403 HydrophobicContact CB-CE2 4.31Å; K1399-F1403 HydrophobicContact CG-CE2 4.31Å; K1399-F1403 WeakPolarHBondContact O-CD2 3.38Å; K1399-F1403 PolarHBondContact O-N 3.05Å; F1403-N1407 HydrophobicContact CB-CB 4.22Å; F1403-N1407 WeakPolarHBondContact O-CB 3.12Å; F1403-N1407 PolarHBondContact O-ND2 2.89Å; F1403-Y1408 HydrophobicContact CD2-CD2 4.49Å
1404	G	86.3	Confident	89.2	Confident	24 Å²	24	59.1 Å²	59.1	25%	0.247	31%	0.314	C	S	.	.			trans	72.3	146.6	-167.9	0	0	0	0	0	111.9	L1400 K1406 N1407 Y1408	L1400-G1404 VanDerWaalsContact O-CA 3.23Å; L1400-G1404 WeakPolarHBondContact O-CA 3.37Å; L1400-G1404 PolarHBondContact O-N 2.94Å; G1404-K1406 VanDerWaalsContact C-N 3.32Å; G1404-K1406 PolarHBondContact O-N 3.35Å; G1404-N1407 PolarHBondContact O-N 3.09Å; G1404-Y1408 PolarHBondContact O-N 2.77Å
1405	F	88.3	Confident	89.1	Confident	144 Å²	144	57.3 Å²	57.3	63%	0.632	30%	0.303	S	S	*	.	H	α-helix	trans	-39.4	-53.7	-172.3	-168.5	-84.7	0	0	0	114.1	L1400 N1407 Y1408 F1409	L1400-F1405 HydrophobicContact CD1-CB 4.43Å; L1400-F1405 HydrophobicContact CD1-CD2 4.41Å; F1405-N1407 VanDerWaalsContact C-N 3.34Å; F1405-N1407 PolarHBondContact O-N 3.46Å; F1405-Y1408 PolarHBondContact O-N 3.23Å; F1405-F1409 AromaticContact CD1-CD2 3.97Å; F1405-F1409 HydrophobicContact CD1-CD2 3.97Å; F1405-F1409 HydrophobicContact CD1-CE2 4.4Å; F1405-F1409 HydrophobicContact CD2-CD2 4.05Å; F1405-F1409 AromaticContact CD2-CE2 3.69Å; F1405-F1409 HydrophobicContact CD2-CE2 3.69Å; F1405-F1409 AromaticContact CE1-CD2 3.89Å; F1405-F1409 HydrophobicContact CE1-CD2 3.89Å; F1405-F1409 HydrophobicContact CE1-CE2 4.21Å; F1405-F1409 AromaticContact CE2-CD2 3.98Å; F1405-F1409 HydrophobicContact CE2-CD2 3.98Å; F1405-F1409 AromaticContact CE2-CE2 3.46Å; F1405-F1409 HydrophobicContact CE2-CE2 3.46Å; F1405-F1409 VanDerWaalsContact CE2-CE2 3.46Å; F1405-F1409 HydrophobicContact CE2-CZ 4.36Å; F1405-F1409 HydrophobicContact CG-CD2 4.04Å; F1405-F1409 HydrophobicContact CG-CE2 4.16Å; F1405-F1409 AromaticContact CZ-CD2 3.89Å; F1405-F1409 HydrophobicContact CZ-CD2 3.89Å; F1405-F1409 AromaticContact CZ-CE2 3.74Å; F1405-F1409 HydrophobicContact CZ-CE2 3.74Å; F1405-F1409 WeakPolarHBondContact O-CD2 3.43Å; F1405-F1409 PolarHBondContact O-N 3.27Å; F1405-F1409 VanDerWaalsContact O-N 3.09Å
1406	K	87.1	Confident	89	Confident	181 Å²	181	58.8 Å²	58.8	79%	0.787	31%	0.309	S	S	*	.	H	α-helix	trans	-63	-32.5	-176	-177.1	169.7	-178.9	170.8	0	114.7	G1404	G1404-K1406 VanDerWaalsContact C-N 3.32Å; G1404-K1406 PolarHBondContact O-N 3.35Å
1407	N	86.3	Confident	88.9	Confident	61 Å²	61	57.5 Å²	57.5	33%	0.326	30%	0.304	S	S	.	.	H	α-helix	trans	-90.8	-31.7	179	-49.6	-64.5	0	0	0	111.1	Y1332 F1403 G1404 F1405 S1410	Y1332-N1407 WeakPolarHBondContact CD2-ND2 3.22Å; Y1332-N1407 WeakPolarHBondContact CE2-ND2 3.45Å; F1403-N1407 HydrophobicContact CB-CB 4.22Å; F1403-N1407 WeakPolarHBondContact O-CB 3.12Å; F1403-N1407 PolarHBondContact O-ND2 2.89Å; G1404-N1407 PolarHBondContact O-N 3.09Å; F1405-N1407 VanDerWaalsContact C-N 3.34Å; F1405-N1407 PolarHBondContact O-N 3.46Å; N1407-S1410 WeakPolarHBondContact O-CB 3.31Å; N1407-S1410 PolarHBondContact O-N 3.28Å; N1407-S1410 VanDerWaalsContact O-N 3.14Å
1408	Y	90.1	Very high	88.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-56.3	-55.2	173.1	-178	-87.1	0	0	0	111.2	F1396 K1399 L1400 F1403 G1404 F1405 S1410 D1411 N1414 F1418	F1396-Y1408 HydrophobicContact CD2-CE1 4.29Å; F1396-Y1408 HydrophobicContact CD2-CE2 4.27Å; F1396-Y1408 AromaticContact CD2-CZ 3.75Å; F1396-Y1408 WeakPolarHBondContact CD2-OH 3.49Å; F1396-Y1408 HydrophobicContact CE2-CE1 4.19Å; K1399-Y1408 HydrophobicContact CB-CD2 3.87Å; K1399-Y1408 HydrophobicContact CB-CE2 3.54Å; K1399-Y1408 HydrophobicContact CD-CE2 4.21Å; L1400-Y1408 HydrophobicContact CB-CD2 4.36Å; L1400-Y1408 HydrophobicContact CD1-CD1 4.23Å; L1400-Y1408 HydrophobicContact CD1-CG 3.98Å; F1403-Y1408 HydrophobicContact CD2-CD2 4.49Å; G1404-Y1408 PolarHBondContact O-N 2.77Å; F1405-Y1408 PolarHBondContact O-N 3.23Å; Y1408-S1410 PolarHBondContact O-N 2.79Å; Y1408-S1410 VanDerWaalsContact O-N 3.1Å; Y1408-D1411 PolarHBondContact O-N 2.84Å; Y1408-N1414 HydrophobicContact CD1-CB 4.31Å; Y1408-N1414 HydrophobicContact CD2-CB 4.07Å; Y1408-N1414 HydrophobicContact CE1-CB 3.97Å; Y1408-N1414 VanDerWaalsContact CE1-O 3.26Å; Y1408-N1414 WeakPolarHBondContact CE1-O 3.26Å; Y1408-N1414 HydrophobicContact CE2-CB 3.74Å; Y1408-N1414 HydrophobicContact CG-CB 4.33Å; Y1408-N1414 VanDerWaalsContact CZ-O 3.24Å; Y1408-N1414 WeakPolarHBondContact O-CB 3.41Å; Y1408-N1414 PolarHBondContact OH-O 3.43Å; Y1408-F1418 HydrophobicContact CE1-CB 4.23Å
1409	F	92	Very high	88.7	Confident	67 Å²	67	58.9 Å²	58.9	29%	0.294	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	6.1	177.7	-69.6	-77.7	0	0	0	114.3	F1405 V1415 F1418	F1405-F1409 AromaticContact CD1-CD2 3.97Å; F1405-F1409 HydrophobicContact CD1-CD2 3.97Å; F1405-F1409 HydrophobicContact CD1-CE2 4.4Å; F1405-F1409 HydrophobicContact CD2-CD2 4.05Å; F1405-F1409 AromaticContact CD2-CE2 3.69Å; F1405-F1409 HydrophobicContact CD2-CE2 3.69Å; F1405-F1409 AromaticContact CE1-CD2 3.89Å; F1405-F1409 HydrophobicContact CE1-CD2 3.89Å; F1405-F1409 HydrophobicContact CE1-CE2 4.21Å; F1405-F1409 AromaticContact CE2-CD2 3.98Å; F1405-F1409 HydrophobicContact CE2-CD2 3.98Å; F1405-F1409 AromaticContact CE2-CE2 3.46Å; F1405-F1409 HydrophobicContact CE2-CE2 3.46Å; F1405-F1409 VanDerWaalsContact CE2-CE2 3.46Å; F1405-F1409 HydrophobicContact CE2-CZ 4.36Å; F1405-F1409 HydrophobicContact CG-CD2 4.04Å; F1405-F1409 HydrophobicContact CG-CE2 4.16Å; F1405-F1409 AromaticContact CZ-CD2 3.89Å; F1405-F1409 HydrophobicContact CZ-CD2 3.89Å; F1405-F1409 AromaticContact CZ-CE2 3.74Å; F1405-F1409 HydrophobicContact CZ-CE2 3.74Å; F1405-F1409 WeakPolarHBondContact O-CD2 3.43Å; F1405-F1409 PolarHBondContact O-N 3.27Å; F1405-F1409 VanDerWaalsContact O-N 3.09Å; F1409-V1415 HydrophobicContact CD1-CG2 4.12Å; F1409-F1418 HydrophobicContact CE1-CB 4.49Å; F1409-F1418 AromaticContact CE1-CD1 3.93Å; F1409-F1418 HydrophobicContact CE1-CD1 3.93Å; F1409-F1418 HydrophobicContact CE1-CE1 4.32Å; F1409-F1418 HydrophobicContact CE1-CG 4.12Å; F1409-F1418 HydrophobicContact CZ-CD1 4.34Å; F1409-F1418 HydrophobicContact CZ-CD2 4.41Å; F1409-F1418 HydrophobicContact CZ-CG 4.29Å
1410	S	85.7	Confident	88.6	Confident	94 Å²	94	57.9 Å²	57.9	66%	0.657	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-10.5	173.8	-170.5	0	0	0	0	113.5	N1407 Y1408	N1407-S1410 WeakPolarHBondContact O-CB 3.31Å; N1407-S1410 PolarHBondContact O-N 3.28Å; N1407-S1410 VanDerWaalsContact O-N 3.14Å; Y1408-S1410 PolarHBondContact O-N 2.79Å; Y1408-S1410 VanDerWaalsContact O-N 3.1Å
1411	D	83.7	Confident	88.6	Confident	59 Å²	59	56 Å²	56	32%	0.316	29%	0.291	S	S	.	.	S	Bend	trans	-109.7	116.1	176.3	174.9	4.2	0	0	0	109.5	Y1408 W1413 N1414 V1415	Y1408-D1411 PolarHBondContact O-N 2.84Å; D1411-W1413 PolarHBondContact O-N 2.93Å; D1411-W1413 VanDerWaalsContact O-N 3.1Å; D1411-W1413 PolarHBondContact OD1-N 3.29Å; D1411-N1414 HydrophobicContact CB-CB 4.36Å; D1411-N1414 WeakPolarHBondContact CB-ND2 3.28Å; D1411-N1414 PolarHBondContact O-N 3.01Å; D1411-N1414 PolarHBondContact OD2-ND2 3.16Å; D1411-V1415 PolarHBondContact O-N 3.36Å
1412	P	86.8	Confident	88.7	Confident	98 Å²	98	55.8 Å²	55.8	64%	0.636	29%	0.289	S	S	*	.	H	α-helix	trans	-53	-30.3	179.8	-28	36	0	0	0	114.8	V1415 F1416	P1412-V1415 PolarHBondContact O-N 2.91Å; P1412-F1416 WeakPolarHBondContact O-CB 3.47Å; P1412-F1416 PolarHBondContact O-N 3.09Å
1413	W	87.3	Confident	88.6	Confident	73 Å²	73	56 Å²	56	28%	0.277	29%	0.292	S	S	.	.	H	α-helix	trans	-70.7	-34.8	178.4	-67.8	104.3	0	0	0	112.6	D1411 F1416 D1417 V1454 N1458	D1411-W1413 PolarHBondContact O-N 2.93Å; D1411-W1413 VanDerWaalsContact O-N 3.1Å; D1411-W1413 PolarHBondContact OD1-N 3.29Å; W1413-F1416 HydrophobicContact CE3-CD1 4.38Å; W1413-F1416 PolarHBondContact O-N 3.36Å; W1413-D1417 PolarHBondContact O-N 2.91Å; W1413-V1454 HydrophobicContact CZ3-CG1 4.47Å; W1413-N1458 HydrophobicContact CD2-CB 4.12Å; W1413-N1458 HydrophobicContact CE3-CB 4.26Å; W1413-N1458 HydrophobicContact CH2-CB 3.99Å; W1413-N1458 HydrophobicContact CZ2-CB 3.83Å; W1413-N1458 HydrophobicContact CZ3-CB 4.19Å; W1413-N1458 PolarHBondContact NE1-OD1 3.19Å
1414	N	89.3	Confident	88.5	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.059	29%	0.285	C	S	.	.	H	α-helix	trans	-74.2	-28.8	173.9	-67.1	-39.9	0	0	0	111.6	K1399 Y1408 D1411 F1418	K1399-N1414 WeakPolarHBondContact CD-OD1 3.44Å; K1399-N1414 PolarHBondContact NZ-OD1 3.03Å; Y1408-N1414 HydrophobicContact CD1-CB 4.31Å; Y1408-N1414 HydrophobicContact CD2-CB 4.07Å; Y1408-N1414 HydrophobicContact CE1-CB 3.97Å; Y1408-N1414 VanDerWaalsContact CE1-O 3.26Å; Y1408-N1414 WeakPolarHBondContact CE1-O 3.26Å; Y1408-N1414 HydrophobicContact CE2-CB 3.74Å; Y1408-N1414 HydrophobicContact CG-CB 4.33Å; Y1408-N1414 VanDerWaalsContact CZ-O 3.24Å; Y1408-N1414 WeakPolarHBondContact O-CB 3.41Å; Y1408-N1414 PolarHBondContact OH-O 3.43Å; D1411-N1414 HydrophobicContact CB-CB 4.36Å; D1411-N1414 WeakPolarHBondContact CB-ND2 3.28Å; D1411-N1414 PolarHBondContact O-N 3.01Å; D1411-N1414 PolarHBondContact OD2-ND2 3.16Å; N1414-F1418 PolarHBondContact O-N 3.06Å; N1414-F1418 VanDerWaalsContact O-N 3.13Å
1415	V	90.5	Very high	88.6	Confident	46 Å²	46	57.7 Å²	57.7	28%	0.279	29%	0.293	S	S	.	.	H	α-helix	trans	-66	-42.3	168.6	-173.9	0	0	0	0	110.9	F1409 D1411 P1412 F1418 I1419	F1409-V1415 HydrophobicContact CD1-CG2 4.12Å; D1411-V1415 PolarHBondContact O-N 3.36Å; P1412-V1415 PolarHBondContact O-N 2.91Å; V1415-F1418 PolarHBondContact O-N 3.29Å; V1415-I1419 HydrophobicContact CG1-CD1 4.24Å; V1415-I1419 WeakPolarHBondContact O-CG1 3.35Å; V1415-I1419 PolarHBondContact O-N 3.03Å; V1415-I1419 VanDerWaalsContact O-N 3.08Å
1416	F	89.3	Confident	88.5	Confident	41 Å²	41	53.9 Å²	53.9	18%	0.18	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-43.6	176.4	-177.6	-113.2	0	0	0	112.5	P1412 W1413 F1418 I1419 I1420 M1451 V1454 K1455	P1412-F1416 WeakPolarHBondContact O-CB 3.47Å; P1412-F1416 PolarHBondContact O-N 3.09Å; W1413-F1416 HydrophobicContact CE3-CD1 4.38Å; W1413-F1416 PolarHBondContact O-N 3.36Å; F1416-F1418 VanDerWaalsContact C-N 3.31Å; F1416-F1418 PolarHBondContact O-N 3.29Å; F1416-I1419 PolarHBondContact O-N 3.4Å; F1416-I1420 HydrophobicContact CD1-CD1 3.78Å; F1416-I1420 HydrophobicContact CE1-CD1 3.37Å; F1416-I1420 HydrophobicContact CE1-CG1 4.43Å; F1416-I1420 HydrophobicContact CE2-CD1 4.29Å; F1416-I1420 HydrophobicContact CG-CD1 4.41Å; F1416-I1420 HydrophobicContact CZ-CD1 3.65Å; F1416-I1420 HydrophobicContact CZ-CG1 4.35Å; F1416-I1420 PolarHBondContact O-N 2.74Å; F1416-M1451 HydrophobicContact CE2-CE 3.86Å; F1416-M1451 HydrophobicContact CZ-CB 4.34Å; F1416-M1451 HydrophobicContact CZ-CE 4.01Å; F1416-M1451 WeakPolarHBondContact CZ-O 3.32Å; F1416-V1454 HydrophobicContact CE1-CB 3.85Å; F1416-V1454 HydrophobicContact CE1-CG1 4.1Å; F1416-V1454 HydrophobicContact CZ-CB 3.76Å; F1416-V1454 HydrophobicContact CZ-CG1 4.01Å; F1416-V1454 HydrophobicContact CZ-CG2 4.27Å; F1416-K1455 HydrophobicContact CD1-CG 4.49Å; F1416-K1455 HydrophobicContact CE1-CG 4.33Å
1417	D	88.7	Confident	88.3	Confident	8 Å²	8	45.3 Å²	45.3	4%	0.043	24%	0.244	C	C	.	.	H	α-helix	trans	-56.4	-43.7	172.7	-78.7	-9.5	0	0	0	112.5	K1399 W1413 I1420 V1421 K1455	K1399-D1417 IonicContact NZ-OD2 3.24Å; K1399-D1417 PolarHBondContact NZ-OD2 3.35Å; W1413-D1417 PolarHBondContact O-N 2.91Å; D1417-I1420 PolarHBondContact O-N 2.8Å; D1417-V1421 WeakPolarHBondContact O-CG2 3.3Å; D1417-V1421 PolarHBondContact O-N 3.03Å; D1417-K1455 WeakPolarHBondContact OD1-CD 3.3Å; D1417-K1455 WeakPolarHBondContact OD1-CE 3.37Å; D1417-K1455 IonicContact OD1-NZ 3.31Å; D1417-K1455 PolarHBondContact OD1-NZ 3.22Å; D1417-K1455 IonicContact OD2-NZ 3.12Å; D1417-K1455 PolarHBondContact OD2-NZ 2.64Å
1418	F	90.8	Very high	88.1	Confident	69 Å²	69	44 Å²	44	30%	0.303	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-42.9	177.1	171.3	-104	0	0	0	111.8	F1396 Y1408 F1409 N1414 V1415 F1416 I1420 V1421 V1422	F1396-F1418 HydrophobicContact CD2-CD2 4.31Å; F1396-F1418 HydrophobicContact CE1-CD2 4.5Å; F1396-F1418 AromaticContact CE2-CD2 3.65Å; F1396-F1418 HydrophobicContact CE2-CD2 3.65Å; F1396-F1418 HydrophobicContact CE2-CE2 4.35Å; F1396-F1418 AromaticContact CZ-CD2 3.75Å; F1396-F1418 HydrophobicContact CZ-CD2 3.75Å; F1396-F1418 HydrophobicContact CZ-CE2 4.04Å; Y1408-F1418 HydrophobicContact CE1-CB 4.23Å; F1409-F1418 HydrophobicContact CE1-CB 4.49Å; F1409-F1418 AromaticContact CE1-CD1 3.93Å; F1409-F1418 HydrophobicContact CE1-CD1 3.93Å; F1409-F1418 HydrophobicContact CE1-CE1 4.32Å; F1409-F1418 HydrophobicContact CE1-CG 4.12Å; F1409-F1418 HydrophobicContact CZ-CD1 4.34Å; F1409-F1418 HydrophobicContact CZ-CD2 4.41Å; F1409-F1418 HydrophobicContact CZ-CG 4.29Å; N1414-F1418 PolarHBondContact O-N 3.06Å; N1414-F1418 VanDerWaalsContact O-N 3.13Å; V1415-F1418 PolarHBondContact O-N 3.29Å; F1416-F1418 VanDerWaalsContact C-N 3.31Å; F1416-F1418 PolarHBondContact O-N 3.29Å; F1418-I1420 PolarHBondContact O-N 2.85Å; F1418-V1421 PolarHBondContact O-N 3.21Å; F1418-V1422 HydrophobicContact CD2-CG2 4.16Å; F1418-V1422 HydrophobicContact CE1-CG2 4.23Å; F1418-V1422 HydrophobicContact CE2-CG2 3.75Å; F1418-V1422 HydrophobicContact CZ-CG2 3.8Å; F1418-V1422 WeakPolarHBondContact O-CB 3.49Å; F1418-V1422 WeakPolarHBondContact O-CG2 3.38Å; F1418-V1422 PolarHBondContact O-N 3.37Å
1419	I	90.8	Very high	87.7	Confident	82 Å²	82	48.5 Å²	48.5	42%	0.421	26%	0.261	S	S	.	.	H	α-helix	trans	-61.9	-42.9	175.8	-67.7	164.4	0	0	0	111.1	V1415 F1416 G1423 F1448	V1415-I1419 HydrophobicContact CG1-CD1 4.24Å; V1415-I1419 WeakPolarHBondContact O-CG1 3.35Å; V1415-I1419 PolarHBondContact O-N 3.03Å; V1415-I1419 VanDerWaalsContact O-N 3.08Å; F1416-I1419 PolarHBondContact O-N 3.4Å; I1419-G1423 PolarHBondContact O-N 2.83Å; I1419-F1448 HydrophobicContact CG2-CE1 4.15Å
1420	I	89.8	Confident	87	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-61	-47.9	176.2	-75.5	168.9	0	0	0	111.3	F1416 D1417 F1418 G1423 S1424 M1451 R1452	F1416-I1420 HydrophobicContact CD1-CD1 3.78Å; F1416-I1420 HydrophobicContact CE1-CD1 3.37Å; F1416-I1420 HydrophobicContact CE1-CG1 4.43Å; F1416-I1420 HydrophobicContact CE2-CD1 4.29Å; F1416-I1420 HydrophobicContact CG-CD1 4.41Å; F1416-I1420 HydrophobicContact CZ-CD1 3.65Å; F1416-I1420 HydrophobicContact CZ-CG1 4.35Å; F1416-I1420 PolarHBondContact O-N 2.74Å; D1417-I1420 PolarHBondContact O-N 2.8Å; F1418-I1420 PolarHBondContact O-N 2.85Å; I1420-G1423 PolarHBondContact O-N 2.8Å; I1420-S1424 WeakPolarHBondContact O-CB 3.42Å; I1420-S1424 PolarHBondContact O-N 3.46Å; I1420-S1424 PolarHBondContact O-OG 2.88Å; I1420-M1451 HydrophobicContact CD1-CB 4.43Å; I1420-M1451 HydrophobicContact CG1-CB 4.3Å; I1420-R1452 HydrophobicContact CG2-CG 3.65Å
1421	V	90.9	Very high	86.4	Confident	8 Å²	8	44.6 Å²	44.6	5%	0.048	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-46.3	-179.1	170.1	0	0	0	0	110.5	F1392 F1396 D1417 F1418 S1424 F1425	F1392-V1421 HydrophobicContact CB-CG2 4.08Å; F1396-V1421 HydrophobicContact CB-CG2 4.31Å; F1396-V1421 HydrophobicContact CD1-CG1 4.47Å; D1417-V1421 WeakPolarHBondContact O-CG2 3.3Å; D1417-V1421 PolarHBondContact O-N 3.03Å; F1418-V1421 PolarHBondContact O-N 3.21Å; V1421-S1424 PolarHBondContact O-N 3.18Å; V1421-F1425 HydrophobicContact CG1-CD2 3.92Å; V1421-F1425 HydrophobicContact CG1-CE2 3.73Å; V1421-F1425 VanDerWaalsContact O-CD2 3.28Å; V1421-F1425 WeakPolarHBondContact O-CD2 2.99Å; V1421-F1425 PolarHBondContact O-N 3.3Å
1422	V	90.3	Very high	86	Confident	65 Å²	65	48.3 Å²	48.3	39%	0.394	25%	0.254	S	S	.	.	H	α-helix	trans	-61.8	-47.2	176.2	172.1	0	0	0	0	111.5	F1418 S1424 F1425 V1426	F1418-V1422 HydrophobicContact CD2-CG2 4.16Å; F1418-V1422 HydrophobicContact CE1-CG2 4.23Å; F1418-V1422 HydrophobicContact CE2-CG2 3.75Å; F1418-V1422 HydrophobicContact CZ-CG2 3.8Å; F1418-V1422 WeakPolarHBondContact O-CB 3.49Å; F1418-V1422 WeakPolarHBondContact O-CG2 3.38Å; F1418-V1422 PolarHBondContact O-N 3.37Å; V1422-S1424 VanDerWaalsContact C-N 3.26Å; V1422-S1424 PolarHBondContact O-N 2.77Å; V1422-F1425 PolarHBondContact O-N 3.42Å; V1422-F1425 VanDerWaalsContact O-N 3.13Å; V1422-V1426 WeakPolarHBondContact O-CG2 3.49Å; V1422-V1426 PolarHBondContact O-N 3.41Å
1423	G	88.3	Confident	85.3	Confident	5 Å²	5	49 Å²	49	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-35	177.1	0	0	0	0	0	113.1	I1419 I1420 V1426 D1427	I1419-G1423 PolarHBondContact O-N 2.83Å; I1420-G1423 PolarHBondContact O-N 2.8Å; G1423-V1426 PolarHBondContact O-N 2.78Å; G1423-D1427 WeakPolarHBondContact O-CB 3.23Å; G1423-D1427 PolarHBondContact O-N 3.45Å
1424	S	86.9	Confident	84.2	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-69.6	-35.6	174.7	-53.1	0	0	0	0	112.6	I1420 V1421 V1422 I1428 R1452	I1420-S1424 WeakPolarHBondContact O-CB 3.42Å; I1420-S1424 PolarHBondContact O-N 3.46Å; I1420-S1424 PolarHBondContact O-OG 2.88Å; V1421-S1424 PolarHBondContact O-N 3.18Å; V1422-S1424 VanDerWaalsContact C-N 3.26Å; V1422-S1424 PolarHBondContact O-N 2.77Å; S1424-I1428 WeakPolarHBondContact O-CG1 3.08Å; S1424-I1428 PolarHBondContact O-N 3.38Å; S1424-I1428 VanDerWaalsContact O-N 3.1Å; S1424-R1452 PolarHBondContact OG-NH2 2.92Å
1425	F	87.4	Confident	83	Confident	93 Å²	93	50.3 Å²	50.3	41%	0.408	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-39.1	171	-84.2	-67.6	0	0	0	112	T1393 V1421 V1422 N1429	T1393-F1425 HydrophobicContact CG2-CE2 3.91Å; T1393-F1425 HydrophobicContact CG2-CZ 3.93Å; T1393-F1425 WeakPolarHBondContact OG1-CE2 3.19Å; V1421-F1425 HydrophobicContact CG1-CD2 3.92Å; V1421-F1425 HydrophobicContact CG1-CE2 3.73Å; V1421-F1425 VanDerWaalsContact O-CD2 3.28Å; V1421-F1425 WeakPolarHBondContact O-CD2 2.99Å; V1421-F1425 PolarHBondContact O-N 3.3Å; V1422-F1425 PolarHBondContact O-N 3.42Å; V1422-F1425 VanDerWaalsContact O-N 3.13Å; F1425-N1429 WeakPolarHBondContact O-CB 3.3Å; F1425-N1429 PolarHBondContact O-N 2.76Å; F1425-N1429 PolarHBondContact O-ND2 3.49Å
1426	V	86	Confident	81.4	Confident	64 Å²	64	55.5 Å²	55.5	39%	0.388	31%	0.305	S	S	.	.	H	α-helix	trans	-64.2	-44.5	175.1	176.7	0	0	0	0	110.6	V1422 G1423 I1428 N1429 M1430 F1445	V1422-V1426 WeakPolarHBondContact O-CG2 3.49Å; V1422-V1426 PolarHBondContact O-N 3.41Å; G1423-V1426 PolarHBondContact O-N 2.78Å; V1426-I1428 PolarHBondContact O-N 3.06Å; V1426-N1429 PolarHBondContact O-N 3.41Å; V1426-M1430 WeakPolarHBondContact O-CB 3.25Å; V1426-M1430 PolarHBondContact O-N 3.22Å; V1426-F1445 HydrophobicContact CB-CD1 4.32Å; V1426-F1445 HydrophobicContact CG1-CD1 3.57Å; V1426-F1445 HydrophobicContact CG1-CE1 3.53Å; V1426-F1445 HydrophobicContact CG1-CG 4.26Å; V1426-F1445 HydrophobicContact CG1-CZ 4.17Å
1427	D	83.4	Confident	80	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.011	31%	0.309	C	S	.	.	H	α-helix	trans	-55.7	-49.9	175.2	-179.7	60.7	0	0	0	112.5	G1423 M1430 S1431 F1445 R1446 R1449	G1423-D1427 WeakPolarHBondContact O-CB 3.23Å; G1423-D1427 PolarHBondContact O-N 3.45Å; D1427-M1430 PolarHBondContact O-N 2.99Å; D1427-S1431 WeakPolarHBondContact O-CB 3.5Å; D1427-S1431 PolarHBondContact O-N 3.19Å; D1427-S1431 PolarHBondContact O-OG 2.77Å; D1427-F1445 HydrophobicContact CB-CB 3.93Å; D1427-R1446 WeakPolarHBondContact OD1-CG 3.39Å; D1427-R1446 PolarHBondContact OD1-N 3.29Å; D1427-R1449 IonicContact OD2-CZ 2.83Å; D1427-R1449 IonicContact OD2-NE 2.6Å; D1427-R1449 PolarHBondContact OD2-NE 2.88Å; D1427-R1449 IonicContact OD2-NH2 2.76Å; D1427-R1449 PolarHBondContact OD2-NH2 3.5Å
1428	I	82.1	Confident	78.4	Confident	34 Å²	34	64.9 Å²	64.9	17%	0.174	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-51.5	177.9	-68	168.4	0	0	0	111.2	T1389 S1424 V1426 M1430 S1431 H1432	T1389-I1428 HydrophobicContact CG2-CD1 3.84Å; S1424-I1428 WeakPolarHBondContact O-CG1 3.08Å; S1424-I1428 PolarHBondContact O-N 3.38Å; S1424-I1428 VanDerWaalsContact O-N 3.1Å; V1426-I1428 PolarHBondContact O-N 3.06Å; I1428-M1430 PolarHBondContact O-N 3.49Å; I1428-S1431 PolarHBondContact O-N 2.95Å; I1428-S1431 PolarHBondContact O-OG 2.9Å; I1428-H1432 PolarHBondContact O-CD2 2.84Å; I1428-H1432 VanDerWaalsContact O-CD2 3.23Å; I1428-H1432 PolarHBondContact O-N 2.86Å
1429	N	81.7	Confident	76.6	Confident	94 Å²	94	68 Å²	68	50%	0.503	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-41	-179.2	-76.8	-85.1	0	0	0	111.9	F1425 V1426 S1431 H1432 L1433	F1425-N1429 WeakPolarHBondContact O-CB 3.3Å; F1425-N1429 PolarHBondContact O-N 2.76Å; F1425-N1429 PolarHBondContact O-ND2 3.49Å; V1426-N1429 PolarHBondContact O-N 3.41Å; N1429-S1431 VanDerWaalsContact C-N 3.33Å; N1429-S1431 PolarHBondContact O-N 3.48Å; N1429-H1432 PolarHBondContact O-N 2.83Å; N1429-L1433 WeakPolarHBondContact O-CG 3.29Å; N1429-L1433 PolarHBondContact O-N 3.48Å
1430	M	76.7	Confident	74.9	Confident	32 Å²	32	72.1 Å²	72.1	16%	0.158	39%	0.385	C	S	.	.	H	α-helix	trans	-66	-35.4	176.9	-167.7	65.6	-167.6	0	0	111.6	V1426 D1427 I1428 H1432 L1433 A1434 F1439 I1442 F1445	V1426-M1430 WeakPolarHBondContact O-CB 3.25Å; V1426-M1430 PolarHBondContact O-N 3.22Å; D1427-M1430 PolarHBondContact O-N 2.99Å; I1428-M1430 PolarHBondContact O-N 3.49Å; M1430-H1432 VanDerWaalsContact C-N 3.3Å; M1430-H1432 PolarHBondContact O-N 3.43Å; M1430-L1433 PolarHBondContact O-N 3.16Å; M1430-A1434 VanDerWaalsContact O-CB 3.25Å; M1430-A1434 WeakPolarHBondContact O-CB 3.42Å; M1430-A1434 PolarHBondContact O-N 3.12Å; M1430-F1439 HydrophobicContact CE-CB 3.52Å; M1430-F1439 HydrophobicContact CE-CD2 4.01Å; M1430-F1439 HydrophobicContact CE-CG 4.03Å; M1430-I1442 HydrophobicContact CE-CG1 4.13Å; M1430-I1442 HydrophobicContact CG-CG1 4.22Å; M1430-F1445 HydrophobicContact CG-CD2 4.44Å
1431	S	73.5	Confident	73.4	Confident	46 Å²	46	74.9 Å²	74.9	32%	0.322	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-32.8	175.9	76.2	0	0	0	0	113.1	D1427 I1428 N1429	D1427-S1431 WeakPolarHBondContact O-CB 3.5Å; D1427-S1431 PolarHBondContact O-N 3.19Å; D1427-S1431 PolarHBondContact O-OG 2.77Å; I1428-S1431 PolarHBondContact O-N 2.95Å; I1428-S1431 PolarHBondContact O-OG 2.9Å; N1429-S1431 VanDerWaalsContact C-N 3.33Å; N1429-S1431 PolarHBondContact O-N 3.48Å
1432	H	75.3	Confident	72.3	Confident	138 Å²	138	76.1 Å²	76.1	64%	0.639	41%	0.411	S	S	*	.	H	α-helix	trans	-75.1	-38.1	172.1	-67.5	-59.6	0	0	0	112.6	I1428 N1429 M1430 A1434	I1428-H1432 PolarHBondContact O-CD2 2.84Å; I1428-H1432 VanDerWaalsContact O-CD2 3.23Å; I1428-H1432 PolarHBondContact O-N 2.86Å; N1429-H1432 PolarHBondContact O-N 2.83Å; M1430-H1432 VanDerWaalsContact C-N 3.3Å; M1430-H1432 PolarHBondContact O-N 3.43Å; H1432-A1434 VanDerWaalsContact C-N 3.34Å
1433	L	73.1	Confident	71.3	Confident	111 Å²	111	75.4 Å²	75.4	58%	0.581	41%	0.405	S	S	*	.	H	α-helix	trans	-72.7	-25.1	177.1	-67.1	168.1	0	0	0	113.2	N1429 M1430 A1435 N1436 S1437	N1429-L1433 WeakPolarHBondContact O-CG 3.29Å; N1429-L1433 PolarHBondContact O-N 3.48Å; M1430-L1433 PolarHBondContact O-N 3.16Å; L1433-A1435 PolarHBondContact O-N 3.17Å; L1433-N1436 PolarHBondContact O-N 3.35Å; L1433-S1437 PolarHBondContact O-OG 2.72Å
1434	A	64.1	Low	70.6	Confident	27 Å²	27	81.1 Å²	81.1	22%	0.223	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-61.7	-29.2	178.5	0	0	0	0	0	113.3	M1430 H1432 N1436 S1437 I1442	M1430-A1434 VanDerWaalsContact O-CB 3.25Å; M1430-A1434 WeakPolarHBondContact O-CB 3.42Å; M1430-A1434 PolarHBondContact O-N 3.12Å; H1432-A1434 VanDerWaalsContact C-N 3.34Å; A1434-N1436 PolarHBondContact O-N 2.73Å; A1434-N1436 VanDerWaalsContact O-N 3.07Å; A1434-S1437 PolarHBondContact O-N 3.14Å; A1434-I1442 HydrophobicContact CB-CD1 3.41Å; A1434-I1442 VanDerWaalsContact CB-CD1 3.41Å; A1434-I1442 HydrophobicContact CB-CG1 4.03Å
1435	A	62.6	Low	70.2	Confident	85 Å²	85	83.4 Å²	83.4	70%	0.702	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-56.3	-25.7	177	0	0	0	0	0	113.1	L1433	L1433-A1435 PolarHBondContact O-N 3.17Å
1436	N	58.7	Low	69.8	Low	155 Å²	155	82.3 Å²	82.3	83%	0.829	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-114.7	1.8	-176.1	-63.1	-1.5	0	0	0	113.8	L1433 A1434	L1433-N1436 PolarHBondContact O-N 3.35Å; A1434-N1436 PolarHBondContact O-N 2.73Å; A1434-N1436 VanDerWaalsContact O-N 3.07Å
1437	S	58.4	Low	69.5	Low	38 Å²	38	80.9 Å²	80.9	27%	0.266	42%	0.422	S	S	.	.			trans	-144.3	136.4	-166.4	62.2	0	0	0	0	115.9	L1433 A1434 F1439	L1433-S1437 PolarHBondContact O-OG 2.72Å; A1434-S1437 PolarHBondContact O-N 3.14Å; S1437-F1439 PolarHBondContact O-N 2.92Å
1438	K	56.5	Low	69.5	Low	208 Å²	208	83.2 Å²	83.2	90%	0.904	43%	0.432	S	S	*	.			trans	-76.5	29.1	-176.3	-62.3	-177.6	179	176.2	0	114.6	I1440	K1438-I1440 PolarHBondContact O-N 2.78Å
1439	F	52.4	Low	69.6	Low	135 Å²	135	82.4 Å²	82.4	59%	0.592	43%	0.427	S	S	*	.			trans	-79.3	107.6	-176.2	-75.2	-67.1	0	0	0	112.3	M1430 S1437 S1441 I1442	M1430-F1439 HydrophobicContact CE-CB 3.52Å; M1430-F1439 HydrophobicContact CE-CD2 4.01Å; M1430-F1439 HydrophobicContact CE-CG 4.03Å; S1437-F1439 PolarHBondContact O-N 2.92Å; F1439-S1441 PolarHBondContact O-N 3.13Å; F1439-S1441 VanDerWaalsContact O-N 3.07Å; F1439-I1442 VanDerWaalsContact O-CD1 3.24Å; F1439-I1442 WeakPolarHBondContact O-CD1 3.48Å; F1439-I1442 WeakPolarHBondContact O-CG1 3.2Å
1440	I	54.2	Low	69.8	Low	168 Å²	168	78.1 Å²	78.1	86%	0.862	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-4.8	-168.6	-76.1	168.9	0	0	0	115.2	K1438	K1438-I1440 PolarHBondContact O-N 2.78Å
1441	S	59.8	Low	70.1	Confident	63 Å²	63	80.4 Å²	80.4	44%	0.441	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	6.3	-172.3	56.3	0	0	0	0	116.6	F1439 N1443 F1444	F1439-S1441 PolarHBondContact O-N 3.13Å; F1439-S1441 VanDerWaalsContact O-N 3.07Å; S1441-N1443 VanDerWaalsContact C-N 3.3Å; S1441-N1443 PolarHBondContact O-N 3.3Å; S1441-F1444 VanDerWaalsContact O-CB 3.31Å; S1441-F1444 WeakPolarHBondContact O-CB 3.38Å; S1441-F1444 PolarHBondContact O-N 2.94Å
1442	I	66.3	Low	70.8	Confident	34 Å²	34	78.3 Å²	78.3	17%	0.174	40%	0.4	C	S	.	.	H	α-helix	trans	-53.9	-41.7	-173.9	-61.2	145.5	0	0	0	112.9	M1430 A1434 F1439 F1444 F1445	M1430-I1442 HydrophobicContact CE-CG1 4.13Å; M1430-I1442 HydrophobicContact CG-CG1 4.22Å; A1434-I1442 HydrophobicContact CB-CD1 3.41Å; A1434-I1442 VanDerWaalsContact CB-CD1 3.41Å; A1434-I1442 HydrophobicContact CB-CG1 4.03Å; F1439-I1442 VanDerWaalsContact O-CD1 3.24Å; F1439-I1442 WeakPolarHBondContact O-CD1 3.48Å; F1439-I1442 WeakPolarHBondContact O-CG1 3.2Å; I1442-F1444 PolarHBondContact O-N 2.83Å; I1442-F1444 VanDerWaalsContact O-N 3.13Å; I1442-F1445 PolarHBondContact O-N 3.14Å; I1442-F1445 VanDerWaalsContact O-N 3.12Å
1443	N	70.4	Confident	71.2	Confident	50 Å²	50	72 Å²	72	27%	0.267	37%	0.371	S	S	.	.	H	α-helix	trans	-60.6	-22.9	179.7	-77.7	-1.3	0	0	0	113.9	L329 S1441 R1446	L329-N1443 HydrophobicContact CD2-CB 4.27Å; S1441-N1443 VanDerWaalsContact C-N 3.3Å; S1441-N1443 PolarHBondContact O-N 3.3Å; N1443-R1446 PolarHBondContact OD1-NH1 3.06Å
1444	F	73.6	Confident	71.7	Confident	124 Å²	124	68.2 Å²	68.2	54%	0.544	35%	0.352	S	S	.	.	H	α-helix	trans	-68.8	-35	177	-178.1	-95.8	0	0	0	112.3	S1441 I1442 R1446 L1447	S1441-F1444 VanDerWaalsContact O-CB 3.31Å; S1441-F1444 WeakPolarHBondContact O-CB 3.38Å; S1441-F1444 PolarHBondContact O-N 2.94Å; I1442-F1444 PolarHBondContact O-N 2.83Å; I1442-F1444 VanDerWaalsContact O-N 3.13Å; F1444-R1446 VanDerWaalsContact C-N 3.3Å; F1444-R1446 PolarHBondContact O-N 2.55Å; F1444-L1447 HydrophobicContact CD2-CD1 3.77Å; F1444-L1447 HydrophobicContact CE2-CD1 4.05Å; F1444-L1447 HydrophobicContact CG-CD1 4.43Å; F1444-L1447 VanDerWaalsContact O-CB 3.26Å; F1444-L1447 WeakPolarHBondContact O-CB 3.38Å; F1444-L1447 VanDerWaalsContact O-CG 3.28Å; F1444-L1447 WeakPolarHBondContact O-CG 3.1Å; F1444-L1447 PolarHBondContact O-N 2.95Å
1445	F	78	Confident	72.6	Confident	51 Å²	51	67.9 Å²	67.9	22%	0.224	35%	0.346	C	S	.	.	H	α-helix	trans	-70.5	-28	-179.5	-66.6	-76.3	0	0	0	112.5	V1426 D1427 M1430 I1442 L1447 F1448	V1426-F1445 HydrophobicContact CB-CD1 4.32Å; V1426-F1445 HydrophobicContact CG1-CD1 3.57Å; V1426-F1445 HydrophobicContact CG1-CE1 3.53Å; V1426-F1445 HydrophobicContact CG1-CG 4.26Å; V1426-F1445 HydrophobicContact CG1-CZ 4.17Å; D1427-F1445 HydrophobicContact CB-CB 3.93Å; M1430-F1445 HydrophobicContact CG-CD2 4.44Å; I1442-F1445 PolarHBondContact O-N 3.14Å; I1442-F1445 VanDerWaalsContact O-N 3.12Å; F1445-L1447 PolarHBondContact O-N 2.91Å; F1445-L1447 VanDerWaalsContact O-N 3.15Å; F1445-F1448 HydrophobicContact CD1-CD2 4.36Å; F1445-F1448 HydrophobicContact CD1-CE2 4.03Å; F1445-F1448 WeakPolarHBondContact O-CB 3.44Å; F1445-F1448 WeakPolarHBondContact O-CD2 3.35Å; F1445-F1448 PolarHBondContact O-N 3.46Å; F1445-F1448 VanDerWaalsContact O-N 3.08Å
1446	R	79.1	Confident	73.5	Confident	70 Å²	70	66.1 Å²	66.1	26%	0.264	32%	0.324	S	S	.	.	H	α-helix	trans	-58.8	-26.5	173.3	-63.4	178.8	173.5	168.4	-9.5	112.7	D1427 N1443 F1444 F1448 R1449	D1427-R1446 WeakPolarHBondContact OD1-CG 3.39Å; D1427-R1446 PolarHBondContact OD1-N 3.29Å; N1443-R1446 PolarHBondContact OD1-NH1 3.06Å; F1444-R1446 VanDerWaalsContact C-N 3.3Å; F1444-R1446 PolarHBondContact O-N 2.55Å; R1446-F1448 PolarHBondContact O-N 3.44Å; R1446-R1449 VanDerWaalsContact O-CB 3.24Å; R1446-R1449 WeakPolarHBondContact O-CB 3.29Å; R1446-R1449 WeakPolarHBondContact O-CG 3.29Å; R1446-R1449 PolarHBondContact O-N 3.06Å
1447	L	80.2	Confident	74.4	Confident	33 Å²	33	60 Å²	60	17%	0.173	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-27.2	176.5	-56.6	179.4	0	0	0	112.8	V325 L329 F1444 F1445 R1449 V1450 M1451	V325-L1447 HydrophobicContact CB-CD2 4.41Å; V325-L1447 HydrophobicContact CG1-CD2 3.86Å; V325-L1447 HydrophobicContact CG2-CD2 4.2Å; L329-L1447 HydrophobicContact CD1-CD2 4.43Å; L329-L1447 HydrophobicContact CD2-CD2 4.18Å; L329-L1447 HydrophobicContact CG-CD2 4.19Å; F1444-L1447 HydrophobicContact CD2-CD1 3.77Å; F1444-L1447 HydrophobicContact CE2-CD1 4.05Å; F1444-L1447 HydrophobicContact CG-CD1 4.43Å; F1444-L1447 VanDerWaalsContact O-CB 3.26Å; F1444-L1447 WeakPolarHBondContact O-CB 3.38Å; F1444-L1447 VanDerWaalsContact O-CG 3.28Å; F1444-L1447 WeakPolarHBondContact O-CG 3.1Å; F1444-L1447 PolarHBondContact O-N 2.95Å; F1445-L1447 PolarHBondContact O-N 2.91Å; F1445-L1447 VanDerWaalsContact O-N 3.15Å; L1447-R1449 PolarHBondContact O-N 3.11Å; L1447-V1450 PolarHBondContact O-N 3.38Å; L1447-M1451 WeakPolarHBondContact O-CG 3.44Å; L1447-M1451 PolarHBondContact O-N 2.9Å
1448	F	83.6	Confident	75.1	Confident	52 Å²	52	60.3 Å²	60.3	23%	0.228	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-23.3	173.5	-70.1	-69.4	0	0	0	113.2	I1419 F1445 R1446	I1419-F1448 HydrophobicContact CG2-CE1 4.15Å; F1445-F1448 HydrophobicContact CD1-CD2 4.36Å; F1445-F1448 HydrophobicContact CD1-CE2 4.03Å; F1445-F1448 WeakPolarHBondContact O-CB 3.44Å; F1445-F1448 WeakPolarHBondContact O-CD2 3.35Å; F1445-F1448 PolarHBondContact O-N 3.46Å; F1445-F1448 VanDerWaalsContact O-N 3.08Å; R1446-F1448 PolarHBondContact O-N 3.44Å
1449	R	84.4	Confident	76	Confident	17 Å²	17	54.1 Å²	54.1	6%	0.064	26%	0.261	C	S	.	.	H	α-helix	trans	-67.9	-41.5	169.6	-54	-179.2	-174.1	-166.4	1.2	110.9	L1366 D1382 N1385 D1427 R1446 L1447 R1452	L1366-R1449 HydrophobicContact CD1-CB 4.13Å; L1366-R1449 HydrophobicContact CD2-CB 4.15Å; D1382-R1449 IonicContact OD1-CZ 3.66Å; D1382-R1449 IonicContact OD1-NH1 3.76Å; D1382-R1449 PolarHBondContact OD1-NH1 3.39Å; D1382-R1449 IonicContact OD1-NH2 2.85Å; N1385-R1449 PolarHBondContact ND2-NH1 3.26Å; D1427-R1449 IonicContact OD2-CZ 2.83Å; D1427-R1449 IonicContact OD2-NE 2.6Å; D1427-R1449 PolarHBondContact OD2-NE 2.88Å; D1427-R1449 IonicContact OD2-NH2 2.76Å; D1427-R1449 PolarHBondContact OD2-NH2 3.5Å; R1446-R1449 VanDerWaalsContact O-CB 3.24Å; R1446-R1449 WeakPolarHBondContact O-CB 3.29Å; R1446-R1449 WeakPolarHBondContact O-CG 3.29Å; R1446-R1449 PolarHBondContact O-N 3.06Å; L1447-R1449 PolarHBondContact O-N 3.11Å; R1449-R1452 WeakPolarHBondContact O-CB 2.92Å; R1449-R1452 VanDerWaalsContact O-CD 3.26Å; R1449-R1452 WeakPolarHBondContact O-CD 3.47Å; R1449-R1452 VanDerWaalsContact O-CG 3.27Å; R1449-R1452 WeakPolarHBondContact O-CG 3.37Å
1450	V	84.1	Confident	76.9	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-71.3	-39	-179.3	-166	0	0	0	0	111.3	I324 V325 E328 L1366 L1447 R1452 L1453	I324-V1450 HydrophobicContact CB-CG1 4.12Å; I324-V1450 HydrophobicContact CG2-CB 4.44Å; I324-V1450 HydrophobicContact CG2-CG1 3.77Å; I324-V1450 HydrophobicContact CG2-CG2 3.84Å; V325-V1450 HydrophobicContact CG2-CB 4.42Å; V325-V1450 HydrophobicContact CG2-CG1 3.99Å; E328-V1450 HydrophobicContact CG-CG2 4.39Å; L1366-V1450 HydrophobicContact CD1-CG2 4.39Å; L1447-V1450 PolarHBondContact O-N 3.38Å; V1450-R1452 PolarHBondContact O-N 2.98Å; V1450-L1453 HydrophobicContact CG1-CD1 4.03Å; V1450-L1453 VanDerWaalsContact O-CB 3.31Å; V1450-L1453 WeakPolarHBondContact O-CB 3.17Å; V1450-L1453 PolarHBondContact O-N 2.64Å
1451	M	85	Confident	77.7	Confident	81 Å²	81	45 Å²	45	40%	0.399	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-56.8	-18.8	178.9	-68.9	-60.9	-73.2	0	0	114.2	F1416 I1420 L1447 L1453 V1454	F1416-M1451 HydrophobicContact CE2-CE 3.86Å; F1416-M1451 HydrophobicContact CZ-CB 4.34Å; F1416-M1451 HydrophobicContact CZ-CE 4.01Å; F1416-M1451 WeakPolarHBondContact CZ-O 3.32Å; I1420-M1451 HydrophobicContact CD1-CB 4.43Å; I1420-M1451 HydrophobicContact CG1-CB 4.3Å; L1447-M1451 WeakPolarHBondContact O-CG 3.44Å; L1447-M1451 PolarHBondContact O-N 2.9Å; M1451-L1453 PolarHBondContact O-N 3.44Å; M1451-V1454 HydrophobicContact CE-CG2 4.35Å; M1451-V1454 WeakPolarHBondContact O-CB 3.06Å; M1451-V1454 WeakPolarHBondContact O-CG2 3.3Å; M1451-V1454 PolarHBondContact O-N 3.16Å; M1451-V1454 VanDerWaalsContact O-N 3.16Å; M1451-V1454 HydrophobicContact SD-CG2 4.49Å
1452	R	86.1	Confident	78.2	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.008	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-54.3	-33.4	170.6	-64.2	171.5	-175.8	-176.4	-0.5	112.8	N1362 T1389 F1392 I1420 S1424 R1449 V1450 V1454 K1455	N1362-R1452 PolarHBondContact OD1-NH1 3.49Å; T1389-R1452 PolarHBondContact OG1-NH2 3.18Å; F1392-R1452 HydrophobicContact CE2-CG 4.46Å; I1420-R1452 HydrophobicContact CG2-CG 3.65Å; S1424-R1452 PolarHBondContact OG-NH2 2.92Å; R1449-R1452 WeakPolarHBondContact O-CB 2.92Å; R1449-R1452 VanDerWaalsContact O-CD 3.26Å; R1449-R1452 WeakPolarHBondContact O-CD 3.47Å; R1449-R1452 VanDerWaalsContact O-CG 3.27Å; R1449-R1452 WeakPolarHBondContact O-CG 3.37Å; V1450-R1452 PolarHBondContact O-N 2.98Å; R1452-V1454 VanDerWaalsContact C-N 3.25Å; R1452-V1454 PolarHBondContact O-N 3.15Å; R1452-K1455 WeakPolarHBondContact O-CB 3.04Å; R1452-K1455 PolarHBondContact O-N 3.07Å
1453	L	83.7	Confident	78.5	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.026	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-52	-43.5	175.9	-89.6	163.2	0	0	0	112.4	F317 I321 I324 T1363 V1450 M1451 K1455 L1456	F317-L1453 HydrophobicContact CE2-CD2 4.06Å; F317-L1453 HydrophobicContact CZ-CB 4.18Å; F317-L1453 HydrophobicContact CZ-CD2 4.36Å; F317-L1453 WeakPolarHBondContact CZ-O 3.23Å; I321-L1453 HydrophobicContact CD1-CB 4.26Å; I321-L1453 HydrophobicContact CG1-CB 4.12Å; I321-L1453 HydrophobicContact CG1-CD1 3.8Å; I324-L1453 HydrophobicContact CD1-CD1 4Å; T1363-L1453 HydrophobicContact CG2-CD1 4.3Å; T1363-L1453 HydrophobicContact CG2-CD2 3.61Å; T1363-L1453 HydrophobicContact CG2-CG 4.22Å; T1363-L1453 VanDerWaalsContact OG1-CD2 3.24Å; T1363-L1453 WeakPolarHBondContact OG1-CD2 3.48Å; V1450-L1453 HydrophobicContact CG1-CD1 4.03Å; V1450-L1453 VanDerWaalsContact O-CB 3.31Å; V1450-L1453 WeakPolarHBondContact O-CB 3.17Å; V1450-L1453 PolarHBondContact O-N 2.64Å; M1451-L1453 PolarHBondContact O-N 3.44Å; L1453-K1455 PolarHBondContact O-N 3.12Å; L1453-L1456 HydrophobicContact CD2-CD1 3.86Å; L1453-L1456 VanDerWaalsContact O-CB 3.29Å; L1453-L1456 WeakPolarHBondContact O-CB 3.38Å; L1453-L1456 WeakPolarHBondContact O-CG 3.28Å; L1453-L1456 PolarHBondContact O-N 2.67Å
1454	V	83.8	Confident	78.8	Confident	32 Å²	32	45 Å²	45	19%	0.194	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-57.5	-24.6	-173	-177.2	0	0	0	0	112.2	I321 W1413 F1416 M1451 R1452 L1456 L1457	I321-V1454 HydrophobicContact CD1-CG2 4.24Å; W1413-V1454 HydrophobicContact CZ3-CG1 4.47Å; F1416-V1454 HydrophobicContact CE1-CB 3.85Å; F1416-V1454 HydrophobicContact CE1-CG1 4.1Å; F1416-V1454 HydrophobicContact CZ-CB 3.76Å; F1416-V1454 HydrophobicContact CZ-CG1 4.01Å; F1416-V1454 HydrophobicContact CZ-CG2 4.27Å; M1451-V1454 HydrophobicContact CE-CG2 4.35Å; M1451-V1454 WeakPolarHBondContact O-CB 3.06Å; M1451-V1454 WeakPolarHBondContact O-CG2 3.3Å; M1451-V1454 PolarHBondContact O-N 3.16Å; M1451-V1454 VanDerWaalsContact O-N 3.16Å; M1451-V1454 HydrophobicContact SD-CG2 4.49Å; R1452-V1454 VanDerWaalsContact C-N 3.25Å; R1452-V1454 PolarHBondContact O-N 3.15Å; V1454-L1456 PolarHBondContact O-N 3.02Å; V1454-L1457 HydrophobicContact CG1-CD1 4.33Å; V1454-L1457 WeakPolarHBondContact O-CB 3.3Å; V1454-L1457 PolarHBondContact O-N 3.38Å
1455	K	83	Confident	78.8	Confident	19 Å²	19	41.2 Å²	41.2	8%	0.083	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-57.5	-31.4	172.5	-66.4	-176.7	66.3	150.5	0	113.2	I1359 E1395 F1416 D1417 R1452 L1453 L1457 N1458	I1359-K1455 HydrophobicContact CD1-CB 3.86Å; I1359-K1455 HydrophobicContact CD1-CD 3.8Å; I1359-K1455 HydrophobicContact CD1-CG 4.42Å; E1395-K1455 IonicContact OE1-NZ 2.67Å; E1395-K1455 PolarHBondContact OE1-NZ 2.76Å; E1395-K1455 IonicContact OE2-NZ 2.65Å; E1395-K1455 PolarHBondContact OE2-NZ 3.32Å; F1416-K1455 HydrophobicContact CD1-CG 4.49Å; F1416-K1455 HydrophobicContact CE1-CG 4.33Å; D1417-K1455 WeakPolarHBondContact OD1-CD 3.3Å; D1417-K1455 WeakPolarHBondContact OD1-CE 3.37Å; D1417-K1455 IonicContact OD1-NZ 3.31Å; D1417-K1455 PolarHBondContact OD1-NZ 3.22Å; D1417-K1455 IonicContact OD2-NZ 3.12Å; D1417-K1455 PolarHBondContact OD2-NZ 2.64Å; R1452-K1455 WeakPolarHBondContact O-CB 3.04Å; R1452-K1455 PolarHBondContact O-N 3.07Å; L1453-K1455 PolarHBondContact O-N 3.12Å; K1455-L1457 VanDerWaalsContact C-N 3.28Å; K1455-L1457 PolarHBondContact O-N 3.39Å; K1455-N1458 WeakPolarHBondContact O-CB 3.11Å; K1455-N1458 PolarHBondContact O-N 3.02Å
1456	L	81.8	Confident	78.3	Confident	48 Å²	48	39.6 Å²	39.6	25%	0.251	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-62.3	-33.5	179.5	-66.7	167.6	0	0	0	112.3	F317 F1356 I1359 L1453 V1454 N1458 R1459	F317-L1456 HydrophobicContact CE2-CB 4.12Å; F317-L1456 HydrophobicContact CE2-CD1 3.98Å; F317-L1456 HydrophobicContact CZ-CB 4.27Å; F1356-L1456 HydrophobicContact CD1-CD2 3.99Å; I1359-L1456 HydrophobicContact CG2-CD1 4.16Å; I1359-L1456 HydrophobicContact CG2-CD2 4.29Å; I1359-L1456 HydrophobicContact CG2-CG 3.98Å; L1453-L1456 HydrophobicContact CD2-CD1 3.86Å; L1453-L1456 VanDerWaalsContact O-CB 3.29Å; L1453-L1456 WeakPolarHBondContact O-CB 3.38Å; L1453-L1456 WeakPolarHBondContact O-CG 3.28Å; L1453-L1456 PolarHBondContact O-N 2.67Å; V1454-L1456 PolarHBondContact O-N 3.02Å; L1456-N1458 PolarHBondContact O-N 3.15Å; L1456-N1458 VanDerWaalsContact O-N 3.17Å; L1456-R1459 PolarHBondContact O-N 3.44Å; L1456-R1459 VanDerWaalsContact O-N 3.15Å
1457	L	77.1	Confident	78	Confident	28 Å²	28	39.7 Å²	39.7	15%	0.147	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-60.9	-25	178.2	-66.2	177.2	0	0	0	113.2	F317 V1454 K1455 R1459 I1463 L1467	F317-L1457 HydrophobicContact CD1-CD1 4.35Å; F317-L1457 HydrophobicContact CD1-CD2 3.62Å; F317-L1457 HydrophobicContact CD1-CG 4.09Å; F317-L1457 HydrophobicContact CE1-CD1 3.8Å; F317-L1457 HydrophobicContact CE1-CD2 3.58Å; F317-L1457 HydrophobicContact CE1-CG 3.51Å; F317-L1457 HydrophobicContact CG-CD2 4.3Å; F317-L1457 HydrophobicContact CZ-CD2 4.24Å; F317-L1457 HydrophobicContact CZ-CG 4.05Å; V1454-L1457 HydrophobicContact CG1-CD1 4.33Å; V1454-L1457 WeakPolarHBondContact O-CB 3.3Å; V1454-L1457 PolarHBondContact O-N 3.38Å; K1455-L1457 VanDerWaalsContact C-N 3.28Å; K1455-L1457 PolarHBondContact O-N 3.39Å; L1457-R1459 VanDerWaalsContact C-N 3.32Å; L1457-R1459 PolarHBondContact O-N 3.49Å; L1457-I1463 HydrophobicContact CD2-CG2 3.87Å; L1457-L1467 HydrophobicContact CD1-CD2 4.49Å
1458	N	73.5	Confident	77.9	Confident	44 Å²	44	45.5 Å²	45.5	24%	0.235	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-72.8	-23.4	-179.9	-165.9	16.3	0	0	0	113	W1413 K1455 L1456 R1464	W1413-N1458 HydrophobicContact CD2-CB 4.12Å; W1413-N1458 HydrophobicContact CE3-CB 4.26Å; W1413-N1458 HydrophobicContact CH2-CB 3.99Å; W1413-N1458 HydrophobicContact CZ2-CB 3.83Å; W1413-N1458 HydrophobicContact CZ3-CB 4.19Å; W1413-N1458 PolarHBondContact NE1-OD1 3.19Å; K1455-N1458 WeakPolarHBondContact O-CB 3.11Å; K1455-N1458 PolarHBondContact O-N 3.02Å; L1456-N1458 PolarHBondContact O-N 3.15Å; L1456-N1458 VanDerWaalsContact O-N 3.17Å; N1458-R1464 PolarHBondContact O-NH1 3.35Å; N1458-R1464 WeakPolarHBondContact OD1-CD 3.33Å; N1458-R1464 PolarHBondContact OD1-NH1 3.41Å; N1458-R1464 VanDerWaalsContact OD1-NH1 3.17Å
1459	R	75.4	Confident	77.3	Confident	77 Å²	77	43.8 Å²	43.8	29%	0.291	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-28.8	-176.7	-173.8	58.4	-172.8	83	-1.4	113.4	Y1353 F1356 L1456 L1457 E1461	Y1353-R1459 PolarHBondContact OH-NH2 2.83Å; F1356-R1459 HydrophobicContact CD2-CG 4.49Å; F1356-R1459 HydrophobicContact CE1-CB 4.1Å; F1356-R1459 HydrophobicContact CE2-CB 4.1Å; F1356-R1459 HydrophobicContact CE2-CG 4.05Å; F1356-R1459 HydrophobicContact CZ-CB 3.75Å; F1356-R1459 HydrophobicContact CZ-CG 4.23Å; L1456-R1459 PolarHBondContact O-N 3.44Å; L1456-R1459 VanDerWaalsContact O-N 3.15Å; L1457-R1459 VanDerWaalsContact C-N 3.32Å; L1457-R1459 PolarHBondContact O-N 3.49Å; R1459-E1461 PolarHBondContact O-N 3.26Å
1460	G	71.8	Confident	76.6	Confident	24 Å²	24	43.8 Å²	43.8	25%	0.247	22%	0.221	C	C	.	.			trans	-86.3	95.5	179.3	0	0	0	0	0	111.6	G1462 I1463 R1464	G1460-G1462 VanDerWaalsContact C-N 3.32Å; G1460-G1462 PolarHBondContact O-N 3Å; G1460-I1463 PolarHBondContact O-N 3.39Å; G1460-I1463 VanDerWaalsContact O-N 3.13Å; G1460-R1464 WeakPolarHBondContact O-CB 3.15Å; G1460-R1464 PolarHBondContact O-N 3.45Å
1461	E	72.1	Confident	76.2	Confident	87 Å²	87	47.3 Å²	47.3	41%	0.407	24%	0.243	S	C	.	.	H	α-helix	trans	-58	-40.2	-174.5	-176.3	138.1	-118.8	0	0	113.6	R1459 R1464 T1465	R1459-E1461 PolarHBondContact O-N 3.26Å; E1461-R1464 IonicContact OE1-NH2 3.79Å; E1461-R1464 PolarHBondContact OE1-NH2 3.26Å; E1461-T1465 WeakPolarHBondContact O-CB 3.28Å; E1461-T1465 PolarHBondContact O-N 3.36Å; E1461-T1465 PolarHBondContact O-OG1 3.01Å
1462	G	69.1	Low	75.6	Confident	39 Å²	39	47.5 Å²	47.5	40%	0.402	24%	0.241	S	C	.	.	H	α-helix	trans	-59.7	-52.7	173.1	0	0	0	0	0	112.3	G1460 R1464 T1465 L1466	G1460-G1462 VanDerWaalsContact C-N 3.32Å; G1460-G1462 PolarHBondContact O-N 3Å; G1462-R1464 PolarHBondContact O-N 3.26Å; G1462-T1465 PolarHBondContact O-N 2.73Å; G1462-L1466 WeakPolarHBondContact O-CB 3.43Å; G1462-L1466 PolarHBondContact O-N 2.91Å
1463	I	72.3	Confident	74.9	Confident	22 Å²	22	47.6 Å²	47.6	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-59.9	-45.4	179.7	-55	170.7	0	0	0	110.8	L313 L314 L1457 G1460 L1466 L1467	L313-I1463 HydrophobicContact CD1-CD1 4.44Å; L313-I1463 HydrophobicContact CD2-CD1 3.76Å; L314-I1463 HydrophobicContact CD1-CG2 4.11Å; L1457-I1463 HydrophobicContact CD2-CG2 3.87Å; G1460-I1463 PolarHBondContact O-N 3.39Å; G1460-I1463 VanDerWaalsContact O-N 3.13Å; I1463-L1466 PolarHBondContact O-N 2.73Å; I1463-L1467 VanDerWaalsContact O-CB 3.29Å; I1463-L1467 WeakPolarHBondContact O-CB 3.38Å; I1463-L1467 PolarHBondContact O-N 3.15Å
1464	R	76.8	Confident	74.3	Confident	87 Å²	87	50.4 Å²	50.4	33%	0.328	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-42.5	178	-175.7	-178.2	67.9	-164.1	-1.9	112.3	N1458 G1460 E1461 G1462 W1468	N1458-R1464 PolarHBondContact O-NH1 3.35Å; N1458-R1464 WeakPolarHBondContact OD1-CD 3.33Å; N1458-R1464 PolarHBondContact OD1-NH1 3.41Å; N1458-R1464 VanDerWaalsContact OD1-NH1 3.17Å; G1460-R1464 WeakPolarHBondContact O-CB 3.15Å; G1460-R1464 PolarHBondContact O-N 3.45Å; E1461-R1464 IonicContact OE1-NH2 3.79Å; E1461-R1464 PolarHBondContact OE1-NH2 3.26Å; G1462-R1464 PolarHBondContact O-N 3.26Å; R1464-W1468 VanDerWaalsContact O-CB 3.23Å; R1464-W1468 WeakPolarHBondContact O-CB 3.37Å; R1464-W1468 PolarHBondContact O-N 3.07Å
1465	T	73.9	Confident	73.7	Confident	45 Å²	45	54.5 Å²	54.5	28%	0.276	27%	0.272	S	S	.	.	H	α-helix	trans	-72.4	-38.8	-179.1	-49.3	0	0	0	0	110.9	E1461 G1462 W1468 T1469 Y1786	E1461-T1465 WeakPolarHBondContact O-CB 3.28Å; E1461-T1465 PolarHBondContact O-N 3.36Å; E1461-T1465 PolarHBondContact O-OG1 3.01Å; G1462-T1465 PolarHBondContact O-N 2.73Å; T1465-W1468 PolarHBondContact O-N 3.27Å; T1465-T1469 WeakPolarHBondContact O-CB 3.25Å; T1465-T1469 PolarHBondContact O-N 2.9Å; T1465-T1469 PolarHBondContact O-OG1 3.35Å; T1465-Y1786 HydrophobicContact CG2-CE2 3.85Å; T1465-Y1786 VanDerWaalsContact CG2-OH 3.26Å; T1465-Y1786 WeakPolarHBondContact CG2-OH 3.25Å
1466	L	68.4	Low	72.9	Confident	16 Å²	16	56.6 Å²	56.6	8%	0.084	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-57	170.8	173.7	154.2	0	0	0	110.6	L314 L468 G1462 I1463 W1468 T1469 F1470	L314-L1466 HydrophobicContact CD1-CD2 3.69Å; L468-L1466 HydrophobicContact CD1-CD2 3.57Å; L468-L1466 HydrophobicContact CD1-CG 4.15Å; L468-L1466 HydrophobicContact CD2-CD1 4.17Å; L468-L1466 HydrophobicContact CD2-CD2 4.16Å; L468-L1466 HydrophobicContact CD2-CG 4.37Å; L468-L1466 HydrophobicContact CG-CD2 4.44Å; G1462-L1466 WeakPolarHBondContact O-CB 3.43Å; G1462-L1466 PolarHBondContact O-N 2.91Å; I1463-L1466 PolarHBondContact O-N 2.73Å; L1466-W1468 VanDerWaalsContact C-N 3.3Å; L1466-W1468 PolarHBondContact O-N 3.18Å; L1466-T1469 PolarHBondContact O-N 3.28Å; L1466-F1470 WeakPolarHBondContact O-CD2 3.35Å; L1466-F1470 PolarHBondContact O-N 3.08Å
1467	L	71.3	Confident	72.3	Confident	73 Å²	73	54.9 Å²	54.9	38%	0.382	28%	0.283	S	S	.	.	H	α-helix	trans	-54.9	-44.3	176.6	-174.1	75.4	0	0	0	112	L1457 I1463 T1469 F1470 V1471	L1457-L1467 HydrophobicContact CD1-CD2 4.49Å; I1463-L1467 VanDerWaalsContact O-CB 3.29Å; I1463-L1467 WeakPolarHBondContact O-CB 3.38Å; I1463-L1467 PolarHBondContact O-N 3.15Å; L1467-T1469 VanDerWaalsContact C-N 3.34Å; L1467-T1469 PolarHBondContact O-N 3.33Å; L1467-F1470 PolarHBondContact O-N 2.67Å; L1467-V1471 WeakPolarHBondContact O-CB 3.44Å; L1467-V1471 VanDerWaalsContact O-CG2 3.3Å; L1467-V1471 WeakPolarHBondContact O-CG2 3.39Å; L1467-V1471 PolarHBondContact O-N 2.97Å
1468	W	78.9	Confident	72.3	Confident	155 Å²	155	54 Å²	54	59%	0.587	28%	0.279	S	S	*	.	H	α-helix	trans	-64	-36.9	177	-179.4	90.5	0	0	0	112.8	R1464 T1465 L1466 V1471 K1472	R1464-W1468 VanDerWaalsContact O-CB 3.23Å; R1464-W1468 WeakPolarHBondContact O-CB 3.37Å; R1464-W1468 PolarHBondContact O-N 3.07Å; T1465-W1468 PolarHBondContact O-N 3.27Å; L1466-W1468 VanDerWaalsContact C-N 3.3Å; L1466-W1468 PolarHBondContact O-N 3.18Å; W1468-V1471 PolarHBondContact O-N 3.13Å; W1468-K1472 HydrophobicContact CD2-CG 3.99Å; W1468-K1472 HydrophobicContact CE3-CG 4.04Å; W1468-K1472 HydrophobicContact CH2-CD 4.38Å; W1468-K1472 HydrophobicContact CH2-CG 4.04Å; W1468-K1472 HydrophobicContact CZ2-CD 4.15Å; W1468-K1472 HydrophobicContact CZ2-CG 3.97Å; W1468-K1472 HydrophobicContact CZ3-CG 4.07Å; W1468-K1472 WeakPolarHBondContact O-CB 3.42Å; W1468-K1472 WeakPolarHBondContact O-CG 3.4Å; W1468-K1472 PolarHBondContact O-N 3.28Å
1469	T	71.9	Confident	72.6	Confident	15 Å²	15	52.8 Å²	52.8	9%	0.092	27%	0.271	C	S	.	.	H	α-helix	trans	-68.4	-41.4	177.8	-52.7	0	0	0	0	110.7	T1465 L1466 L1467 K1472 S1473 N1783 Y1786	T1465-T1469 WeakPolarHBondContact O-CB 3.25Å; T1465-T1469 PolarHBondContact O-N 2.9Å; T1465-T1469 PolarHBondContact O-OG1 3.35Å; L1466-T1469 PolarHBondContact O-N 3.28Å; L1467-T1469 VanDerWaalsContact C-N 3.34Å; L1467-T1469 PolarHBondContact O-N 3.33Å; T1469-K1472 CarbonylContact O-C 3.55Å; T1469-K1472 WeakPolarHBondContact O-CA 3.06Å; T1469-K1472 VanDerWaalsContact O-CB 3.28Å; T1469-K1472 WeakPolarHBondContact O-CB 3.33Å; T1469-K1472 PolarHBondContact O-N 2.92Å; T1469-K1472 VanDerWaalsContact O-N 3.08Å; T1469-S1473 PolarHBondContact O-N 2.77Å; T1469-N1783 WeakPolarHBondContact CG2-OD1 3.29Å; T1469-N1783 PolarHBondContact O-OD1 3.25Å; T1469-Y1786 HydrophobicContact CG2-CD1 4.21Å; T1469-Y1786 HydrophobicContact CG2-CD2 3.93Å; T1469-Y1786 HydrophobicContact CG2-CG 3.73Å; T1469-Y1786 WeakPolarHBondContact OG1-CE2 3.11Å
1470	F	69.1	Low	72.7	Confident	17 Å²	17	49.6 Å²	49.6	8%	0.075	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-44.1	173.5	-81.7	-92	0	0	0	112.2	L468 L1466 L1467 K1472 S1473 F1474 V1779 N1783	L468-F1470 HydrophobicContact CB-CD1 4.49Å; L468-F1470 HydrophobicContact CB-CE1 3.93Å; L468-F1470 HydrophobicContact CB-CE2 4.3Å; L468-F1470 HydrophobicContact CB-CZ 3.84Å; L468-F1470 HydrophobicContact CD1-CD1 4.07Å; L468-F1470 HydrophobicContact CD1-CD2 3.36Å; L468-F1470 HydrophobicContact CD1-CE1 4.1Å; L468-F1470 HydrophobicContact CD1-CE2 3.43Å; L468-F1470 VanDerWaalsContact CD1-CE2 3.43Å; L468-F1470 HydrophobicContact CD1-CG 3.72Å; L468-F1470 HydrophobicContact CD1-CZ 3.82Å; L468-F1470 HydrophobicContact CG-CD1 4.45Å; L468-F1470 HydrophobicContact CG-CD2 3.96Å; L468-F1470 HydrophobicContact CG-CE1 3.98Å; L468-F1470 HydrophobicContact CG-CE2 3.45Å; L468-F1470 VanDerWaalsContact CG-CE2 3.45Å; L468-F1470 HydrophobicContact CG-CG 4.45Å; L468-F1470 HydrophobicContact CG-CZ 3.47Å; L468-F1470 VanDerWaalsContact CG-CZ 3.47Å; L1466-F1470 WeakPolarHBondContact O-CD2 3.35Å; L1466-F1470 PolarHBondContact O-N 3.08Å; L1467-F1470 PolarHBondContact O-N 2.67Å; F1470-K1472 PolarHBondContact O-N 3.42Å; F1470-K1472 VanDerWaalsContact O-N 3.16Å; F1470-S1473 PolarHBondContact O-N 2.69Å; F1470-S1473 PolarHBondContact O-OG 2.75Å; F1470-F1474 VanDerWaalsContact O-CD2 3.23Å; F1470-F1474 WeakPolarHBondContact O-CD2 3.28Å; F1470-F1474 PolarHBondContact O-N 2.86Å; F1470-V1779 HydrophobicContact CD1-CG1 4.09Å; F1470-V1779 HydrophobicContact CE1-CG1 3.86Å; F1470-N1783 HydrophobicContact CE1-CB 4.37Å; F1470-N1783 WeakPolarHBondContact CE1-ND2 3.31Å; F1470-N1783 HydrophobicContact CE2-CB 4.43Å; F1470-N1783 HydrophobicContact CZ-CB 4Å
1471	V	75.8	Confident	73.1	Confident	78 Å²	78	50 Å²	50	47%	0.473	26%	0.261	S	S	.	.	H	α-helix	trans	-59.7	-25.3	171.1	171	0	0	0	0	112.1	L1467 W1468 Q1475	L1467-V1471 WeakPolarHBondContact O-CB 3.44Å; L1467-V1471 VanDerWaalsContact O-CG2 3.3Å; L1467-V1471 WeakPolarHBondContact O-CG2 3.39Å; L1467-V1471 PolarHBondContact O-N 2.97Å; W1468-V1471 PolarHBondContact O-N 3.13Å; V1471-Q1475 WeakPolarHBondContact O-CG 3.48Å
1472	K	72.4	Confident	73.4	Confident	84 Å²	84	49.5 Å²	49.5	37%	0.365	26%	0.261	S	S	.	.	H	α-helix	trans	-75.3	-40.2	170.5	-77.3	-77.5	156.2	-167.8	0	113	W1468 T1469 F1470 F1474 Q1475 A1476	W1468-K1472 HydrophobicContact CD2-CG 3.99Å; W1468-K1472 HydrophobicContact CE3-CG 4.04Å; W1468-K1472 HydrophobicContact CH2-CD 4.38Å; W1468-K1472 HydrophobicContact CH2-CG 4.04Å; W1468-K1472 HydrophobicContact CZ2-CD 4.15Å; W1468-K1472 HydrophobicContact CZ2-CG 3.97Å; W1468-K1472 HydrophobicContact CZ3-CG 4.07Å; W1468-K1472 WeakPolarHBondContact O-CB 3.42Å; W1468-K1472 WeakPolarHBondContact O-CG 3.4Å; W1468-K1472 PolarHBondContact O-N 3.28Å; T1469-K1472 CarbonylContact O-C 3.55Å; T1469-K1472 WeakPolarHBondContact O-CA 3.06Å; T1469-K1472 VanDerWaalsContact O-CB 3.28Å; T1469-K1472 WeakPolarHBondContact O-CB 3.33Å; T1469-K1472 PolarHBondContact O-N 2.92Å; T1469-K1472 VanDerWaalsContact O-N 3.08Å; F1470-K1472 PolarHBondContact O-N 3.42Å; F1470-K1472 VanDerWaalsContact O-N 3.16Å; K1472-F1474 VanDerWaalsContact C-N 3.27Å; K1472-F1474 PolarHBondContact O-N 3.42Å; K1472-Q1475 WeakPolarHBondContact O-CA 3.29Å; K1472-Q1475 WeakPolarHBondContact O-CB 3.36Å; K1472-Q1475 PolarHBondContact O-N 3.44Å; K1472-A1476 PolarHBondContact O-N 3.02Å
1473	S	71.5	Confident	74.1	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-35.5	172	66.6	0	0	0	0	112	T1469 F1470 Q1475 A1476 L1477 N1783	T1469-S1473 PolarHBondContact O-N 2.77Å; F1470-S1473 PolarHBondContact O-N 2.69Å; F1470-S1473 PolarHBondContact O-OG 2.75Å; S1473-Q1475 PolarHBondContact O-N 3.01Å; S1473-A1476 PolarHBondContact O-N 2.98Å; S1473-L1477 VanDerWaalsContact O-CB 3.3Å; S1473-L1477 WeakPolarHBondContact O-CB 3.32Å; S1473-L1477 VanDerWaalsContact O-CG 3.31Å; S1473-L1477 WeakPolarHBondContact O-CG 3.28Å; S1473-L1477 PolarHBondContact O-N 3.29Å; S1473-N1783 WeakPolarHBondContact CB-ND2 3.32Å; S1473-N1783 PolarHBondContact OG-ND2 3.41Å
1474	F	71.5	Confident	74.7	Confident	64 Å²	64	48.7 Å²	48.7	28%	0.281	25%	0.248	S	C	.	.	H	α-helix	trans	-63.4	-4	170	-74.3	-69.9	0	0	0	115.7	F464 F1470 K1472 L1477 W2347	F464-F1474 HydrophobicContact CD1-CE1 4.46Å; F464-F1474 HydrophobicContact CD1-CE2 4.16Å; F464-F1474 AromaticContact CD1-CZ 3.54Å; F464-F1474 HydrophobicContact CD1-CZ 3.54Å; F464-F1474 AromaticContact CE1-CE1 3.77Å; F464-F1474 HydrophobicContact CE1-CE1 3.77Å; F464-F1474 HydrophobicContact CE1-CE2 4.09Å; F464-F1474 AromaticContact CE1-CZ 3.24Å; F464-F1474 HydrophobicContact CE1-CZ 3.24Å; F464-F1474 HydrophobicContact CE2-CE2 4.45Å; F464-F1474 HydrophobicContact CE2-CZ 4.31Å; F464-F1474 HydrophobicContact CG-CE2 4.4Å; F464-F1474 HydrophobicContact CG-CZ 4.22Å; F464-F1474 HydrophobicContact CZ-CE1 4.06Å; F464-F1474 HydrophobicContact CZ-CE2 4.23Å; F464-F1474 AromaticContact CZ-CZ 3.67Å; F464-F1474 HydrophobicContact CZ-CZ 3.67Å; F1470-F1474 VanDerWaalsContact O-CD2 3.23Å; F1470-F1474 WeakPolarHBondContact O-CD2 3.28Å; F1470-F1474 PolarHBondContact O-N 2.86Å; K1472-F1474 VanDerWaalsContact C-N 3.27Å; K1472-F1474 PolarHBondContact O-N 3.42Å; F1474-L1477 HydrophobicContact CD1-CD1 3.63Å; F1474-L1477 HydrophobicContact CE1-CD1 3.66Å; F1474-L1477 HydrophobicContact CG-CD1 4.2Å; F1474-L1477 HydrophobicContact CZ-CD1 4.24Å; F1474-W2347 PolarHBondContact O-NE1 3.1Å
1475	Q	70.7	Confident	75.1	Confident	119 Å²	119	50.2 Å²	50.2	56%	0.556	26%	0.261	S	S	*	.	H	α-helix	trans	-100.6	-18.3	169.9	-51	-167.5	-30	0	0	113.6	V1471 K1472 S1473 P1478	V1471-Q1475 WeakPolarHBondContact O-CG 3.48Å; K1472-Q1475 WeakPolarHBondContact O-CA 3.29Å; K1472-Q1475 WeakPolarHBondContact O-CB 3.36Å; K1472-Q1475 PolarHBondContact O-N 3.44Å; S1473-Q1475 PolarHBondContact O-N 3.01Å; Q1475-P1478 WeakPolarHBondContact O-CD 3.21Å; Q1475-P1478 VanDerWaalsContact O-CG 3.29Å; Q1475-P1478 WeakPolarHBondContact O-CG 3.22Å
1476	A	64.9	Low	75.5	Confident	63 Å²	63	49.3 Å²	49.3	52%	0.521	25%	0.254	S	S	.	.	H	α-helix	trans	-102.8	-35.3	-179.1	0	0	0	0	0	112.3	K1472 S1473 P1478 D1782	K1472-A1476 PolarHBondContact O-N 3.02Å; S1473-A1476 PolarHBondContact O-N 2.98Å; A1476-P1478 WeakPolarHBondContact O-CD 3.43Å; A1476-D1782 WeakPolarHBondContact CB-OD2 3.4Å
1477	L	70.3	Confident	76.5	Confident	11 Å²	11	49.6 Å²	49.6	6%	0.058	26%	0.255	C	S	.	.			trans	-35.6	0	157.8	-75.9	168.6	0	0	0	113.6	S1473 F1474 L1775 A1778 V1779 W2347	S1473-L1477 VanDerWaalsContact O-CB 3.3Å; S1473-L1477 WeakPolarHBondContact O-CB 3.32Å; S1473-L1477 VanDerWaalsContact O-CG 3.31Å; S1473-L1477 WeakPolarHBondContact O-CG 3.28Å; S1473-L1477 PolarHBondContact O-N 3.29Å; F1474-L1477 HydrophobicContact CD1-CD1 3.63Å; F1474-L1477 HydrophobicContact CE1-CD1 3.66Å; F1474-L1477 HydrophobicContact CG-CD1 4.2Å; F1474-L1477 HydrophobicContact CZ-CD1 4.24Å; L1477-L1775 HydrophobicContact CD2-CG 4.49Å; L1477-A1778 HydrophobicContact CD2-CB 3.63Å; L1477-V1779 HydrophobicContact CD1-CB 4.47Å; L1477-V1779 HydrophobicContact CD1-CG2 3.59Å; L1477-V1779 HydrophobicContact CD2-CG2 3.99Å; L1477-V1779 HydrophobicContact CG-CG2 4.37Å; L1477-W2347 HydrophobicContact CB-CH2 3.44Å; L1477-W2347 VanDerWaalsContact CB-CH2 3.44Å; L1477-W2347 HydrophobicContact CB-CZ2 3.43Å; L1477-W2347 VanDerWaalsContact CB-CZ2 3.43Å; L1477-W2347 HydrophobicContact CB-CZ3 4.33Å; L1477-W2347 WeakPolarHBondContact O-CH2 3.4Å; L1477-W2347 WeakPolarHBondContact O-CZ3 3.33Å
1478	P	76.9	Confident	77.4	Confident	10 Å²	10	47 Å²	47	7%	0.065	24%	0.241	C	C	.	.	S	Bend		0	-52.7	0	-0.5	-1.9	0	0	0	133	Q1475 A1476 V1480 A1481 L1482 M2346 W2347	Q1475-P1478 WeakPolarHBondContact O-CD 3.21Å; Q1475-P1478 VanDerWaalsContact O-CG 3.29Å; Q1475-P1478 WeakPolarHBondContact O-CG 3.22Å; A1476-P1478 WeakPolarHBondContact O-CD 3.43Å; P1478-V1480 PolarHBondContact O-N 3Å; P1478-A1481 CarbonylContact O-C 3.43Å; P1478-A1481 PolarHBondContact O-N 2.89Å; P1478-A1481 VanDerWaalsContact O-N 3.08Å; P1478-L1482 WeakPolarHBondContact O-CB 3.19Å; P1478-L1482 PolarHBondContact O-N 3.37Å; P1478-M2346 HydrophobicContact CB-CE 4.08Å; P1478-W2347 VanDerWaalsContact CA-CG 3.43Å; P1478-W2347 VanDerWaalsContact CA-NE1 3.33Å; P1478-W2347 HydrophobicContact CB-CB 3.49Å; P1478-W2347 VanDerWaalsContact CB-CB 3.49Å; P1478-W2347 HydrophobicContact CB-CD2 2.17Å; P1478-W2347 HydrophobicContact CB-CE3 3.2Å; P1478-W2347 HydrophobicContact CB-CG 2.33Å; P1478-W2347 HydrophobicContact CB-CH2 3.85Å; P1478-W2347 HydrophobicContact CB-CZ2 3.24Å; P1478-W2347 HydrophobicContact CB-CZ3 3.84Å; P1478-W2347 HydrophobicContact CG-CB 3.65Å; P1478-W2347 HydrophobicContact CG-CD2 2.18Å; P1478-W2347 HydrophobicContact CG-CE3 3.65Å; P1478-W2347 HydrophobicContact CG-CG 2.32Å; P1478-W2347 HydrophobicContact CG-CZ2 3.66Å; P1478-W2347 WeakPolarHBondContact O-CH2 3.29Å; P1478-W2347 WeakPolarHBondContact O-CZ3 3.31Å
1479	Y	79.7	Confident	77.9	Confident	18 Å²	18	41.2 Å²	41.2	7%	0.071	22%	0.22	C	C	.	.	H	α-helix	trans	-18.5	-64	143.4	-55.2	-44.7	0	0	0	118.3	A1142 G1144 L1145 A1481 L1482 L1483 W2347 T2348	A1142-Y1479 HydrophobicContact CB-CD1 4.24Å; A1142-Y1479 HydrophobicContact CB-CE1 3.94Å; G1144-Y1479 VanDerWaalsContact C-CD2 3.44Å; L1145-Y1479 HydrophobicContact CB-CD1 3.52Å; L1145-Y1479 HydrophobicContact CB-CE1 4.42Å; L1145-Y1479 HydrophobicContact CB-CG 3.94Å; L1145-Y1479 HydrophobicContact CD1-CD1 4.35Å; L1145-Y1479 HydrophobicContact CD1-CG 4.41Å; L1145-Y1479 HydrophobicContact CD2-CD1 4.29Å; L1145-Y1479 HydrophobicContact CG-CD1 4.24Å; L1145-Y1479 VanDerWaalsContact N-CG 3.34Å; Y1479-A1481 VanDerWaalsContact C-N 3.31Å; Y1479-A1481 PolarHBondContact O-N 3.14Å; Y1479-L1482 CarbonylContact O-C 3.52Å; Y1479-L1482 WeakPolarHBondContact O-CB 3.27Å; Y1479-L1482 PolarHBondContact O-N 3.46Å; Y1479-L1482 VanDerWaalsContact O-N 3.14Å; Y1479-L1483 VanDerWaalsContact O-CB 3.23Å; Y1479-L1483 WeakPolarHBondContact O-CB 3.31Å; Y1479-L1483 PolarHBondContact O-N 3.15Å; Y1479-W2347 HydrophobicContact CD2-CD2 4.35Å; Y1479-W2347 AromaticContact CD2-CE3 3.43Å; Y1479-W2347 HydrophobicContact CD2-CE3 3.43Å; Y1479-W2347 VanDerWaalsContact CD2-CE3 3.43Å; Y1479-W2347 HydrophobicContact CE2-CB 3.64Å; Y1479-W2347 HydrophobicContact CE2-CD2 4.23Å; Y1479-W2347 AromaticContact CE2-CE3 3.87Å; Y1479-W2347 HydrophobicContact CE2-CE3 3.87Å; Y1479-W2347 HydrophobicContact CE2-CG 4.37Å; Y1479-W2347 AromaticContact CG-CE3 3.82Å; Y1479-W2347 HydrophobicContact CG-CE3 3.82Å; Y1479-W2347 WeakPolarHBondContact OH-CB 3.26Å; Y1479-W2347 PolarHBondContact OH-O 2.86Å; Y1479-T2348 HydrophobicContact CE2-CG2 4.49Å; Y1479-T2348 WeakPolarHBondContact OH-CA 3.33Å; Y1479-T2348 VanDerWaalsContact OH-CB 3.3Å; Y1479-T2348 WeakPolarHBondContact OH-CB 3.41Å; Y1479-T2348 PolarHBondContact OH-N 3.18Å; Y1479-T2348 PolarHBondContact OH-OG1 2.85Å
1480	V	77.4	Confident	78.7	Confident	11 Å²	11	41.7 Å²	41.7	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-54	-47.7	177.7	-170.2	0	0	0	0	111	V1148 P1478 L1483 I1484 L1775 W2347	V1148-V1480 HydrophobicContact CG1-CG2 3.74Å; V1148-V1480 HydrophobicContact CG2-CG2 3.99Å; P1478-V1480 PolarHBondContact O-N 3Å; V1480-L1483 WeakPolarHBondContact O-CB 3.39Å; V1480-L1483 PolarHBondContact O-N 3.13Å; V1480-I1484 HydrophobicContact CG1-CD1 4.45Å; V1480-I1484 WeakPolarHBondContact O-CG1 3.27Å; V1480-I1484 PolarHBondContact O-N 3.33Å; V1480-L1775 HydrophobicContact CG1-CB 3.72Å; V1480-L1775 HydrophobicContact CG1-CD1 4.12Å; V1480-L1775 HydrophobicContact CG1-CG 4.16Å; V1480-W2347 HydrophobicContact CB-CH2 4.23Å; V1480-W2347 HydrophobicContact CB-CZ3 4.05Å; V1480-W2347 HydrophobicContact CG2-CZ3 4.06Å
1481	A	79.9	Confident	79.8	Confident	31 Å²	31	42.5 Å²	42.5	26%	0.256	22%	0.224	S	C	.	.	H	α-helix	trans	-67.9	-35.2	177	0	0	0	0	0	112.7	P1478 Y1479 I1484 I1485 L1775 W2347	P1478-A1481 CarbonylContact O-C 3.43Å; P1478-A1481 PolarHBondContact O-N 2.89Å; P1478-A1481 VanDerWaalsContact O-N 3.08Å; Y1479-A1481 VanDerWaalsContact C-N 3.31Å; Y1479-A1481 PolarHBondContact O-N 3.14Å; A1481-I1484 PolarHBondContact O-N 2.9Å; A1481-I1485 WeakPolarHBondContact O-CB 3.24Å; A1481-I1485 WeakPolarHBondContact O-CD1 3.33Å; A1481-I1485 WeakPolarHBondContact O-CG1 3.49Å; A1481-I1485 PolarHBondContact O-N 3.05Å; A1481-L1775 HydrophobicContact CB-CD1 4.41Å; A1481-W2347 HydrophobicContact CB-CH2 4.06Å; A1481-W2347 HydrophobicContact CB-CZ2 4.34Å
1482	L	79.5	Confident	80.5	Confident	78 Å²	78	38.8 Å²	38.8	41%	0.408	20%	0.202	S	C	.	.	H	α-helix	trans	-69	-35.4	174.6	-173	167.6	0	0	0	111.1	L1145 P1478 Y1479 I1485 M1486	L1145-L1482 HydrophobicContact CD2-CD2 3.8Å; P1478-L1482 WeakPolarHBondContact O-CB 3.19Å; P1478-L1482 PolarHBondContact O-N 3.37Å; Y1479-L1482 CarbonylContact O-C 3.52Å; Y1479-L1482 WeakPolarHBondContact O-CB 3.27Å; Y1479-L1482 PolarHBondContact O-N 3.46Å; Y1479-L1482 VanDerWaalsContact O-N 3.14Å; L1482-I1485 PolarHBondContact O-N 3Å; L1482-M1486 WeakPolarHBondContact O-CB 3.21Å; L1482-M1486 PolarHBondContact O-N 2.97Å
1483	L	82.1	Confident	81.3	Confident	18 Å²	18	34.8 Å²	34.8	9%	0.094	18%	0.184	C	C	.	.	H	α-helix	trans	-66.1	-43.3	174.4	-161.2	173.9	0	0	0	109.4	L1145 V1148 V1149 Y1479 V1480 M1486 L1487 L1771	L1145-L1483 HydrophobicContact CD1-CB 4.04Å; L1145-L1483 HydrophobicContact CD1-CD1 4.06Å; L1145-L1483 HydrophobicContact CD1-CG 4.27Å; V1148-L1483 HydrophobicContact CG1-CD1 4.2Å; V1149-L1483 HydrophobicContact CG2-CD1 3.9Å; Y1479-L1483 VanDerWaalsContact O-CB 3.23Å; Y1479-L1483 WeakPolarHBondContact O-CB 3.31Å; Y1479-L1483 PolarHBondContact O-N 3.15Å; V1480-L1483 WeakPolarHBondContact O-CB 3.39Å; V1480-L1483 PolarHBondContact O-N 3.13Å; L1483-M1486 HydrophobicContact CG-CE 4.46Å; L1483-M1486 PolarHBondContact O-N 3.16Å; L1483-L1487 WeakPolarHBondContact O-CB 3.41Å; L1483-L1487 PolarHBondContact O-N 3.08Å; L1483-L1771 HydrophobicContact CD1-CD2 4.23Å; L1483-L1771 HydrophobicContact CD2-CD1 3.54Å; L1483-L1771 HydrophobicContact CD2-CD2 3.72Å; L1483-L1771 HydrophobicContact CD2-CG 4.28Å
1484	I	86.1	Confident	82	Confident	26 Å²	26	36 Å²	36	13%	0.133	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-52.6	171	-66.6	167	0	0	0	110.6	V1480 A1481 M1486 L1487 F1488 L1771 L1775	V1480-I1484 HydrophobicContact CG1-CD1 4.45Å; V1480-I1484 WeakPolarHBondContact O-CG1 3.27Å; V1480-I1484 PolarHBondContact O-N 3.33Å; A1481-I1484 PolarHBondContact O-N 2.9Å; I1484-M1486 PolarHBondContact O-N 2.92Å; I1484-L1487 WeakPolarHBondContact O-CA 3.48Å; I1484-L1487 WeakPolarHBondContact O-CB 3.45Å; I1484-L1487 PolarHBondContact O-N 3.31Å; I1484-F1488 HydrophobicContact CG2-CD2 3.76Å; I1484-F1488 HydrophobicContact CG2-CE2 3.63Å; I1484-F1488 VanDerWaalsContact O-CD2 3.27Å; I1484-F1488 WeakPolarHBondContact O-CD2 3.26Å; I1484-F1488 PolarHBondContact O-N 3.1Å; I1484-L1771 HydrophobicContact CD1-CB 4.38Å; I1484-L1771 HydrophobicContact CG1-CB 3.92Å; I1484-L1775 HydrophobicContact CD1-CB 4.34Å; I1484-L1775 HydrophobicContact CD1-CD1 3.72Å
1485	I	85.3	Confident	82.9	Confident	118 Å²	118	32.9 Å²	32.9	61%	0.605	18%	0.177	S	C	*	.	H	α-helix	trans	-56.9	-37.3	177.2	-70.5	162	0	0	0	111.6	A1481 L1482 F1489	A1481-I1485 WeakPolarHBondContact O-CB 3.24Å; A1481-I1485 WeakPolarHBondContact O-CD1 3.33Å; A1481-I1485 WeakPolarHBondContact O-CG1 3.49Å; A1481-I1485 PolarHBondContact O-N 3.05Å; L1482-I1485 PolarHBondContact O-N 3Å; I1485-F1489 VanDerWaalsContact O-CB 3.26Å; I1485-F1489 WeakPolarHBondContact O-CB 3.49Å; I1485-F1489 PolarHBondContact O-N 3.43Å
1486	M	82.7	Confident	83.7	Confident	27 Å²	27	27.3 Å²	27.3	13%	0.133	15%	0.151	C	C	.	.	H	α-helix	trans	-71.6	-37.6	176.3	-178.3	-163.4	76.7	0	0	112.1	L1136 I1139 L1482 L1483 I1484 F1489 I1490	L1136-M1486 HydrophobicContact CD2-CE 3.69Å; L1136-M1486 HydrophobicContact CD2-SD 3.72Å; I1139-M1486 HydrophobicContact CD1-CE 3.97Å; I1139-M1486 HydrophobicContact CD1-SD 3.94Å; I1139-M1486 HydrophobicContact CG1-SD 4.15Å; L1482-M1486 WeakPolarHBondContact O-CB 3.21Å; L1482-M1486 PolarHBondContact O-N 2.97Å; L1483-M1486 HydrophobicContact CG-CE 4.46Å; L1483-M1486 PolarHBondContact O-N 3.16Å; I1484-M1486 PolarHBondContact O-N 2.92Å; M1486-F1489 PolarHBondContact O-N 3.47Å; M1486-I1490 HydrophobicContact CE-CD1 4.45Å; M1486-I1490 HydrophobicContact CG-CD1 4.06Å; M1486-I1490 WeakPolarHBondContact O-CB 3.48Å; M1486-I1490 WeakPolarHBondContact O-CD1 3.44Å; M1486-I1490 WeakPolarHBondContact O-CG1 3.44Å; M1486-I1490 PolarHBondContact O-N 3.27Å
1487	L	87.8	Confident	84.5	Confident	21 Å²	21	26.2 Å²	26.2	11%	0.11	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-53.2	171.2	-174.7	86.7	0	0	0	110	L1483 I1484 F1489 I1490 Y1491 F1764 V1767 C1768 L1771	L1483-L1487 WeakPolarHBondContact O-CB 3.41Å; L1483-L1487 PolarHBondContact O-N 3.08Å; I1484-L1487 WeakPolarHBondContact O-CA 3.48Å; I1484-L1487 WeakPolarHBondContact O-CB 3.45Å; I1484-L1487 PolarHBondContact O-N 3.31Å; L1487-F1489 VanDerWaalsContact C-N 3.31Å; L1487-F1489 PolarHBondContact O-N 2.92Å; L1487-I1490 PolarHBondContact O-N 3.23Å; L1487-I1490 VanDerWaalsContact O-N 3.09Å; L1487-Y1491 HydrophobicContact CD1-CD2 4.08Å; L1487-Y1491 HydrophobicContact CD1-CE2 3.71Å; L1487-Y1491 HydrophobicContact CG-CD2 3.99Å; L1487-Y1491 HydrophobicContact CG-CE2 4.07Å; L1487-Y1491 WeakPolarHBondContact O-CD2 3.4Å; L1487-Y1491 PolarHBondContact O-N 2.88Å; L1487-F1764 HydrophobicContact CD2-CE2 4.39Å; L1487-V1767 HydrophobicContact CD1-CG1 3.61Å; L1487-V1767 HydrophobicContact CD2-CG1 4.07Å; L1487-C1768 HydrophobicContact CD2-CB 4.3Å; L1487-L1771 HydrophobicContact CD1-CD1 4.49Å; L1487-L1771 HydrophobicContact CD2-CD1 4.05Å
1488	F	91.2	Very high	85.1	Confident	18 Å²	18	28.3 Å²	28.3	8%	0.079	15%	0.145	C	C	.	.	H	α-helix	trans	-58	-42.3	177.7	-86.4	-113.6	0	0	0	111.6	I1484 A1492 L1524 L1527 F1528 A1531 F1764 C1768	I1484-F1488 HydrophobicContact CG2-CD2 3.76Å; I1484-F1488 HydrophobicContact CG2-CE2 3.63Å; I1484-F1488 VanDerWaalsContact O-CD2 3.27Å; I1484-F1488 WeakPolarHBondContact O-CD2 3.26Å; I1484-F1488 PolarHBondContact O-N 3.1Å; F1488-A1492 WeakPolarHBondContact O-CB 3.42Å; F1488-A1492 PolarHBondContact O-N 3.04Å; F1488-L1524 HydrophobicContact CB-CD1 3.77Å; F1488-L1524 HydrophobicContact CD1-CD1 3.88Å; F1488-L1524 HydrophobicContact CG-CD1 4.33Å; F1488-L1527 HydrophobicContact CD1-CB 4.23Å; F1488-L1527 HydrophobicContact CE1-CB 4.37Å; F1488-F1528 HydrophobicContact CE1-CB 4.29Å; F1488-F1528 HydrophobicContact CE1-CD2 4.44Å; F1488-A1531 HydrophobicContact CE1-CB 4.22Å; F1488-A1531 HydrophobicContact CZ-CB 3.59Å; F1488-F1764 HydrophobicContact CD2-CE2 4.29Å; F1488-F1764 HydrophobicContact CD2-CZ 4.49Å; F1488-F1764 HydrophobicContact CE1-CZ 4.09Å; F1488-F1764 HydrophobicContact CE2-CE2 4.26Å; F1488-F1764 HydrophobicContact CE2-CZ 4.08Å; F1488-F1764 HydrophobicContact CZ-CE2 4.48Å; F1488-F1764 AromaticContact CZ-CZ 3.89Å; F1488-F1764 HydrophobicContact CZ-CZ 3.89Å; F1488-C1768 VanDerWaalsContact CE2-SG 3.58Å
1489	F	89.5	Confident	85.7	Confident	35 Å²	35	28 Å²	28	15%	0.154	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-45.5	173.5	176.6	-87.7	0	0	0	112.2	S1044 A1048 V1132 P1135 I1485 M1486 L1487 V1493 F1520	S1044-F1489 WeakPolarHBondContact O-CZ 3.46Å; A1048-F1489 HydrophobicContact CB-CE2 4Å; V1132-F1489 HydrophobicContact CG1-CD1 4.42Å; V1132-F1489 HydrophobicContact CG1-CE1 4.13Å; P1135-F1489 HydrophobicContact CG-CE1 4.12Å; I1485-F1489 VanDerWaalsContact O-CB 3.26Å; I1485-F1489 WeakPolarHBondContact O-CB 3.49Å; I1485-F1489 PolarHBondContact O-N 3.43Å; M1486-F1489 PolarHBondContact O-N 3.47Å; L1487-F1489 VanDerWaalsContact C-N 3.31Å; L1487-F1489 PolarHBondContact O-N 2.92Å; F1489-V1493 HydrophobicContact CE1-CG2 4.43Å; F1489-V1493 HydrophobicContact CE2-CG2 4.44Å; F1489-V1493 HydrophobicContact CZ-CG2 4.2Å; F1489-V1493 WeakPolarHBondContact O-CG2 3.49Å; F1489-V1493 PolarHBondContact O-N 3.2Å; F1489-F1520 AromaticContact CD2-CE2 3.72Å; F1489-F1520 HydrophobicContact CD2-CE2 3.72Å; F1489-F1520 AromaticContact CD2-CZ 3.7Å; F1489-F1520 HydrophobicContact CD2-CZ 3.7Å; F1489-F1520 HydrophobicContact CE2-CE2 4.11Å; F1489-F1520 HydrophobicContact CE2-CZ 4.28Å; F1489-F1520 HydrophobicContact CG-CE2 4.46Å
1490	I	88.5	Confident	86	Confident	24 Å²	24	27.2 Å²	27.2	12%	0.123	14%	0.14	C	C	.	.	H	α-helix	trans	-62.9	-51	179.4	-70	160.6	0	0	0	110.5	V1132 L1136 M1486 L1487 I1494	V1132-I1490 HydrophobicContact CG1-CB 4.2Å; V1132-I1490 HydrophobicContact CG1-CG1 4.06Å; V1132-I1490 HydrophobicContact CG1-CG2 4.26Å; L1136-I1490 HydrophobicContact CD2-CD1 4.09Å; M1486-I1490 HydrophobicContact CE-CD1 4.45Å; M1486-I1490 HydrophobicContact CG-CD1 4.06Å; M1486-I1490 WeakPolarHBondContact O-CB 3.48Å; M1486-I1490 WeakPolarHBondContact O-CD1 3.44Å; M1486-I1490 WeakPolarHBondContact O-CG1 3.44Å; M1486-I1490 PolarHBondContact O-N 3.27Å; L1487-I1490 PolarHBondContact O-N 3.23Å; L1487-I1490 VanDerWaalsContact O-N 3.09Å; I1490-I1494 HydrophobicContact CG2-CD1 3.8Å; I1490-I1494 WeakPolarHBondContact O-CD1 3.19Å; I1490-I1494 VanDerWaalsContact O-CG1 3.25Å; I1490-I1494 WeakPolarHBondContact O-CG1 3.29Å; I1490-I1494 PolarHBondContact O-N 3.48Å
1491	Y	91.4	Very high	86.4	Confident	34 Å²	34	28.3 Å²	28.3	13%	0.133	14%	0.144	C	C	.	.	H	α-helix	trans	-66.6	-39.3	179.8	-82.2	-98.7	0	0	0	112.1	L1487 V1493 I1494 G1495 Y1760 S1763 F1764	L1487-Y1491 HydrophobicContact CD1-CD2 4.08Å; L1487-Y1491 HydrophobicContact CD1-CE2 3.71Å; L1487-Y1491 HydrophobicContact CG-CD2 3.99Å; L1487-Y1491 HydrophobicContact CG-CE2 4.07Å; L1487-Y1491 WeakPolarHBondContact O-CD2 3.4Å; L1487-Y1491 PolarHBondContact O-N 2.88Å; Y1491-V1493 PolarHBondContact O-N 2.87Å; Y1491-I1494 WeakPolarHBondContact O-CB 3.44Å; Y1491-I1494 PolarHBondContact O-N 3.43Å; Y1491-I1494 VanDerWaalsContact O-N 3.14Å; Y1491-G1495 PolarHBondContact O-N 2.71Å; Y1491-Y1760 AromaticContact CD1-CD2 3.92Å; Y1491-Y1760 HydrophobicContact CD1-CD2 3.92Å; Y1491-Y1760 AromaticContact CD1-CE2 3.61Å; Y1491-Y1760 HydrophobicContact CD1-CE2 3.61Å; Y1491-Y1760 HydrophobicContact CE1-CD2 4.29Å; Y1491-Y1760 HydrophobicContact CE1-CE2 4.42Å; Y1491-Y1760 HydrophobicContact CG-CE2 4.45Å; Y1491-Y1760 PolarHBondContact O-OH 3.35Å; Y1491-S1763 PolarHBondContact OH-OG 3.26Å; Y1491-F1764 HydrophobicContact CD1-CB 3.73Å; Y1491-F1764 AromaticContact CD1-CD2 3.86Å; Y1491-F1764 HydrophobicContact CD1-CD2 3.86Å; Y1491-F1764 HydrophobicContact CD1-CG 4.2Å; Y1491-F1764 HydrophobicContact CD2-CD2 4.03Å; Y1491-F1764 HydrophobicContact CE1-CB 3.61Å; Y1491-F1764 HydrophobicContact CE1-CD2 4.32Å; Y1491-F1764 HydrophobicContact CE1-CG 4.46Å; Y1491-F1764 HydrophobicContact CE2-CD2 4.46Å; Y1491-F1764 HydrophobicContact CG-CB 4.43Å; Y1491-F1764 AromaticContact CG-CD2 3.69Å; Y1491-F1764 HydrophobicContact CG-CD2 3.69Å; Y1491-F1764 HydrophobicContact CG-CG 4.48Å
1492	A	92	Very high	86.7	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-41.4	179.6	0	0	0	0	0	112.6	F1488 M1496 F1520 L1527	F1488-A1492 WeakPolarHBondContact O-CB 3.42Å; F1488-A1492 PolarHBondContact O-N 3.04Å; A1492-M1496 VanDerWaalsContact O-CB 3.29Å; A1492-M1496 WeakPolarHBondContact O-CB 3.28Å; A1492-M1496 PolarHBondContact O-N 2.87Å; A1492-F1520 HydrophobicContact CB-CD2 3.93Å; A1492-F1520 HydrophobicContact CB-CE2 3.69Å; A1492-L1527 HydrophobicContact CB-CD1 3.94Å; A1492-L1527 VanDerWaalsContact N-CD1 3.3Å
1493	V	88	Confident	86.9	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-70.9	-35.2	176.2	-178.1	0	0	0	0	111.4	V1132 F1489 Y1491 Q1497 F1520	V1132-V1493 HydrophobicContact CG1-CB 4.19Å; V1132-V1493 HydrophobicContact CG2-CB 4.03Å; V1132-V1493 HydrophobicContact CG2-CG1 3.55Å; F1489-V1493 HydrophobicContact CE1-CG2 4.43Å; F1489-V1493 HydrophobicContact CE2-CG2 4.44Å; F1489-V1493 HydrophobicContact CZ-CG2 4.2Å; F1489-V1493 WeakPolarHBondContact O-CG2 3.49Å; F1489-V1493 PolarHBondContact O-N 3.2Å; Y1491-V1493 PolarHBondContact O-N 2.87Å; V1493-Q1497 HydrophobicContact CG1-CG 4.46Å; V1493-Q1497 WeakPolarHBondContact O-CB 3.35Å; V1493-Q1497 WeakPolarHBondContact O-CG 3.4Å; V1493-Q1497 PolarHBondContact O-N 2.93Å; V1493-F1520 HydrophobicContact CG2-CD2 4.01Å; V1493-F1520 HydrophobicContact CG2-CE2 4.11Å
1494	I	87.2	Confident	86.9	Confident	29 Å²	29	25 Å²	25	15%	0.149	12%	0.124	C	C	.	.	H	α-helix	trans	-61.8	-50.6	172.2	-66.5	164.4	0	0	0	110.6	V1129 I1490 Y1491 M1496 Q1497 M1498 Y1760	V1129-I1494 HydrophobicContact CG1-CD1 4.27Å; V1129-I1494 HydrophobicContact CG1-CG1 3.57Å; I1490-I1494 HydrophobicContact CG2-CD1 3.8Å; I1490-I1494 WeakPolarHBondContact O-CD1 3.19Å; I1490-I1494 VanDerWaalsContact O-CG1 3.25Å; I1490-I1494 WeakPolarHBondContact O-CG1 3.29Å; I1490-I1494 PolarHBondContact O-N 3.48Å; Y1491-I1494 WeakPolarHBondContact O-CB 3.44Å; Y1491-I1494 PolarHBondContact O-N 3.43Å; Y1491-I1494 VanDerWaalsContact O-N 3.14Å; I1494-M1496 PolarHBondContact O-N 3.38Å; I1494-Q1497 PolarHBondContact O-N 3.18Å; I1494-M1498 HydrophobicContact CG2-CG 4.26Å; I1494-M1498 WeakPolarHBondContact O-CB 3.35Å; I1494-M1498 VanDerWaalsContact O-CG 3.26Å; I1494-M1498 WeakPolarHBondContact O-CG 3.37Å; I1494-M1498 PolarHBondContact O-N 2.64Å; I1494-Y1760 HydrophobicContact CB-CE2 4.04Å; I1494-Y1760 HydrophobicContact CG2-CD2 3.85Å; I1494-Y1760 HydrophobicContact CG2-CE2 3.66Å
1495	G	88.8	Confident	86.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-42.9	178.9	0	0	0	0	0	112.2	Y1491 M1498 F1499 Y1760	Y1491-G1495 PolarHBondContact O-N 2.71Å; G1495-M1498 PolarHBondContact O-N 3.24Å; G1495-F1499 WeakPolarHBondContact O-CA 3.33Å; G1495-F1499 WeakPolarHBondContact O-CB 3.48Å; G1495-F1499 PolarHBondContact O-N 3.21Å; G1495-Y1760 WeakPolarHBondContact CA-OH 3.49Å
1496	M	88.3	Confident	85.4	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-60.7	-45.7	175.4	-169.4	179.2	81.4	0	0	112.1	E1050 P1052 A1492 I1494 M1498 G1500 F1517 F1520	E1050-M1496 HydrophobicContact CB-CE 4.02Å; P1052-M1496 HydrophobicContact CB-CG 4.34Å; P1052-M1496 WeakPolarHBondContact CB-O 3.49Å; P1052-M1496 HydrophobicContact CG-CG 3.93Å; A1492-M1496 VanDerWaalsContact O-CB 3.29Å; A1492-M1496 WeakPolarHBondContact O-CB 3.28Å; A1492-M1496 PolarHBondContact O-N 2.87Å; I1494-M1496 PolarHBondContact O-N 3.38Å; M1496-M1498 PolarHBondContact O-N 3.03Å; M1496-G1500 WeakPolarHBondContact O-CA 3.2Å; M1496-G1500 PolarHBondContact O-N 3.43Å; M1496-G1500 VanDerWaalsContact O-N 3.14Å; M1496-F1517 WeakPolarHBondContact CA-O 3.15Å; M1496-F1517 WeakPolarHBondContact CG-O 3.25Å; M1496-F1520 HydrophobicContact SD-CB 4.14Å
1497	Q	82.6	Confident	84.6	Confident	40 Å²	40	29.4 Å²	29.4	19%	0.187	15%	0.153	C	C	.	.	H	α-helix	trans	-73.4	-22.2	179.8	-72.1	-179.6	-14.3	0	0	114.1	E1050 V1129 V1493 I1494	E1050-Q1497 PolarHBondContact OE2-NE2 3.42Å; V1129-Q1497 VanDerWaalsContact CG2-OE1 3.24Å; V1493-Q1497 HydrophobicContact CG1-CG 4.46Å; V1493-Q1497 WeakPolarHBondContact O-CB 3.35Å; V1493-Q1497 WeakPolarHBondContact O-CG 3.4Å; V1493-Q1497 PolarHBondContact O-N 2.93Å; I1494-Q1497 PolarHBondContact O-N 3.18Å
1498	M	82.6	Confident	83.5	Confident	55 Å²	55	31.4 Å²	31.4	27%	0.271	16%	0.164	S	C	.	.	H	α-helix	trans	-98.8	-39.7	-178.6	-68.3	-65	-64.3	0	0	114	I1126 I1494 G1495 M1496 F1756	I1126-M1498 HydrophobicContact CG1-SD 4.37Å; I1494-M1498 HydrophobicContact CG2-CG 4.26Å; I1494-M1498 WeakPolarHBondContact O-CB 3.35Å; I1494-M1498 VanDerWaalsContact O-CG 3.26Å; I1494-M1498 WeakPolarHBondContact O-CG 3.37Å; I1494-M1498 PolarHBondContact O-N 2.64Å; G1495-M1498 PolarHBondContact O-N 3.24Å; M1496-M1498 PolarHBondContact O-N 3.03Å; M1498-F1756 HydrophobicContact CE-CB 4.34Å; M1498-F1756 HydrophobicContact CE-CD1 4.27Å
1499	F	88.6	Confident	83	Confident	3 Å²	3	30.8 Å²	30.8	1%	0.013	16%	0.161	C	C	.	.	H	α-helix	trans	-114.8	-9.3	-170.9	-52.1	-56.1	0	0	0	113.6	G1495 K1501 I1502 F1517 C1543 A1757 Y1760 F1761	G1495-F1499 WeakPolarHBondContact O-CA 3.33Å; G1495-F1499 WeakPolarHBondContact O-CB 3.48Å; G1495-F1499 PolarHBondContact O-N 3.21Å; F1499-K1501 PolarHBondContact O-N 3.43Å; F1499-I1502 HydrophobicContact CB-CD1 4.04Å; F1499-I1502 HydrophobicContact CD1-CD1 4.46Å; F1499-I1502 WeakPolarHBondContact O-CG1 3.41Å; F1499-I1502 PolarHBondContact O-N 3.07Å; F1499-I1502 VanDerWaalsContact O-N 3.12Å; F1499-F1517 HydrophobicContact CB-CB 3.95Å; F1499-F1517 HydrophobicContact CB-CD2 3.72Å; F1499-F1517 HydrophobicContact CB-CE2 4.47Å; F1499-F1517 HydrophobicContact CB-CG 3.93Å; F1499-F1517 HydrophobicContact CD2-CD2 4.32Å; F1499-F1517 HydrophobicContact CD2-CE2 4.33Å; F1499-F1517 HydrophobicContact CG-CD2 4.41Å; F1499-C1543 HydrophobicContact CD1-CB 3.87Å; F1499-C1543 HydrophobicContact CE1-CB 3.82Å; F1499-C1543 HydrophobicContact CG-CB 4.33Å; F1499-C1543 HydrophobicContact CZ-CB 4.26Å; F1499-A1757 HydrophobicContact CE1-CB 4.25Å; F1499-A1757 HydrophobicContact CZ-CB 4.09Å; F1499-Y1760 AromaticContact CE2-CD1 3.84Å; F1499-Y1760 HydrophobicContact CE2-CD1 3.84Å; F1499-Y1760 HydrophobicContact CE2-CD2 4.5Å; F1499-Y1760 AromaticContact CE2-CE1 3.94Å; F1499-Y1760 HydrophobicContact CE2-CE1 3.94Å; F1499-Y1760 HydrophobicContact CE2-CG 4.13Å; F1499-Y1760 HydrophobicContact CZ-CD1 4.48Å; F1499-F1761 HydrophobicContact CE2-CE2 4.42Å
1500	G	86.3	Confident	82.8	Confident	2 Å²	2	29.6 Å²	29.6	2%	0.021	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	14.6	-179.4	0	0	0	0	0	116.9	M1496 F1517	M1496-G1500 WeakPolarHBondContact O-CA 3.2Å; M1496-G1500 PolarHBondContact O-N 3.43Å; M1496-G1500 VanDerWaalsContact O-N 3.14Å; G1500-F1517 VanDerWaalsContact CA-O 3.28Å; G1500-F1517 WeakPolarHBondContact CA-O 3.34Å
1501	K	85.7	Confident	82.8	Confident	33 Å²	33	28.5 Å²	28.5	14%	0.143	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-2.8	171.6	-68.1	-168.2	179.3	-57.8	0	114.2	P1052 L1053 F1499 C1551 D1552 D1556 C1752	P1052-K1501 WeakPolarHBondContact O-CE 3.29Å; P1052-K1501 WeakPolarHBondContact O-CG 3.48Å; P1052-K1501 PolarHBondContact O-NZ 3.23Å; L1053-K1501 PolarHBondContact O-NZ 3.25Å; F1499-K1501 PolarHBondContact O-N 3.43Å; K1501-C1551 WeakPolarHBondContact O-CA 3.07Å; K1501-D1552 PolarHBondContact O-N 3.36Å; K1501-D1556 WeakPolarHBondContact CE-OD2 3.5Å; K1501-D1556 IonicContact NZ-OD2 2.69Å; K1501-D1556 PolarHBondContact NZ-OD2 2.72Å; K1501-C1752 PolarHBondContact O-SG 3.31Å
1502	I	87.2	Confident	82.4	Confident	5 Å²	5	28.6 Å²	28.6	3%	0.026	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-67	140.1	175.7	-62.3	171	0	0	0	109.5	F1499 I1511 Q1518 V1549 C1752	F1499-I1502 HydrophobicContact CB-CD1 4.04Å; F1499-I1502 HydrophobicContact CD1-CD1 4.46Å; F1499-I1502 WeakPolarHBondContact O-CG1 3.41Å; F1499-I1502 PolarHBondContact O-N 3.07Å; F1499-I1502 VanDerWaalsContact O-N 3.12Å; I1502-I1511 HydrophobicContact CB-CG2 4.38Å; I1502-I1511 HydrophobicContact CG2-CB 4.17Å; I1502-I1511 HydrophobicContact CG2-CG2 3.9Å; I1502-Q1518 PolarHBondContact O-NE2 2.99Å; I1502-V1549 HydrophobicContact CB-CG1 4.47Å; I1502-V1549 HydrophobicContact CD1-CG1 4Å; I1502-V1549 HydrophobicContact CG1-CG1 3.85Å; I1502-V1549 HydrophobicContact CG2-CG1 3.88Å; I1502-C1752 HydrophobicContact CG1-CB 4.14Å
1503	A	83.5	Confident	82	Confident	11 Å²	11	33.5 Å²	33.5	9%	0.091	17%	0.173	C	C	.	.			trans	-66.9	136.9	178.8	0	0	0	0	0	112.6	K1550	A1503-K1550 WeakPolarHBondContact CB-O 3.38Å; A1503-K1550 PolarHBondContact N-O 2.87Å
1504	L	82.7	Confident	81.9	Confident	42 Å²	42	33.7 Å²	33.7	22%	0.22	17%	0.174	C	C	.	.	S	Bend	trans	-83.3	-12.5	174	-50.5	-172.4	0	0	0	113.9	I1511 N1516 Q1518	L1504-I1511 HydrophobicContact CD2-CG2 4.49Å; L1504-N1516 HydrophobicContact CD2-CB 3.46Å; L1504-N1516 VanDerWaalsContact CD2-CB 3.46Å; L1504-Q1518 HydrophobicContact CD2-CG 4.19Å
1505	I	69	Low	82.1	Confident	157 Å²	157	32.3 Å²	32.3	81%	0.805	17%	0.167	S	C	*	.			trans	-114.8	70.7	-176	-48.1	177.9	0	0	0	108.3
1506	N	70.7	Confident	82.1	Confident	15 Å²	15	32.7 Å²	32.7	8%	0.08	17%	0.169	C	C	.	.			trans	-139.4	116.6	170.2	-171.1	50.2	0	0	0	106.8	D1508 T1548 K1550	N1506-D1508 PolarHBondContact O-N 2.87Å; N1506-T1548 PolarHBondContact ND2-O 3.35Å; N1506-T1548 VanDerWaalsContact ND2-O 3.1Å; N1506-K1550 WeakPolarHBondContact OD1-CD 3.37Å; N1506-K1550 PolarHBondContact OD1-NZ 3.5Å
1507	P	65.6	Low	82.2	Confident	91 Å²	91	32.8 Å²	32.8	59%	0.591	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-35.1	177.1	26.2	-32.3	0	0	0	110.7	S1509 Y2459	P1507-S1509 PolarHBondContact O-N 2.89Å; P1507-Y2459 WeakPolarHBondContact O-CE2 3.4Å; P1507-Y2459 PolarHBondContact O-OH 3.27Å
1508	D	65.2	Low	82.5	Confident	64 Å²	64	32.5 Å²	32.5	34%	0.342	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	18.3	-176.9	-41.9	-27.5	0	0	0	115.3	N1506 K1550 Y2442	N1506-D1508 PolarHBondContact O-N 2.87Å; D1508-K1550 IonicContact OD2-NZ 3.73Å; D1508-K1550 PolarHBondContact OD2-NZ 2.84Å; D1508-Y2442 PolarHBondContact OD2-OH 2.91Å
1509	S	79.2	Confident	82.8	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.028	17%	0.173	C	C	.	.			trans	-146.2	137.5	-169.2	177.6	0	0	0	0	113.9	P1507 I1511	P1507-S1509 PolarHBondContact O-N 2.89Å; S1509-I1511 PolarHBondContact O-N 2.91Å; S1509-I1511 PolarHBondContact OG-N 2.85Å; S1509-I1511 VanDerWaalsContact OG-N 3.09Å
1510	S	84.8	Confident	82.8	Confident	10 Å²	10	34.5 Å²	34.5	7%	0.07	18%	0.181	C	C	.	.	S	Bend	trans	-72.4	-7.4	172.6	-51.8	0	0	0	0	113.1	N1515 S1542	S1510-N1515 PolarHBondContact O-ND2 2.78Å; S1510-S1542 PolarHBondContact N-OG 3.15Å
1511	I	88.5	Confident	83	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	21%	0.207	C	C	.	.			trans	-88.4	111.6	170.1	-58.4	-59.6	0	0	0	109.2	I1502 L1504 S1509 N1515 F1517 I1539	I1502-I1511 HydrophobicContact CB-CG2 4.38Å; I1502-I1511 HydrophobicContact CG2-CB 4.17Å; I1502-I1511 HydrophobicContact CG2-CG2 3.9Å; L1504-I1511 HydrophobicContact CD2-CG2 4.49Å; S1509-I1511 PolarHBondContact O-N 2.91Å; S1509-I1511 PolarHBondContact OG-N 2.85Å; S1509-I1511 VanDerWaalsContact OG-N 3.09Å; I1511-N1515 WeakPolarHBondContact CA-O 3.27Å; I1511-F1517 HydrophobicContact CD1-CD2 4.2Å; I1511-F1517 HydrophobicContact CD1-CE2 4.07Å; I1511-I1539 HydrophobicContact CD1-CG2 4.12Å
1512	N	84.3	Confident	83.2	Confident	36 Å²	36	38.4 Å²	38.4	19%	0.193	21%	0.206	C	C	.	.			trans	-142.7	-174.7	-169.9	69.8	43.4	0	0	0	112	N1514 N1515	N1512-N1514 PolarHBondContact O-N 3.08Å; N1512-N1514 VanDerWaalsContact O-N 3.13Å; N1512-N1514 PolarHBondContact OD1-N 3.17Å; N1512-N1515 PolarHBondContact N-O 3.48Å; N1512-N1515 CarbonylContact O-C 3.57Å; N1512-N1515 PolarHBondContact O-N 2.95Å; N1512-N1515 VanDerWaalsContact O-N 3.11Å; N1512-N1515 PolarHBondContact OD1-N 3.39Å
1513	R	83.6	Confident	83.4	Confident	103 Å²	103	38.1 Å²	38.1	39%	0.389	21%	0.205	S	C	.	.	S	Bend	trans	-50.4	-39.7	-179	80.5	-178.8	95.5	-133.1	9.4	113.6	A360 M447 N1516	A360-R1513 PolarHBondContact O-NH1 2.87Å; M447-R1513 WeakPolarHBondContact CE-O 3.33Å; R1513-N1516 PolarHBondContact O-ND2 3.13Å
1514	N	86.3	Confident	83.8	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	22%	0.217	C	C	.	.	S	Bend	trans	-92.7	-18.7	-178.3	-74.8	-58.6	0	0	0	114.1	Y439 N442 D443 M447 N1512	Y439-N1514 HydrophobicContact CD1-CB 3.47Å; Y439-N1514 VanDerWaalsContact CD1-CB 3.47Å; Y439-N1514 HydrophobicContact CD2-CB 4.07Å; Y439-N1514 HydrophobicContact CE1-CB 3.74Å; Y439-N1514 HydrophobicContact CE2-CB 4.3Å; Y439-N1514 HydrophobicContact CG-CB 3.66Å; N442-N1514 WeakPolarHBondContact CB-OD1 3.32Å; N442-N1514 PolarHBondContact ND2-OD1 3.38Å; D443-N1514 PolarHBondContact OD1-ND2 2.91Å; D443-N1514 PolarHBondContact OD2-ND2 3.09Å; M447-N1514 HydrophobicContact CE-CB 4.46Å; M447-N1514 WeakPolarHBondContact CE-OD1 3.47Å; N1512-N1514 PolarHBondContact O-N 3.08Å; N1512-N1514 VanDerWaalsContact O-N 3.13Å; N1512-N1514 PolarHBondContact OD1-N 3.17Å
1515	N	89.8	Confident	84.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	-124.9	84.9	-174.8	-165.2	39.8	0	0	0	110	Y439 S1510 I1511 N1512 V1526	Y439-N1515 HydrophobicContact CE2-CB 4.32Å; Y439-N1515 WeakPolarHBondContact OH-CB 3.49Å; Y439-N1515 PolarHBondContact OH-OD1 2.86Å; S1510-N1515 PolarHBondContact O-ND2 2.78Å; I1511-N1515 WeakPolarHBondContact CA-O 3.27Å; N1512-N1515 PolarHBondContact N-O 3.48Å; N1512-N1515 CarbonylContact O-C 3.57Å; N1512-N1515 PolarHBondContact O-N 2.95Å; N1512-N1515 VanDerWaalsContact O-N 3.11Å; N1512-N1515 PolarHBondContact OD1-N 3.39Å; N1515-V1526 VanDerWaalsContact OD1-CG2 3.29Å; N1515-V1526 WeakPolarHBondContact OD1-CG2 3.44Å
1516	N	89.4	Confident	85.4	Confident	9 Å²	9	31.9 Å²	31.9	5%	0.048	17%	0.172	C	C	.	.			trans	-143.2	155.5	-171.9	71.4	76.8	0	0	0	116.2	L1504 R1513 Q1518 Q1522 S1523	L1504-N1516 HydrophobicContact CD2-CB 3.46Å; L1504-N1516 VanDerWaalsContact CD2-CB 3.46Å; R1513-N1516 PolarHBondContact O-ND2 3.13Å; N1516-Q1518 PolarHBondContact OD1-N 2.99Å; N1516-Q1522 CarbonylContact O-C 3.56Å; N1516-Q1522 VanDerWaalsContact O-C 3.25Å; N1516-Q1522 VanDerWaalsContact O-CB 3.22Å; N1516-Q1522 WeakPolarHBondContact O-CB 3.3Å; N1516-Q1522 WeakPolarHBondContact OD1-CB 3.19Å; N1516-S1523 PolarHBondContact O-N 3.43Å
1517	F	91	Very high	86.5	Confident	3 Å²	3	31.2 Å²	31.2	1%	0.013	17%	0.168	C	C	.	.	S	Bend	trans	-99.1	11.9	175	-69.6	-72.6	0	0	0	113.9	M1496 F1499 G1500 I1511 T1519 S1523 V1526 I1539 F1761	M1496-F1517 WeakPolarHBondContact CA-O 3.15Å; M1496-F1517 WeakPolarHBondContact CG-O 3.25Å; F1499-F1517 HydrophobicContact CB-CB 3.95Å; F1499-F1517 HydrophobicContact CB-CD2 3.72Å; F1499-F1517 HydrophobicContact CB-CE2 4.47Å; F1499-F1517 HydrophobicContact CB-CG 3.93Å; F1499-F1517 HydrophobicContact CD2-CD2 4.32Å; F1499-F1517 HydrophobicContact CD2-CE2 4.33Å; F1499-F1517 HydrophobicContact CG-CD2 4.41Å; G1500-F1517 VanDerWaalsContact CA-O 3.28Å; G1500-F1517 WeakPolarHBondContact CA-O 3.34Å; I1511-F1517 HydrophobicContact CD1-CD2 4.2Å; I1511-F1517 HydrophobicContact CD1-CE2 4.07Å; F1517-T1519 VanDerWaalsContact C-N 3.32Å; F1517-T1519 PolarHBondContact O-N 3.28Å; F1517-S1523 WeakPolarHBondContact CA-OG 3.38Å; F1517-V1526 HydrophobicContact CE1-CB 4.11Å; F1517-V1526 HydrophobicContact CE1-CG1 4.23Å; F1517-V1526 HydrophobicContact CE2-CG1 3.94Å; F1517-V1526 HydrophobicContact CZ-CB 3.93Å; F1517-V1526 HydrophobicContact CZ-CG1 3.54Å; F1517-V1526 HydrophobicContact CZ-CG2 4.45Å; F1517-I1539 HydrophobicContact CE2-CG2 4.33Å; F1517-F1761 HydrophobicContact CE2-CZ 4.17Å; F1517-F1761 HydrophobicContact CZ-CE1 4.4Å; F1517-F1761 AromaticContact CZ-CZ 3.88Å; F1517-F1761 HydrophobicContact CZ-CZ 3.88Å
1518	Q	88	Confident	87.7	Confident	34 Å²	34	28.3 Å²	28.3	16%	0.159	15%	0.146	C	C	.	.	S	Bend	trans	-76	-20.3	-178	-66.4	-167.2	-6.1	0	0	113.1	P1052 I1502 L1504 N1516 D1552	P1052-Q1518 WeakPolarHBondContact CD-O 3.3Å; P1052-Q1518 WeakPolarHBondContact CG-O 3.3Å; I1502-Q1518 PolarHBondContact O-NE2 2.99Å; L1504-Q1518 HydrophobicContact CD2-CG 4.19Å; N1516-Q1518 PolarHBondContact OD1-N 2.99Å; Q1518-D1552 PolarHBondContact NE2-OD2 2.81Å
1519	T	88.8	Confident	89.1	Confident	61 Å²	61	25.8 Å²	25.8	37%	0.374	13%	0.132	S	C	.	.	S	Bend	trans	-134	151.4	178.4	67.6	0	0	0	0	111.5	F1517 Q1522 S1523	F1517-T1519 VanDerWaalsContact C-N 3.32Å; F1517-T1519 PolarHBondContact O-N 3.28Å; T1519-Q1522 PolarHBondContact O-N 2.74Å; T1519-Q1522 WeakPolarHBondContact OG1-CB 3.17Å; T1519-Q1522 WeakPolarHBondContact OG1-CG 3.27Å; T1519-S1523 WeakPolarHBondContact O-CB 3.23Å; T1519-S1523 PolarHBondContact O-N 2.87Å; T1519-S1523 PolarHBondContact O-OG 2.82Å
1520	F	90.1	Very high	89.7	Confident	40 Å²	40	25.7 Å²	25.7	18%	0.175	13%	0.131	C	C	.	.	H	α-helix	trans	-58.9	-44.3	178.8	174.2	-91	0	0	0	114	A1048 F1489 A1492 V1493 M1496 Q1522 S1523 L1524	A1048-F1520 HydrophobicContact CB-CB 4.25Å; A1048-F1520 HydrophobicContact CB-CD1 4.24Å; A1048-F1520 HydrophobicContact CB-CD2 3.74Å; A1048-F1520 HydrophobicContact CB-CE2 4.14Å; A1048-F1520 HydrophobicContact CB-CG 3.8Å; A1048-F1520 VanDerWaalsContact O-CB 3.27Å; A1048-F1520 WeakPolarHBondContact O-CB 3.36Å; F1489-F1520 AromaticContact CD2-CE2 3.72Å; F1489-F1520 HydrophobicContact CD2-CE2 3.72Å; F1489-F1520 AromaticContact CD2-CZ 3.7Å; F1489-F1520 HydrophobicContact CD2-CZ 3.7Å; F1489-F1520 HydrophobicContact CE2-CE2 4.11Å; F1489-F1520 HydrophobicContact CE2-CZ 4.28Å; F1489-F1520 HydrophobicContact CG-CE2 4.46Å; A1492-F1520 HydrophobicContact CB-CD2 3.93Å; A1492-F1520 HydrophobicContact CB-CE2 3.69Å; V1493-F1520 HydrophobicContact CG2-CD2 4.01Å; V1493-F1520 HydrophobicContact CG2-CE2 4.11Å; M1496-F1520 HydrophobicContact SD-CB 4.14Å; F1520-Q1522 PolarHBondContact O-N 2.84Å; F1520-S1523 PolarHBondContact O-N 3.22Å; F1520-L1524 WeakPolarHBondContact O-CB 3.4Å; F1520-L1524 PolarHBondContact O-N 3.5Å
1521	P	89	Confident	89.9	Confident	87 Å²	87	25.6 Å²	25.6	57%	0.565	13%	0.131	S	C	*	.	H	α-helix	trans	-65.3	-36.7	178.9	-22.9	35.5	0	0	0	113.4	L1524 L1525	P1521-L1524 WeakPolarHBondContact O-CB 3.46Å; P1521-L1524 PolarHBondContact O-N 3.11Å; P1521-L1525 PolarHBondContact O-N 2.86Å; P1521-L1525 VanDerWaalsContact O-N 3.08Å
1522	Q	90.3	Very high	89.9	Confident	29 Å²	29	25.6 Å²	25.6	14%	0.136	13%	0.131	C	C	.	.	H	α-helix	trans	-72.7	-41.1	174.9	-61.7	-66.8	21.3	0	0	111.1	M447 N1516 T1519 F1520 L1524 L1525 V1526	M447-Q1522 VanDerWaalsContact CE-NE2 3.26Å; N1516-Q1522 CarbonylContact O-C 3.56Å; N1516-Q1522 VanDerWaalsContact O-C 3.25Å; N1516-Q1522 VanDerWaalsContact O-CB 3.22Å; N1516-Q1522 WeakPolarHBondContact O-CB 3.3Å; N1516-Q1522 WeakPolarHBondContact OD1-CB 3.19Å; T1519-Q1522 PolarHBondContact O-N 2.74Å; T1519-Q1522 WeakPolarHBondContact OG1-CB 3.17Å; T1519-Q1522 WeakPolarHBondContact OG1-CG 3.27Å; F1520-Q1522 PolarHBondContact O-N 2.84Å; Q1522-L1524 PolarHBondContact O-N 3.44Å; Q1522-L1525 CarbonylContact O-C 3.46Å; Q1522-L1525 WeakPolarHBondContact O-CA 3.35Å; Q1522-L1525 WeakPolarHBondContact O-CB 3.12Å; Q1522-L1525 PolarHBondContact O-N 3.43Å; Q1522-V1526 VanDerWaalsContact O-CG2 3.28Å; Q1522-V1526 WeakPolarHBondContact O-CG2 3.5Å; Q1522-V1526 PolarHBondContact O-N 2.57Å
1523	S	92.4	Very high	89.9	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56	-38.3	172.6	-55.8	0	0	0	0	112.2	N1516 F1517 T1519 F1520 L1527	N1516-S1523 PolarHBondContact O-N 3.43Å; F1517-S1523 WeakPolarHBondContact CA-OG 3.38Å; T1519-S1523 WeakPolarHBondContact O-CB 3.23Å; T1519-S1523 PolarHBondContact O-N 2.87Å; T1519-S1523 PolarHBondContact O-OG 2.82Å; F1520-S1523 PolarHBondContact O-N 3.22Å; S1523-L1527 WeakPolarHBondContact O-CG 3.27Å; S1523-L1527 PolarHBondContact O-N 2.66Å; S1523-L1527 VanDerWaalsContact O-N 3.11Å
1524	L	92.1	Very high	90	Very high	64 Å²	64	19 Å²	19	34%	0.335	10%	0.103	S	C	.	.	H	α-helix	trans	-67.2	-36.3	173.8	-174.2	71.5	0	0	0	112.1	F1488 F1520 P1521 Q1522 F1528	F1488-L1524 HydrophobicContact CB-CD1 3.77Å; F1488-L1524 HydrophobicContact CD1-CD1 3.88Å; F1488-L1524 HydrophobicContact CG-CD1 4.33Å; F1520-L1524 WeakPolarHBondContact O-CB 3.4Å; F1520-L1524 PolarHBondContact O-N 3.5Å; P1521-L1524 WeakPolarHBondContact O-CB 3.46Å; P1521-L1524 PolarHBondContact O-N 3.11Å; Q1522-L1524 PolarHBondContact O-N 3.44Å; L1524-F1528 WeakPolarHBondContact O-CB 3.08Å; L1524-F1528 PolarHBondContact O-N 3.01Å
1525	L	91.3	Very high	90	Very high	15 Å²	15	18.8 Å²	18.8	8%	0.079	10%	0.102	C	C	.	.	H	α-helix	trans	-71.2	-41.2	176.3	-166.2	151.6	0	0	0	111.9	L438 Y439 W451 P1521 Q1522 L1527 F1528 R1529	L438-L1525 HydrophobicContact CD2-CD1 4.23Å; Y439-L1525 HydrophobicContact CE1-CD2 4.42Å; W451-L1525 HydrophobicContact CB-CD1 4.39Å; P1521-L1525 PolarHBondContact O-N 2.86Å; P1521-L1525 VanDerWaalsContact O-N 3.08Å; Q1522-L1525 CarbonylContact O-C 3.46Å; Q1522-L1525 WeakPolarHBondContact O-CA 3.35Å; Q1522-L1525 WeakPolarHBondContact O-CB 3.12Å; Q1522-L1525 PolarHBondContact O-N 3.43Å; L1525-L1527 VanDerWaalsContact C-N 3.3Å; L1525-L1527 PolarHBondContact O-N 3.33Å; L1525-F1528 PolarHBondContact O-N 2.7Å; L1525-F1528 VanDerWaalsContact O-N 3.17Å; L1525-R1529 WeakPolarHBondContact O-CB 3.33Å; L1525-R1529 PolarHBondContact O-N 2.51Å
1526	V	92.7	Very high	90.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61	-40.4	172.8	-170.8	0	0	0	0	110.9	N1515 F1517 Q1522 R1529 S1530 I1539	N1515-V1526 VanDerWaalsContact OD1-CG2 3.29Å; N1515-V1526 WeakPolarHBondContact OD1-CG2 3.44Å; F1517-V1526 HydrophobicContact CE1-CB 4.11Å; F1517-V1526 HydrophobicContact CE1-CG1 4.23Å; F1517-V1526 HydrophobicContact CE2-CG1 3.94Å; F1517-V1526 HydrophobicContact CZ-CB 3.93Å; F1517-V1526 HydrophobicContact CZ-CG1 3.54Å; F1517-V1526 HydrophobicContact CZ-CG2 4.45Å; Q1522-V1526 VanDerWaalsContact O-CG2 3.28Å; Q1522-V1526 WeakPolarHBondContact O-CG2 3.5Å; Q1522-V1526 PolarHBondContact O-N 2.57Å; V1526-R1529 WeakPolarHBondContact O-CB 3.34Å; V1526-R1529 PolarHBondContact O-N 3.04Å; V1526-S1530 WeakPolarHBondContact O-CB 3.22Å; V1526-S1530 PolarHBondContact O-N 2.83Å; V1526-S1530 PolarHBondContact O-OG 3.08Å; V1526-I1539 HydrophobicContact CG1-CD1 4.07Å; V1526-I1539 HydrophobicContact CG1-CG2 3.75Å
1527	L	94	Very high	90.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-72.2	-29.7	175	-72.2	173.4	0	0	0	113.3	F1488 A1492 S1523 L1525 A1531 Y1760 F1764	F1488-L1527 HydrophobicContact CD1-CB 4.23Å; F1488-L1527 HydrophobicContact CE1-CB 4.37Å; A1492-L1527 HydrophobicContact CB-CD1 3.94Å; A1492-L1527 VanDerWaalsContact N-CD1 3.3Å; S1523-L1527 WeakPolarHBondContact O-CG 3.27Å; S1523-L1527 PolarHBondContact O-N 2.66Å; S1523-L1527 VanDerWaalsContact O-N 3.11Å; L1525-L1527 VanDerWaalsContact C-N 3.3Å; L1525-L1527 PolarHBondContact O-N 3.33Å; L1527-A1531 VanDerWaalsContact O-CB 3.24Å; L1527-A1531 WeakPolarHBondContact O-CB 2.96Å; L1527-A1531 PolarHBondContact O-N 2.77Å; L1527-Y1760 HydrophobicContact CD2-CE1 4.28Å; L1527-F1764 HydrophobicContact CB-CE1 4.31Å; L1527-F1764 HydrophobicContact CB-CE2 4.3Å; L1527-F1764 HydrophobicContact CB-CZ 3.86Å; L1527-F1764 HydrophobicContact CD2-CD1 3.85Å; L1527-F1764 HydrophobicContact CD2-CD2 3.95Å; L1527-F1764 HydrophobicContact CD2-CE1 3.84Å; L1527-F1764 HydrophobicContact CD2-CE2 3.93Å; L1527-F1764 HydrophobicContact CD2-CG 3.91Å; L1527-F1764 HydrophobicContact CD2-CZ 3.88Å; L1527-F1764 HydrophobicContact CG-CE2 4.5Å; L1527-F1764 HydrophobicContact CG-CZ 4.39Å; L1527-F1764 WeakPolarHBondContact O-CE1 3.27Å; L1527-F1764 WeakPolarHBondContact O-CZ 3.41Å
1528	F	91.8	Very high	90.1	Very high	30 Å²	30	20 Å²	20	13%	0.132	11%	0.107	C	C	.	.	H	α-helix	trans	-70.2	-42.7	171.7	-173.3	-92.9	0	0	0	111.5	W434 I455 I458 I459 F1488 L1524 L1525 A1531 T1532	W434-F1528 AromaticContact CH2-CD1 3.65Å; W434-F1528 HydrophobicContact CH2-CD1 3.65Å; W434-F1528 AromaticContact CH2-CE1 3.88Å; W434-F1528 HydrophobicContact CH2-CE1 3.88Å; W434-F1528 AromaticContact CZ2-CD1 3.72Å; W434-F1528 HydrophobicContact CZ2-CD1 3.72Å; W434-F1528 AromaticContact CZ2-CE1 3.82Å; W434-F1528 HydrophobicContact CZ2-CE1 3.82Å; I455-F1528 HydrophobicContact CD1-CD1 4.33Å; I455-F1528 HydrophobicContact CG1-CD1 4.32Å; I455-F1528 HydrophobicContact CG1-CE1 4.12Å; I455-F1528 HydrophobicContact CG2-CE1 4.46Å; I455-F1528 HydrophobicContact CG2-CE2 4.44Å; I455-F1528 HydrophobicContact CG2-CZ 4.14Å; I458-F1528 HydrophobicContact CB-CZ 4.45Å; I458-F1528 HydrophobicContact CD1-CE1 4.13Å; I458-F1528 HydrophobicContact CG2-CE1 4.19Å; I458-F1528 HydrophobicContact CG2-CZ 3.95Å; I459-F1528 HydrophobicContact CG1-CZ 4.43Å; F1488-F1528 HydrophobicContact CE1-CB 4.29Å; F1488-F1528 HydrophobicContact CE1-CD2 4.44Å; L1524-F1528 WeakPolarHBondContact O-CB 3.08Å; L1524-F1528 PolarHBondContact O-N 3.01Å; L1525-F1528 PolarHBondContact O-N 2.7Å; L1525-F1528 VanDerWaalsContact O-N 3.17Å; F1528-A1531 PolarHBondContact O-N 3.01Å; F1528-A1531 VanDerWaalsContact O-N 3.12Å; F1528-T1532 HydrophobicContact CE1-CG2 4.16Å; F1528-T1532 HydrophobicContact CZ-CG2 4.44Å; F1528-T1532 PolarHBondContact O-N 3.07Å; F1528-T1532 PolarHBondContact O-OG1 3.46Å
1529	R	92.9	Very high	90.3	Very high	12 Å²	12	18.3 Å²	18.3	5%	0.045	10%	0.1	C	C	.	.	H	α-helix	trans	-52.1	-55.2	167.8	172.3	174.3	178.4	146.1	10.7	110.6	T435 Y439 L1525 V1526 A1531 T1532 G1533 E1534 I1539	T435-R1529 HydrophobicContact CG2-CB 4.05Å; T435-R1529 HydrophobicContact CG2-CG 3.87Å; T435-R1529 PolarHBondContact OG1-NH1 3.17Å; Y439-R1529 PolarHBondContact OH-NH1 2.9Å; L1525-R1529 WeakPolarHBondContact O-CB 3.33Å; L1525-R1529 PolarHBondContact O-N 2.51Å; V1526-R1529 WeakPolarHBondContact O-CB 3.34Å; V1526-R1529 PolarHBondContact O-N 3.04Å; R1529-A1531 PolarHBondContact O-N 3.05Å; R1529-A1531 VanDerWaalsContact O-N 3.16Å; R1529-T1532 CarbonylContact O-C 3.25Å; R1529-T1532 PolarHBondContact O-N 3.02Å; R1529-T1532 PolarHBondContact O-OG1 3.33Å; R1529-G1533 CarbonylContact C-O 3.08Å; R1529-G1533 CarbonylContact O-C 3.23Å; R1529-G1533 VanDerWaalsContact O-C 3.25Å; R1529-G1533 PolarHBondContact O-N 2.7Å; R1529-E1534 HydrophobicContact CG-CB 3.93Å; R1529-E1534 HydrophobicContact CG-CG 3.96Å; R1529-E1534 WeakPolarHBondContact CG-O 3.39Å; R1529-E1534 PolarHBondContact NE-O 3.01Å; R1529-E1534 PolarHBondContact NH2-O 3.19Å; R1529-E1534 VanDerWaalsContact NH2-O 3.14Å; R1529-I1539 HydrophobicContact CG-CD1 4.16Å
1530	S	91.7	Very high	90.5	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.007	8%	0.082	C	C	.	.	H	α-helix	trans	-62.4	-23.1	177.8	-51.9	0	0	0	0	114	V1526 G1533 Y1765	V1526-S1530 WeakPolarHBondContact O-CB 3.22Å; V1526-S1530 PolarHBondContact O-N 2.83Å; V1526-S1530 PolarHBondContact O-OG 3.08Å; S1530-G1533 WeakPolarHBondContact CA-O 3.33Å; S1530-G1533 PolarHBondContact O-N 2.9Å; S1530-Y1765 WeakPolarHBondContact O-CD2 3.45Å
1531	A	90.5	Very high	90.5	Very high	9 Å²	9	15.4 Å²	15.4	7%	0.074	8%	0.083	C	C	.	.	H	α-helix	trans	-86.2	-24.9	176.3	0	0	0	0	0	113.3	F1488 L1527 F1528 R1529 G1533 F1764 C1768	F1488-A1531 HydrophobicContact CE1-CB 4.22Å; F1488-A1531 HydrophobicContact CZ-CB 3.59Å; L1527-A1531 VanDerWaalsContact O-CB 3.24Å; L1527-A1531 WeakPolarHBondContact O-CB 2.96Å; L1527-A1531 PolarHBondContact O-N 2.77Å; F1528-A1531 PolarHBondContact O-N 3.01Å; F1528-A1531 VanDerWaalsContact O-N 3.12Å; R1529-A1531 PolarHBondContact O-N 3.05Å; R1529-A1531 VanDerWaalsContact O-N 3.16Å; A1531-G1533 VanDerWaalsContact C-N 3.28Å; A1531-F1764 HydrophobicContact CB-CE1 4.15Å; A1531-F1764 HydrophobicContact CB-CZ 4.17Å; A1531-C1768 VanDerWaalsContact CB-SG 3.58Å
1532	T	87.1	Confident	90.5	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.006	6%	0.061	C	C	.	.	H	α-helix	trans	-81.6	-9	162.3	52.3	0	0	0	0	112.5	M431 W434 I458 F463 F1528 R1529 E2465	M431-T1532 HydrophobicContact SD-CG2 4.02Å; W434-T1532 HydrophobicContact CZ2-CG2 4.31Å; W434-T1532 PolarHBondContact NE1-OG1 3.26Å; W434-T1532 VanDerWaalsContact NE1-OG1 3.13Å; I458-T1532 HydrophobicContact CG2-CG2 4.19Å; F463-T1532 HydrophobicContact CE2-CG2 4.3Å; F1528-T1532 HydrophobicContact CE1-CG2 4.16Å; F1528-T1532 HydrophobicContact CZ-CG2 4.44Å; F1528-T1532 PolarHBondContact O-N 3.07Å; F1528-T1532 PolarHBondContact O-OG1 3.46Å; R1529-T1532 CarbonylContact O-C 3.25Å; R1529-T1532 PolarHBondContact O-N 3.02Å; R1529-T1532 PolarHBondContact O-OG1 3.33Å; T1532-E2465 WeakPolarHBondContact O-CA 3.5Å
1533	G	84.1	Confident	90.5	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.055	C	C	.	.			trans	99.2	-98.3	-170.8	0	0	0	0	0	111.9	R1529 S1530 A1531 A1535 W1536 T2464	R1529-G1533 CarbonylContact C-O 3.08Å; R1529-G1533 CarbonylContact O-C 3.23Å; R1529-G1533 VanDerWaalsContact O-C 3.25Å; R1529-G1533 PolarHBondContact O-N 2.7Å; S1530-G1533 WeakPolarHBondContact CA-O 3.33Å; S1530-G1533 PolarHBondContact O-N 2.9Å; A1531-G1533 VanDerWaalsContact C-N 3.28Å; G1533-A1535 PolarHBondContact O-N 3.21Å; G1533-W1536 PolarHBondContact O-N 3.04Å; G1533-T2464 VanDerWaalsContact C-OG1 3.24Å; G1533-T2464 WeakPolarHBondContact CA-OG1 3.27Å
1534	E	87.2	Confident	90.4	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.059	C	C	.	.	S	Bend	trans	36.1	69.4	174.3	-177.7	144.7	-166.8	0	0	113.5	W434 T435 R1529 F2463 T2464	W434-E1534 PolarHBondContact N-OE2 3.1Å; W434-E1534 PolarHBondContact NE1-OE2 2.83Å; W434-E1534 VanDerWaalsContact NE1-OE2 3.11Å; T435-E1534 WeakPolarHBondContact CA-OE1 3.44Å; T435-E1534 VanDerWaalsContact CB-OE1 3.26Å; T435-E1534 WeakPolarHBondContact CB-OE1 3.47Å; T435-E1534 VanDerWaalsContact CG2-CD 3.43Å; T435-E1534 HydrophobicContact CG2-CG 4.04Å; T435-E1534 VanDerWaalsContact CG2-OE2 3.25Å; T435-E1534 WeakPolarHBondContact CG2-OE2 3.35Å; T435-E1534 VanDerWaalsContact N-CD 3.31Å; T435-E1534 PolarHBondContact N-OE1 3.47Å; T435-E1534 PolarHBondContact N-OE2 3.29Å; T435-E1534 PolarHBondContact OG1-OE1 2.79Å; R1529-E1534 HydrophobicContact CG-CB 3.93Å; R1529-E1534 HydrophobicContact CG-CG 3.96Å; R1529-E1534 WeakPolarHBondContact CG-O 3.39Å; R1529-E1534 PolarHBondContact NE-O 3.01Å; R1529-E1534 PolarHBondContact NH2-O 3.19Å; R1529-E1534 VanDerWaalsContact NH2-O 3.14Å; E1534-F2463 HydrophobicContact CB-CD2 4.47Å; E1534-F2463 HydrophobicContact CB-CE1 3.92Å; E1534-F2463 HydrophobicContact CB-CE2 3.67Å; E1534-F2463 HydrophobicContact CB-CZ 3.3Å; E1534-F2463 HydrophobicContact CG-CD2 4.17Å; E1534-F2463 HydrophobicContact CG-CE1 4.41Å; E1534-F2463 HydrophobicContact CG-CE2 3.24Å; E1534-F2463 HydrophobicContact CG-CZ 3.37Å; E1534-F2463 WeakPolarHBondContact OE1-CE2 3.5Å; E1534-F2463 WeakPolarHBondContact OE2-CZ 3.44Å; E1534-T2464 PolarHBondContact N-OG1 3.5Å
1535	A	86.6	Confident	90.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.064	C	C	.	.	S	Bend	trans	63.9	49.1	174.7	0	0	0	0	0	115.8	E1245 G1533 Q1537 E1538 I1539 S2461 S2462	E1245-A1535 WeakPolarHBondContact OE2-CA 3.33Å; E1245-A1535 PolarHBondContact OE2-N 3.22Å; G1533-A1535 PolarHBondContact O-N 3.21Å; A1535-Q1537 PolarHBondContact O-OE1 3.21Å; A1535-E1538 HydrophobicContact CB-CB 4.36Å; A1535-I1539 WeakPolarHBondContact O-CD1 3.34Å; A1535-I1539 VanDerWaalsContact O-CG1 3.27Å; A1535-I1539 WeakPolarHBondContact O-CG1 3.12Å; A1535-I1539 PolarHBondContact O-N 3.22Å; A1535-S2461 WeakPolarHBondContact CB-O 3.39Å; A1535-S2462 WeakPolarHBondContact CA-O 3.43Å; A1535-S2462 WeakPolarHBondContact CB-O 3.13Å; A1535-S2462 PolarHBondContact N-O 2.74Å
1536	W	92.6	Very high	89.5	Confident	1 Å²	1	12.1 Å²	12.1	0%	0.004	6%	0.064	C	C	.	.	H	α-helix	trans	-74.1	-33.4	179.9	76	-98.4	0	0	0	112.4	F1239 E1245 G1533 E1538 M1540 F1761 I1762	F1239-W1536 AromaticContact CD1-CH2 3.86Å; F1239-W1536 HydrophobicContact CD1-CH2 3.86Å; F1239-W1536 HydrophobicContact CD1-CZ2 4.08Å; F1239-W1536 AromaticContact CE1-CH2 3.63Å; F1239-W1536 HydrophobicContact CE1-CH2 3.63Å; F1239-W1536 AromaticContact CE1-CZ2 3.72Å; F1239-W1536 HydrophobicContact CE1-CZ2 3.72Å; E1245-W1536 PolarHBondContact OE1-NE1 3.12Å; E1245-W1536 PolarHBondContact OE2-N 3.25Å; G1533-W1536 PolarHBondContact O-N 3.04Å; W1536-E1538 VanDerWaalsContact C-N 3.3Å; W1536-E1538 PolarHBondContact O-N 3.17Å; W1536-M1540 HydrophobicContact CZ3-CE 4.25Å; W1536-M1540 HydrophobicContact CZ3-SD 3.78Å; W1536-M1540 VanDerWaalsContact O-CB 3.26Å; W1536-M1540 WeakPolarHBondContact O-CB 3.44Å; W1536-M1540 PolarHBondContact O-N 3.13Å; W1536-F1761 HydrophobicContact CE3-CB 3.93Å; W1536-F1761 HydrophobicContact CZ3-CB 4.15Å; W1536-I1762 HydrophobicContact CH2-CG1 4.21Å; W1536-I1762 HydrophobicContact CZ3-CG1 4.19Å
1537	Q	91.2	Very high	88.6	Confident	4 Å²	4	14.1 Å²	14.1	2%	0.019	7%	0.073	C	C	.	.	H	α-helix	trans	-61.5	-33.3	173.2	74	-43.9	37.7	0	0	113.6	L1226 E1245 A1535 M1540 L1541 S2462	L1226-Q1537 HydrophobicContact CD1-CG 4.31Å; E1245-Q1537 HydrophobicContact CB-CG 4.25Å; E1245-Q1537 WeakPolarHBondContact OE1-CA 3.24Å; E1245-Q1537 WeakPolarHBondContact OE1-CB 3.45Å; E1245-Q1537 WeakPolarHBondContact OE1-CG 3.22Å; E1245-Q1537 PolarHBondContact OE1-N 2.82Å; E1245-Q1537 PolarHBondContact OE1-OE1 2.72Å; E1245-Q1537 PolarHBondContact OE2-OE1 3.12Å; A1535-Q1537 PolarHBondContact O-OE1 3.21Å; Q1537-M1540 HydrophobicContact CB-CE 4.27Å; Q1537-M1540 WeakPolarHBondContact O-CB 3.38Å; Q1537-L1541 WeakPolarHBondContact O-CB 3.23Å; Q1537-L1541 WeakPolarHBondContact O-CG 3.41Å; Q1537-L1541 PolarHBondContact O-N 3.34Å; Q1537-S2462 PolarHBondContact NE2-O 2.82Å; Q1537-S2462 PolarHBondContact NE2-OG 2.81Å
1538	E	88.6	Confident	87.6	Confident	31 Å²	31	14.9 Å²	14.9	15%	0.145	8%	0.078	C	C	.	.	H	α-helix	trans	-84.5	-34.9	-178.6	-71.7	168.5	-175.2	0	0	111.8	A1535 W1536 M1540 L1541 S1542 S2461 S2462	A1535-E1538 HydrophobicContact CB-CB 4.36Å; W1536-E1538 VanDerWaalsContact C-N 3.3Å; W1536-E1538 PolarHBondContact O-N 3.17Å; E1538-M1540 VanDerWaalsContact C-N 3.28Å; E1538-L1541 PolarHBondContact O-N 3.08Å; E1538-S1542 VanDerWaalsContact O-CB 3.26Å; E1538-S1542 WeakPolarHBondContact O-CB 3.44Å; E1538-S1542 PolarHBondContact O-N 3.37Å; E1538-S1542 PolarHBondContact O-OG 3.42Å; E1538-S2461 VanDerWaalsContact CD-CB 3.44Å; E1538-S2461 WeakPolarHBondContact OE1-CB 3.14Å; E1538-S2461 WeakPolarHBondContact OE2-CA 3.44Å; E1538-S2461 WeakPolarHBondContact OE2-CB 3.38Å; E1538-S2461 PolarHBondContact OE2-OG 2.83Å; E1538-S2462 PolarHBondContact OE1-N 3.33Å; E1538-S2462 PolarHBondContact OE1-OG 3.38Å; E1538-S2462 PolarHBondContact OE2-N 3.41Å; E1538-S2462 VanDerWaalsContact OE2-N 3.17Å
1539	I	91.9	Very high	87	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.9	-41.3	165.8	-66	166.5	0	0	0	109.6	I1511 F1517 V1526 R1529 A1535 S1542 C1543 F1761	I1511-I1539 HydrophobicContact CD1-CG2 4.12Å; F1517-I1539 HydrophobicContact CE2-CG2 4.33Å; V1526-I1539 HydrophobicContact CG1-CD1 4.07Å; V1526-I1539 HydrophobicContact CG1-CG2 3.75Å; R1529-I1539 HydrophobicContact CG-CD1 4.16Å; A1535-I1539 WeakPolarHBondContact O-CD1 3.34Å; A1535-I1539 VanDerWaalsContact O-CG1 3.27Å; A1535-I1539 WeakPolarHBondContact O-CG1 3.12Å; A1535-I1539 PolarHBondContact O-N 3.22Å; I1539-S1542 PolarHBondContact O-N 3.28Å; I1539-C1543 PolarHBondContact O-N 3.4Å; I1539-C1543 PolarHBondContact O-SG 3.2Å; I1539-F1761 HydrophobicContact CG2-CE1 3.77Å; I1539-F1761 HydrophobicContact CG2-CE2 4.44Å; I1539-F1761 HydrophobicContact CG2-CZ 3.55Å
1540	M	93.1	Very high	86.4	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-60.5	-50.1	173.4	174.1	-170.3	71	0	0	111.5	L1236 W1536 Q1537 E1538 C1543 V1544 A1757 Y1758 F1761	L1236-M1540 HydrophobicContact CD1-CE 4.3Å; W1536-M1540 HydrophobicContact CZ3-CE 4.25Å; W1536-M1540 HydrophobicContact CZ3-SD 3.78Å; W1536-M1540 VanDerWaalsContact O-CB 3.26Å; W1536-M1540 WeakPolarHBondContact O-CB 3.44Å; W1536-M1540 PolarHBondContact O-N 3.13Å; Q1537-M1540 HydrophobicContact CB-CE 4.27Å; Q1537-M1540 WeakPolarHBondContact O-CB 3.38Å; E1538-M1540 VanDerWaalsContact C-N 3.28Å; M1540-C1543 WeakPolarHBondContact O-CB 3.36Å; M1540-C1543 PolarHBondContact O-N 2.96Å; M1540-V1544 PolarHBondContact O-N 3.12Å; M1540-A1757 HydrophobicContact CG-CB 4.36Å; M1540-Y1758 HydrophobicContact CE-CD1 3.82Å; M1540-Y1758 HydrophobicContact CE-CE1 3.98Å; M1540-Y1758 HydrophobicContact CG-CD1 4.15Å; M1540-Y1758 HydrophobicContact SD-CD1 3.58Å; M1540-Y1758 VanDerWaalsContact SD-CD1 3.58Å; M1540-Y1758 HydrophobicContact SD-CE1 4.28Å; M1540-Y1758 HydrophobicContact SD-CG 4.4Å; M1540-F1761 HydrophobicContact CB-CB 4.04Å; M1540-F1761 HydrophobicContact CB-CD2 3.56Å; M1540-F1761 HydrophobicContact CB-CE2 4.23Å; M1540-F1761 HydrophobicContact CB-CG 3.86Å; M1540-F1761 HydrophobicContact CG-CB 4.18Å; M1540-F1761 HydrophobicContact CG-CD2 3.88Å; M1540-F1761 HydrophobicContact CG-CG 4.33Å; M1540-F1761 HydrophobicContact SD-CB 4.38Å
1541	L	88.9	Confident	86	Confident	38 Å²	38	15 Å²	15	20%	0.199	8%	0.079	C	C	.	.	H	α-helix	trans	-61.6	-43	178	-74.2	168.3	0	0	0	111.8	P1225 Q1537 E1538 C1543 V1544 Y1758	P1225-L1541 HydrophobicContact CB-CD1 3.85Å; P1225-L1541 HydrophobicContact CB-CD2 3.77Å; P1225-L1541 HydrophobicContact CB-CG 4.46Å; P1225-L1541 HydrophobicContact CG-CD1 3.87Å; Q1537-L1541 WeakPolarHBondContact O-CB 3.23Å; Q1537-L1541 WeakPolarHBondContact O-CG 3.41Å; Q1537-L1541 PolarHBondContact O-N 3.34Å; E1538-L1541 PolarHBondContact O-N 3.08Å; L1541-C1543 PolarHBondContact O-N 3.19Å; L1541-V1544 WeakPolarHBondContact O-CB 3.26Å; L1541-V1544 PolarHBondContact O-N 3.13Å; L1541-Y1758 HydrophobicContact CD2-CE1 4.38Å
1542	S	88.8	Confident	85.6	Confident	14 Å²	14	15.6 Å²	15.6	10%	0.098	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-8.2	174.5	-56.1	0	0	0	0	114	S1510 E1538 I1539 V1549	S1510-S1542 PolarHBondContact N-OG 3.15Å; E1538-S1542 VanDerWaalsContact O-CB 3.26Å; E1538-S1542 WeakPolarHBondContact O-CB 3.44Å; E1538-S1542 PolarHBondContact O-N 3.37Å; E1538-S1542 PolarHBondContact O-OG 3.42Å; I1539-S1542 PolarHBondContact O-N 3.28Å; S1542-V1549 WeakPolarHBondContact O-CG2 3.34Å
1543	C	91.2	Very high	84.9	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-1	176.1	-68.2	0	0	0	0	113.6	F1499 I1539 M1540 L1541 G1753 S1754 A1757 F1761	F1499-C1543 HydrophobicContact CD1-CB 3.87Å; F1499-C1543 HydrophobicContact CE1-CB 3.82Å; F1499-C1543 HydrophobicContact CG-CB 4.33Å; F1499-C1543 HydrophobicContact CZ-CB 4.26Å; I1539-C1543 PolarHBondContact O-N 3.4Å; I1539-C1543 PolarHBondContact O-SG 3.2Å; M1540-C1543 WeakPolarHBondContact O-CB 3.36Å; M1540-C1543 PolarHBondContact O-N 2.96Å; L1541-C1543 PolarHBondContact O-N 3.19Å; C1543-G1753 CarbonylContact O-C 3.41Å; C1543-G1753 WeakPolarHBondContact O-CA 3.44Å; C1543-S1754 PolarHBondContact O-N 3.49Å; C1543-S1754 VanDerWaalsContact O-O 3.13Å; C1543-A1757 HydrophobicContact CB-CB 3.76Å; C1543-F1761 HydrophobicContact CB-CE2 4.21Å
1544	V	89.3	Confident	84.5	Confident	15 Å²	15	28 Å²	28	9%	0.091	13%	0.133	C	C	.	.	S	Bend	trans	-69.5	157.7	175.1	176.8	0	0	0	0	110.2	M1540 L1541 D1546 A1757 Y1758	M1540-V1544 PolarHBondContact O-N 3.12Å; L1541-V1544 WeakPolarHBondContact O-CB 3.26Å; L1541-V1544 PolarHBondContact O-N 3.13Å; V1544-D1546 PolarHBondContact O-N 2.99Å; V1544-A1757 HydrophobicContact CG2-CB 4.43Å; V1544-Y1758 HydrophobicContact CG1-CE2 4.24Å; V1544-Y1758 HydrophobicContact CG2-CD2 4.43Å; V1544-Y1758 HydrophobicContact CG2-CE1 4.22Å; V1544-Y1758 HydrophobicContact CG2-CE2 3.72Å
1545	N	85.6	Confident	84	Confident	84 Å²	84	28 Å²	28	45%	0.449	13%	0.133	S	C	.	.	S	Bend	trans	-77.2	91.3	173.1	176.8	85.3	0	0	0	110.1	N1755	N1545-N1755 WeakPolarHBondContact CB-OD1 3.4Å; N1545-N1755 PolarHBondContact N-OD1 3.14Å
1546	D	79.8	Confident	83.4	Confident	14 Å²	14	29.5 Å²	29.5	8%	0.075	14%	0.141	C	C	.	.			trans	-134.6	151.7	-178	170	37.1	0	0	0	110.5	V1544 T1548 V1549 P2441	V1544-D1546 PolarHBondContact O-N 2.99Å; D1546-T1548 VanDerWaalsContact C-N 3.33Å; D1546-T1548 PolarHBondContact O-N 3.43Å; D1546-T1548 PolarHBondContact OD1-N 2.9Å; D1546-T1548 WeakPolarHBondContact OD2-CB 3.25Å; D1546-T1548 WeakPolarHBondContact OD2-CG2 3.38Å; D1546-T1548 PolarHBondContact OD2-N 2.88Å; D1546-T1548 PolarHBondContact OD2-OG1 2.68Å; D1546-V1549 HydrophobicContact CB-CG2 4.24Å; D1546-V1549 WeakPolarHBondContact O-CB 3.43Å; D1546-V1549 PolarHBondContact O-N 2.81Å; D1546-P2441 HydrophobicContact CB-CB 4.07Å; D1546-P2441 HydrophobicContact CB-CG 3.95Å; D1546-P2441 VanDerWaalsContact OD1-CB 3.25Å; D1546-P2441 WeakPolarHBondContact OD1-CB 3.49Å; D1546-P2441 WeakPolarHBondContact OD1-CD 3.43Å; D1546-P2441 WeakPolarHBondContact OD1-CG 3.38Å
1547	H	73.9	Confident	82.5	Confident	41 Å²	41	32.3 Å²	32.3	19%	0.19	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-11.3	176.2	61.7	-23.2	0	0	0	115.9	D1684 T1751 V2440 Y2442	H1547-D1684 IonicContact CD2-OD1 3.43Å; H1547-D1684 PolarHBondContact CD2-OD1 3.07Å; H1547-T1751 HydrophobicContact CB-CG2 4.14Å; H1547-V2440 VanDerWaalsContact CE1-CA 3.5Å; H1547-V2440 WeakPolarHBondContact CE1-CA 3.25Å; H1547-Y2442 AromaticContact CD2-CD2 3.89Å; H1547-Y2442 VanDerWaalsContact CE1-CB 3.49Å; H1547-Y2442 WeakPolarHBondContact CE1-CB 3.41Å; H1547-Y2442 AromaticContact CE1-CD2 3.66Å; H1547-Y2442 PolarHBondContact CE1-N 2.94Å; H1547-Y2442 VanDerWaalsContact CE1-N 3.26Å; H1547-Y2442 AromaticContact CG-CD2 3.8Å; H1547-Y2442 AromaticContact ND1-CD2 3.64Å; H1547-Y2442 AromaticContact NE2-CD2 3.83Å
1548	T	72	Confident	81.6	Confident	17 Å²	17	32.6 Å²	32.6	10%	0.104	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-35	161.1	69.7	0	0	0	0	110.7	N1506 D1546 K1550 Y2442	N1506-T1548 PolarHBondContact ND2-O 3.35Å; N1506-T1548 VanDerWaalsContact ND2-O 3.1Å; D1546-T1548 VanDerWaalsContact C-N 3.33Å; D1546-T1548 PolarHBondContact O-N 3.43Å; D1546-T1548 PolarHBondContact OD1-N 2.9Å; D1546-T1548 WeakPolarHBondContact OD2-CB 3.25Å; D1546-T1548 WeakPolarHBondContact OD2-CG2 3.38Å; D1546-T1548 PolarHBondContact OD2-N 2.88Å; D1546-T1548 PolarHBondContact OD2-OG1 2.68Å; T1548-K1550 WeakPolarHBondContact O-CD 3.21Å; T1548-K1550 WeakPolarHBondContact O-CE 3.11Å; T1548-K1550 PolarHBondContact O-N 3.2Å; T1548-Y2442 HydrophobicContact CG2-CD1 3.66Å; T1548-Y2442 HydrophobicContact CG2-CD2 3.68Å; T1548-Y2442 HydrophobicContact CG2-CE1 3.81Å; T1548-Y2442 HydrophobicContact CG2-CE2 3.84Å; T1548-Y2442 HydrophobicContact CG2-CG 3.57Å
1549	V	80.2	Confident	80.6	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.012	17%	0.168	C	C	.	.	S	Bend	trans	-82.1	79.7	-173.5	-171	0	0	0	0	110.4	I1502 S1542 D1546 C1752	I1502-V1549 HydrophobicContact CB-CG1 4.47Å; I1502-V1549 HydrophobicContact CD1-CG1 4Å; I1502-V1549 HydrophobicContact CG1-CG1 3.85Å; I1502-V1549 HydrophobicContact CG2-CG1 3.88Å; S1542-V1549 WeakPolarHBondContact O-CG2 3.34Å; D1546-V1549 HydrophobicContact CB-CG2 4.24Å; D1546-V1549 WeakPolarHBondContact O-CB 3.43Å; D1546-V1549 PolarHBondContact O-N 2.81Å; V1549-C1752 HydrophobicContact CG1-CB 4.4Å; V1549-C1752 WeakPolarHBondContact CG1-O 3.33Å; V1549-C1752 PolarHBondContact O-N 3.44Å
1550	K	80.8	Confident	79.5	Confident	39 Å²	39	38.7 Å²	38.7	17%	0.17	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-71.7	144.2	176.3	-60.1	127.3	-163.3	171.4	0	111.2	A1503 N1506 D1508 T1548 Y2442	A1503-K1550 WeakPolarHBondContact CB-O 3.38Å; A1503-K1550 PolarHBondContact N-O 2.87Å; N1506-K1550 WeakPolarHBondContact OD1-CD 3.37Å; N1506-K1550 PolarHBondContact OD1-NZ 3.5Å; D1508-K1550 IonicContact OD2-NZ 3.73Å; D1508-K1550 PolarHBondContact OD2-NZ 2.84Å; T1548-K1550 WeakPolarHBondContact O-CD 3.21Å; T1548-K1550 WeakPolarHBondContact O-CE 3.11Å; T1548-K1550 PolarHBondContact O-N 3.2Å; K1550-Y2442 PolarHBondContact NZ-OH 3.11Å
1551	C	83.5	Confident	78.3	Confident	4 Å²	4	40 Å²	40	3%	0.027	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-69.6	159	168.2	-65.9	0	0	0	0	112.1	K1501 A1750 T1751 C1752	K1501-C1551 WeakPolarHBondContact O-CA 3.07Å; C1551-A1750 HydrophobicContact CB-CB 4.13Å; C1551-A1750 WeakPolarHBondContact CB-O 3.34Å; C1551-A1750 PolarHBondContact N-O 3.35Å; C1551-A1750 PolarHBondContact SG-O 2.03Å; C1551-T1751 VanDerWaalsContact SG-C 3.58Å; C1551-C1752 WeakPolarHBondContact CA-SG 3.1Å; C1551-C1752 HydrophobicContact CB-CB 4.01Å; C1551-C1752 WeakPolarHBondContact CB-SG 3.21Å; C1551-C1752 WeakPolarHBondContact SG-CB 3.24Å; C1551-C1752 CovalentContact SG-SG 2.04Å; C1551-C1752 PolarHBondContact SG-SG 3.19Å
1552	D	81.5	Confident	77.2	Confident	21 Å²	21	39.1 Å²	39.1	11%	0.112	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-74.1	140.2	170.7	-166.1	-51.6	0	0	0	111.2	L1053 K1501 Q1518 F1554 S1555	L1053-D1552 HydrophobicContact CD1-CB 3.84Å; K1501-D1552 PolarHBondContact O-N 3.36Å; Q1518-D1552 PolarHBondContact NE2-OD2 2.81Å; D1552-F1554 PolarHBondContact O-N 3.47Å; D1552-F1554 WeakPolarHBondContact OD1-CD2 3.08Å; D1552-F1554 PolarHBondContact OD1-N 3.41Å; D1552-S1555 WeakPolarHBondContact O-CB 3.3Å; D1552-S1555 PolarHBondContact O-N 3.49Å; D1552-S1555 PolarHBondContact O-OG 3.02Å
1553	R	72.4	Confident	76.2	Confident	111 Å²	111	45.7 Å²	45.7	42%	0.419	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.8	-178.3	-65	177.7	178.4	170.1	-2.5	113.5	S1555	R1553-S1555 VanDerWaalsContact C-N 3.29Å
1554	F	74.7	Confident	75.1	Confident	152 Å²	152	49.1 Å²	49.1	67%	0.667	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	0.8	179.1	-59.5	-73.1	0	0	0	113.3	L1053 D1552	L1053-F1554 HydrophobicContact CD1-CB 4.39Å; L1053-F1554 HydrophobicContact CD2-CB 3.89Å; L1053-F1554 HydrophobicContact CG-CB 4.05Å; D1552-F1554 PolarHBondContact O-N 3.47Å; D1552-F1554 WeakPolarHBondContact OD1-CD2 3.08Å; D1552-F1554 PolarHBondContact OD1-N 3.41Å
1555	S	78.3	Confident	74	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-72	144.4	-179.5	70.7	0	0	0	0	112.9	L1053 D1552 R1553 T1557 E1558 M1559	L1053-S1555 WeakPolarHBondContact O-CA 3.25Å; D1552-S1555 WeakPolarHBondContact O-CB 3.3Å; D1552-S1555 PolarHBondContact O-N 3.49Å; D1552-S1555 PolarHBondContact O-OG 3.02Å; R1553-S1555 VanDerWaalsContact C-N 3.29Å; S1555-T1557 WeakPolarHBondContact CB-OG1 3.32Å; S1555-T1557 PolarHBondContact O-N 3.23Å; S1555-T1557 PolarHBondContact OG-OG1 3.24Å; S1555-E1558 PolarHBondContact O-N 3Å; S1555-E1558 PolarHBondContact OG-N 3.39Å; S1555-E1558 VanDerWaalsContact OG-N 3.16Å; S1555-M1559 PolarHBondContact O-N 2.94Å
1556	D	73.2	Confident	72.9	Confident	31 Å²	31	48.2 Å²	48.2	17%	0.166	23%	0.233	C	C	.	.	H	α-helix	trans	-47.6	-33.9	170.5	-44.6	-63.5	0	0	0	112.7	L1053 A1055 K1501 K1560	L1053-D1556 PolarHBondContact O-N 3.04Å; A1055-D1556 WeakPolarHBondContact CB-OD1 3.24Å; A1055-D1556 PolarHBondContact N-OD1 2.79Å; K1501-D1556 WeakPolarHBondContact CE-OD2 3.5Å; K1501-D1556 IonicContact NZ-OD2 2.69Å; K1501-D1556 PolarHBondContact NZ-OD2 2.72Å; D1556-K1560 WeakPolarHBondContact O-CB 3.26Å; D1556-K1560 WeakPolarHBondContact O-CD 3.37Å; D1556-K1560 WeakPolarHBondContact O-CG 3.49Å; D1556-K1560 PolarHBondContact O-N 3.04Å
1557	T	73.9	Confident	72.2	Confident	60 Å²	60	52.8 Å²	52.8	37%	0.368	26%	0.257	S	S	.	.	H	α-helix	trans	-70.4	-49	-177.2	24.8	0	0	0	0	112.6	S1555 K1560 A1561	S1555-T1557 WeakPolarHBondContact CB-OG1 3.32Å; S1555-T1557 PolarHBondContact O-N 3.23Å; S1555-T1557 PolarHBondContact OG-OG1 3.24Å; T1557-K1560 PolarHBondContact O-N 2.96Å; T1557-A1561 PolarHBondContact O-N 3.07Å; T1557-A1561 VanDerWaalsContact O-N 3.13Å
1558	E	72.2	Confident	71.6	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.047	28%	0.28	C	S	.	.	H	α-helix	trans	-74.3	-39.1	177.2	-167.6	168.2	154	0	0	111	S1555 K1560 A1561 I1562	S1555-E1558 PolarHBondContact O-N 3Å; S1555-E1558 PolarHBondContact OG-N 3.39Å; S1555-E1558 VanDerWaalsContact OG-N 3.16Å; E1558-K1560 VanDerWaalsContact C-N 3.27Å; E1558-K1560 PolarHBondContact O-N 3.49Å; E1558-A1561 WeakPolarHBondContact O-CB 3.12Å; E1558-A1561 PolarHBondContact O-N 3.18Å; E1558-A1561 VanDerWaalsContact O-N 3.09Å; E1558-I1562 HydrophobicContact CG-CD1 4.09Å; E1558-I1562 WeakPolarHBondContact O-CG1 3.28Å; E1558-I1562 PolarHBondContact O-N 3.34Å
1559	M	66.5	Low	70.8	Confident	65 Å²	65	61.3 Å²	61.3	32%	0.32	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-29.6	174.7	-170.5	174.2	-82.7	0	0	112.4	S1555 R1563	S1555-M1559 PolarHBondContact O-N 2.94Å; M1559-R1563 WeakPolarHBondContact O-CB 3.35Å; M1559-R1563 WeakPolarHBondContact O-CG 3.48Å; M1559-R1563 PolarHBondContact O-N 3.3Å; M1559-R1563 PolarHBondContact SD-NH2 2.85Å
1560	K	69.2	Low	69.3	Low	93 Å²	93	66.9 Å²	66.9	40%	0.404	32%	0.322	S	S	.	.	H	α-helix	trans	-68.5	-41.7	168.8	-83.7	170.7	176.1	176.7	0	112.5	D1119 D1556 T1557 E1558 R1563 S1564	D1119-K1560 IonicContact OD1-NZ 3.31Å; D1119-K1560 PolarHBondContact OD1-NZ 3.39Å; D1119-K1560 IonicContact OD2-NZ 3.35Å; D1119-K1560 PolarHBondContact OD2-NZ 3.38Å; D1556-K1560 WeakPolarHBondContact O-CB 3.26Å; D1556-K1560 WeakPolarHBondContact O-CD 3.37Å; D1556-K1560 WeakPolarHBondContact O-CG 3.49Å; D1556-K1560 PolarHBondContact O-N 3.04Å; T1557-K1560 PolarHBondContact O-N 2.96Å; E1558-K1560 VanDerWaalsContact C-N 3.27Å; E1558-K1560 PolarHBondContact O-N 3.49Å; K1560-R1563 PolarHBondContact O-N 2.92Å; K1560-S1564 PolarHBondContact O-N 3.06Å; K1560-S1564 PolarHBondContact O-OG 3.38Å; K1560-S1564 VanDerWaalsContact O-OG 3.1Å
1561	A	68.6	Low	67.6	Low	29 Å²	29	72.4 Å²	72.4	24%	0.24	35%	0.348	C	S	.	.	H	α-helix	trans	-61.3	-46.6	175.4	0	0	0	0	0	111.8	T1557 E1558 R1563 S1564 F1565	T1557-A1561 PolarHBondContact O-N 3.07Å; T1557-A1561 VanDerWaalsContact O-N 3.13Å; E1558-A1561 WeakPolarHBondContact O-CB 3.12Å; E1558-A1561 PolarHBondContact O-N 3.18Å; E1558-A1561 VanDerWaalsContact O-N 3.09Å; A1561-R1563 PolarHBondContact O-N 2.82Å; A1561-S1564 WeakPolarHBondContact CA-OG 3.4Å; A1561-S1564 PolarHBondContact O-N 3.15Å; A1561-S1564 PolarHBondContact O-OG 2.95Å; A1561-F1565 PolarHBondContact O-N 3.22Å
1562	I	66	Low	65.6	Low	20 Å²	20	77.2 Å²	77.2	10%	0.103	38%	0.377	C	S	.	.	H	α-helix	trans	-59.4	-46.3	174	-67.4	164.7	0	0	0	110.6	E1558 S1564 F1565 L1566 L1740 Y1745	E1558-I1562 HydrophobicContact CG-CD1 4.09Å; E1558-I1562 WeakPolarHBondContact O-CG1 3.28Å; E1558-I1562 PolarHBondContact O-N 3.34Å; I1562-S1564 PolarHBondContact O-N 3.49Å; I1562-F1565 PolarHBondContact O-N 2.93Å; I1562-L1566 HydrophobicContact CG2-CD1 3.81Å; I1562-L1566 HydrophobicContact CG2-CG 4.4Å; I1562-L1566 VanDerWaalsContact O-CG 3.29Å; I1562-L1566 WeakPolarHBondContact O-CG 3.41Å; I1562-L1566 PolarHBondContact O-N 3.31Å; I1562-L1740 HydrophobicContact CD1-CD1 4.19Å; I1562-L1740 HydrophobicContact CG2-CD2 3.83Å; I1562-Y1745 HydrophobicContact CD1-CE1 4.32Å; I1562-Y1745 HydrophobicContact CG1-CD1 4.3Å; I1562-Y1745 HydrophobicContact CG1-CE1 3.6Å; I1562-Y1745 HydrophobicContact CG1-CE2 4.33Å
1563	R	68.3	Low	63.6	Low	152 Å²	152	82.4 Å²	82.4	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-62.7	-40.7	176.4	-76	176	-162.1	175.9	8.4	112.7	M1559 K1560 A1561 F1565 L1566 D1567	M1559-R1563 WeakPolarHBondContact O-CB 3.35Å; M1559-R1563 WeakPolarHBondContact O-CG 3.48Å; M1559-R1563 PolarHBondContact O-N 3.3Å; M1559-R1563 PolarHBondContact SD-NH2 2.85Å; K1560-R1563 PolarHBondContact O-N 2.92Å; A1561-R1563 PolarHBondContact O-N 2.82Å; R1563-F1565 VanDerWaalsContact C-N 3.34Å; R1563-L1566 PolarHBondContact O-N 2.94Å; R1563-D1567 WeakPolarHBondContact O-CB 3.36Å; R1563-D1567 PolarHBondContact O-N 2.93Å
1564	S	66.3	Low	61.8	Low	71 Å²	71	84 Å²	84	50%	0.497	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-38	176.5	47.2	0	0	0	0	112.4	K1560 A1561 I1562 E1568	K1560-S1564 PolarHBondContact O-N 3.06Å; K1560-S1564 PolarHBondContact O-OG 3.38Å; K1560-S1564 VanDerWaalsContact O-OG 3.1Å; A1561-S1564 WeakPolarHBondContact CA-OG 3.4Å; A1561-S1564 PolarHBondContact O-N 3.15Å; A1561-S1564 PolarHBondContact O-OG 2.95Å; I1562-S1564 PolarHBondContact O-N 3.49Å; S1564-E1568 VanDerWaalsContact O-CB 3.27Å; S1564-E1568 WeakPolarHBondContact O-CB 3.47Å; S1564-E1568 PolarHBondContact O-N 2.63Å
1565	F	66.2	Low	60.1	Low	38 Å²	38	82.3 Å²	82.3	17%	0.167	42%	0.422	C	S	.	.	H	α-helix	trans	-63.2	-45.6	172.1	172.6	-93.8	0	0	0	111.6	A1561 I1562 R1563 D1567 E1568 Q1569 Y1745	A1561-F1565 PolarHBondContact O-N 3.22Å; I1562-F1565 PolarHBondContact O-N 2.93Å; R1563-F1565 VanDerWaalsContact C-N 3.34Å; F1565-D1567 PolarHBondContact O-N 3.45Å; F1565-E1568 PolarHBondContact O-N 2.81Å; F1565-Q1569 HydrophobicContact CD1-CG 4.4Å; F1565-Q1569 HydrophobicContact CE1-CG 4.11Å; F1565-Q1569 HydrophobicContact CE2-CG 4.48Å; F1565-Q1569 HydrophobicContact CZ-CG 4.15Å; F1565-Q1569 WeakPolarHBondContact O-CG 3.45Å; F1565-Q1569 PolarHBondContact O-N 3.39Å; F1565-Y1745 HydrophobicContact CB-CD2 3.98Å; F1565-Y1745 HydrophobicContact CB-CE2 3.84Å; F1565-Y1745 AromaticContact CD1-CD2 3.5Å; F1565-Y1745 HydrophobicContact CD1-CD2 3.5Å; F1565-Y1745 VanDerWaalsContact CD1-CD2 3.5Å; F1565-Y1745 HydrophobicContact CD1-CE2 4.23Å; F1565-Y1745 HydrophobicContact CD1-CG 4.33Å; F1565-Y1745 AromaticContact CD2-CD2 3.88Å; F1565-Y1745 HydrophobicContact CD2-CD2 3.88Å; F1565-Y1745 HydrophobicContact CD2-CE2 4.31Å; F1565-Y1745 AromaticContact CE1-CD2 3.84Å; F1565-Y1745 HydrophobicContact CE1-CD2 3.84Å; F1565-Y1745 HydrophobicContact CE1-CG 4.37Å; F1565-Y1745 HydrophobicContact CE2-CD2 4.19Å; F1565-Y1745 AromaticContact CG-CD2 3.52Å; F1565-Y1745 HydrophobicContact CG-CD2 3.52Å; F1565-Y1745 AromaticContact CG-CE2 3.89Å; F1565-Y1745 HydrophobicContact CG-CE2 3.89Å; F1565-Y1745 HydrophobicContact CZ-CD2 4.16Å
1566	L	63.8	Low	58	Low	43 Å²	43	88.8 Å²	88.8	23%	0.225	46%	0.456	C	S	.	.	H	α-helix	trans	-64	-40.6	178.8	-69.5	168	0	0	0	112.4	I1562 R1563 Q1569 Q1570 I1735 L1743	I1562-L1566 HydrophobicContact CG2-CD1 3.81Å; I1562-L1566 HydrophobicContact CG2-CG 4.4Å; I1562-L1566 VanDerWaalsContact O-CG 3.29Å; I1562-L1566 WeakPolarHBondContact O-CG 3.41Å; I1562-L1566 PolarHBondContact O-N 3.31Å; R1563-L1566 PolarHBondContact O-N 2.94Å; L1566-Q1569 PolarHBondContact O-N 3.09Å; L1566-Q1570 VanDerWaalsContact O-CB 3.25Å; L1566-Q1570 WeakPolarHBondContact O-CB 3.37Å; L1566-Q1570 PolarHBondContact O-N 3.05Å; L1566-I1735 HydrophobicContact CD1-CD1 3.6Å; L1566-L1743 HydrophobicContact CD2-CD1 4.22Å
1567	D	64.4	Low	56.2	Low	109 Å²	109	94.1 Å²	94.1	58%	0.583	49%	0.49	S	S	*	.	H	α-helix	trans	-68.2	-38.3	177.7	-158.5	41	0	0	0	111.6	R1563 F1565 Q1570 H1571	R1563-D1567 WeakPolarHBondContact O-CB 3.36Å; R1563-D1567 PolarHBondContact O-N 2.93Å; F1565-D1567 PolarHBondContact O-N 3.45Å; D1567-Q1570 PolarHBondContact O-N 2.91Å; D1567-H1571 PolarHBondContact O-N 3.3Å
1568	E	60.9	Low	54.2	Low	146 Å²	146	96.8 Å²	96.8	68%	0.682	51%	0.511	S	S	*	.	H	α-helix	trans	-63.8	-38	172.8	-171.7	169.1	-145.9	0	0	112.1	S1564 F1565	S1564-E1568 VanDerWaalsContact O-CB 3.27Å; S1564-E1568 WeakPolarHBondContact O-CB 3.47Å; S1564-E1568 PolarHBondContact O-N 2.63Å; F1565-E1568 PolarHBondContact O-N 2.81Å
1569	Q	56.3	Low	52.3	Low	91 Å²	91	101.7 Å²	101.7	43%	0.425	55%	0.547	S	S	.	.	H	α-helix	trans	-71.6	-39.5	171.7	-66.4	-60.8	-28.1	0	0	112.7	F1565 L1566 H1571 V1572	F1565-Q1569 HydrophobicContact CD1-CG 4.4Å; F1565-Q1569 HydrophobicContact CE1-CG 4.11Å; F1565-Q1569 HydrophobicContact CE2-CG 4.48Å; F1565-Q1569 HydrophobicContact CZ-CG 4.15Å; F1565-Q1569 WeakPolarHBondContact O-CG 3.45Å; F1565-Q1569 PolarHBondContact O-N 3.39Å; L1566-Q1569 PolarHBondContact O-N 3.09Å; Q1569-H1571 PolarHBondContact O-N 3.28Å; Q1569-V1572 WeakPolarHBondContact O-CB 3.34Å; Q1569-V1572 PolarHBondContact O-N 2.67Å
1570	Q	47.6	Very low	50.7	Low	120 Å²	120	104.8 Å²	104.8	56%	0.561	57%	0.569	S	S	*	*	H	α-helix	trans	-66.6	-24.5	-172.9	-169.1	159.1	-41.8	0	0	112.6	L1566 D1567 V1572 I1573	L1566-Q1570 VanDerWaalsContact O-CB 3.25Å; L1566-Q1570 WeakPolarHBondContact O-CB 3.37Å; L1566-Q1570 PolarHBondContact O-N 3.05Å; D1567-Q1570 PolarHBondContact O-N 2.91Å; Q1570-V1572 PolarHBondContact O-N 3.27Å; Q1570-I1573 PolarHBondContact O-N 3.04Å
1571	H	45.5	Very low	48.7	Very low	155 Å²	155	108.6 Å²	108.6	72%	0.718	59%	0.588	S	S	*	*	H	α-helix	trans	-67.4	-14.3	172.3	-115.6	-68.4	0	0	0	114.8	D1567 Q1569	D1567-H1571 PolarHBondContact O-N 3.3Å; Q1569-H1571 PolarHBondContact O-N 3.28Å
1572	V	41.8	Very low	46.7	Very low	105 Å²	105	114.8 Å²	114.8	64%	0.636	61%	0.612	S	S	*	*	H	α-helix	trans	-89.7	-21.5	177.9	-176.3	0	0	0	0	112.4	Q1569 Q1570	Q1569-V1572 WeakPolarHBondContact O-CB 3.34Å; Q1569-V1572 PolarHBondContact O-N 2.67Å; Q1570-V1572 PolarHBondContact O-N 3.27Å
1573	I	39	Very low	45	Very low	130 Å²	130	122 Å²	122	67%	0.667	65%	0.649	S	S	*	*	H	α-helix	trans	-87	-17.9	-166.3	-63.4	174.5	0	0	0	113	Q1570 T1575	Q1570-I1573 PolarHBondContact O-N 3.04Å; I1573-T1575 PolarHBondContact O-N 3.1Å
1574	L	35.4	Very low	43	Very low	145 Å²	145	120.5 Å²	120.5	76%	0.759	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	3.3	-167.7	-80.8	167.1	0	0	0	117
1575	T	38.8	Very low	41.3	Very low	116 Å²	116	123.9 Å²	123.9	71%	0.712	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	5	-171.4	62.6	0	0	0	0	116.2	I1573	I1573-T1575 PolarHBondContact O-N 3.1Å
1576	N	34.7	Very low	39.5	Very low	135 Å²	135	131.2 Å²	131.2	72%	0.722	70%	0.701	S	S	*	*	S	Bend	trans	-141.4	149.3	179.1	-89.3	-52.9	0	0	0	114.1
1577	T	35.8	Very low	37.8	Very low	144 Å²	144	136.9 Å²	136.9	88%	0.883	73%	0.726	S	S	*	*			trans	66	111.6	177.8	65.2	0	0	0	0	117.1
1578	S	30.8	Very low	36.1	Very low	115 Å²	115	139 Å²	139	80%	0.804	74%	0.737	S	S	*	*			trans	-90.7	112.9	172.9	53.5	0	0	0	0	111.7
1579	S	33.1	Very low	34.5	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	74%	0.741	S	S	*	*			trans	-168.4	116.7	153	-84.4	0	0	0	0	112.9
1580	T	31.2	Very low	33.3	Very low	129 Å²	129	138.8 Å²	138.8	79%	0.791	76%	0.761	S	S	*	*			trans	49.7	119	153.3	43.9	0	0	0	0	121.9
1581	Q	27.5	Very low	32.3	Very low	174 Å²	174	141.3 Å²	141.3	81%	0.813	78%	0.777	S	S	*	*			trans	81.8	80.7	140.7	-66.1	-179.4	-34.1	0	0	120.3
1582	H	27.6	Very low	31.4	Very low	159 Å²	159	138.6 Å²	138.6	74%	0.736	78%	0.775	S	S	*	*				35.1	104.1	129.1	-65.9	-79.4	0	0	0	119.6
1583	I	29.2	Very low	30.6	Very low	171 Å²	171	139.4 Å²	139.4	88%	0.877	78%	0.781	S	S	*	*			trans	-101.7	117.4	139	-62.6	176.3	0	0	0	106
1584	L	27.6	Very low	29.9	Very low	121 Å²	121	141.8 Å²	141.8	63%	0.634	79%	0.789	S	S	*	*			trans	-115.1	107.1	-171.2	-106.3	172	0	0	0	111	K1586	L1584-K1586 PolarHBondContact O-N 3.43Å
1585	V	30.5	Very low	29.4	Very low	142 Å²	142	139.7 Å²	139.7	86%	0.861	79%	0.786	S	S	*	*			trans	-56.4	123.6	165.6	178.4	0	0	0	0	109.1
1586	K	27.3	Very low	28.9	Very low	192 Å²	192	138.8 Å²	138.8	84%	0.835	79%	0.785	S	S	*	*			trans	-155	134.3	175.4	-133.9	177.3	-176.5	-175.5	0	114.9	L1584	L1584-K1586 PolarHBondContact O-N 3.43Å
1587	Q	29.1	Very low	28.8	Very low	162 Å²	162	138.5 Å²	138.5	76%	0.757	79%	0.788	S	S	*	*			trans	-91.5	163.6	172.2	-59.1	175.6	-60.2	0	0	112.2
1588	N	28.6	Very low	28.7	Very low	152 Å²	152	136.6 Å²	136.6	81%	0.813	78%	0.778	S	S	*	*			trans	73.2	136.5	152.3	-55.3	-33.1	0	0	0	119.8
1589	G	28.1	Very low	28.4	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	78%	0.778	S	S	*	*			trans	132.3	104.8	132.6	0	0	0	0	0	116.9
1590	N	30	Very low	28	Very low	160 Å²	160	139.9 Å²	139.9	86%	0.856	77%	0.769	S	S	*	*			trans	-60.8	148.8	168.8	-50.7	-11.4	0	0	0	111.9
1591	I	26.5	Very low	27.8	Very low	173 Å²	173	139.8 Å²	139.8	89%	0.887	77%	0.768	S	S	*	*			trans	-167.4	151.4	130.4	-102.8	155.1	0	0	0	111
1592	S	27.2	Very low	27.8	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	76%	0.764	S	S	*	*			trans	-91.8	152.5	-173.9	53.8	0	0	0	0	114.7
1593	T	24.9	Very low	27.9	Very low	122 Å²	122	135.4 Å²	135.4	75%	0.748	76%	0.763	S	S	*	*			trans	-171.6	132.4	130.3	25.7	0	0	0	0	112.5
1594	E	24	Very low	27.9	Very low	179 Å²	179	130.8 Å²	130.8	84%	0.836	74%	0.74	S	S	*	*				35.9	141.4	128.5	-64.1	170.7	-167.6	0	0	121.3
1595	S	24.5	Very low	27.9	Very low	101 Å²	101	130.1 Å²	130.1	71%	0.706	74%	0.737	S	S	*	*			cis	-171.9	-178.8	-2.4	55.4	0	0	0	0	112.5
1596	S	28.4	Very low	27.8	Very low	97 Å²	97	128.7 Å²	128.7	68%	0.678	72%	0.724	S	S	*	*			trans	78.2	88	160.5	63.2	0	0	0	0	122.7
1597	T	32.2	Very low	27.9	Very low	129 Å²	129	122.8 Å²	122.8	79%	0.791	70%	0.704	S	S	*	*				40.2	158.4	108	59.4	0	0	0	0	122.8
1598	P	34.4	Very low	27.9	Very low	105 Å²	105	122.2 Å²	122.2	68%	0.682	70%	0.701	S	S	*	*			cis	-146	-157.2	-25.5	39.4	-17.4	0	0	0	115.2
1599	F	24.3	Very low	27.7	Very low	180 Å²	180	124 Å²	124	79%	0.789	70%	0.698	S	S	*	*			trans	82.6	143.5	153.9	-106.6	-115.9	0	0	0	120.3
1600	L	24.8	Very low	27.8	Very low	117 Å²	117	126.1 Å²	126.1	61%	0.613	69%	0.692	S	S	*	*			cis	-174.1	144.9	-33	-142.5	85.5	0	0	0	112.7
1601	T	26.3	Very low	27.8	Very low	127 Å²	127	127 Å²	127	78%	0.779	69%	0.691	S	S	*	*			trans	61	165	155.2	46.2	0	0	0	0	121.2
1602	S	28.3	Very low	28	Very low	103 Å²	103	124.8 Å²	124.8	72%	0.72	69%	0.688	S	S	*	*			cis	176.7	171.6	-28.3	-168.9	0	0	0	0	111.6
1603	I	30.2	Very low	27.8	Very low	138 Å²	138	124.8 Å²	124.8	71%	0.708	69%	0.688	S	S	*	*			trans	104.5	153.9	165	-57.5	177.3	0	0	0	115.9
1604	D	29.2	Very low	27.9	Very low	75 Å²	75	125.8 Å²	125.8	40%	0.401	69%	0.693	S	S	.	*			trans	-141.9	146.9	-150.8	-41.5	-106.8	0	0	0	116.1	S1625 D1628	D1604-S1625 WeakPolarHBondContact OD1-CB 3.35Å; D1604-S1625 PolarHBondContact OD1-OG 2.95Å; D1604-D1628 WeakPolarHBondContact CA-OD2 3.37Å
1605	D	27.8	Very low	27.9	Very low	106 Å²	106	122.5 Å²	122.5	57%	0.567	69%	0.69	S	S	*	*			trans	141.8	154.4	134.9	-89.4	-30.6	0	0	0	117.5	D1628	D1605-D1628 PolarHBondContact N-OD2 3.39Å; D1605-D1628 WeakPolarHBondContact O-CA 3.28Å; D1605-D1628 PolarHBondContact O-N 3.01Å
1606	L	27.8	Very low	27.9	Very low	113 Å²	113	125.8 Å²	125.8	59%	0.592	70%	0.699	S	S	*	*			trans	71.1	126.4	166.7	-58.9	161.2	0	0	0	123.3	W1627 N1631	L1606-W1627 CarbonylContact C-O 3.58Å; L1606-N1631 PolarHBondContact O-ND2 3.23Å
1607	T	29.8	Very low	27.6	Very low	67 Å²	67	131.4 Å²	131.4	41%	0.411	71%	0.707	S	S	.	*			cis	179.4	137.5	-36.7	25.4	0	0	0	0	110.1	W1627 N1631	T1607-W1627 HydrophobicContact CG2-CD2 4.14Å; T1607-W1627 HydrophobicContact CG2-CH2 4.42Å; T1607-W1627 HydrophobicContact CG2-CZ2 3.91Å; T1607-N1631 PolarHBondContact N-ND2 3.01Å; T1607-N1631 PolarHBondContact O-ND2 2.89Å
1608	E	28.1	Very low	27.5	Very low	151 Å²	151	130.1 Å²	130.1	71%	0.706	70%	0.703	S	S	*	*			trans	78	146.6	163.2	-160.4	157.3	-158.6	0	0	120.5
1609	Y	25	Very low	27.1	Very low	190 Å²	190	132.8 Å²	132.8	75%	0.745	71%	0.706	S	S	*	*			trans	70.7	152.4	-177.1	-95	-143.6	0	0	0	117.2
1610	N	30.5	Very low	27.5	Very low	116 Å²	116	130.1 Å²	130.1	62%	0.62	70%	0.696	S	S	*	*			cis	-161.7	179.4	-23.5	-144.8	-51.2	0	0	0	110.9
1611	Q	29.3	Very low	27.8	Very low	179 Å²	179	133.4 Å²	133.4	84%	0.836	70%	0.701	S	S	*	*			trans	60.6	176.4	-175.7	-87.5	-175.1	-0.8	0	0	113
1612	P	30.5	Very low	28	Very low	127 Å²	127	133.8 Å²	133.8	83%	0.825	70%	0.698	S	S	*	*			cis	-137.5	-128.9	21.9	44.3	-21.7	0	0	0	115.5
1613	S	23.4	Very low	28.2	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	70%	0.7	S	S	*	*			trans	-131.6	148.4	-152.7	54.4	0	0	0	0	116.8
1614	V	28.1	Very low	28.1	Very low	143 Å²	143	137.8 Å²	137.8	87%	0.867	71%	0.706	S	S	*	*			trans	35.9	98	144.2	-169.7	0	0	0	0	120.1
1615	S	23	Very low	28.5	Very low	111 Å²	111	136.8 Å²	136.8	78%	0.776	71%	0.705	S	S	*	*			trans	-177.7	133.4	144.4	45	0	0	0	0	108.5
1616	L	24.2	Very low	28.6	Very low	170 Å²	170	138.5 Å²	138.5	89%	0.89	71%	0.713	S	S	*	*				76.6	116.5	75.7	-139.9	81.3	0	0	0	115.5
1617	Y	23.5	Very low	28.8	Very low	215 Å²	215	139.3 Å²	139.3	84%	0.843	71%	0.708	S	S	*	*			trans	28	120.4	163.1	-110.5	-108	0	0	0	123.7
1618	S	28.6	Very low	28.8	Very low	102 Å²	102	140 Å²	140	71%	0.713	71%	0.709	S	S	*	*			trans	62.2	150.5	139.4	66	0	0	0	0	124.7
1619	H	26.6	Very low	29.1	Very low	160 Å²	160	138.5 Å²	138.5	74%	0.741	71%	0.711	S	S	*	*			trans	97	87.1	151.4	-127.5	-79.3	0	0	0	122.4
1620	E	32.3	Very low	29.2	Very low	125 Å²	125	136.8 Å²	136.8	58%	0.584	71%	0.713	S	S	*	*				57.9	134.2	127.2	-121	-166.6	162.6	0	0	126.7
1621	R	30.7	Very low	29.4	Very low	186 Å²	186	135.3 Å²	135.3	70%	0.702	71%	0.705	S	S	*	*			trans	68.9	110.5	145.5	-95.4	-173.5	-79.7	144.5	3.1	124.1
1622	D	31.7	Very low	29.3	Very low	134 Å²	134	134.8 Å²	134.8	72%	0.717	71%	0.708	S	S	*	*				63.7	110.1	129.1	-61.3	-4.3	0	0	0	125.2
1623	N	31.4	Very low	29.1	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	70%	0.702	S	S	*	*			trans	88.6	137.6	132.9	-70.3	-36	0	0	0	124.3
1624	H	28.9	Very low	29.3	Very low	180 Å²	180	134.8 Å²	134.8	83%	0.833	71%	0.709	S	S	*	*			trans	84.6	168.2	161.3	-82.7	-70.4	0	0	0	121
1625	S	36.6	Very low	29.4	Very low	55 Å²	55	134.6 Å²	134.6	39%	0.385	70%	0.702	S	S	.	*			trans	-106.5	137.7	-134.8	23.2	0	0	0	0	115.7	D1604	D1604-S1625 WeakPolarHBondContact OD1-CB 3.35Å; D1604-S1625 PolarHBondContact OD1-OG 2.95Å
1626	I	30.6	Very low	29.6	Very low	142 Å²	142	136.2 Å²	136.2	73%	0.728	70%	0.702	S	S	*	*			trans	-142	122.6	153.3	-59	-179.3	0	0	0	106.1	V1629	I1626-V1629 HydrophobicContact CG2-CG2 4.21Å
1627	W	32.3	Very low	29.8	Very low	129 Å²	129	133.7 Å²	133.7	49%	0.489	69%	0.689	S	S	.	*			trans	-131.4	-25.4	-178.9	-116.6	147.5	0	0	0	114	L1606 T1607 V1629	L1606-W1627 CarbonylContact C-O 3.58Å; T1607-W1627 HydrophobicContact CG2-CD2 4.14Å; T1607-W1627 HydrophobicContact CG2-CH2 4.42Å; T1607-W1627 HydrophobicContact CG2-CZ2 3.91Å; W1627-V1629 PolarHBondContact O-N 3.36Å
1628	D	30.4	Very low	30	Very low	81 Å²	81	130.4 Å²	130.4	43%	0.433	69%	0.686	S	S	.	*	G	3₁₀ helix	trans	-65.3	-26.5	-166.4	-58.2	-119.3	0	0	0	117.4	D1604 D1605 L1630	D1604-D1628 WeakPolarHBondContact CA-OD2 3.37Å; D1605-D1628 PolarHBondContact N-OD2 3.39Å; D1605-D1628 WeakPolarHBondContact O-CA 3.28Å; D1605-D1628 PolarHBondContact O-N 3.01Å; D1628-L1630 PolarHBondContact O-N 3.16Å
1629	V	32.8	Very low	30.2	Very low	121 Å²	121	134 Å²	134	73%	0.733	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-80.7	-10	-148.8	-177.6	0	0	0	0	114.7	I1626 W1627	I1626-V1629 HydrophobicContact CG2-CG2 4.21Å; W1627-V1629 PolarHBondContact O-N 3.36Å
1630	L	29	Very low	30.3	Very low	153 Å²	153	133.1 Å²	133.1	80%	0.801	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-112.4	5.6	-167.4	-81.3	169.8	0	0	0	117	D1628	D1628-L1630 PolarHBondContact O-N 3.16Å
1631	N	32.9	Very low	30	Very low	85 Å²	85	131.7 Å²	131.7	46%	0.455	70%	0.695	S	S	.	*	S	Bend	trans	-104.1	130.2	174.7	-86.5	-65.3	0	0	0	113.2	L1606 T1607	L1606-N1631 PolarHBondContact O-ND2 3.23Å; T1607-N1631 PolarHBondContact N-ND2 3.01Å; T1607-N1631 PolarHBondContact O-ND2 2.89Å
1632	N	28	Very low	29.8	Very low	168 Å²	168	131 Å²	131	90%	0.898	71%	0.705	S	S	*	*			trans	82.2	118	174.8	-46.6	-78.6	0	0	0	118
1633	G	27.2	Very low	30.1	Very low	67 Å²	67	132.1 Å²	132.1	69%	0.691	70%	0.704	S	S	*	*			trans	155.2	106.8	155.5	0	0	0	0	0	116.5
1634	L	26.4	Very low	29.7	Very low	158 Å²	158	128.7 Å²	128.7	83%	0.827	70%	0.695	S	S	*	*			trans	39.4	107.7	156.8	-67.8	104	0	0	0	118
1635	I	30.8	Very low	29.4	Very low	140 Å²	140	126.9 Å²	126.9	72%	0.718	68%	0.682	S	S	*	*				43.3	100	67.4	-47.5	172.2	0	0	0	111.8
1636	D	27.6	Very low	28.7	Very low	145 Å²	145	129.1 Å²	129.1	78%	0.775	70%	0.698	S	S	*	*				-152.1	159.7	107.7	-130.8	-32.3	0	0	0	114.7
1637	N	28	Very low	28.8	Very low	116 Å²	116	130.5 Å²	130.5	62%	0.62	70%	0.701	S	S	*	*			trans	-87.4	147.4	-171.1	-52.2	-98.7	0	0	0	110.1
1638	N	28.2	Very low	28.4	Very low	146 Å²	146	130.5 Å²	130.5	78%	0.781	72%	0.718	S	S	*	*				171.2	161.1	120.7	-89.7	-53.7	0	0	0	113.2
1639	H	31.4	Very low	28.3	Very low	177 Å²	177	131 Å²	131	82%	0.819	73%	0.727	S	S	*	*			trans	68	68.5	170.8	-60.6	-64.5	0	0	0	118.6	S1641	H1639-S1641 PolarHBondContact O-N 3.11Å
1640	N	30.2	Very low	28	Very low	142 Å²	142	132.1 Å²	132.1	76%	0.759	73%	0.729	S	S	*	*			trans	-59.9	118.5	150.1	-75.5	-28.2	0	0	0	111.1	F1643	N1640-F1643 HydrophobicContact CB-CE2 4.2Å
1641	S	25.6	Very low	27.8	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	73%	0.731	S	S	*	*			trans	171	118.1	133.3	40.3	0	0	0	0	114.3	H1639	H1639-S1641 PolarHBondContact O-N 3.11Å
1642	L	25.1	Very low	27.5	Very low	171 Å²	171	136.1 Å²	136.1	90%	0.895	75%	0.749	S	S	*	*				-151.9	110.8	110.7	-132.7	85.9	0	0	0	106.8
1643	F	39.4	Very low	27.5	Very low	159 Å²	159	131.9 Å²	131.9	70%	0.697	74%	0.738	S	S	*	*			trans	-103.9	-168	-170	-80.4	-98.4	0	0	0	110.8	N1640 Y1645	N1640-F1643 HydrophobicContact CB-CE2 4.2Å; F1643-Y1645 PolarHBondContact O-N 2.97Å
1644	A	21.9	Very low	27.6	Very low	72 Å²	72	135 Å²	135	60%	0.595	74%	0.744	S	S	*	*	S	Bend	trans	-42	126.1	165.7	0	0	0	0	0	112.6
1645	Y	23.2	Very low	27.6	Very low	143 Å²	143	135 Å²	135	56%	0.561	74%	0.739	S	S	*	*	S	Bend	trans	66.2	150.6	171	-92	-87.6	0	0	0	119.7	F1643	F1643-Y1645 PolarHBondContact O-N 2.97Å
1646	S	21.9	Very low	27.5	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	74%	0.739	S	S	*	*			trans	84.1	130.5	152.8	72.2	0	0	0	0	120.6
1647	H	32.4	Very low	27.8	Very low	170 Å²	170	132.3 Å²	132.3	79%	0.787	73%	0.732	S	S	*	*			trans	-39.9	161.7	173.8	-55.2	-92	0	0	0	117.5
1648	P	24.9	Very low	27.7	Very low	130 Å²	130	132.8 Å²	132.8	84%	0.844	74%	0.739	S	S	*	*				-113	133.7	118.9	32.9	-32.9	0	0	0	112.6
1649	S	27.1	Very low	27.7	Very low	90 Å²	90	132.9 Å²	132.9	63%	0.629	74%	0.738	S	S	*	*			trans	-70.9	168.8	-177.4	-39.8	0	0	0	0	114
1650	N	26.3	Very low	27.3	Very low	145 Å²	145	131 Å²	131	78%	0.775	73%	0.729	S	S	*	*			trans	71.8	87.3	156.2	-50.8	-24.9	0	0	0	117.3
1651	L	25.5	Very low	27.1	Very low	163 Å²	163	132 Å²	132	85%	0.853	73%	0.727	S	S	*	*				-141	112.4	105	-138.4	75.8	0	0	0	112.3
1652	L	27	Very low	27	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	73%	0.727	S	S	*	*			trans	8.9	139.9	140.1	-58.9	165.1	0	0	0	117.9
1653	A	27	Very low	27	Very low	80 Å²	80	135.8 Å²	135.8	66%	0.661	72%	0.724	S	S	*	*			cis	-171.3	-161.9	-4.7	0	0	0	0	0	108.1
1654	V	29.1	Very low	26.4	Very low	133 Å²	133	133 Å²	133	81%	0.806	72%	0.724	S	S	*	*			trans	69.9	83.5	171.5	-165.3	0	0	0	0	111.8
1655	E	27.3	Very low	26.5	Very low	157 Å²	157	134.6 Å²	134.6	73%	0.734	73%	0.731	S	S	*	*			cis	58.2	105.9	36.8	-166.3	-155.1	-97.7	0	0	112.3
1656	N	29	Very low	26.5	Very low	133 Å²	133	133.1 Å²	133.1	71%	0.711	74%	0.742	S	S	*	*				167.5	156.6	124.8	-89.3	-72.1	0	0	0	111.6
1657	P	33.5	Very low	26.8	Very low	96 Å²	96	138.1 Å²	138.1	62%	0.623	75%	0.751	S	S	*	*			trans	-142.6	-162.1	-142	42	-20.9	0	0	0	116
1658	T	26.7	Very low	26.6	Very low	126 Å²	126	136 Å²	136	77%	0.773	75%	0.753	S	S	*	*			trans	74.6	169.6	150	50.8	0	0	0	0	121
1659	I	26.2	Very low	26.6	Very low	147 Å²	147	134.8 Å²	134.8	75%	0.754	75%	0.747	S	S	*	*			trans	92.7	81.9	164.4	-46.5	-173.5	0	0	0	116.7
1660	E	24.6	Very low	26.6	Very low	137 Å²	137	136.1 Å²	136.1	64%	0.64	75%	0.751	S	S	*	*				36.5	120.2	122	-68.5	-169.8	103.7	0	0	121.9
1661	K	25.8	Very low	26.6	Very low	164 Å²	164	136.6 Å²	136.6	71%	0.713	75%	0.749	S	S	*	*				71.5	155.9	121.5	-65.2	177.1	177.8	157.3	0	122.1
1662	D	24.2	Very low	26.8	Very low	124 Å²	124	134.4 Å²	134.4	66%	0.663	74%	0.738	S	S	*	*			trans	97.6	121.1	131.5	-102.2	38.5	0	0	0	120.5
1663	W	23.7	Very low	27	Very low	221 Å²	221	135.1 Å²	135.1	84%	0.837	74%	0.741	S	S	*	*			trans	72.4	130.3	165.1	-58.3	89.8	0	0	0	121.8
1664	S	27.1	Very low	27.1	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	75%	0.747	S	S	*	*			trans	-61.3	137.6	161.8	45.5	0	0	0	0	113
1665	S	23.6	Very low	27.2	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	74%	0.738	S	S	*	*				171.2	148.1	119.7	48.3	0	0	0	0	113
1666	S	23.3	Very low	27.4	Very low	111 Å²	111	136 Å²	136	78%	0.776	74%	0.741	S	S	*	*			trans	61.8	120.3	153.3	-56.3	0	0	0	0	121
1667	F	28.4	Very low	27.3	Very low	207 Å²	207	136.2 Å²	136.2	91%	0.908	74%	0.742	S	S	*	*			trans	-5.7	139.2	147.2	-66.3	-81.3	0	0	0	118
1668	P	28.3	Very low	27.1	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	74%	0.742	S	S	*	*				-145.6	-176.5	68	41.3	-23.5	0	0	0	117.3
1669	S	24.5	Very low	27.2	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	74%	0.74	S	S	*	*			trans	-85.8	167.5	-179	50.6	0	0	0	0	115.2
1670	V	27.3	Very low	27.2	Very low	118 Å²	118	134 Å²	134	72%	0.715	73%	0.725	S	S	*	*			trans	134.3	97.6	146.8	174.4	0	0	0	0	114.6
1671	E	27.4	Very low	27.3	Very low	154 Å²	154	136.5 Å²	136.5	72%	0.72	73%	0.73	S	S	*	*			trans	64.4	124.8	130.6	-66.4	-166.9	102.7	0	0	126.1
1672	N	28.4	Very low	27.4	Very low	117 Å²	117	132.7 Å²	132.7	63%	0.626	72%	0.724	S	S	*	*				74.6	93.1	127	-55.2	-12	0	0	0	122.3
1673	I	31.4	Very low	27.6	Very low	175 Å²	175	129.4 Å²	129.4	90%	0.897	71%	0.71	S	S	*	*			trans	-132.7	139.6	137.2	-60.8	-176.7	0	0	0	107.7
1674	H	29.6	Very low	28	Very low	170 Å²	170	121.8 Å²	121.8	79%	0.787	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-86.9	153.3	-168.2	-94.5	-98.1	0	0	0	115.6
1675	P	31.4	Very low	28.3	Very low	96 Å²	96	125 Å²	125	62%	0.623	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-94.8	170.2	175.5	39.6	-36.3	0	0	0	113.7
1676	P	31.8	Very low	28.6	Very low	123 Å²	123	125.1 Å²	125.1	80%	0.799	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-88.3	158.8	160.4	36.6	-32.9	0	0	0	112.5
1677	D	27.2	Very low	29.2	Very low	136 Å²	136	124.4 Å²	124.4	73%	0.727	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-99.7	143.1	-158.7	-41.6	-93.9	0	0	0	116.1
1678	D	27.9	Very low	29.4	Very low	116 Å²	116	120.3 Å²	120.3	62%	0.62	65%	0.652	S	S	*	*			trans	-175.4	58.5	147.4	-91	-27.9	0	0	0	110.3	K1738	D1678-K1738 IonicContact OD1-NZ 2.69Å; D1678-K1738 PolarHBondContact OD1-NZ 3.07Å; D1678-K1738 IonicContact OD2-NZ 2.71Å; D1678-K1738 PolarHBondContact OD2-NZ 3.3Å
1679	V	28.4	Very low	29.4	Very low	121 Å²	121	124.2 Å²	124.2	73%	0.733	65%	0.652	S	S	*	*			trans	-133.2	104.4	177.4	-179.4	0	0	0	0	110.8	Y1681	V1679-Y1681 HydrophobicContact CG1-CE2 4.47Å
1680	I	26.6	Very low	29.8	Very low	87 Å²	87	129 Å²	129	45%	0.446	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-93.7	116.6	-177.6	-61.2	179	0	0	0	110.8	L1737	I1680-L1737 HydrophobicContact CD1-CD2 4.26Å
1681	Y	27.4	Very low	30	Very low	189 Å²	189	127.9 Å²	127.9	74%	0.741	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-72.5	159.2	-177.5	-80.2	-110.6	0	0	0	114.1	V1679	V1679-Y1681 HydrophobicContact CG1-CE2 4.47Å
1682	S	27.5	Very low	30.1	Very low	84 Å²	84	124.2 Å²	124.2	59%	0.587	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-71.2	132.8	163	48.6	0	0	0	0	111.1	D1684	S1682-D1684 VanDerWaalsContact C-N 3.28Å; S1682-D1684 PolarHBondContact O-N 3.33Å
1683	P	28.5	Very low	30	Very low	55 Å²	55	127.8 Å²	127.8	36%	0.357	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.9	-17.2	-174.4	-24.6	35.8	0	0	0	116.5	F1685 P1748	P1683-F1685 VanDerWaalsContact C-N 3.29Å; P1683-F1685 PolarHBondContact O-N 3.32Å; P1683-F1685 VanDerWaalsContact O-N 3.16Å; P1683-P1748 HydrophobicContact CB-CB 4.11Å
1684	D	30.9	Very low	29.8	Very low	60 Å²	60	124.9 Å²	124.9	32%	0.321	62%	0.62	S	S	.	*	H	α-helix	trans	-75.2	-10.2	-159.1	-57.3	-66.6	0	0	0	115.9	H1547 S1682	H1547-D1684 IonicContact CD2-OD1 3.43Å; H1547-D1684 PolarHBondContact CD2-OD1 3.07Å; S1682-D1684 VanDerWaalsContact C-N 3.28Å; S1682-D1684 PolarHBondContact O-N 3.33Å
1685	F	34.1	Very low	29.8	Very low	169 Å²	169	122.1 Å²	122.1	74%	0.741	61%	0.609	S	S	*	*	H	α-helix	trans	-71	-35.5	178.7	-170.9	-108.8	0	0	0	113	P1683	P1683-F1685 VanDerWaalsContact C-N 3.29Å; P1683-F1685 PolarHBondContact O-N 3.32Å; P1683-F1685 VanDerWaalsContact O-N 3.16Å
1686	V	30.4	Very low	29.6	Very low	108 Å²	108	122.3 Å²	122.3	66%	0.655	61%	0.606	S	S	*	*	H	α-helix	trans	-84.1	-29.5	-172.8	-178.8	0	0	0	0	112.1
1687	T	34.8	Very low	29.4	Very low	96 Å²	96	121.5 Å²	121.5	59%	0.589	59%	0.594	S	S	*	*	H	α-helix	trans	-72.9	-31.3	-173.5	-33.4	0	0	0	0	113.1
1688	R	32.4	Very low	29.4	Very low	122 Å²	122	120.3 Å²	120.3	46%	0.46	59%	0.585	S	S	.	*	H	α-helix	trans	-78.1	-29	-179.6	-87.7	176.9	166	167.7	-9.1	114.2	R1690 S2438	R1688-R1690 PolarHBondContact O-N 3.49Å; R1688-R1690 VanDerWaalsContact O-N 3.15Å; R1688-S2438 WeakPolarHBondContact CG-OG 3.31Å; R1688-S2438 PolarHBondContact NE-OG 3.37Å; R1688-S2438 PolarHBondContact NH2-O 2.97Å
1689	Y	29.8	Very low	29.4	Very low	208 Å²	208	120.6 Å²	120.6	82%	0.816	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	2	-175.9	-131.3	-83.2	0	0	0	114.7
1690	R	31.7	Very low	29.4	Very low	204 Å²	204	118.9 Å²	118.9	77%	0.77	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-2.2	-176.4	-136.1	174.4	-158	152.9	6	114.7	R1688 N2434	R1688-R1690 PolarHBondContact O-N 3.49Å; R1688-R1690 VanDerWaalsContact O-N 3.15Å; R1690-N2434 PolarHBondContact O-ND2 2.88Å; R1690-N2434 PolarHBondContact O-OD1 2.94Å
1691	Q	31.8	Very low	29.3	Very low	95 Å²	95	120.9 Å²	120.9	44%	0.444	60%	0.601	S	S	.	*	S	Bend	trans	-113.1	13.8	-169.9	-132.2	173.7	15.5	0	0	115.4	N2434 D2435	Q1691-N2434 WeakPolarHBondContact CA-OD1 3.38Å; Q1691-N2434 CarbonylContact O-C 3.43Å; Q1691-N2434 WeakPolarHBondContact O-CA 3.38Å; Q1691-N2434 WeakPolarHBondContact O-CB 3.48Å; Q1691-D2435 VanDerWaalsContact O-CA 3.26Å; Q1691-D2435 WeakPolarHBondContact O-CA 3.44Å; Q1691-D2435 PolarHBondContact O-N 2.81Å; Q1691-D2435 VanDerWaalsContact O-N 3.14Å
1692	S	28.9	Very low	29.5	Very low	77 Å²	77	118.5 Å²	118.5	54%	0.538	61%	0.606	S	S	.	*			trans	-131.4	106	179	-54.5	0	0	0	0	113	N2434 D2435	S1692-N2434 PolarHBondContact N-ND2 3.33Å; S1692-D2435 WeakPolarHBondContact CA-OD1 3.32Å; S1692-D2435 WeakPolarHBondContact CB-OD1 3.17Å; S1692-D2435 PolarHBondContact OG-OD1 3.14Å
1693	R	28.1	Very low	29.7	Very low	193 Å²	193	120.2 Å²	120.2	73%	0.728	62%	0.615	S	S	*	*			trans	168.6	150.3	164.8	-139.1	-175.4	173.9	131.4	6.1	111	Q2432 N2434	R1693-Q2432 WeakPolarHBondContact O-CB 3.47Å; R1693-N2434 PolarHBondContact N-ND2 3.49Å; R1693-N2434 WeakPolarHBondContact O-CB 3.49Å
1694	E	26	Very low	29.7	Very low	114 Å²	114	122.3 Å²	122.3	53%	0.533	63%	0.631	S	S	.	*			trans	-116.1	165.9	170.8	-152.7	-172.6	-128.3	0	0	111.7	Q2432 I2433	E1694-Q2432 WeakPolarHBondContact CA-O 3.24Å; E1694-Q2432 WeakPolarHBondContact CG-O 3.46Å; E1694-I2433 HydrophobicContact CG-CB 4.2Å
1695	I	30.8	Very low	29.5	Very low	111 Å²	111	127.3 Å²	127.3	57%	0.569	66%	0.656	S	S	*	*			trans	89.8	114.3	154.1	-56.4	144.3	0	0	0	118.1	S2431 Q2432	I1695-S2431 VanDerWaalsContact C-CB 3.49Å; I1695-Q2432 PolarHBondContact N-O 3.49Å
1696	N	27.3	Very low	29.2	Very low	101 Å²	101	123.1 Å²	123.1	54%	0.54	65%	0.648	S	S	.	*			trans	40.7	158.2	146.7	-54.1	-10.9	0	0	0	125.1	K2430 S2431	N1696-K2430 CarbonylContact C-O 3.59Å; N1696-K2430 VanDerWaalsContact CA-O 3.26Å; N1696-K2430 WeakPolarHBondContact CA-O 3.06Å; N1696-S2431 PolarHBondContact N-OG 3.26Å
1697	D	27.4	Very low	29.1	Very low	105 Å²	105	122.8 Å²	122.8	56%	0.561	65%	0.646	S	S	*	*				105.1	128.9	129.6	-81.8	-41	0	0	0	123.1	K2430	D1697-K2430 PolarHBondContact N-O 3.49Å; D1697-K2430 WeakPolarHBondContact O-CD 3.27Å; D1697-K2430 WeakPolarHBondContact O-CE 3.42Å; D1697-K2430 PolarHBondContact O-NZ 2.97Å
1698	Q	27	Very low	28.6	Very low	112 Å²	112	126.1 Å²	126.1	52%	0.523	66%	0.655	S	S	.	*			trans	-45.6	164.2	-167.8	-80	179.2	1.9	0	0	120.9	E2429 K2430	Q1698-E2429 HydrophobicContact CG-CG 3.88Å; Q1698-E2429 WeakPolarHBondContact CG-OE1 3.29Å; Q1698-E2429 WeakPolarHBondContact CG-OE2 3.28Å; Q1698-E2429 PolarHBondContact NE2-OE2 3.27Å; Q1698-K2430 PolarHBondContact O-NZ 3.33Å
1699	N	28.1	Very low	28.3	Very low	121 Å²	121	126.7 Å²	126.7	65%	0.647	67%	0.666	S	S	*	*			trans	59	-174.9	147.8	-65	-30.4	0	0	0	119.6	K2430	N1699-K2430 PolarHBondContact O-NZ 2.87Å
1700	A	27.3	Very low	28.1	Very low	85 Å²	85	121 Å²	121	70%	0.702	66%	0.657	S	S	*	*			trans	59.7	100.9	175.2	0	0	0	0	0	117.4
1701	T	25.4	Very low	27.7	Very low	130 Å²	130	118.5 Å²	118.5	80%	0.798	66%	0.658	S	S	*	*				73.7	102.4	73.1	63.1	0	0	0	0	117.3
1702	V	31.4	Very low	27.4	Very low	138 Å²	138	118 Å²	118	84%	0.836	67%	0.665	S	S	*	*			trans	2.7	130.2	130.6	-164.6	0	0	0	0	114.2
1703	P	31	Very low	27.3	Very low	120 Å²	120	119.7 Å²	119.7	78%	0.779	68%	0.677	S	S	*	*				-152.9	178.6	65.1	43.8	-23.5	0	0	0	120.2
1704	S	29.5	Very low	27.2	Very low	100 Å²	100	115 Å²	115	70%	0.699	67%	0.673	S	S	*	*			trans	-61	153.7	173.1	55.1	0	0	0	0	116.8
1705	I	26.4	Very low	27.3	Very low	165 Å²	165	116.8 Å²	116.8	85%	0.846	69%	0.686	S	S	*	*			trans	-161.7	145.9	136.8	-95.9	145.2	0	0	0	106.4
1706	S	27.9	Very low	27.2	Very low	81 Å²	81	120.9 Å²	120.9	57%	0.566	70%	0.7	S	S	*	*			cis	166.9	169.9	-43.6	56.5	0	0	0	0	107.9
1707	T	27.1	Very low	27.8	Very low	101 Å²	101	121.3 Å²	121.3	62%	0.62	71%	0.708	S	S	*	*			trans	68.7	105	149.8	44.1	0	0	0	0	122.1
1708	Q	25.9	Very low	27.7	Very low	165 Å²	165	122.7 Å²	122.7	77%	0.771	72%	0.72	S	S	*	*				71.4	163.9	128.9	-57.1	167.9	16.3	0	0	117.8
1709	L	24.6	Very low	27.8	Very low	135 Å²	135	124.7 Å²	124.7	71%	0.707	73%	0.729	S	S	*	*			cis	-116.8	140.4	-6.2	-82.7	85.1	0	0	0	107.8
1710	S	25.8	Very low	27.8	Very low	89 Å²	89	126.5 Å²	126.5	62%	0.622	74%	0.737	S	S	*	*			cis	80.1	149.7	49.5	93	0	0	0	0	115.2
1711	L	24.7	Very low	27.8	Very low	150 Å²	150	130.1 Å²	130.1	79%	0.785	74%	0.74	S	S	*	*			trans	79	140.6	176.7	-57.9	155.5	0	0	0	117.4
1712	S	26	Very low	28.5	Very low	84 Å²	84	129.4 Å²	129.4	59%	0.587	74%	0.737	S	S	*	*			cis	-179	134.2	-34	43.2	0	0	0	0	111.6
1713	S	26	Very low	28.1	Very low	113 Å²	113	130.5 Å²	130.5	79%	0.79	74%	0.735	S	S	*	*			trans	64	167.6	153.4	77.9	0	0	0	0	116.6
1714	S	26.7	Very low	28	Very low	94 Å²	94	132 Å²	132	66%	0.657	73%	0.731	S	S	*	*			cis	-160.8	167	16.8	-154.4	0	0	0	0	113.1
1715	L	27.7	Very low	27.7	Very low	152 Å²	152	132.1 Å²	132.1	80%	0.796	73%	0.732	S	S	*	*			trans	69.3	145.6	161.9	-62.6	146.4	0	0	0	118.8
1716	K	28.9	Very low	27.8	Very low	197 Å²	197	129.9 Å²	129.9	86%	0.857	73%	0.731	S	S	*	*				-164.3	164.4	-58.1	-111.9	-171.5	174.6	-173.4	0	110.6
1717	P	39.2	Very low	27.7	Very low	111 Å²	111	132.3 Å²	132.3	72%	0.721	74%	0.742	S	S	*	*			trans	-113	168.6	-165.6	42.1	-36.3	0	0	0	117.1
1718	V	25.7	Very low	27.6	Very low	133 Å²	133	136.2 Å²	136.2	81%	0.806	75%	0.753	S	S	*	*			trans	-150.2	137.4	156.3	-178.3	0	0	0	0	107.8
1719	H	28.3	Very low	27.6	Very low	154 Å²	154	137.5 Å²	137.5	71%	0.713	76%	0.759	S	S	*	*			cis	113.9	67.8	-2.1	-160.1	-62.4	0	0	0	117.8
1720	I	28.3	Very low	27.5	Very low	159 Å²	159	139.4 Å²	139.4	82%	0.815	77%	0.769	S	S	*	*			trans	-134.9	103	161.9	-77.7	159.4	0	0	0	106.3
1721	Q	28.1	Very low	27.7	Very low	162 Å²	162	141.8 Å²	141.8	76%	0.757	78%	0.775	S	S	*	*				88.3	148.8	74.5	-78.7	-161.1	-4.3	0	0	114.7
1722	P	39.5	Very low	27.8	Very low	115 Å²	115	143.5 Å²	143.5	75%	0.747	78%	0.779	S	S	*	*			trans	-125.9	-148.2	-138.5	45.4	-31.8	0	0	0	114.4
1723	M	23.8	Very low	28.5	Very low	161 Å²	161	145.8 Å²	145.8	79%	0.793	78%	0.775	S	S	*	*			trans	105.1	139.6	174	-60.4	-165.7	158.7	0	0	114.5
1724	H	27.4	Very low	29.2	Very low	152 Å²	152	146.5 Å²	146.5	70%	0.704	77%	0.774	S	S	*	*			cis	-159.1	156.6	-16.2	-122.2	-60.2	0	0	0	110.6
1725	S	24.6	Very low	30.4	Very low	102 Å²	102	145.7 Å²	145.7	71%	0.713	76%	0.762	S	S	*	*			trans	18	131.1	152.8	56.7	0	0	0	0	119.8
1726	S	27	Very low	31.4	Very low	118 Å²	118	142 Å²	142	83%	0.825	75%	0.749	S	S	*	*				-126	167.3	64.2	48.5	0	0	0	0	115.9
1727	V	26.3	Very low	32.1	Very low	132 Å²	132	136.1 Å²	136.1	80%	0.8	73%	0.726	S	S	*	*			trans	-102.9	132	177	174.9	0	0	0	0	108.9
1728	E	25.8	Very low	32.5	Very low	183 Å²	183	136 Å²	136	86%	0.855	71%	0.714	S	S	*	*			trans	-148.8	165.6	155.7	-112.8	154.7	-163	0	0	108.4
1729	E	25.4	Very low	33.6	Very low	191 Å²	191	135.3 Å²	135.3	89%	0.893	70%	0.701	S	S	*	*			trans	-77.9	154.4	-137.9	-66.3	177.4	106.9	0	0	117.5
1730	L	23.7	Very low	35	Very low	175 Å²	175	128.7 Å²	128.7	92%	0.916	67%	0.67	S	S	*	*			trans	-68.7	127.5	164.1	-96.6	68.3	0	0	0	109.7
1731	D	28.8	Very low	36.5	Very low	139 Å²	139	123.8 Å²	123.8	74%	0.743	65%	0.646	S	S	*	*			trans	-110.9	137.9	159	-166.1	3.7	0	0	0	110.2	R1733	D1731-R1733 PolarHBondContact O-N 3.17Å; D1731-R1733 VanDerWaalsContact O-N 3.13Å
1732	E	27.8	Very low	37.8	Very low	186 Å²	186	123.2 Å²	123.2	87%	0.869	64%	0.643	S	S	*	*	S	Bend	trans	-95.9	28.9	-141.5	-152	175.2	-149.7	0	0	113.8
1733	R	39.9	Very low	38.5	Very low	133 Å²	133	122.1 Å²	122.1	50%	0.502	63%	0.631	S	S	.	*			trans	-113.2	-9	-157.1	-73.3	-172.2	169.6	-134.8	-0.9	118.9	D1054 S1056 D1731	D1054-R1733 IonicContact OD2-NH1 2.66Å; D1054-R1733 PolarHBondContact OD2-NH1 3.37Å; S1056-R1733 PolarHBondContact OG-NH1 2.93Å; S1056-R1733 PolarHBondContact OG-NH2 3.19Å; D1731-R1733 PolarHBondContact O-N 3.17Å; D1731-R1733 VanDerWaalsContact O-N 3.13Å
1734	T	41.4	Very low	39.8	Very low	127 Å²	127	116.3 Å²	116.3	78%	0.779	61%	0.612	S	S	*	*			trans	-120.7	106.7	-165.4	-42.4	0	0	0	0	114.8
1735	I	50.3	Low	41.2	Very low	77 Å²	77	110.4 Å²	110.4	40%	0.395	58%	0.584	S	S	.	*			trans	-95.3	116.8	160.2	-50.4	175.8	0	0	0	107.4	L1566 K1739 L1740	L1566-I1735 HydrophobicContact CD1-CD1 3.6Å; I1735-K1739 HydrophobicContact CG2-CB 3.97Å; I1735-K1739 HydrophobicContact CG2-CG 4.11Å; I1735-L1740 HydrophobicContact CB-CG 4.4Å; I1735-L1740 HydrophobicContact CG2-CD2 4.07Å; I1735-L1740 HydrophobicContact CG2-CG 3.82Å
1736	S	49.3	Very low	42.7	Very low	75 Å²	75	112 Å²	112	52%	0.524	59%	0.585	S	S	.	*			trans	-63.5	153	178.3	-63.7	0	0	0	0	112.1	K1738 K1739 L1740	S1736-K1738 PolarHBondContact O-N 3.04Å; S1736-K1739 CarbonylContact O-C 3.58Å; S1736-K1739 WeakPolarHBondContact O-CA 3.44Å; S1736-K1739 WeakPolarHBondContact O-CB 3.45Å; S1736-K1739 PolarHBondContact O-N 3.05Å; S1736-L1740 PolarHBondContact O-N 3.24Å
1737	L	43.9	Very low	44.1	Very low	73 Å²	73	107.4 Å²	107.4	38%	0.382	56%	0.556	S	S	.	*	H	α-helix	trans	-55.3	-52.5	179.8	-162.1	78.2	0	0	0	111.9	I1680 K1739 L1740 D1741	I1680-L1737 HydrophobicContact CD1-CD2 4.26Å; L1737-K1739 PolarHBondContact O-N 3.4Å; L1737-L1740 WeakPolarHBondContact O-CA 3.42Å; L1737-L1740 WeakPolarHBondContact O-CB 3.33Å; L1737-L1740 PolarHBondContact O-N 3Å; L1737-D1741 PolarHBondContact O-N 3.2Å; L1737-D1741 VanDerWaalsContact O-OD2 3.07Å
1738	K	47.4	Very low	45.5	Very low	108 Å²	108	105.4 Å²	105.4	47%	0.47	55%	0.545	S	S	.	.	H	α-helix	trans	-52.5	-29.8	172.7	-78.2	-164.8	174.5	-65.8	0	113.7	D1678 S1736 E1742	D1678-K1738 IonicContact OD1-NZ 2.69Å; D1678-K1738 PolarHBondContact OD1-NZ 3.07Å; D1678-K1738 IonicContact OD2-NZ 2.71Å; D1678-K1738 PolarHBondContact OD2-NZ 3.3Å; S1736-K1738 PolarHBondContact O-N 3.04Å; K1738-E1742 VanDerWaalsContact O-CB 3.25Å; K1738-E1742 WeakPolarHBondContact O-CB 3.08Å; K1738-E1742 WeakPolarHBondContact O-CG 3.26Å; K1738-E1742 PolarHBondContact O-N 2.82Å
1739	K	49.6	Very low	47.3	Very low	119 Å²	119	100.8 Å²	100.8	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-82.8	-21.1	177.6	-164.5	164.9	-173	175.6	0	113.5	I1735 S1736 L1737 L1743	I1735-K1739 HydrophobicContact CG2-CB 3.97Å; I1735-K1739 HydrophobicContact CG2-CG 4.11Å; S1736-K1739 CarbonylContact O-C 3.58Å; S1736-K1739 WeakPolarHBondContact O-CA 3.44Å; S1736-K1739 WeakPolarHBondContact O-CB 3.45Å; S1736-K1739 PolarHBondContact O-N 3.05Å; L1737-K1739 PolarHBondContact O-N 3.4Å; K1739-L1743 WeakPolarHBondContact O-CB 3.36Å; K1739-L1743 VanDerWaalsContact O-CD1 3.29Å; K1739-L1743 WeakPolarHBondContact O-CD1 3.18Å; K1739-L1743 WeakPolarHBondContact O-CG 3.26Å; K1739-L1743 PolarHBondContact O-N 3.37Å
1740	L	57.2	Low	49.4	Very low	15 Å²	15	92.8 Å²	92.8	8%	0.079	49%	0.487	C	S	.	.	H	α-helix	trans	-77.4	-37.5	165.9	-75	166.9	0	0	0	110.9	I1562 I1735 S1736 L1737 L1743 G1744 Y1745	I1562-L1740 HydrophobicContact CD1-CD1 4.19Å; I1562-L1740 HydrophobicContact CG2-CD2 3.83Å; I1735-L1740 HydrophobicContact CB-CG 4.4Å; I1735-L1740 HydrophobicContact CG2-CD2 4.07Å; I1735-L1740 HydrophobicContact CG2-CG 3.82Å; S1736-L1740 PolarHBondContact O-N 3.24Å; L1737-L1740 WeakPolarHBondContact O-CA 3.42Å; L1737-L1740 WeakPolarHBondContact O-CB 3.33Å; L1737-L1740 PolarHBondContact O-N 3Å; L1740-L1743 CarbonylContact O-C 3.6Å; L1740-L1743 PolarHBondContact O-N 2.8Å; L1740-G1744 PolarHBondContact O-N 3.14Å; L1740-G1744 VanDerWaalsContact O-N 3.11Å; L1740-Y1745 WeakPolarHBondContact O-CB 3.49Å; L1740-Y1745 PolarHBondContact O-N 2.92Å
1741	D	59.1	Low	51.7	Low	57 Å²	57	88 Å²	88	31%	0.305	47%	0.465	S	S	.	.	H	α-helix	trans	-68.2	-43.8	174.5	-57.6	-44.5	0	0	0	111.1	L1737 L1743 G1744	L1737-D1741 PolarHBondContact O-N 3.2Å; L1737-D1741 VanDerWaalsContact O-OD2 3.07Å; D1741-L1743 PolarHBondContact O-N 3.24Å; D1741-G1744 WeakPolarHBondContact O-CA 3.35Å; D1741-G1744 PolarHBondContact O-N 2.99Å
1742	E	56	Low	54.1	Low	150 Å²	150	82 Å²	82	70%	0.701	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.6	168.5	-77.6	162.7	-168.9	0	0	113	K1738 G1744	K1738-E1742 VanDerWaalsContact O-CB 3.25Å; K1738-E1742 WeakPolarHBondContact O-CB 3.08Å; K1738-E1742 WeakPolarHBondContact O-CG 3.26Å; K1738-E1742 PolarHBondContact O-N 2.82Å; E1742-G1744 VanDerWaalsContact C-N 3.34Å
1743	L	53.6	Low	56.7	Low	92 Å²	92	74.2 Å²	74.2	48%	0.482	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	4.2	174	-73.5	171.7	0	0	0	113	L1566 K1739 L1740 D1741	L1566-L1743 HydrophobicContact CD2-CD1 4.22Å; K1739-L1743 WeakPolarHBondContact O-CB 3.36Å; K1739-L1743 VanDerWaalsContact O-CD1 3.29Å; K1739-L1743 WeakPolarHBondContact O-CD1 3.18Å; K1739-L1743 WeakPolarHBondContact O-CG 3.26Å; K1739-L1743 PolarHBondContact O-N 3.37Å; L1740-L1743 CarbonylContact O-C 3.6Å; L1740-L1743 PolarHBondContact O-N 2.8Å; D1741-L1743 PolarHBondContact O-N 3.24Å
1744	G	51.5	Low	58.8	Low	39 Å²	39	69.5 Å²	69.5	40%	0.402	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	26.1	174.8	0	0	0	0	0	115.2	L1740 D1741 E1742 N1746	L1740-G1744 PolarHBondContact O-N 3.14Å; L1740-G1744 VanDerWaalsContact O-N 3.11Å; D1741-G1744 WeakPolarHBondContact O-CA 3.35Å; D1741-G1744 PolarHBondContact O-N 2.99Å; E1742-G1744 VanDerWaalsContact C-N 3.34Å; G1744-N1746 PolarHBondContact O-N 3.33Å
1745	Y	57	Low	61.1	Low	28 Å²	28	68 Å²	68	11%	0.11	38%	0.378	C	S	.	.			trans	-73.7	65.3	-179.6	-175.3	-112.8	0	0	0	113.4	I1562 F1565 L1740 G1747	I1562-Y1745 HydrophobicContact CD1-CE1 4.32Å; I1562-Y1745 HydrophobicContact CG1-CD1 4.3Å; I1562-Y1745 HydrophobicContact CG1-CE1 3.6Å; I1562-Y1745 HydrophobicContact CG1-CE2 4.33Å; F1565-Y1745 HydrophobicContact CB-CD2 3.98Å; F1565-Y1745 HydrophobicContact CB-CE2 3.84Å; F1565-Y1745 AromaticContact CD1-CD2 3.5Å; F1565-Y1745 HydrophobicContact CD1-CD2 3.5Å; F1565-Y1745 VanDerWaalsContact CD1-CD2 3.5Å; F1565-Y1745 HydrophobicContact CD1-CE2 4.23Å; F1565-Y1745 HydrophobicContact CD1-CG 4.33Å; F1565-Y1745 AromaticContact CD2-CD2 3.88Å; F1565-Y1745 HydrophobicContact CD2-CD2 3.88Å; F1565-Y1745 HydrophobicContact CD2-CE2 4.31Å; F1565-Y1745 AromaticContact CE1-CD2 3.84Å; F1565-Y1745 HydrophobicContact CE1-CD2 3.84Å; F1565-Y1745 HydrophobicContact CE1-CG 4.37Å; F1565-Y1745 HydrophobicContact CE2-CD2 4.19Å; F1565-Y1745 AromaticContact CG-CD2 3.52Å; F1565-Y1745 HydrophobicContact CG-CD2 3.52Å; F1565-Y1745 AromaticContact CG-CE2 3.89Å; F1565-Y1745 HydrophobicContact CG-CE2 3.89Å; F1565-Y1745 HydrophobicContact CZ-CD2 4.16Å; L1740-Y1745 WeakPolarHBondContact O-CB 3.49Å; L1740-Y1745 PolarHBondContact O-N 2.92Å; Y1745-G1747 PolarHBondContact O-N 3.39Å
1746	N	56.1	Low	62.8	Low	136 Å²	136	69.1 Å²	69.1	73%	0.727	38%	0.38	S	S	*	.			trans	-78.9	35.9	167.5	-70	-59.5	0	0	0	112.1	G1744	G1744-N1746 PolarHBondContact O-N 3.33Å
1747	G	55.5	Low	64.8	Low	21 Å²	21	65.5 Å²	65.5	22%	0.216	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-72.6	143.8	-178.2	0	0	0	0	0	112	Y1745 R1749	Y1745-G1747 PolarHBondContact O-N 3.39Å; G1747-R1749 PolarHBondContact O-N 2.98Å
1748	P	55.3	Low	67.1	Low	89 Å²	89	65.3 Å²	65.3	58%	0.578	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-61.2	124.1	171.1	26.9	-33.3	0	0	0	109.2	P1683	P1683-P1748 HydrophobicContact CB-CB 4.11Å
1749	R	64.3	Low	69.2	Low	86 Å²	86	63.1 Å²	63.1	33%	0.325	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-58.9	145	175.1	-66.2	-172.1	-168.6	149.5	10.8	109.6	G1747 T1751	G1747-R1749 PolarHBondContact O-N 2.98Å; R1749-T1751 PolarHBondContact O-N 3.14Å
1750	A	69.4	Low	71.3	Confident	24 Å²	24	57.6 Å²	57.6	20%	0.198	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-59.8	131.9	175.9	0	0	0	0	0	110	C1551	C1551-A1750 HydrophobicContact CB-CB 4.13Å; C1551-A1750 WeakPolarHBondContact CB-O 3.34Å; C1551-A1750 PolarHBondContact N-O 3.35Å; C1551-A1750 PolarHBondContact SG-O 2.03Å
1751	T	72.1	Confident	73	Confident	75 Å²	75	56.9 Å²	56.9	46%	0.46	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-77.8	133.6	171.9	55.2	0	0	0	0	109.5	H1547 C1551 R1749	H1547-T1751 HydrophobicContact CB-CG2 4.14Å; C1551-T1751 VanDerWaalsContact SG-C 3.58Å; R1749-T1751 PolarHBondContact O-N 3.14Å
1752	C	80.5	Confident	74.6	Confident	13 Å²	13	56.3 Å²	56.3	9%	0.088	32%	0.315	C	S	.	.			trans	-114.2	179	177.3	-95.7	0	0	0	0	110.6	K1501 I1502 V1549 C1551	K1501-C1752 PolarHBondContact O-SG 3.31Å; I1502-C1752 HydrophobicContact CG1-CB 4.14Å; V1549-C1752 HydrophobicContact CG1-CB 4.4Å; V1549-C1752 WeakPolarHBondContact CG1-O 3.33Å; V1549-C1752 PolarHBondContact O-N 3.44Å; C1551-C1752 WeakPolarHBondContact CA-SG 3.1Å; C1551-C1752 HydrophobicContact CB-CB 4.01Å; C1551-C1752 WeakPolarHBondContact CB-SG 3.21Å; C1551-C1752 WeakPolarHBondContact SG-CB 3.24Å; C1551-C1752 CovalentContact SG-SG 2.04Å; C1551-C1752 PolarHBondContact SG-SG 3.19Å
1753	G	80.4	Confident	76.2	Confident	22 Å²	22	51.4 Å²	51.4	23%	0.227	30%	0.297	C	S	.	.			trans	95.7	178.3	-175.1	0	0	0	0	0	113.4	C1543	C1543-G1753 CarbonylContact O-C 3.41Å; C1543-G1753 WeakPolarHBondContact O-CA 3.44Å
1754	S	85.7	Confident	78.1	Confident	33 Å²	33	47 Å²	47	23%	0.231	27%	0.274	C	S	.	.			trans	-160.1	137.9	-178.2	-171.8	0	0	0	0	111.6	C1543 F1756 A1757	C1543-S1754 PolarHBondContact O-N 3.49Å; C1543-S1754 VanDerWaalsContact O-O 3.13Å; S1754-F1756 PolarHBondContact O-N 2.75Å; S1754-F1756 PolarHBondContact OG-N 2.71Å; S1754-A1757 VanDerWaalsContact O-CB 3.32Å; S1754-A1757 WeakPolarHBondContact O-CB 3.26Å; S1754-A1757 PolarHBondContact O-N 3.39Å
1755	N	88.3	Confident	80	Confident	97 Å²	97	45.5 Å²	45.5	52%	0.519	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-5	173.3	-61.6	5.8	0	0	0	113.1	N1545 A1757	N1545-N1755 WeakPolarHBondContact CB-OD1 3.4Å; N1545-N1755 PolarHBondContact N-OD1 3.14Å; N1755-A1757 PolarHBondContact O-N 2.84Å
1756	F	87.3	Confident	81.3	Confident	99 Å²	99	47.3 Å²	47.3	43%	0.434	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-12.2	165.4	-167.7	-105.4	0	0	0	113.4	M1498 S1754 Y1758 P1759 Y1760	M1498-F1756 HydrophobicContact CE-CB 4.34Å; M1498-F1756 HydrophobicContact CE-CD1 4.27Å; S1754-F1756 PolarHBondContact O-N 2.75Å; S1754-F1756 PolarHBondContact OG-N 2.71Å; F1756-Y1758 PolarHBondContact O-N 2.83Å; F1756-P1759 HydrophobicContact CD2-CG 3.93Å; F1756-P1759 HydrophobicContact CE2-CG 4.24Å; F1756-P1759 HydrophobicContact CG-CG 4.43Å; F1756-P1759 VanDerWaalsContact O-CD 3.26Å; F1756-P1759 WeakPolarHBondContact O-CD 3.37Å; F1756-P1759 WeakPolarHBondContact O-CG 3.44Å; F1756-Y1760 HydrophobicContact CE1-CD2 4.37Å; F1756-Y1760 WeakPolarHBondContact O-CB 3.42Å; F1756-Y1760 PolarHBondContact O-N 3.09Å
1757	A	91.2	Very high	82.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-54.3	-47.3	173.3	0	0	0	0	0	112.5	F1499 M1540 C1543 V1544 S1754 N1755 Y1760 F1761	F1499-A1757 HydrophobicContact CE1-CB 4.25Å; F1499-A1757 HydrophobicContact CZ-CB 4.09Å; M1540-A1757 HydrophobicContact CG-CB 4.36Å; C1543-A1757 HydrophobicContact CB-CB 3.76Å; V1544-A1757 HydrophobicContact CG2-CB 4.43Å; S1754-A1757 VanDerWaalsContact O-CB 3.32Å; S1754-A1757 WeakPolarHBondContact O-CB 3.26Å; S1754-A1757 PolarHBondContact O-N 3.39Å; N1755-A1757 PolarHBondContact O-N 2.84Å; A1757-Y1760 PolarHBondContact O-N 3.3Å; A1757-F1761 HydrophobicContact CB-CD2 4.37Å; A1757-F1761 HydrophobicContact CB-CE2 4.49Å; A1757-F1761 WeakPolarHBondContact O-CD2 3.48Å; A1757-F1761 PolarHBondContact O-N 3.25Å
1758	Y	91.4	Very high	84.3	Confident	68 Å²	68	42.6 Å²	42.6	27%	0.267	24%	0.238	S	C	.	.	H	α-helix	trans	-53.7	-59.8	179.6	-60.6	-72.4	0	0	0	113	L1236 M1540 L1541 V1544 F1756 Y1760 I1762	L1236-Y1758 HydrophobicContact CD1-CD1 4.43Å; L1236-Y1758 HydrophobicContact CD2-CD1 3.67Å; L1236-Y1758 HydrophobicContact CD2-CE1 3.56Å; M1540-Y1758 HydrophobicContact CE-CD1 3.82Å; M1540-Y1758 HydrophobicContact CE-CE1 3.98Å; M1540-Y1758 HydrophobicContact CG-CD1 4.15Å; M1540-Y1758 HydrophobicContact SD-CD1 3.58Å; M1540-Y1758 VanDerWaalsContact SD-CD1 3.58Å; M1540-Y1758 HydrophobicContact SD-CE1 4.28Å; M1540-Y1758 HydrophobicContact SD-CG 4.4Å; L1541-Y1758 HydrophobicContact CD2-CE1 4.38Å; V1544-Y1758 HydrophobicContact CG1-CE2 4.24Å; V1544-Y1758 HydrophobicContact CG2-CD2 4.43Å; V1544-Y1758 HydrophobicContact CG2-CE1 4.22Å; V1544-Y1758 HydrophobicContact CG2-CE2 3.72Å; F1756-Y1758 PolarHBondContact O-N 2.83Å; Y1758-Y1760 VanDerWaalsContact C-N 3.31Å; Y1758-Y1760 PolarHBondContact O-N 3.01Å; Y1758-I1762 WeakPolarHBondContact O-CB 3.34Å; Y1758-I1762 VanDerWaalsContact O-CD1 3.3Å; Y1758-I1762 WeakPolarHBondContact O-CD1 3.1Å; Y1758-I1762 WeakPolarHBondContact O-CG1 2.96Å; Y1758-I1762 PolarHBondContact O-N 3.24Å; Y1758-I1762 VanDerWaalsContact O-N 3.16Å
1759	P	91.4	Very high	85.6	Confident	63 Å²	63	38.7 Å²	38.7	41%	0.409	21%	0.214	S	C	.	.	H	α-helix	trans	-66.2	-30.3	177.4	26.2	-35	0	0	0	113.1	F1756 S1763	F1756-P1759 HydrophobicContact CD2-CG 3.93Å; F1756-P1759 HydrophobicContact CE2-CG 4.24Å; F1756-P1759 HydrophobicContact CG-CG 4.43Å; F1756-P1759 VanDerWaalsContact O-CD 3.26Å; F1756-P1759 WeakPolarHBondContact O-CD 3.37Å; F1756-P1759 WeakPolarHBondContact O-CG 3.44Å; P1759-S1763 WeakPolarHBondContact O-CB 3.26Å; P1759-S1763 PolarHBondContact O-N 2.91Å; P1759-S1763 PolarHBondContact O-OG 3.35Å
1760	Y	93.2	Very high	86.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-53.7	178.2	172.5	-90.5	0	0	0	111.9	Y1491 I1494 G1495 F1499 L1527 F1756 A1757 Y1758 S1763 F1764	Y1491-Y1760 AromaticContact CD1-CD2 3.92Å; Y1491-Y1760 HydrophobicContact CD1-CD2 3.92Å; Y1491-Y1760 AromaticContact CD1-CE2 3.61Å; Y1491-Y1760 HydrophobicContact CD1-CE2 3.61Å; Y1491-Y1760 HydrophobicContact CE1-CD2 4.29Å; Y1491-Y1760 HydrophobicContact CE1-CE2 4.42Å; Y1491-Y1760 HydrophobicContact CG-CE2 4.45Å; Y1491-Y1760 PolarHBondContact O-OH 3.35Å; I1494-Y1760 HydrophobicContact CB-CE2 4.04Å; I1494-Y1760 HydrophobicContact CG2-CD2 3.85Å; I1494-Y1760 HydrophobicContact CG2-CE2 3.66Å; G1495-Y1760 WeakPolarHBondContact CA-OH 3.49Å; F1499-Y1760 AromaticContact CE2-CD1 3.84Å; F1499-Y1760 HydrophobicContact CE2-CD1 3.84Å; F1499-Y1760 HydrophobicContact CE2-CD2 4.5Å; F1499-Y1760 AromaticContact CE2-CE1 3.94Å; F1499-Y1760 HydrophobicContact CE2-CE1 3.94Å; F1499-Y1760 HydrophobicContact CE2-CG 4.13Å; F1499-Y1760 HydrophobicContact CZ-CD1 4.48Å; L1527-Y1760 HydrophobicContact CD2-CE1 4.28Å; F1756-Y1760 HydrophobicContact CE1-CD2 4.37Å; F1756-Y1760 WeakPolarHBondContact O-CB 3.42Å; F1756-Y1760 PolarHBondContact O-N 3.09Å; A1757-Y1760 PolarHBondContact O-N 3.3Å; Y1758-Y1760 VanDerWaalsContact C-N 3.31Å; Y1758-Y1760 PolarHBondContact O-N 3.01Å; Y1760-S1763 PolarHBondContact O-OG 3.38Å; Y1760-F1764 VanDerWaalsContact O-CB 3.26Å; Y1760-F1764 WeakPolarHBondContact O-CB 3.21Å; Y1760-F1764 PolarHBondContact O-N 3.46Å
1761	F	93.9	Very high	86.8	Confident	1 Å²	1	35.1 Å²	35.1	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-71.1	-43.2	-178.1	-76.2	-78.1	0	0	0	112.2	F1499 F1517 W1536 I1539 M1540 C1543 A1757 S1763 F1764 Y1765	F1499-F1761 HydrophobicContact CE2-CE2 4.42Å; F1517-F1761 HydrophobicContact CE2-CZ 4.17Å; F1517-F1761 HydrophobicContact CZ-CE1 4.4Å; F1517-F1761 AromaticContact CZ-CZ 3.88Å; F1517-F1761 HydrophobicContact CZ-CZ 3.88Å; W1536-F1761 HydrophobicContact CE3-CB 3.93Å; W1536-F1761 HydrophobicContact CZ3-CB 4.15Å; I1539-F1761 HydrophobicContact CG2-CE1 3.77Å; I1539-F1761 HydrophobicContact CG2-CE2 4.44Å; I1539-F1761 HydrophobicContact CG2-CZ 3.55Å; M1540-F1761 HydrophobicContact CB-CB 4.04Å; M1540-F1761 HydrophobicContact CB-CD2 3.56Å; M1540-F1761 HydrophobicContact CB-CE2 4.23Å; M1540-F1761 HydrophobicContact CB-CG 3.86Å; M1540-F1761 HydrophobicContact CG-CB 4.18Å; M1540-F1761 HydrophobicContact CG-CD2 3.88Å; M1540-F1761 HydrophobicContact CG-CG 4.33Å; M1540-F1761 HydrophobicContact SD-CB 4.38Å; C1543-F1761 HydrophobicContact CB-CE2 4.21Å; A1757-F1761 HydrophobicContact CB-CD2 4.37Å; A1757-F1761 HydrophobicContact CB-CE2 4.49Å; A1757-F1761 WeakPolarHBondContact O-CD2 3.48Å; A1757-F1761 PolarHBondContact O-N 3.25Å; F1761-S1763 PolarHBondContact O-N 2.87Å; F1761-F1764 PolarHBondContact O-N 3.12Å; F1761-Y1765 WeakPolarHBondContact O-CB 3.45Å; F1761-Y1765 PolarHBondContact O-N 2.91Å
1762	I	91.6	Very high	87.1	Confident	44 Å²	44	32.6 Å²	32.6	23%	0.226	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-41.7	179.1	-62.2	166.1	0	0	0	111.3	L1236 F1239 W1536 Y1758 M1766	L1236-I1762 HydrophobicContact CD1-CD1 3.61Å; F1239-I1762 HydrophobicContact CD1-CG1 4.4Å; F1239-I1762 HydrophobicContact CD1-CG2 4.49Å; F1239-I1762 HydrophobicContact CE1-CB 4.47Å; F1239-I1762 HydrophobicContact CE1-CG1 4.17Å; F1239-I1762 HydrophobicContact CE1-CG2 3.95Å; F1239-I1762 HydrophobicContact CZ-CG2 3.98Å; W1536-I1762 HydrophobicContact CH2-CG1 4.21Å; W1536-I1762 HydrophobicContact CZ3-CG1 4.19Å; Y1758-I1762 WeakPolarHBondContact O-CB 3.34Å; Y1758-I1762 VanDerWaalsContact O-CD1 3.3Å; Y1758-I1762 WeakPolarHBondContact O-CD1 3.1Å; Y1758-I1762 WeakPolarHBondContact O-CG1 2.96Å; Y1758-I1762 PolarHBondContact O-N 3.24Å; Y1758-I1762 VanDerWaalsContact O-N 3.16Å; I1762-M1766 WeakPolarHBondContact O-CB 3.36Å; I1762-M1766 WeakPolarHBondContact O-CG 3.11Å; I1762-M1766 PolarHBondContact O-N 3.48Å
1763	S	91.1	Very high	86.7	Confident	48 Å²	48	32 Å²	32	34%	0.336	18%	0.175	S	C	.	.	H	α-helix	trans	-76	-33.4	178.1	69.3	0	0	0	0	113.3	Y1491 P1759 Y1760 F1761 V1767	Y1491-S1763 PolarHBondContact OH-OG 3.26Å; P1759-S1763 WeakPolarHBondContact O-CB 3.26Å; P1759-S1763 PolarHBondContact O-N 2.91Å; P1759-S1763 PolarHBondContact O-OG 3.35Å; Y1760-S1763 PolarHBondContact O-OG 3.38Å; F1761-S1763 PolarHBondContact O-N 2.87Å; S1763-V1767 WeakPolarHBondContact O-CB 3.34Å; S1763-V1767 VanDerWaalsContact O-CG2 3.25Å; S1763-V1767 WeakPolarHBondContact O-CG2 3.01Å; S1763-V1767 PolarHBondContact O-N 3.34Å
1764	F	93.3	Very high	86.1	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-53.2	168.2	174.3	-106	0	0	0	109.8	L1487 F1488 Y1491 L1527 A1531 Y1760 F1761 V1767 C1768	L1487-F1764 HydrophobicContact CD2-CE2 4.39Å; F1488-F1764 HydrophobicContact CD2-CE2 4.29Å; F1488-F1764 HydrophobicContact CD2-CZ 4.49Å; F1488-F1764 HydrophobicContact CE1-CZ 4.09Å; F1488-F1764 HydrophobicContact CE2-CE2 4.26Å; F1488-F1764 HydrophobicContact CE2-CZ 4.08Å; F1488-F1764 HydrophobicContact CZ-CE2 4.48Å; F1488-F1764 AromaticContact CZ-CZ 3.89Å; F1488-F1764 HydrophobicContact CZ-CZ 3.89Å; Y1491-F1764 HydrophobicContact CD1-CB 3.73Å; Y1491-F1764 AromaticContact CD1-CD2 3.86Å; Y1491-F1764 HydrophobicContact CD1-CD2 3.86Å; Y1491-F1764 HydrophobicContact CD1-CG 4.2Å; Y1491-F1764 HydrophobicContact CD2-CD2 4.03Å; Y1491-F1764 HydrophobicContact CE1-CB 3.61Å; Y1491-F1764 HydrophobicContact CE1-CD2 4.32Å; Y1491-F1764 HydrophobicContact CE1-CG 4.46Å; Y1491-F1764 HydrophobicContact CE2-CD2 4.46Å; Y1491-F1764 HydrophobicContact CG-CB 4.43Å; Y1491-F1764 AromaticContact CG-CD2 3.69Å; Y1491-F1764 HydrophobicContact CG-CD2 3.69Å; Y1491-F1764 HydrophobicContact CG-CG 4.48Å; L1527-F1764 HydrophobicContact CB-CE1 4.31Å; L1527-F1764 HydrophobicContact CB-CE2 4.3Å; L1527-F1764 HydrophobicContact CB-CZ 3.86Å; L1527-F1764 HydrophobicContact CD2-CD1 3.85Å; L1527-F1764 HydrophobicContact CD2-CD2 3.95Å; L1527-F1764 HydrophobicContact CD2-CE1 3.84Å; L1527-F1764 HydrophobicContact CD2-CE2 3.93Å; L1527-F1764 HydrophobicContact CD2-CG 3.91Å; L1527-F1764 HydrophobicContact CD2-CZ 3.88Å; L1527-F1764 HydrophobicContact CG-CE2 4.5Å; L1527-F1764 HydrophobicContact CG-CZ 4.39Å; L1527-F1764 WeakPolarHBondContact O-CE1 3.27Å; L1527-F1764 WeakPolarHBondContact O-CZ 3.41Å; A1531-F1764 HydrophobicContact CB-CE1 4.15Å; A1531-F1764 HydrophobicContact CB-CZ 4.17Å; Y1760-F1764 VanDerWaalsContact O-CB 3.26Å; Y1760-F1764 WeakPolarHBondContact O-CB 3.21Å; Y1760-F1764 PolarHBondContact O-N 3.46Å; F1761-F1764 PolarHBondContact O-N 3.12Å; F1764-V1767 PolarHBondContact O-N 2.75Å; F1764-C1768 HydrophobicContact CE1-CB 4.37Å; F1764-C1768 HydrophobicContact CE2-CB 4.38Å; F1764-C1768 HydrophobicContact CZ-CB 4.21Å; F1764-C1768 WeakPolarHBondContact O-CB 3.31Å; F1764-C1768 PolarHBondContact O-N 2.8Å
1765	Y	90.4	Very high	85.5	Confident	7 Å²	7	30.8 Å²	30.8	3%	0.027	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-55.2	-174.2	-170.2	-91.8	0	0	0	112.1	S1530 F1761 V1767 C1768 S1769 P2466	S1530-Y1765 WeakPolarHBondContact O-CD2 3.45Å; F1761-Y1765 WeakPolarHBondContact O-CB 3.45Å; F1761-Y1765 PolarHBondContact O-N 2.91Å; Y1765-V1767 VanDerWaalsContact C-N 3.27Å; Y1765-V1767 PolarHBondContact O-N 2.84Å; Y1765-C1768 PolarHBondContact O-N 2.87Å; Y1765-C1768 VanDerWaalsContact O-N 3.13Å; Y1765-S1769 VanDerWaalsContact CE1-OG 3.28Å; Y1765-S1769 WeakPolarHBondContact CE1-OG 3.42Å; Y1765-S1769 WeakPolarHBondContact CE2-OG 2.92Å; Y1765-S1769 PolarHBondContact O-N 3.04Å; Y1765-S1769 PolarHBondContact O-OG 3.42Å; Y1765-S1769 PolarHBondContact OH-OG 2.92Å; Y1765-P2466 HydrophobicContact CD1-CB 4.28Å; Y1765-P2466 HydrophobicContact CD2-CB 4.22Å; Y1765-P2466 HydrophobicContact CD2-CG 3.93Å; Y1765-P2466 HydrophobicContact CE1-CB 3.62Å; Y1765-P2466 HydrophobicContact CE1-CG 4.27Å; Y1765-P2466 VanDerWaalsContact CE1-O 3.26Å; Y1765-P2466 WeakPolarHBondContact CE1-O 3.35Å; Y1765-P2466 HydrophobicContact CE2-CB 3.58Å; Y1765-P2466 HydrophobicContact CE2-CG 3.25Å; Y1765-P2466 VanDerWaalsContact CZ-CG 3.45Å; Y1765-P2466 WeakPolarHBondContact OH-CA 3.35Å; Y1765-P2466 WeakPolarHBondContact OH-CB 3.47Å; Y1765-P2466 VanDerWaalsContact OH-CD 3.29Å; Y1765-P2466 WeakPolarHBondContact OH-CD 3.38Å; Y1765-P2466 PolarHBondContact OH-O 2.93Å
1766	M	85.6	Confident	84.6	Confident	65 Å²	65	27.2 Å²	27.2	32%	0.32	14%	0.141	S	C	.	.	H	α-helix	trans	-57.2	-37.7	-179.6	-74	-70.6	-78	0	0	113.1	F1239 I1762 F1770	F1239-M1766 HydrophobicContact CE2-CG 4.2Å; F1239-M1766 HydrophobicContact CE2-SD 3.81Å; F1239-M1766 HydrophobicContact CZ-CG 3.93Å; F1239-M1766 HydrophobicContact CZ-SD 3.96Å; I1762-M1766 WeakPolarHBondContact O-CB 3.36Å; I1762-M1766 WeakPolarHBondContact O-CG 3.11Å; I1762-M1766 PolarHBondContact O-N 3.48Å; M1766-F1770 VanDerWaalsContact O-CB 3.22Å; M1766-F1770 WeakPolarHBondContact O-CB 3.38Å; M1766-F1770 PolarHBondContact O-N 3.11Å
1767	V	84.8	Confident	83.5	Confident	57 Å²	57	22.6 Å²	22.6	35%	0.345	12%	0.121	S	C	.	.	H	α-helix	trans	-79.2	-36.3	178.4	176.7	0	0	0	0	111.7	L1487 S1763 F1764 Y1765 L1771	L1487-V1767 HydrophobicContact CD1-CG1 3.61Å; L1487-V1767 HydrophobicContact CD2-CG1 4.07Å; S1763-V1767 WeakPolarHBondContact O-CB 3.34Å; S1763-V1767 VanDerWaalsContact O-CG2 3.25Å; S1763-V1767 WeakPolarHBondContact O-CG2 3.01Å; S1763-V1767 PolarHBondContact O-N 3.34Å; F1764-V1767 PolarHBondContact O-N 2.75Å; Y1765-V1767 VanDerWaalsContact C-N 3.27Å; Y1765-V1767 PolarHBondContact O-N 2.84Å; V1767-L1771 HydrophobicContact CG1-CD1 3.89Å; V1767-L1771 WeakPolarHBondContact O-CB 3.06Å; V1767-L1771 WeakPolarHBondContact O-CD1 3.01Å; V1767-L1771 VanDerWaalsContact O-CG 3.3Å; V1767-L1771 WeakPolarHBondContact O-CG 3.09Å; V1767-L1771 PolarHBondContact O-N 3.31Å; V1767-L1771 VanDerWaalsContact O-N 3.07Å
1768	C	88.1	Confident	82.3	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.007	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-54.1	177.3	-172.3	0	0	0	0	110.5	L1487 F1488 A1531 F1764 Y1765 F1770 L1771 I1772	L1487-C1768 HydrophobicContact CD2-CB 4.3Å; F1488-C1768 VanDerWaalsContact CE2-SG 3.58Å; A1531-C1768 VanDerWaalsContact CB-SG 3.58Å; F1764-C1768 HydrophobicContact CE1-CB 4.37Å; F1764-C1768 HydrophobicContact CE2-CB 4.38Å; F1764-C1768 HydrophobicContact CZ-CB 4.21Å; F1764-C1768 WeakPolarHBondContact O-CB 3.31Å; F1764-C1768 PolarHBondContact O-N 2.8Å; Y1765-C1768 PolarHBondContact O-N 2.87Å; Y1765-C1768 VanDerWaalsContact O-N 3.13Å; C1768-F1770 VanDerWaalsContact C-N 3.35Å; C1768-F1770 PolarHBondContact O-N 2.95Å; C1768-L1771 PolarHBondContact O-N 3.18Å; C1768-L1771 VanDerWaalsContact O-N 3.08Å; C1768-I1772 WeakPolarHBondContact O-CG1 3.12Å; C1768-I1772 PolarHBondContact O-N 2.84Å; C1768-I1772 VanDerWaalsContact SG-CD1 3.57Å
1769	S	82.6	Confident	81.2	Confident	8 Å²	8	20.5 Å²	20.5	6%	0.056	12%	0.117	C	C	.	.	H	α-helix	trans	-62.8	-41.7	178.6	-62	0	0	0	0	111.8	Y1765 L1771 I1772 I1773	Y1765-S1769 VanDerWaalsContact CE1-OG 3.28Å; Y1765-S1769 WeakPolarHBondContact CE1-OG 3.42Å; Y1765-S1769 WeakPolarHBondContact CE2-OG 2.92Å; Y1765-S1769 PolarHBondContact O-N 3.04Å; Y1765-S1769 PolarHBondContact O-OG 3.42Å; Y1765-S1769 PolarHBondContact OH-OG 2.92Å; S1769-L1771 VanDerWaalsContact C-N 3.25Å; S1769-L1771 PolarHBondContact O-N 3.08Å; S1769-I1772 PolarHBondContact O-N 3.33Å; S1769-I1772 VanDerWaalsContact O-N 3.12Å; S1769-I1773 WeakPolarHBondContact O-CD1 3.16Å; S1769-I1773 WeakPolarHBondContact O-CG1 3.37Å; S1769-I1773 PolarHBondContact O-N 3.09Å
1770	F	80.8	Confident	80	Confident	26 Å²	26	18 Å²	18	11%	0.114	10%	0.1	C	C	.	.	H	α-helix	trans	-52.1	-45.3	172.8	178.9	-129.8	0	0	0	112.3	V1152 V1156 I1159 F1291 M1766 C1768 N1774	V1152-F1770 HydrophobicContact CG1-CE1 3.6Å; V1152-F1770 HydrophobicContact CG1-CZ 3.99Å; V1156-F1770 HydrophobicContact CG2-CD1 4.4Å; V1156-F1770 HydrophobicContact CG2-CE1 3.33Å; V1156-F1770 HydrophobicContact CG2-CZ 3.46Å; V1156-F1770 VanDerWaalsContact CG2-CZ 3.46Å; I1159-F1770 HydrophobicContact CD1-CD2 4.48Å; I1159-F1770 HydrophobicContact CD1-CE2 3.57Å; I1159-F1770 HydrophobicContact CD1-CZ 4.09Å; F1291-F1770 AromaticContact CE1-CD2 3.88Å; F1291-F1770 HydrophobicContact CE1-CD2 3.88Å; F1291-F1770 HydrophobicContact CE1-CE2 4.25Å; F1291-F1770 AromaticContact CZ-CD2 3.8Å; F1291-F1770 HydrophobicContact CZ-CD2 3.8Å; F1291-F1770 HydrophobicContact CZ-CE2 4.28Å; M1766-F1770 VanDerWaalsContact O-CB 3.22Å; M1766-F1770 WeakPolarHBondContact O-CB 3.38Å; M1766-F1770 PolarHBondContact O-N 3.11Å; C1768-F1770 VanDerWaalsContact C-N 3.35Å; C1768-F1770 PolarHBondContact O-N 2.95Å; F1770-N1774 WeakPolarHBondContact CE2-ND2 3.47Å; F1770-N1774 WeakPolarHBondContact CZ-ND2 3.19Å; F1770-N1774 PolarHBondContact O-N 2.79Å; F1770-N1774 PolarHBondContact O-ND2 2.88Å
1771	L	79.2	Confident	78.6	Confident	8 Å²	8	19.6 Å²	19.6	4%	0.042	11%	0.108	C	C	.	.	H	α-helix	trans	-75.2	-31.4	179.5	-70	166.8	0	0	0	113.6	L1483 I1484 L1487 V1767 C1768 S1769 N1774 L1775	L1483-L1771 HydrophobicContact CD1-CD2 4.23Å; L1483-L1771 HydrophobicContact CD2-CD1 3.54Å; L1483-L1771 HydrophobicContact CD2-CD2 3.72Å; L1483-L1771 HydrophobicContact CD2-CG 4.28Å; I1484-L1771 HydrophobicContact CD1-CB 4.38Å; I1484-L1771 HydrophobicContact CG1-CB 3.92Å; L1487-L1771 HydrophobicContact CD1-CD1 4.49Å; L1487-L1771 HydrophobicContact CD2-CD1 4.05Å; V1767-L1771 HydrophobicContact CG1-CD1 3.89Å; V1767-L1771 WeakPolarHBondContact O-CB 3.06Å; V1767-L1771 WeakPolarHBondContact O-CD1 3.01Å; V1767-L1771 VanDerWaalsContact O-CG 3.3Å; V1767-L1771 WeakPolarHBondContact O-CG 3.09Å; V1767-L1771 PolarHBondContact O-N 3.31Å; V1767-L1771 VanDerWaalsContact O-N 3.07Å; C1768-L1771 PolarHBondContact O-N 3.18Å; C1768-L1771 VanDerWaalsContact O-N 3.08Å; S1769-L1771 VanDerWaalsContact C-N 3.25Å; S1769-L1771 PolarHBondContact O-N 3.08Å; L1771-N1774 PolarHBondContact O-N 3.04Å; L1771-L1775 PolarHBondContact O-N 3.41Å
1772	I	79.3	Confident	77.2	Confident	22 Å²	22	23.1 Å²	23.1	11%	0.113	13%	0.127	C	C	.	.	H	α-helix	trans	-65.4	-45.7	174.6	-72.4	169.4	0	0	0	110.3	F463 C1768 S1769 N1774 L1775 F1776	F463-I1772 HydrophobicContact CE1-CD1 4.25Å; F463-I1772 HydrophobicContact CE1-CG2 4.21Å; C1768-I1772 WeakPolarHBondContact O-CG1 3.12Å; C1768-I1772 PolarHBondContact O-N 2.84Å; C1768-I1772 VanDerWaalsContact SG-CD1 3.57Å; S1769-I1772 PolarHBondContact O-N 3.33Å; S1769-I1772 VanDerWaalsContact O-N 3.12Å; I1772-N1774 VanDerWaalsContact C-N 3.32Å; I1772-N1774 PolarHBondContact O-N 3.03Å; I1772-L1775 CarbonylContact O-C 3.6Å; I1772-L1775 WeakPolarHBondContact O-CA 3.42Å; I1772-L1775 WeakPolarHBondContact O-CB 3.4Å; I1772-L1775 PolarHBondContact O-N 2.78Å; I1772-L1775 VanDerWaalsContact O-N 3.11Å; I1772-F1776 HydrophobicContact CG2-CD1 4.13Å; I1772-F1776 HydrophobicContact CG2-CD2 4.05Å; I1772-F1776 HydrophobicContact CG2-CE1 3.61Å; I1772-F1776 HydrophobicContact CG2-CE2 3.53Å; I1772-F1776 HydrophobicContact CG2-CG 4.35Å; I1772-F1776 HydrophobicContact CG2-CZ 3.29Å; I1772-F1776 VanDerWaalsContact O-CD1 3.25Å; I1772-F1776 WeakPolarHBondContact O-CD1 3.25Å; I1772-F1776 VanDerWaalsContact O-CG 3.26Å; I1772-F1776 WeakPolarHBondContact O-CG 3.34Å; I1772-F1776 PolarHBondContact O-N 3.22Å
1773	I	70.8	Confident	75.9	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.1	-41.5	174.4	-41.8	128.9	0	0	0	110.5	F1291 V1292 V1295 S1769 L1775 F1776 V1777 M2468	F1291-I1773 HydrophobicContact CE1-CD1 4.24Å; V1292-I1773 HydrophobicContact CG1-CG2 4.19Å; V1292-I1773 HydrophobicContact CG2-CG2 4.07Å; V1295-I1773 HydrophobicContact CG1-CG2 4.42Å; S1769-I1773 WeakPolarHBondContact O-CD1 3.16Å; S1769-I1773 WeakPolarHBondContact O-CG1 3.37Å; S1769-I1773 PolarHBondContact O-N 3.09Å; I1773-L1775 PolarHBondContact O-N 3.1Å; I1773-F1776 CarbonylContact O-C 3.6Å; I1773-F1776 PolarHBondContact O-N 2.98Å; I1773-V1777 HydrophobicContact CG2-CG2 3.8Å; I1773-V1777 WeakPolarHBondContact O-CB 3.16Å; I1773-V1777 WeakPolarHBondContact O-CG2 3.47Å; I1773-V1777 PolarHBondContact O-N 2.71Å; I1773-M2468 HydrophobicContact CD1-CB 3.58Å; I1773-M2468 HydrophobicContact CD1-CE 4.16Å; I1773-M2468 HydrophobicContact CD1-CG 3.38Å; I1773-M2468 HydrophobicContact CD1-SD 3.2Å; I1773-M2468 WeakPolarHBondContact CD1-SD 3.5Å; I1773-M2468 HydrophobicContact CG1-CB 3.61Å; I1773-M2468 HydrophobicContact CG1-CG 3.56Å; I1773-M2468 WeakPolarHBondContact CG1-O 3.38Å; I1773-M2468 HydrophobicContact CG1-SD 4.06Å
1774	N	67.8	Low	74.6	Confident	2 Å²	2	20.3 Å²	20.3	1%	0.011	11%	0.107	C	C	.	.	H	α-helix	trans	-61.7	-32.1	178	-69.6	-37	0	0	0	111.5	F1299 F1770 L1771 I1772 A1778	F1299-N1774 HydrophobicContact CE2-CB 4.4Å; F1299-N1774 VanDerWaalsContact CE2-OD1 3.31Å; F1299-N1774 WeakPolarHBondContact CE2-OD1 3.38Å; F1299-N1774 HydrophobicContact CZ-CB 4.27Å; F1770-N1774 WeakPolarHBondContact CE2-ND2 3.47Å; F1770-N1774 WeakPolarHBondContact CZ-ND2 3.19Å; F1770-N1774 PolarHBondContact O-N 2.79Å; F1770-N1774 PolarHBondContact O-ND2 2.88Å; L1771-N1774 PolarHBondContact O-N 3.04Å; I1772-N1774 VanDerWaalsContact C-N 3.32Å; I1772-N1774 PolarHBondContact O-N 3.03Å; N1774-A1778 VanDerWaalsContact O-CB 3.29Å; N1774-A1778 WeakPolarHBondContact O-CB 3.15Å; N1774-A1778 PolarHBondContact O-N 2.95Å
1775	L	73.6	Confident	73.1	Confident	29 Å²	29	21.7 Å²	21.7	15%	0.152	12%	0.115	C	C	.	.	H	α-helix	trans	-69.4	-47.1	169.5	-169.5	150.8	0	0	0	111.1	L1477 V1480 A1481 I1484 L1771 I1772 I1773 A1778 V1779	L1477-L1775 HydrophobicContact CD2-CG 4.49Å; V1480-L1775 HydrophobicContact CG1-CB 3.72Å; V1480-L1775 HydrophobicContact CG1-CD1 4.12Å; V1480-L1775 HydrophobicContact CG1-CG 4.16Å; A1481-L1775 HydrophobicContact CB-CD1 4.41Å; I1484-L1775 HydrophobicContact CD1-CB 4.34Å; I1484-L1775 HydrophobicContact CD1-CD1 3.72Å; L1771-L1775 PolarHBondContact O-N 3.41Å; I1772-L1775 CarbonylContact O-C 3.6Å; I1772-L1775 WeakPolarHBondContact O-CA 3.42Å; I1772-L1775 WeakPolarHBondContact O-CB 3.4Å; I1772-L1775 PolarHBondContact O-N 2.78Å; I1772-L1775 VanDerWaalsContact O-N 3.11Å; I1773-L1775 PolarHBondContact O-N 3.1Å; L1775-A1778 WeakPolarHBondContact O-CB 3.26Å; L1775-A1778 PolarHBondContact O-N 3.27Å; L1775-V1779 HydrophobicContact CD2-CG2 3.81Å; L1775-V1779 VanDerWaalsContact O-CG2 3.24Å; L1775-V1779 WeakPolarHBondContact O-CG2 3.06Å; L1775-V1779 PolarHBondContact O-N 2.55Å
1776	F	69	Low	71.9	Confident	22 Å²	22	23.2 Å²	23.2	10%	0.096	12%	0.121	C	C	.	.	H	α-helix	trans	-63	-46.2	-178.5	-69.8	1.6	0	0	0	112.5	F463 N467 I1772 I1773 A1778 V1779 I1780	F463-F1776 AromaticContact CD1-CE1 3.72Å; F463-F1776 HydrophobicContact CD1-CE1 3.72Å; F463-F1776 AromaticContact CD1-CZ 3.63Å; F463-F1776 HydrophobicContact CD1-CZ 3.63Å; F463-F1776 HydrophobicContact CE1-CE1 4.37Å; F463-F1776 HydrophobicContact CE1-CZ 4.04Å; F463-F1776 HydrophobicContact CG-CZ 4.41Å; N467-F1776 WeakPolarHBondContact ND2-CD1 3.44Å; N467-F1776 WeakPolarHBondContact ND2-CE1 2.87Å; N467-F1776 VanDerWaalsContact ND2-CG 3.29Å; N467-F1776 WeakPolarHBondContact ND2-CG 3.47Å; N467-F1776 VanDerWaalsContact ND2-CZ 3.28Å; N467-F1776 WeakPolarHBondContact ND2-CZ 3.33Å; N467-F1776 WeakPolarHBondContact OD1-CB 3.43Å; N467-F1776 WeakPolarHBondContact OD1-CG 3.47Å; I1772-F1776 HydrophobicContact CG2-CD1 4.13Å; I1772-F1776 HydrophobicContact CG2-CD2 4.05Å; I1772-F1776 HydrophobicContact CG2-CE1 3.61Å; I1772-F1776 HydrophobicContact CG2-CE2 3.53Å; I1772-F1776 HydrophobicContact CG2-CG 4.35Å; I1772-F1776 HydrophobicContact CG2-CZ 3.29Å; I1772-F1776 VanDerWaalsContact O-CD1 3.25Å; I1772-F1776 WeakPolarHBondContact O-CD1 3.25Å; I1772-F1776 VanDerWaalsContact O-CG 3.26Å; I1772-F1776 WeakPolarHBondContact O-CG 3.34Å; I1772-F1776 PolarHBondContact O-N 3.22Å; I1773-F1776 CarbonylContact O-C 3.6Å; I1773-F1776 PolarHBondContact O-N 2.98Å; F1776-A1778 VanDerWaalsContact C-N 3.31Å; F1776-A1778 PolarHBondContact O-N 2.83Å; F1776-V1779 WeakPolarHBondContact O-CB 3.43Å; F1776-V1779 PolarHBondContact O-N 3.28Å; F1776-I1780 WeakPolarHBondContact O-CB 3.34Å; F1776-I1780 VanDerWaalsContact O-CG1 3.28Å; F1776-I1780 WeakPolarHBondContact O-CG1 3.27Å; F1776-I1780 PolarHBondContact O-N 3.48Å
1777	V	64.8	Low	70.7	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-64.6	-36.4	175.1	172.9	0	0	0	0	110.6	V1295 I1296 F1299 I1773 I1780 M1781	V1295-V1777 HydrophobicContact CG1-CB 4.34Å; V1295-V1777 HydrophobicContact CG1-CG1 4.37Å; V1295-V1777 HydrophobicContact CG1-CG2 4.03Å; I1296-V1777 HydrophobicContact CD1-CG2 4.47Å; I1296-V1777 HydrophobicContact CG1-CG1 4.1Å; I1296-V1777 HydrophobicContact CG1-CG2 3.6Å; F1299-V1777 HydrophobicContact CB-CG1 3.65Å; F1299-V1777 HydrophobicContact CD2-CG1 4.08Å; F1299-V1777 HydrophobicContact CG-CG1 3.94Å; I1773-V1777 HydrophobicContact CG2-CG2 3.8Å; I1773-V1777 WeakPolarHBondContact O-CB 3.16Å; I1773-V1777 WeakPolarHBondContact O-CG2 3.47Å; I1773-V1777 PolarHBondContact O-N 2.71Å; V1777-I1780 PolarHBondContact O-N 3.37Å; V1777-M1781 HydrophobicContact CG1-CG 4.26Å; V1777-M1781 VanDerWaalsContact O-CB 3.23Å; V1777-M1781 WeakPolarHBondContact O-CB 3.36Å; V1777-M1781 WeakPolarHBondContact O-CG 3.08Å; V1777-M1781 PolarHBondContact O-N 2.77Å
1778	A	65.9	Low	69.7	Low	18 Å²	18	20.1 Å²	20.1	15%	0.149	11%	0.105	C	C	.	.	H	α-helix	trans	-65.8	-42.7	170.9	0	0	0	0	0	112.6	L1477 N1774 L1775 F1776 I1780 M1781 D1782	L1477-A1778 HydrophobicContact CD2-CB 3.63Å; N1774-A1778 VanDerWaalsContact O-CB 3.29Å; N1774-A1778 WeakPolarHBondContact O-CB 3.15Å; N1774-A1778 PolarHBondContact O-N 2.95Å; L1775-A1778 WeakPolarHBondContact O-CB 3.26Å; L1775-A1778 PolarHBondContact O-N 3.27Å; F1776-A1778 VanDerWaalsContact C-N 3.31Å; F1776-A1778 PolarHBondContact O-N 2.83Å; A1778-I1780 VanDerWaalsContact C-N 3.35Å; A1778-I1780 PolarHBondContact O-N 3.46Å; A1778-M1781 PolarHBondContact O-N 3.07Å; A1778-D1782 PolarHBondContact O-N 3.07Å
1779	V	68	Low	68.7	Low	6 Å²	6	21.2 Å²	21.2	4%	0.036	11%	0.109	C	C	.	.	H	α-helix	trans	-56.4	-52	172.8	179.1	0	0	0	0	109.1	F1470 L1477 L1775 F1776 M1781 D1782 N1783	F1470-V1779 HydrophobicContact CD1-CG1 4.09Å; F1470-V1779 HydrophobicContact CE1-CG1 3.86Å; L1477-V1779 HydrophobicContact CD1-CB 4.47Å; L1477-V1779 HydrophobicContact CD1-CG2 3.59Å; L1477-V1779 HydrophobicContact CD2-CG2 3.99Å; L1477-V1779 HydrophobicContact CG-CG2 4.37Å; L1775-V1779 HydrophobicContact CD2-CG2 3.81Å; L1775-V1779 VanDerWaalsContact O-CG2 3.24Å; L1775-V1779 WeakPolarHBondContact O-CG2 3.06Å; L1775-V1779 PolarHBondContact O-N 2.55Å; F1776-V1779 WeakPolarHBondContact O-CB 3.43Å; F1776-V1779 PolarHBondContact O-N 3.28Å; V1779-M1781 PolarHBondContact O-N 3.2Å; V1779-D1782 PolarHBondContact O-N 3.48Å; V1779-N1783 WeakPolarHBondContact O-CB 3.4Å; V1779-N1783 PolarHBondContact O-N 3.21Å; V1779-N1783 VanDerWaalsContact O-N 3.15Å; V1779-N1783 PolarHBondContact O-ND2 3.02Å
1780	I	65.2	Low	67.5	Low	12 Å²	12	23.7 Å²	23.7	6%	0.062	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-45.7	-177.1	-69.6	166.6	0	0	0	109.4	L470 F1776 V1777 A1778 D1782 N1783 F1784	L470-I1780 HydrophobicContact CB-CD1 4.19Å; F1776-I1780 WeakPolarHBondContact O-CB 3.34Å; F1776-I1780 VanDerWaalsContact O-CG1 3.28Å; F1776-I1780 WeakPolarHBondContact O-CG1 3.27Å; F1776-I1780 PolarHBondContact O-N 3.48Å; V1777-I1780 PolarHBondContact O-N 3.37Å; A1778-I1780 VanDerWaalsContact C-N 3.35Å; A1778-I1780 PolarHBondContact O-N 3.46Å; I1780-D1782 PolarHBondContact O-N 2.9Å; I1780-N1783 CarbonylContact O-C 3.58Å; I1780-N1783 PolarHBondContact O-N 2.82Å; I1780-F1784 WeakPolarHBondContact O-CA 3.21Å; I1780-F1784 VanDerWaalsContact O-CB 3.24Å; I1780-F1784 WeakPolarHBondContact O-CB 3.32Å; I1780-F1784 PolarHBondContact O-N 3.42Å
1781	M	64.1	Low	66.8	Low	34 Å²	34	27.3 Å²	27.3	17%	0.167	13%	0.134	C	C	.	.	H	α-helix	trans	-61.5	-43.9	-179.8	-79.4	-60.6	-62.9	0	0	113.9	F1299 Q1300 V1777 A1778 V1779 N1783 F1784	F1299-M1781 HydrophobicContact CB-CG 4.48Å; Q1300-M1781 HydrophobicContact CB-CE 4.32Å; Q1300-M1781 HydrophobicContact CB-SD 4.42Å; Q1300-M1781 HydrophobicContact CG-CE 3.77Å; Q1300-M1781 HydrophobicContact CG-SD 3.36Å; Q1300-M1781 WeakPolarHBondContact CG-SD 3.29Å; V1777-M1781 HydrophobicContact CG1-CG 4.26Å; V1777-M1781 VanDerWaalsContact O-CB 3.23Å; V1777-M1781 WeakPolarHBondContact O-CB 3.36Å; V1777-M1781 WeakPolarHBondContact O-CG 3.08Å; V1777-M1781 PolarHBondContact O-N 2.77Å; A1778-M1781 PolarHBondContact O-N 3.07Å; V1779-M1781 PolarHBondContact O-N 3.2Å; M1781-N1783 VanDerWaalsContact C-N 3.29Å; M1781-N1783 PolarHBondContact O-N 2.81Å; M1781-F1784 PolarHBondContact O-N 2.87Å
1782	D	66.3	Low	66.2	Low	75 Å²	75	31.3 Å²	31.3	40%	0.401	16%	0.163	S	C	.	.	H	α-helix	trans	-63.5	-35.8	175.3	-83.4	-30.8	0	0	0	111.9	A1476 A1778 V1779 I1780	A1476-D1782 WeakPolarHBondContact CB-OD2 3.4Å; A1778-D1782 PolarHBondContact O-N 3.07Å; V1779-D1782 PolarHBondContact O-N 3.48Å; I1780-D1782 PolarHBondContact O-N 2.9Å
1783	N	64.1	Low	65.6	Low	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-87.5	-20.4	179.9	-69.7	-74	0	0	0	113.7	T1469 F1470 S1473 V1779 I1780 M1781 D1785 Y1786 L1787	T1469-N1783 WeakPolarHBondContact CG2-OD1 3.29Å; T1469-N1783 PolarHBondContact O-OD1 3.25Å; F1470-N1783 HydrophobicContact CE1-CB 4.37Å; F1470-N1783 WeakPolarHBondContact CE1-ND2 3.31Å; F1470-N1783 HydrophobicContact CE2-CB 4.43Å; F1470-N1783 HydrophobicContact CZ-CB 4Å; S1473-N1783 WeakPolarHBondContact CB-ND2 3.32Å; S1473-N1783 PolarHBondContact OG-ND2 3.41Å; V1779-N1783 WeakPolarHBondContact O-CB 3.4Å; V1779-N1783 PolarHBondContact O-N 3.21Å; V1779-N1783 VanDerWaalsContact O-N 3.15Å; V1779-N1783 PolarHBondContact O-ND2 3.02Å; I1780-N1783 CarbonylContact O-C 3.58Å; I1780-N1783 PolarHBondContact O-N 2.82Å; M1781-N1783 VanDerWaalsContact C-N 3.29Å; M1781-N1783 PolarHBondContact O-N 2.81Å; N1783-D1785 PolarHBondContact O-N 3.46Å; N1783-D1785 VanDerWaalsContact O-N 3.14Å; N1783-Y1786 WeakPolarHBondContact O-CA 3.14Å; N1783-Y1786 WeakPolarHBondContact O-CB 3.5Å; N1783-Y1786 PolarHBondContact O-N 3.22Å; N1783-L1787 HydrophobicContact CB-CD1 3.95Å; N1783-L1787 VanDerWaalsContact O-CG 3.28Å; N1783-L1787 WeakPolarHBondContact O-CG 3.37Å; N1783-L1787 PolarHBondContact O-N 2.74Å; N1783-L1787 VanDerWaalsContact O-N 3.13Å
1784	F	62.8	Low	65.7	Low	32 Å²	32	35.9 Å²	35.9	14%	0.14	19%	0.186	C	C	.	.	H	α-helix	trans	-57.5	-35.9	-173.9	-168.3	-110	0	0	0	111.5	I1780 M1781 Y1786 L1787 T1788	I1780-F1784 WeakPolarHBondContact O-CA 3.21Å; I1780-F1784 VanDerWaalsContact O-CB 3.24Å; I1780-F1784 WeakPolarHBondContact O-CB 3.32Å; I1780-F1784 PolarHBondContact O-N 3.42Å; M1781-F1784 PolarHBondContact O-N 2.87Å; F1784-Y1786 VanDerWaalsContact C-N 3.26Å; F1784-Y1786 PolarHBondContact O-N 3.48Å; F1784-L1787 PolarHBondContact O-N 3.29Å; F1784-T1788 HydrophobicContact CD1-CG2 3.83Å; F1784-T1788 HydrophobicContact CD2-CG2 3.96Å; F1784-T1788 HydrophobicContact CE1-CG2 3.53Å; F1784-T1788 HydrophobicContact CE2-CG2 3.66Å; F1784-T1788 HydrophobicContact CG-CG2 4.05Å; F1784-T1788 HydrophobicContact CZ-CG2 3.44Å; F1784-T1788 VanDerWaalsContact CZ-CG2 3.44Å; F1784-T1788 WeakPolarHBondContact O-CB 3.41Å; F1784-T1788 PolarHBondContact O-N 3.04Å; F1784-T1788 PolarHBondContact O-OG1 3.16Å
1785	D	62.6	Low	65.7	Low	29 Å²	29	35.9 Å²	35.9	16%	0.155	19%	0.186	C	C	.	.	H	α-helix	trans	-66.8	-18.1	175	-87.5	14	0	0	0	115.3	K1314 K1318 N1783 R1789	K1314-D1785 WeakPolarHBondContact CD-OD1 3.44Å; K1314-D1785 WeakPolarHBondContact CD-OD2 3.48Å; K1314-D1785 VanDerWaalsContact CE-OD1 3.26Å; K1314-D1785 WeakPolarHBondContact CE-OD1 3.38Å; K1314-D1785 WeakPolarHBondContact CE-OD2 3.32Å; K1314-D1785 IonicContact NZ-OD1 3.34Å; K1314-D1785 PolarHBondContact NZ-OD1 2.97Å; K1314-D1785 IonicContact NZ-OD2 3.99Å; K1314-D1785 PolarHBondContact NZ-OD2 2.66Å; K1318-D1785 WeakPolarHBondContact CE-OD2 3.34Å; K1318-D1785 VanDerWaalsContact NZ-CB 3.26Å; K1318-D1785 VanDerWaalsContact NZ-CG 3.34Å; K1318-D1785 IonicContact NZ-OD2 2.93Å; K1318-D1785 PolarHBondContact NZ-OD2 3.19Å; N1783-D1785 PolarHBondContact O-N 3.46Å; N1783-D1785 VanDerWaalsContact O-N 3.14Å; D1785-R1789 WeakPolarHBondContact O-CB 3.5Å
1786	Y	64.9	Low	65.7	Low	39 Å²	39	36.8 Å²	36.8	15%	0.153	19%	0.194	C	C	.	.	H	α-helix	trans	-92.1	-33	171.5	177.8	-90.3	0	0	0	111	T1465 T1469 N1783 F1784 W1791	T1465-Y1786 HydrophobicContact CG2-CE2 3.85Å; T1465-Y1786 VanDerWaalsContact CG2-OH 3.26Å; T1465-Y1786 WeakPolarHBondContact CG2-OH 3.25Å; T1469-Y1786 HydrophobicContact CG2-CD1 4.21Å; T1469-Y1786 HydrophobicContact CG2-CD2 3.93Å; T1469-Y1786 HydrophobicContact CG2-CG 3.73Å; T1469-Y1786 WeakPolarHBondContact OG1-CE2 3.11Å; N1783-Y1786 WeakPolarHBondContact O-CA 3.14Å; N1783-Y1786 WeakPolarHBondContact O-CB 3.5Å; N1783-Y1786 PolarHBondContact O-N 3.22Å; F1784-Y1786 VanDerWaalsContact C-N 3.26Å; F1784-Y1786 PolarHBondContact O-N 3.48Å; Y1786-W1791 HydrophobicContact CD2-CH2 4.33Å; Y1786-W1791 HydrophobicContact CD2-CZ2 4.37Å; Y1786-W1791 HydrophobicContact CE1-CH2 4.44Å; Y1786-W1791 AromaticContact CE1-CZ2 3.96Å; Y1786-W1791 HydrophobicContact CE1-CZ2 3.96Å; Y1786-W1791 AromaticContact CE2-CH2 3.54Å; Y1786-W1791 HydrophobicContact CE2-CH2 3.54Å; Y1786-W1791 AromaticContact CE2-CZ2 3.81Å; Y1786-W1791 HydrophobicContact CE2-CZ2 3.81Å; Y1786-W1791 AromaticContact CZ-CH2 3.6Å; Y1786-W1791 AromaticContact CZ-CZ2 3.57Å
1787	L	60.8	Low	65.9	Low	21 Å²	21	39.7 Å²	39.7	11%	0.11	21%	0.208	C	C	.	.	H	α-helix	trans	-85.2	-41.3	-170.9	-63.1	171.7	0	0	0	113.3	V472 N1783 F1784 R1789	V472-L1787 HydrophobicContact CB-CD2 4.47Å; V472-L1787 HydrophobicContact CG2-CD2 3.5Å; V472-L1787 VanDerWaalsContact CG2-CD2 3.5Å; N1783-L1787 HydrophobicContact CB-CD1 3.95Å; N1783-L1787 VanDerWaalsContact O-CG 3.28Å; N1783-L1787 WeakPolarHBondContact O-CG 3.37Å; N1783-L1787 PolarHBondContact O-N 2.74Å; N1783-L1787 VanDerWaalsContact O-N 3.13Å; F1784-L1787 PolarHBondContact O-N 3.29Å; L1787-R1789 VanDerWaalsContact C-N 3.34Å
1788	T	63.7	Low	66.8	Low	36 Å²	36	40.3 Å²	40.3	22%	0.221	21%	0.21	C	C	.	.	S	Bend	trans	-75	-21.2	174.7	51	0	0	0	0	113.8	F1784 D1790	F1784-T1788 HydrophobicContact CD1-CG2 3.83Å; F1784-T1788 HydrophobicContact CD2-CG2 3.96Å; F1784-T1788 HydrophobicContact CE1-CG2 3.53Å; F1784-T1788 HydrophobicContact CE2-CG2 3.66Å; F1784-T1788 HydrophobicContact CG-CG2 4.05Å; F1784-T1788 HydrophobicContact CZ-CG2 3.44Å; F1784-T1788 VanDerWaalsContact CZ-CG2 3.44Å; F1784-T1788 WeakPolarHBondContact O-CB 3.41Å; F1784-T1788 PolarHBondContact O-N 3.04Å; F1784-T1788 PolarHBondContact O-OG1 3.16Å; T1788-D1790 PolarHBondContact O-N 3.26Å
1789	R	65.8	Low	67.8	Low	25 Å²	25	39.5 Å²	39.5	9%	0.094	20%	0.204	C	C	.	.	S	Bend	trans	-71.3	117.3	-167.5	-178.5	179.9	55.2	62.5	17.2	112	N1315 D1785 L1787 W1791	N1315-R1789 WeakPolarHBondContact OD1-CD 3.35Å; N1315-R1789 WeakPolarHBondContact OD1-CG 3.49Å; D1785-R1789 WeakPolarHBondContact O-CB 3.5Å; L1787-R1789 VanDerWaalsContact C-N 3.34Å; R1789-W1791 PolarHBondContact O-N 3.41Å
1790	D	58.4	Low	68.5	Low	59 Å²	59	43 Å²	43	32%	0.316	22%	0.222	S	C	.	.			trans	-61.6	103.9	174.8	-84	-32.2	0	0	0	112.3	K479 T1788 S1792 I1793	K479-D1790 WeakPolarHBondContact CE-OD1 3.38Å; K479-D1790 IonicContact NZ-OD1 3.35Å; K479-D1790 PolarHBondContact NZ-OD1 3Å; T1788-D1790 PolarHBondContact O-N 3.26Å; D1790-S1792 PolarHBondContact O-N 2.79Å; D1790-S1792 VanDerWaalsContact O-N 3.1Å; D1790-I1793 HydrophobicContact CB-CD1 3.86Å; D1790-I1793 HydrophobicContact CB-CG1 3.98Å; D1790-I1793 PolarHBondContact O-N 3.18Å
1791	W	66.3	Low	69.5	Low	103 Å²	103	43.5 Å²	43.5	39%	0.39	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.4	175.9	-63.7	92.5	0	0	0	113.9	Y1786 R1789 H1798	Y1786-W1791 HydrophobicContact CD2-CH2 4.33Å; Y1786-W1791 HydrophobicContact CD2-CZ2 4.37Å; Y1786-W1791 HydrophobicContact CE1-CH2 4.44Å; Y1786-W1791 AromaticContact CE1-CZ2 3.96Å; Y1786-W1791 HydrophobicContact CE1-CZ2 3.96Å; Y1786-W1791 AromaticContact CE2-CH2 3.54Å; Y1786-W1791 HydrophobicContact CE2-CH2 3.54Å; Y1786-W1791 AromaticContact CE2-CZ2 3.81Å; Y1786-W1791 HydrophobicContact CE2-CZ2 3.81Å; Y1786-W1791 AromaticContact CZ-CH2 3.6Å; Y1786-W1791 AromaticContact CZ-CZ2 3.57Å; R1789-W1791 PolarHBondContact O-N 3.41Å; W1791-H1798 PolarHBondContact O-CE1 2.97Å
1792	S	66.2	Low	70.8	Confident	91 Å²	91	41.9 Å²	41.9	64%	0.636	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-22.5	179.6	50.6	0	0	0	0	114.9	D1790	D1790-S1792 PolarHBondContact O-N 2.79Å; D1790-S1792 VanDerWaalsContact O-N 3.1Å
1793	I	66.8	Low	71.9	Confident	112 Å²	112	39 Å²	39	57%	0.574	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-66.6	-174	-59.8	177.3	0	0	0	110.3	D1790 P1832	D1790-I1793 HydrophobicContact CB-CD1 3.86Å; D1790-I1793 HydrophobicContact CB-CG1 3.98Å; D1790-I1793 PolarHBondContact O-N 3.18Å; I1793-P1832 WeakPolarHBondContact O-CG 3.43Å
1794	L	72.4	Confident	73	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.037	23%	0.227	C	C	.	.			trans	-162.4	156.9	167.6	-168.5	56.3	0	0	0	108.1	H1798 P1832 L1833 V1871 L1875	L1794-H1798 HydrophobicContact CD1-CB 4.25Å; L1794-P1832 HydrophobicContact CD1-CG 4.45Å; L1794-L1833 HydrophobicContact CD1-CB 4.3Å; L1794-L1833 HydrophobicContact CD1-CD1 4.28Å; L1794-V1871 HydrophobicContact CD2-CG2 4.5Å; L1794-L1875 HydrophobicContact CB-CD2 4.38Å; L1794-L1875 HydrophobicContact CD2-CD1 4.29Å; L1794-L1875 HydrophobicContact CD2-CD2 4.16Å; L1794-L1875 HydrophobicContact CD2-CG 4.03Å
1795	G	69	Low	74.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.01	22%	0.221	C	C	.	.			trans	-164	164.3	-176.6	0	0	0	0	0	113.6	H1797 H1798	G1795-H1797 VanDerWaalsContact C-N 3.29Å; G1795-H1797 PolarHBondContact O-N 2.97Å; G1795-H1798 PolarHBondContact O-N 3.42Å; G1795-H1798 VanDerWaalsContact O-N 3.13Å
1796	P	72.4	Confident	75.8	Confident	48 Å²	48	43.2 Å²	43.2	31%	0.312	21%	0.214	S	C	.	.	H	α-helix	trans	-58.6	-40.5	-176.5	24	-33	0	0	0	111.6	F1322 H1798 L1799 D1800	F1322-P1796 HydrophobicContact CE2-CB 4.44Å; P1796-H1798 VanDerWaalsContact C-N 3.25Å; P1796-H1798 PolarHBondContact O-N 3.38Å; P1796-H1798 VanDerWaalsContact O-N 3.13Å; P1796-L1799 CarbonylContact O-C 3.58Å; P1796-L1799 WeakPolarHBondContact O-CA 3.41Å; P1796-L1799 WeakPolarHBondContact O-CB 3.29Å; P1796-L1799 PolarHBondContact O-N 2.9Å; P1796-D1800 PolarHBondContact O-N 2.65Å
1797	H	74.1	Confident	76.9	Confident	84 Å²	84	41.9 Å²	41.9	39%	0.389	21%	0.21	S	C	.	.	H	α-helix	trans	-51	-39.5	176	178.9	-95.3	0	0	0	113.8	G1795 L1799 D1800 E1801	G1795-H1797 VanDerWaalsContact C-N 3.29Å; G1795-H1797 PolarHBondContact O-N 2.97Å; H1797-L1799 VanDerWaalsContact C-N 3.35Å; H1797-D1800 PolarHBondContact O-N 3.5Å; H1797-E1801 WeakPolarHBondContact O-CB 3.49Å; H1797-E1801 PolarHBondContact O-N 3.25Å
1798	H	83.6	Confident	78.1	Confident	13 Å²	13	44.2 Å²	44.2	6%	0.06	22%	0.221	C	C	.	.	H	α-helix	trans	-69.4	-33.7	176.2	-58.3	116.8	0	0	0	112.2	W1791 L1794 G1795 P1796 F1802 L1833	W1791-H1798 PolarHBondContact O-CE1 2.97Å; L1794-H1798 HydrophobicContact CD1-CB 4.25Å; G1795-H1798 PolarHBondContact O-N 3.42Å; G1795-H1798 VanDerWaalsContact O-N 3.13Å; P1796-H1798 VanDerWaalsContact C-N 3.25Å; P1796-H1798 PolarHBondContact O-N 3.38Å; P1796-H1798 VanDerWaalsContact O-N 3.13Å; H1798-F1802 PolarHBondContact O-N 3.07Å; H1798-L1833 HydrophobicContact CB-CB 4.03Å; H1798-L1833 HydrophobicContact CB-CD2 4.17Å; H1798-L1833 WeakPolarHBondContact O-CD2 3.12Å
1799	L	86.1	Confident	79.3	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-76.6	-32	177	-48.4	173	0	0	0	111.4	F1322 P1796 H1797 F1802 I1803 L1833 L1867 V1871	F1322-L1799 HydrophobicContact CB-CD1 3.91Å; F1322-L1799 HydrophobicContact CD1-CB 3.58Å; F1322-L1799 HydrophobicContact CD1-CD1 3.56Å; F1322-L1799 HydrophobicContact CD1-CG 4.17Å; F1322-L1799 HydrophobicContact CD2-CD1 4.42Å; F1322-L1799 HydrophobicContact CE1-CB 3.29Å; F1322-L1799 HydrophobicContact CE1-CD1 4.19Å; F1322-L1799 HydrophobicContact CE1-CG 4.35Å; F1322-L1799 HydrophobicContact CG-CB 4.34Å; F1322-L1799 HydrophobicContact CG-CD1 3.7Å; F1322-L1799 HydrophobicContact CZ-CB 3.82Å; P1796-L1799 CarbonylContact O-C 3.58Å; P1796-L1799 WeakPolarHBondContact O-CA 3.41Å; P1796-L1799 WeakPolarHBondContact O-CB 3.29Å; P1796-L1799 PolarHBondContact O-N 2.9Å; H1797-L1799 VanDerWaalsContact C-N 3.35Å; L1799-F1802 WeakPolarHBondContact O-CB 3.29Å; L1799-F1802 PolarHBondContact O-N 2.81Å; L1799-I1803 WeakPolarHBondContact O-CG1 3.38Å; L1799-I1803 PolarHBondContact O-N 2.86Å; L1799-L1833 HydrophobicContact CD2-CD1 4.27Å; L1799-L1833 HydrophobicContact CD2-CD2 3.99Å; L1799-L1867 HydrophobicContact CD2-CD1 3.77Å; L1799-V1871 HydrophobicContact CD2-CG2 3.69Å
1800	D	83.4	Confident	80.5	Confident	78 Å²	78	45.3 Å²	45.3	42%	0.417	22%	0.222	S	C	.	.	H	α-helix	trans	-72	-37.6	170.3	-70.9	-53.1	0	0	0	111.7	F1322 P1796 H1797 F1802 I1803 R1804	F1322-D1800 WeakPolarHBondContact CZ-OD1 3.35Å; P1796-D1800 PolarHBondContact O-N 2.65Å; H1797-D1800 PolarHBondContact O-N 3.5Å; D1800-F1802 VanDerWaalsContact C-N 3.32Å; D1800-F1802 PolarHBondContact O-N 2.94Å; D1800-I1803 PolarHBondContact O-N 3.14Å; D1800-R1804 WeakPolarHBondContact O-CB 3.49Å; D1800-R1804 PolarHBondContact O-N 3.39Å
1801	E	86.4	Confident	81.8	Confident	23 Å²	23	44.5 Å²	44.5	11%	0.107	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-44.5	169.4	-168.4	-161.9	153.9	0	0	110.3	H1797 R1804 L1805 I1829 S1830	H1797-E1801 WeakPolarHBondContact O-CB 3.49Å; H1797-E1801 PolarHBondContact O-N 3.25Å; E1801-R1804 PolarHBondContact O-N 3.06Å; E1801-L1805 HydrophobicContact CG-CD1 4Å; E1801-L1805 HydrophobicContact CG-CG 4.45Å; E1801-L1805 WeakPolarHBondContact O-CB 3.45Å; E1801-L1805 WeakPolarHBondContact O-CG 3.36Å; E1801-L1805 PolarHBondContact O-N 2.95Å; E1801-I1829 WeakPolarHBondContact OE1-CA 3.21Å; E1801-S1830 PolarHBondContact OE1-N 3.26Å; E1801-S1830 WeakPolarHBondContact OE2-CB 3.47Å; E1801-S1830 PolarHBondContact OE2-OG 3.08Å
1802	F	90.9	Very high	82.6	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.3	-45.5	173.3	177.3	-85.8	0	0	0	112.1	H1798 L1799 D1800 W1806 L1825 I1829 L1833 F1863 T1866 L1867 L1870	H1798-F1802 PolarHBondContact O-N 3.07Å; L1799-F1802 WeakPolarHBondContact O-CB 3.29Å; L1799-F1802 PolarHBondContact O-N 2.81Å; D1800-F1802 VanDerWaalsContact C-N 3.32Å; D1800-F1802 PolarHBondContact O-N 2.94Å; F1802-W1806 AromaticContact CE1-CE3 3.94Å; F1802-W1806 HydrophobicContact CE1-CE3 3.94Å; F1802-W1806 HydrophobicContact CE2-CE3 4.43Å; F1802-W1806 AromaticContact CZ-CE3 3.62Å; F1802-W1806 HydrophobicContact CZ-CE3 3.62Å; F1802-W1806 AromaticContact CZ-CZ3 3.91Å; F1802-W1806 HydrophobicContact CZ-CZ3 3.91Å; F1802-W1806 VanDerWaalsContact O-CB 3.27Å; F1802-W1806 WeakPolarHBondContact O-CB 3.46Å; F1802-W1806 PolarHBondContact O-N 2.97Å; F1802-L1825 HydrophobicContact CD2-CD2 4.31Å; F1802-L1825 HydrophobicContact CE2-CD2 3.91Å; F1802-I1829 HydrophobicContact CD2-CD1 3.62Å; F1802-I1829 HydrophobicContact CE2-CD1 4.32Å; F1802-L1833 HydrophobicContact CB-CD2 3.9Å; F1802-F1863 AromaticContact CD1-CE2 3.85Å; F1802-F1863 HydrophobicContact CD1-CE2 3.85Å; F1802-F1863 AromaticContact CE1-CD2 3.75Å; F1802-F1863 HydrophobicContact CE1-CD2 3.75Å; F1802-F1863 AromaticContact CE1-CE2 3.46Å; F1802-F1863 HydrophobicContact CE1-CE2 3.46Å; F1802-F1863 VanDerWaalsContact CE1-CE2 3.46Å; F1802-F1863 HydrophobicContact CE1-CZ 4.35Å; F1802-T1866 HydrophobicContact CE2-CG2 3.91Å; F1802-T1866 HydrophobicContact CZ-CG2 3.7Å; F1802-L1867 HydrophobicContact CD1-CB 4.36Å; F1802-L1867 HydrophobicContact CD1-CD1 3.72Å; F1802-L1867 HydrophobicContact CD1-CD2 4.35Å; F1802-L1867 HydrophobicContact CD1-CG 4.37Å; F1802-L1867 HydrophobicContact CE1-CB 3.81Å; F1802-L1867 HydrophobicContact CE1-CD1 4.03Å; F1802-L1867 HydrophobicContact CE1-CD2 4.44Å; F1802-L1867 HydrophobicContact CE1-CG 4.31Å; F1802-L1867 HydrophobicContact CG-CD1 4.05Å; F1802-L1867 HydrophobicContact CZ-CB 4.24Å; F1802-L1870 HydrophobicContact CD2-CD1 3.84Å; F1802-L1870 HydrophobicContact CE2-CD1 3.47Å; F1802-L1870 VanDerWaalsContact CE2-CD1 3.47Å; F1802-L1870 HydrophobicContact CZ-CD1 4.29Å
1803	I	90.4	Very high	83.5	Confident	16 Å²	16	42 Å²	42	8%	0.082	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-46.3	175.4	-72.9	165.7	0	0	0	111.3	F1322 A1326 V1329 L1799 D1800 W1806 S1807 F1863	F1322-I1803 HydrophobicContact CE1-CD1 3.65Å; F1322-I1803 HydrophobicContact CZ-CD1 3.69Å; A1326-I1803 HydrophobicContact CB-CD1 4.19Å; V1329-I1803 HydrophobicContact CB-CG2 4.03Å; V1329-I1803 HydrophobicContact CG2-CG2 3.52Å; L1799-I1803 WeakPolarHBondContact O-CG1 3.38Å; L1799-I1803 PolarHBondContact O-N 2.86Å; D1800-I1803 PolarHBondContact O-N 3.14Å; I1803-W1806 PolarHBondContact O-N 3.11Å; I1803-S1807 PolarHBondContact O-N 3.37Å; I1803-S1807 VanDerWaalsContact O-N 3.11Å; I1803-F1863 HydrophobicContact CD1-CZ 4.41Å; I1803-F1863 HydrophobicContact CG1-CE2 4.01Å; I1803-F1863 HydrophobicContact CG1-CZ 3.71Å
1804	R	87.1	Confident	84.5	Confident	145 Å²	145	41.7 Å²	41.7	55%	0.547	20%	0.201	S	C	.	.	H	α-helix	trans	-62.7	-47.2	-179.2	-174.2	176.7	64.6	79.7	-1	111.1	D1800 E1801 S1807	D1800-R1804 WeakPolarHBondContact O-CB 3.49Å; D1800-R1804 PolarHBondContact O-N 3.39Å; E1801-R1804 PolarHBondContact O-N 3.06Å; R1804-S1807 WeakPolarHBondContact O-CB 3.48Å; R1804-S1807 PolarHBondContact O-N 3.48Å; R1804-S1807 PolarHBondContact O-OG 3.48Å
1805	L	89.8	Confident	85.1	Confident	4 Å²	4	42 Å²	42	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-68.4	-35.8	177.4	-69.5	176.3	0	0	0	112	E1801 S1807 E1808 Y1809 K1828 I1829	E1801-L1805 HydrophobicContact CG-CD1 4Å; E1801-L1805 HydrophobicContact CG-CG 4.45Å; E1801-L1805 WeakPolarHBondContact O-CB 3.45Å; E1801-L1805 WeakPolarHBondContact O-CG 3.36Å; E1801-L1805 PolarHBondContact O-N 2.95Å; L1805-S1807 VanDerWaalsContact C-N 3.27Å; L1805-S1807 PolarHBondContact O-N 3.35Å; L1805-E1808 WeakPolarHBondContact O-CB 3.2Å; L1805-E1808 PolarHBondContact O-N 2.68Å; L1805-E1808 VanDerWaalsContact O-N 3.1Å; L1805-Y1809 WeakPolarHBondContact O-CD2 3.45Å; L1805-K1828 HydrophobicContact CD1-CG 4.19Å; L1805-K1828 HydrophobicContact CD2-CD 3.88Å; L1805-K1828 HydrophobicContact CD2-CG 4.15Å; L1805-I1829 HydrophobicContact CD1-CB 4.31Å; L1805-I1829 HydrophobicContact CD1-CG1 3.54Å
1806	W	92.4	Very high	86.1	Confident	1 Å²	1	46.8 Å²	46.8	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-57.5	-39.7	171.9	-170.5	-75.9	0	0	0	111.8	F1802 I1803 E1808 Y1809 D1810 I1817 L1825 F1863 T1866	F1802-W1806 AromaticContact CE1-CE3 3.94Å; F1802-W1806 HydrophobicContact CE1-CE3 3.94Å; F1802-W1806 HydrophobicContact CE2-CE3 4.43Å; F1802-W1806 AromaticContact CZ-CE3 3.62Å; F1802-W1806 HydrophobicContact CZ-CE3 3.62Å; F1802-W1806 AromaticContact CZ-CZ3 3.91Å; F1802-W1806 HydrophobicContact CZ-CZ3 3.91Å; F1802-W1806 VanDerWaalsContact O-CB 3.27Å; F1802-W1806 WeakPolarHBondContact O-CB 3.46Å; F1802-W1806 PolarHBondContact O-N 2.97Å; I1803-W1806 PolarHBondContact O-N 3.11Å; W1806-E1808 PolarHBondContact O-N 2.9Å; W1806-E1808 VanDerWaalsContact O-N 3.13Å; W1806-Y1809 PolarHBondContact O-N 3.23Å; W1806-Y1809 VanDerWaalsContact O-N 3.14Å; W1806-D1810 PolarHBondContact NE1-OD2 3.43Å; W1806-D1810 VanDerWaalsContact NE1-OD2 3.15Å; W1806-D1810 PolarHBondContact O-N 2.86Å; W1806-I1817 HydrophobicContact CD2-CD1 3.35Å; W1806-I1817 HydrophobicContact CD2-CG1 4.22Å; W1806-I1817 HydrophobicContact CE3-CD1 3.69Å; W1806-I1817 HydrophobicContact CG-CD1 3.84Å; W1806-I1817 HydrophobicContact CH2-CB 3.97Å; W1806-I1817 HydrophobicContact CH2-CD1 3.94Å; W1806-I1817 HydrophobicContact CH2-CG1 4.03Å; W1806-I1817 HydrophobicContact CZ2-CB 3.94Å; W1806-I1817 HydrophobicContact CZ2-CD1 3.64Å; W1806-I1817 HydrophobicContact CZ2-CG1 3.56Å; W1806-I1817 HydrophobicContact CZ3-CD1 3.96Å; W1806-L1825 HydrophobicContact CE3-CD1 4.22Å; W1806-F1863 HydrophobicContact CB-CD2 4.48Å; W1806-F1863 HydrophobicContact CD2-CB 4.43Å; W1806-F1863 AromaticContact CD2-CD2 3.57Å; W1806-F1863 HydrophobicContact CD2-CD2 3.57Å; W1806-F1863 HydrophobicContact CD2-CE2 4.41Å; W1806-F1863 HydrophobicContact CD2-CG 4.45Å; W1806-F1863 AromaticContact CE2-CD2 3.82Å; W1806-F1863 AromaticContact CE3-CD2 3.9Å; W1806-F1863 HydrophobicContact CE3-CD2 3.9Å; W1806-F1863 AromaticContact CG-CD2 3.82Å; W1806-F1863 HydrophobicContact CG-CD2 3.82Å; W1806-F1863 HydrophobicContact CG-CE2 4.32Å; W1806-F1863 HydrophobicContact CH2-CB 4.06Å; W1806-F1863 HydrophobicContact CZ2-CB 3.64Å; W1806-F1863 HydrophobicContact CZ2-CD2 4.36Å; W1806-F1863 HydrophobicContact CZ3-CD2 4.43Å; W1806-T1866 HydrophobicContact CZ3-CG2 4.15Å
1807	S	88.1	Confident	86.9	Confident	11 Å²	11	44.8 Å²	44.8	8%	0.077	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-12.4	178.2	81.9	0	0	0	0	115	V1329 I1803 R1804 L1805 P1811	V1329-S1807 VanDerWaalsContact O-CB 3.29Å; V1329-S1807 WeakPolarHBondContact O-CB 3.29Å; I1803-S1807 PolarHBondContact O-N 3.37Å; I1803-S1807 VanDerWaalsContact O-N 3.11Å; R1804-S1807 WeakPolarHBondContact O-CB 3.48Å; R1804-S1807 PolarHBondContact O-N 3.48Å; R1804-S1807 PolarHBondContact O-OG 3.48Å; L1805-S1807 VanDerWaalsContact C-N 3.27Å; L1805-S1807 PolarHBondContact O-N 3.35Å; S1807-P1811 VanDerWaalsContact O-CA 3.28Å; S1807-P1811 WeakPolarHBondContact O-CA 3.48Å
1808	E	87.3	Confident	87.5	Confident	70 Å²	70	46.9 Å²	46.9	33%	0.327	22%	0.218	S	C	.	.	H	α-helix	trans	-82.7	-32.9	174.2	-54.2	-168.5	140.9	0	0	112.2	R1331 L1805 W1806 K1828	R1331-E1808 IonicContact NH1-OE1 4Å; L1805-E1808 WeakPolarHBondContact O-CB 3.2Å; L1805-E1808 PolarHBondContact O-N 2.68Å; L1805-E1808 VanDerWaalsContact O-N 3.1Å; W1806-E1808 PolarHBondContact O-N 2.9Å; W1806-E1808 VanDerWaalsContact O-N 3.13Å; E1808-K1828 IonicContact OE2-NZ 3.45Å; E1808-K1828 PolarHBondContact OE2-NZ 2.88Å
1809	Y	89.2	Confident	87.5	Confident	79 Å²	79	47.8 Å²	47.8	31%	0.31	22%	0.223	S	C	.	.	H	α-helix	trans	-91.4	-25.8	177.4	-67.1	-96.1	0	0	0	112.3	L1805 W1806 P1811 D1821 T1824 L1825	L1805-Y1809 WeakPolarHBondContact O-CD2 3.45Å; W1806-Y1809 PolarHBondContact O-N 3.23Å; W1806-Y1809 VanDerWaalsContact O-N 3.14Å; Y1809-P1811 VanDerWaalsContact C-CD 3.47Å; Y1809-D1821 HydrophobicContact CD1-CB 3.89Å; Y1809-D1821 HydrophobicContact CE1-CB 4.13Å; Y1809-T1824 VanDerWaalsContact CE1-OG1 3.29Å; Y1809-T1824 WeakPolarHBondContact CE1-OG1 3.46Å; Y1809-T1824 PolarHBondContact OH-OG1 3.13Å; Y1809-L1825 HydrophobicContact CD2-CB 4.49Å; Y1809-L1825 HydrophobicContact CD2-CD1 3.96Å; Y1809-L1825 HydrophobicContact CE2-CB 4.03Å; Y1809-L1825 HydrophobicContact CE2-CD1 4.23Å; Y1809-L1825 HydrophobicContact CE2-CG 4.5Å
1810	D	90.2	Very high	87.3	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.027	25%	0.248	C	C	.	.			trans	-126.9	65.7	177.5	-176.8	16	0	0	0	111.1	W1806 E1812 A1813 K1814 G1815 I1817	W1806-D1810 PolarHBondContact NE1-OD2 3.43Å; W1806-D1810 VanDerWaalsContact NE1-OD2 3.15Å; W1806-D1810 PolarHBondContact O-N 2.86Å; D1810-E1812 PolarHBondContact O-N 3.14Å; D1810-A1813 PolarHBondContact O-N 3.47Å; D1810-A1813 PolarHBondContact OD1-N 3.38Å; D1810-K1814 VanDerWaalsContact CG-N 3.29Å; D1810-K1814 WeakPolarHBondContact OD1-CB 3.19Å; D1810-K1814 PolarHBondContact OD1-N 3.48Å; D1810-K1814 PolarHBondContact OD2-N 3.22Å; D1810-G1815 PolarHBondContact OD2-N 3.12Å; D1810-I1817 HydrophobicContact CB-CD1 4.24Å; D1810-I1817 HydrophobicContact CB-CG1 4.02Å
1811	P	84.9	Confident	87.4	Confident	42 Å²	42	51.5 Å²	51.5	27%	0.273	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.6	-175.4	26.5	-35.9	0	0	0	113.6	K1330 R1331 I1333 S1807 Y1809 A1813	K1330-P1811 WeakPolarHBondContact CG-O 3.45Å; R1331-P1811 HydrophobicContact CB-CB 4.46Å; R1331-P1811 PolarHBondContact N-O 3.02Å; I1333-P1811 HydrophobicContact CD1-CB 3.97Å; S1807-P1811 VanDerWaalsContact O-CA 3.28Å; S1807-P1811 WeakPolarHBondContact O-CA 3.48Å; Y1809-P1811 VanDerWaalsContact C-CD 3.47Å; P1811-A1813 VanDerWaalsContact C-N 3.33Å
1812	E	83.6	Confident	87.3	Confident	114 Å²	114	50.6 Å²	50.6	53%	0.533	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.3	176.2	-64.2	-170.1	129.8	0	0	113.4	D1810 K1814	D1810-E1812 PolarHBondContact O-N 3.14Å; E1812-K1814 HydrophobicContact CB-CG 4.4Å; E1812-K1814 WeakPolarHBondContact OE2-CE 3.32Å; E1812-K1814 IonicContact OE2-NZ 2.78Å; E1812-K1814 PolarHBondContact OE2-NZ 3Å
1813	A	86.4	Confident	86.8	Confident	28 Å²	28	50.9 Å²	50.9	23%	0.231	24%	0.24	C	C	.	.			trans	56.5	46.7	-178.3	0	0	0	0	0	114.3	P1328 K1330 D1810 P1811 G1815	P1328-A1813 HydrophobicContact CB-CB 4.01Å; P1328-A1813 HydrophobicContact CG-CB 4.17Å; K1330-A1813 HydrophobicContact CB-CB 3.9Å; D1810-A1813 PolarHBondContact O-N 3.47Å; D1810-A1813 PolarHBondContact OD1-N 3.38Å; P1811-A1813 VanDerWaalsContact C-N 3.33Å; A1813-G1815 PolarHBondContact O-N 2.98Å
1814	K	86.1	Confident	86.6	Confident	105 Å²	105	53.4 Å²	53.4	46%	0.457	26%	0.256	S	S	.	.			trans	-69.3	-16.1	174.6	-68.6	162.7	-179.3	158.7	0	113.3	D1810 E1812 R1816	D1810-K1814 VanDerWaalsContact CG-N 3.29Å; D1810-K1814 WeakPolarHBondContact OD1-CB 3.19Å; D1810-K1814 PolarHBondContact OD1-N 3.48Å; D1810-K1814 PolarHBondContact OD2-N 3.22Å; E1812-K1814 HydrophobicContact CB-CG 4.4Å; E1812-K1814 WeakPolarHBondContact OE2-CE 3.32Å; E1812-K1814 IonicContact OE2-NZ 2.78Å; E1812-K1814 PolarHBondContact OE2-NZ 3Å; K1814-R1816 VanDerWaalsContact C-N 3.27Å; K1814-R1816 HydrophobicContact CB-CG 4.29Å; K1814-R1816 PolarHBondContact O-N 3.46Å
1815	G	86.1	Confident	86.6	Confident	13 Å²	13	46.5 Å²	46.5	13%	0.134	23%	0.23	C	C	.	.	S	Bend	trans	73.5	14.5	-178.2	0	0	0	0	0	114.2	D1810 A1813 F1863	D1810-G1815 PolarHBondContact OD2-N 3.12Å; A1813-G1815 PolarHBondContact O-N 2.98Å; G1815-F1863 WeakPolarHBondContact O-CB 3.5Å; G1815-F1863 PolarHBondContact O-N 2.77Å
1816	R	88.6	Confident	86.4	Confident	101 Å²	101	46.3 Å²	46.3	38%	0.381	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	134.1	-178	68.1	-169.9	-171.1	122.2	-11.3	113.1	K1814 D1858 T1860 V1861 M1862	K1814-R1816 VanDerWaalsContact C-N 3.27Å; K1814-R1816 HydrophobicContact CB-CG 4.29Å; K1814-R1816 PolarHBondContact O-N 3.46Å; R1816-D1858 IonicContact CZ-OD2 3.56Å; R1816-D1858 IonicContact NH1-OD2 2.75Å; R1816-D1858 PolarHBondContact NH1-OD2 3.43Å; R1816-D1858 IonicContact NH2-OD2 2.69Å; R1816-D1858 PolarHBondContact NH2-OD2 3.33Å; R1816-T1860 PolarHBondContact NH1-OG1 3.13Å; R1816-V1861 VanDerWaalsContact CA-O 3.28Å; R1816-V1861 WeakPolarHBondContact CA-O 3.39Å; R1816-M1862 HydrophobicContact CB-SD 4.19Å
1817	I	90.4	Very high	86.1	Confident	7 Å²	7	51 Å²	51	4%	0.036	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	156.7	-178.4	-73.7	176.7	0	0	0	109.3	W1806 D1810 D1821 V1822 L1825 T1860 V1861	W1806-I1817 HydrophobicContact CD2-CD1 3.35Å; W1806-I1817 HydrophobicContact CD2-CG1 4.22Å; W1806-I1817 HydrophobicContact CE3-CD1 3.69Å; W1806-I1817 HydrophobicContact CG-CD1 3.84Å; W1806-I1817 HydrophobicContact CH2-CB 3.97Å; W1806-I1817 HydrophobicContact CH2-CD1 3.94Å; W1806-I1817 HydrophobicContact CH2-CG1 4.03Å; W1806-I1817 HydrophobicContact CZ2-CB 3.94Å; W1806-I1817 HydrophobicContact CZ2-CD1 3.64Å; W1806-I1817 HydrophobicContact CZ2-CG1 3.56Å; W1806-I1817 HydrophobicContact CZ3-CD1 3.96Å; D1810-I1817 HydrophobicContact CB-CD1 4.24Å; D1810-I1817 HydrophobicContact CB-CG1 4.02Å; I1817-D1821 HydrophobicContact CG2-CB 3.62Å; I1817-V1822 HydrophobicContact CG2-CG2 4.27Å; I1817-L1825 HydrophobicContact CD1-CD1 4.27Å; I1817-T1860 CarbonylContact O-C 3.28Å; I1817-T1860 WeakPolarHBondContact O-CA 3.4Å; I1817-T1860 WeakPolarHBondContact O-CB 3.13Å; I1817-V1861 PolarHBondContact N-O 3.02Å; I1817-V1861 VanDerWaalsContact N-O 3.15Å; I1817-V1861 PolarHBondContact O-N 2.96Å
1818	K	87.5	Confident	85.9	Confident	127 Å²	127	55.4 Å²	55.4	55%	0.552	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	144.8	175.9	-57.6	174.5	179	174.4	0	110.7	L1820 D1821 V1822 T1860	K1818-L1820 PolarHBondContact O-N 3.27Å; K1818-D1821 WeakPolarHBondContact CB-OD2 3.42Å; K1818-D1821 PolarHBondContact O-N 2.92Å; K1818-V1822 PolarHBondContact O-N 3.07Å; K1818-T1860 HydrophobicContact CG-CG2 4.4Å
1819	H	81.9	Confident	85.9	Confident	32 Å²	32	52.1 Å²	52.1	15%	0.148	25%	0.249	C	C	.	.	H	α-helix	trans	-57.6	-22.7	-178.7	68	-84.4	0	0	0	115.3	L1855 G1859 V1861 F1916	H1819-L1855 HydrophobicContact CB-CD1 3.95Å; H1819-G1859 PolarHBondContact N-O 3.45Å; H1819-G1859 PolarHBondContact ND1-O 3.28Å; H1819-V1861 HydrophobicContact CB-CG2 4.19Å; H1819-F1916 AromaticContact CD2-CE1 3.9Å; H1819-F1916 AromaticContact NE2-CE1 3.7Å; H1819-F1916 AromaticContact NE2-CZ 3.88Å
1820	L	81.7	Confident	85.5	Confident	104 Å²	104	50 Å²	50	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-67.2	-47.5	174.7	-62.4	173	0	0	0	111.4	K1818 V1822 V1823	K1818-L1820 PolarHBondContact O-N 3.27Å; L1820-V1822 VanDerWaalsContact C-N 3.26Å; L1820-V1822 PolarHBondContact O-N 3.47Å; L1820-V1823 PolarHBondContact O-N 3.13Å
1821	D	86.2	Confident	85	Confident	55 Å²	55	53 Å²	53	29%	0.294	27%	0.266	S	S	.	.	H	α-helix	trans	-67.7	-30.4	-174.1	-49	-40.1	0	0	0	111.1	Y1809 I1817 K1818 V1823 T1824 L1825	Y1809-D1821 HydrophobicContact CD1-CB 3.89Å; Y1809-D1821 HydrophobicContact CE1-CB 4.13Å; I1817-D1821 HydrophobicContact CG2-CB 3.62Å; K1818-D1821 WeakPolarHBondContact CB-OD2 3.42Å; K1818-D1821 PolarHBondContact O-N 2.92Å; D1821-V1823 VanDerWaalsContact C-N 3.27Å; D1821-V1823 PolarHBondContact O-N 2.66Å; D1821-T1824 WeakPolarHBondContact O-CA 3.25Å; D1821-T1824 PolarHBondContact O-N 3.35Å; D1821-T1824 PolarHBondContact O-OG1 3.29Å; D1821-L1825 PolarHBondContact O-N 3.44Å
1822	V	84.2	Confident	84.7	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-54.3	-39.1	177.7	179.1	0	0	0	0	112.2	I1817 K1818 L1820 T1824 L1825 L1826 L1848 V1861	I1817-V1822 HydrophobicContact CG2-CG2 4.27Å; K1818-V1822 PolarHBondContact O-N 3.07Å; L1820-V1822 VanDerWaalsContact C-N 3.26Å; L1820-V1822 PolarHBondContact O-N 3.47Å; V1822-T1824 VanDerWaalsContact C-N 3.31Å; V1822-T1824 PolarHBondContact O-N 2.98Å; V1822-L1825 PolarHBondContact O-N 3.31Å; V1822-L1826 HydrophobicContact CG1-CD1 3.94Å; V1822-L1826 HydrophobicContact CG1-CG 4.26Å; V1822-L1826 WeakPolarHBondContact O-CB 3.2Å; V1822-L1826 VanDerWaalsContact O-CG 3.31Å; V1822-L1826 WeakPolarHBondContact O-CG 3.32Å; V1822-L1826 PolarHBondContact O-N 3.21Å; V1822-L1848 HydrophobicContact CG1-CD2 4.33Å; V1822-V1861 HydrophobicContact CG2-CG2 4.47Å
1823	V	81.6	Confident	84.6	Confident	6 Å²	6	47.8 Å²	47.8	4%	0.036	24%	0.242	C	C	.	.	H	α-helix	trans	-66.7	-35.9	177.5	-178.2	0	0	0	0	111.2	L1820 D1821 R1827 L1848 Y1917	L1820-V1823 PolarHBondContact O-N 3.13Å; D1821-V1823 VanDerWaalsContact C-N 3.27Å; D1821-V1823 PolarHBondContact O-N 2.66Å; V1823-R1827 WeakPolarHBondContact O-CG 3.5Å; V1823-R1827 PolarHBondContact O-N 2.74Å; V1823-L1848 HydrophobicContact CG2-CD1 3.78Å; V1823-Y1917 HydrophobicContact CG2-CE1 4.47Å; V1823-Y1917 HydrophobicContact CG2-CE2 4.39Å; V1823-Y1917 VanDerWaalsContact CG2-OH 3.24Å; V1823-Y1917 WeakPolarHBondContact CG2-OH 3.33Å
1824	T	84.8	Confident	84.3	Confident	69 Å²	69	46.8 Å²	46.8	42%	0.423	23%	0.233	S	C	.	.	H	α-helix	trans	-72.1	-40.1	177.4	75.1	0	0	0	0	111.5	Y1809 D1821 V1822 R1827 K1828	Y1809-T1824 VanDerWaalsContact CE1-OG1 3.29Å; Y1809-T1824 WeakPolarHBondContact CE1-OG1 3.46Å; Y1809-T1824 PolarHBondContact OH-OG1 3.13Å; D1821-T1824 WeakPolarHBondContact O-CA 3.25Å; D1821-T1824 PolarHBondContact O-N 3.35Å; D1821-T1824 PolarHBondContact O-OG1 3.29Å; V1822-T1824 VanDerWaalsContact C-N 3.31Å; V1822-T1824 PolarHBondContact O-N 2.98Å; T1824-R1827 PolarHBondContact O-N 3.31Å; T1824-K1828 WeakPolarHBondContact O-CB 3.4Å; T1824-K1828 PolarHBondContact O-N 3.26Å; T1824-K1828 VanDerWaalsContact O-N 3.11Å
1825	L	87.1	Confident	84.2	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-46.1	175.4	174.8	144.2	0	0	0	111.4	F1802 W1806 Y1809 I1817 D1821 V1822 R1827 K1828 I1829	F1802-L1825 HydrophobicContact CD2-CD2 4.31Å; F1802-L1825 HydrophobicContact CE2-CD2 3.91Å; W1806-L1825 HydrophobicContact CE3-CD1 4.22Å; Y1809-L1825 HydrophobicContact CD2-CB 4.49Å; Y1809-L1825 HydrophobicContact CD2-CD1 3.96Å; Y1809-L1825 HydrophobicContact CE2-CB 4.03Å; Y1809-L1825 HydrophobicContact CE2-CD1 4.23Å; Y1809-L1825 HydrophobicContact CE2-CG 4.5Å; I1817-L1825 HydrophobicContact CD1-CD1 4.27Å; D1821-L1825 PolarHBondContact O-N 3.44Å; V1822-L1825 PolarHBondContact O-N 3.31Å; L1825-R1827 VanDerWaalsContact C-N 3.3Å; L1825-R1827 PolarHBondContact O-N 2.79Å; L1825-K1828 WeakPolarHBondContact O-CB 3.47Å; L1825-K1828 PolarHBondContact O-N 2.81Å; L1825-I1829 HydrophobicContact CD2-CD1 3.51Å; L1825-I1829 HydrophobicContact CG-CD1 4.05Å; L1825-I1829 WeakPolarHBondContact O-CD1 3.46Å; L1825-I1829 WeakPolarHBondContact O-CG1 3.5Å; L1825-I1829 PolarHBondContact O-N 2.97Å
1826	L	85.2	Confident	83.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.8	-22.6	178.4	-68.1	177.3	0	0	0	114.4	V1822 I1829 F1835 L1848 L1870	V1822-L1826 HydrophobicContact CG1-CD1 3.94Å; V1822-L1826 HydrophobicContact CG1-CG 4.26Å; V1822-L1826 WeakPolarHBondContact O-CB 3.2Å; V1822-L1826 VanDerWaalsContact O-CG 3.31Å; V1822-L1826 WeakPolarHBondContact O-CG 3.32Å; V1822-L1826 PolarHBondContact O-N 3.21Å; L1826-I1829 HydrophobicContact CD2-CD1 4.14Å; L1826-F1835 HydrophobicContact CB-CD2 3.74Å; L1826-F1835 HydrophobicContact CB-CE2 3.76Å; L1826-F1835 HydrophobicContact CD1-CE2 3.81Å; L1826-F1835 HydrophobicContact CD1-CZ 4.37Å; L1826-F1835 HydrophobicContact CG-CE2 4.38Å; L1826-F1835 PolarHBondContact O-N 3.39Å; L1826-L1848 HydrophobicContact CD1-CD1 4.23Å; L1826-L1848 HydrophobicContact CD1-CD2 3.71Å; L1826-L1848 HydrophobicContact CD1-CG 4.02Å; L1826-L1870 HydrophobicContact CD2-CD1 3.86Å; L1826-L1870 HydrophobicContact CD2-CD2 3.63Å; L1826-L1870 HydrophobicContact CD2-CG 4.36Å
1827	R	86	Confident	83.1	Confident	99 Å²	99	47 Å²	47	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-84.1	-14.7	169.6	-70.9	-179	68.2	-145.2	-2.7	113.4	V1823 T1824 L1825 G1836 K1837	V1823-R1827 WeakPolarHBondContact O-CG 3.5Å; V1823-R1827 PolarHBondContact O-N 2.74Å; T1824-R1827 PolarHBondContact O-N 3.31Å; L1825-R1827 VanDerWaalsContact C-N 3.3Å; L1825-R1827 PolarHBondContact O-N 2.79Å; R1827-G1836 CarbonylContact O-C 3.18Å; R1827-K1837 PolarHBondContact NH2-O 3.26Å; R1827-K1837 PolarHBondContact O-N 2.85Å
1828	K	85.7	Confident	82.2	Confident	104 Å²	104	54.8 Å²	54.8	45%	0.452	28%	0.279	S	S	.	.	H	α-helix	trans	-89.2	-32.4	177.3	-168.3	171.5	-178.5	-177.2	0	112.5	L1805 E1808 T1824 L1825	L1805-K1828 HydrophobicContact CD1-CG 4.19Å; L1805-K1828 HydrophobicContact CD2-CD 3.88Å; L1805-K1828 HydrophobicContact CD2-CG 4.15Å; E1808-K1828 IonicContact OE2-NZ 3.45Å; E1808-K1828 PolarHBondContact OE2-NZ 2.88Å; T1824-K1828 WeakPolarHBondContact O-CB 3.4Å; T1824-K1828 PolarHBondContact O-N 3.26Å; T1824-K1828 VanDerWaalsContact O-N 3.11Å; L1825-K1828 WeakPolarHBondContact O-CB 3.47Å; L1825-K1828 PolarHBondContact O-N 2.81Å
1829	I	86.3	Confident	81.5	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	26%	0.258	C	S	.	.	S	Bend	trans	-69.9	141.5	175.2	-62.4	152.7	0	0	0	111.1	E1801 F1802 L1805 L1825 L1826 L1833 G1836	E1801-I1829 WeakPolarHBondContact OE1-CA 3.21Å; F1802-I1829 HydrophobicContact CD2-CD1 3.62Å; F1802-I1829 HydrophobicContact CE2-CD1 4.32Å; L1805-I1829 HydrophobicContact CD1-CB 4.31Å; L1805-I1829 HydrophobicContact CD1-CG1 3.54Å; L1825-I1829 HydrophobicContact CD2-CD1 3.51Å; L1825-I1829 HydrophobicContact CG-CD1 4.05Å; L1825-I1829 WeakPolarHBondContact O-CD1 3.46Å; L1825-I1829 WeakPolarHBondContact O-CG1 3.5Å; L1825-I1829 PolarHBondContact O-N 2.97Å; L1826-I1829 HydrophobicContact CD2-CD1 4.14Å; I1829-L1833 HydrophobicContact CG2-CB 4.21Å; I1829-L1833 HydrophobicContact CG2-CD2 4.45Å; I1829-L1833 HydrophobicContact CG2-CG 4.47Å; I1829-G1836 PolarHBondContact O-N 3.47Å
1830	S	82	Confident	81.1	Confident	33 Å²	33	52 Å²	52	23%	0.231	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-65.2	142.7	173.9	67.9	0	0	0	0	113.8	E1801 L1833 G1834	E1801-S1830 PolarHBondContact OE1-N 3.26Å; E1801-S1830 WeakPolarHBondContact OE2-CB 3.47Å; E1801-S1830 PolarHBondContact OE2-OG 3.08Å; S1830-L1833 PolarHBondContact O-N 2.95Å; S1830-G1834 PolarHBondContact O-N 3.02Å
1831	P	79.7	Confident	80.7	Confident	69 Å²	69	51.6 Å²	51.6	45%	0.448	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	141.8	159.3	-19.1	33	0	0	0	109.8	G1834	P1831-G1834 WeakPolarHBondContact CA-O 3.15Å
1832	P	76.9	Confident	80.3	Confident	44 Å²	44	57 Å²	57	29%	0.286	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.1	-11	17.9	33.5	-36.4	0	0	0	115.9	I1793 L1794 N1874	I1793-P1832 WeakPolarHBondContact O-CG 3.43Å; L1794-P1832 HydrophobicContact CD1-CG 4.45Å; P1832-N1874 PolarHBondContact O-ND2 3.15Å; P1832-N1874 PolarHBondContact O-OD1 3.41Å
1833	L	81.9	Confident	80.1	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.016	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-40.2	-176.3	-174.7	66.5	0	0	0	112.7	L1794 H1798 L1799 F1802 I1829 S1830 L1870	L1794-L1833 HydrophobicContact CD1-CB 4.3Å; L1794-L1833 HydrophobicContact CD1-CD1 4.28Å; H1798-L1833 HydrophobicContact CB-CB 4.03Å; H1798-L1833 HydrophobicContact CB-CD2 4.17Å; H1798-L1833 WeakPolarHBondContact O-CD2 3.12Å; L1799-L1833 HydrophobicContact CD2-CD1 4.27Å; L1799-L1833 HydrophobicContact CD2-CD2 3.99Å; F1802-L1833 HydrophobicContact CB-CD2 3.9Å; I1829-L1833 HydrophobicContact CG2-CB 4.21Å; I1829-L1833 HydrophobicContact CG2-CD2 4.45Å; I1829-L1833 HydrophobicContact CG2-CG 4.47Å; S1830-L1833 PolarHBondContact O-N 2.95Å; L1833-L1870 HydrophobicContact CD1-CB 3.77Å
1834	G	81.5	Confident	79.8	Confident	6 Å²	6	59.9 Å²	59.9	6%	0.062	31%	0.306	C	S	.	.	S	Bend	trans	-99.7	-176.4	176.1	0	0	0	0	0	113.1	S1830 P1831	S1830-G1834 PolarHBondContact O-N 3.02Å; P1831-G1834 WeakPolarHBondContact CA-O 3.15Å
1835	F	83.1	Confident	79.4	Confident	40 Å²	40	56.7 Å²	56.7	18%	0.175	29%	0.286	C	S	.	.			trans	-99.3	-11.6	-179.7	-53.5	-49.5	0	0	0	113.7	L1826 C1839 A1844 T1847 M1851	L1826-F1835 HydrophobicContact CB-CD2 3.74Å; L1826-F1835 HydrophobicContact CB-CE2 3.76Å; L1826-F1835 HydrophobicContact CD1-CE2 3.81Å; L1826-F1835 HydrophobicContact CD1-CZ 4.37Å; L1826-F1835 HydrophobicContact CG-CE2 4.38Å; L1826-F1835 PolarHBondContact O-N 3.39Å; F1835-C1839 HydrophobicContact CB-CB 3.59Å; F1835-C1839 VanDerWaalsContact O-CB 3.29Å; F1835-C1839 WeakPolarHBondContact O-CB 3.44Å; F1835-A1844 HydrophobicContact CD2-CB 3.54Å; F1835-A1844 HydrophobicContact CE2-CB 3.65Å; F1835-A1844 HydrophobicContact CG-CB 4.38Å; F1835-T1847 HydrophobicContact CE1-CG2 3.97Å; F1835-T1847 HydrophobicContact CZ-CG2 4.19Å; F1835-M1851 HydrophobicContact CE1-CE 4.31Å; F1835-M1851 HydrophobicContact CZ-CE 3.83Å
1836	G	77.3	Confident	79	Confident	14 Å²	14	59.2 Å²	59.2	14%	0.144	30%	0.301	C	S	.	.			trans	66.1	175.2	-172.2	0	0	0	0	0	114.6	R1827 I1829	R1827-G1836 CarbonylContact O-C 3.18Å; I1829-G1836 PolarHBondContact O-N 3.47Å
1837	K	74.7	Confident	78.6	Confident	170 Å²	170	60.6 Å²	60.6	74%	0.739	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-40.1	-170.6	-63.5	175.4	-175.8	170.6	0	113.3	R1827 C1839	R1827-K1837 PolarHBondContact NH2-O 3.26Å; R1827-K1837 PolarHBondContact O-N 2.85Å; K1837-C1839 VanDerWaalsContact C-N 3.33Å; K1837-C1839 PolarHBondContact O-N 2.54Å
1838	L	71.2	Confident	78.2	Confident	171 Å²	171	55.9 Å²	55.9	90%	0.895	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-14	-174.8	-85.8	71.2	0	0	0	114	P1840	L1838-P1840 WeakPolarHBondContact O-CD 3.45Å
1839	C	71.8	Confident	77.8	Confident	17 Å²	17	53.1 Å²	53.1	12%	0.115	28%	0.284	C	S	.	.	S	Bend	trans	-60.9	122.8	-177.5	178.2	0	0	0	0	111.3	F1835 K1837	F1835-C1839 HydrophobicContact CB-CB 3.59Å; F1835-C1839 VanDerWaalsContact O-CB 3.29Å; F1835-C1839 WeakPolarHBondContact O-CB 3.44Å; K1837-C1839 VanDerWaalsContact C-N 3.33Å; K1837-C1839 PolarHBondContact O-N 2.54Å
1840	P	74	Confident	77.3	Confident	82 Å²	82	61.7 Å²	61.7	53%	0.532	32%	0.316	S	S	.	.			trans	-66.7	137.1	178.6	27.1	-33.6	0	0	0	109.9	L1838 R1842 T1843 A1844	L1838-P1840 WeakPolarHBondContact O-CD 3.45Å; P1840-R1842 PolarHBondContact O-N 3.26Å; P1840-T1843 PolarHBondContact O-N 3.46Å; P1840-A1844 PolarHBondContact O-N 2.79Å
1841	H	73.7	Confident	76.8	Confident	96 Å²	96	60.4 Å²	60.4	44%	0.444	31%	0.307	S	S	.	.	H	α-helix	trans	-48.2	-37.9	-173.3	-172.7	-94.1	0	0	0	113.5	T1843 A1844 C1845	H1841-T1843 PolarHBondContact O-N 3.04Å; H1841-A1844 PolarHBondContact O-N 3.35Å; H1841-C1845 PolarHBondContact CE1-SG 3.46Å; H1841-C1845 PolarHBondContact O-N 3.48Å; H1841-C1845 PolarHBondContact O-SG 3.14Å; H1841-C1845 VanDerWaalsContact O-SG 3.33Å
1842	R	77.9	Confident	76.5	Confident	168 Å²	168	61.8 Å²	61.8	63%	0.634	31%	0.31	S	S	*	.	H	α-helix	trans	-58.1	-42.9	175.9	-174.1	178.9	176.7	-156.8	-2.4	113.2	P1840 C1845 V1846 L1921	P1840-R1842 PolarHBondContact O-N 3.26Å; R1842-C1845 PolarHBondContact O-N 2.96Å; R1842-V1846 WeakPolarHBondContact O-CB 3.38Å; R1842-V1846 VanDerWaalsContact O-CG2 3.28Å; R1842-V1846 WeakPolarHBondContact O-CG2 3.49Å; R1842-V1846 PolarHBondContact O-N 2.92Å; R1842-L1921 HydrophobicContact CG-CD2 4.48Å
1843	T	78.8	Confident	76.5	Confident	71 Å²	71	59.8 Å²	59.8	44%	0.436	30%	0.297	S	S	.	.	H	α-helix	trans	-71.7	-38.1	-179	-59.9	0	0	0	0	111.4	P1840 H1841 V1846 T1847	P1840-T1843 PolarHBondContact O-N 3.46Å; H1841-T1843 PolarHBondContact O-N 3.04Å; T1843-V1846 PolarHBondContact O-N 3.25Å; T1843-T1847 PolarHBondContact O-N 3.43Å; T1843-T1847 PolarHBondContact O-OG1 3.19Å
1844	A	76.4	Confident	76.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.2	-48.3	170.7	0	0	0	0	0	111.5	F1835 P1840 H1841 T1847 L1848	F1835-A1844 HydrophobicContact CD2-CB 3.54Å; F1835-A1844 HydrophobicContact CE2-CB 3.65Å; F1835-A1844 HydrophobicContact CG-CB 4.38Å; P1840-A1844 PolarHBondContact O-N 2.79Å; H1841-A1844 PolarHBondContact O-N 3.35Å; A1844-T1847 PolarHBondContact O-N 2.66Å; A1844-L1848 WeakPolarHBondContact O-CB 3.47Å; A1844-L1848 PolarHBondContact O-N 3.21Å
1845	C	75.8	Confident	76.1	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.007	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-45.1	176.2	-69.9	0	0	0	0	112.9	H1841 R1842 T1847 L1848 V1849 Y1917 L1921	H1841-C1845 PolarHBondContact CE1-SG 3.46Å; H1841-C1845 PolarHBondContact O-N 3.48Å; H1841-C1845 PolarHBondContact O-SG 3.14Å; H1841-C1845 VanDerWaalsContact O-SG 3.33Å; R1842-C1845 PolarHBondContact O-N 2.96Å; C1845-T1847 VanDerWaalsContact C-N 3.29Å; C1845-T1847 PolarHBondContact O-N 2.93Å; C1845-L1848 WeakPolarHBondContact O-CB 3.02Å; C1845-L1848 PolarHBondContact O-N 3.28Å; C1845-V1849 WeakPolarHBondContact O-CG2 3.25Å; C1845-V1849 PolarHBondContact O-N 3.02Å; C1845-Y1917 HydrophobicContact CB-CD1 4.16Å; C1845-Y1917 VanDerWaalsContact SG-CD1 3.55Å; C1845-L1921 HydrophobicContact CB-CD1 4.49Å
1846	V	79.4	Confident	75.8	Confident	54 Å²	54	62.9 Å²	62.9	33%	0.327	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-37	178.1	166.7	0	0	0	0	111.5	R1842 T1843 V1849 R1850 L1921	R1842-V1846 WeakPolarHBondContact O-CB 3.38Å; R1842-V1846 VanDerWaalsContact O-CG2 3.28Å; R1842-V1846 WeakPolarHBondContact O-CG2 3.49Å; R1842-V1846 PolarHBondContact O-N 2.92Å; T1843-V1846 PolarHBondContact O-N 3.25Å; V1846-V1849 PolarHBondContact O-N 3.18Å; V1846-R1850 PolarHBondContact O-N 3.49Å; V1846-L1921 HydrophobicContact CG2-CD1 4.1Å
1847	T	77.4	Confident	75.9	Confident	29 Å²	29	67.6 Å²	67.6	18%	0.178	35%	0.347	C	S	.	.	H	α-helix	trans	-74.7	-37.5	177.7	-44	0	0	0	0	111.4	F1835 T1843 A1844 C1845 V1849 R1850 M1851	F1835-T1847 HydrophobicContact CE1-CG2 3.97Å; F1835-T1847 HydrophobicContact CZ-CG2 4.19Å; T1843-T1847 PolarHBondContact O-N 3.43Å; T1843-T1847 PolarHBondContact O-OG1 3.19Å; A1844-T1847 PolarHBondContact O-N 2.66Å; C1845-T1847 VanDerWaalsContact C-N 3.29Å; C1845-T1847 PolarHBondContact O-N 2.93Å; T1847-V1849 VanDerWaalsContact C-N 3.26Å; T1847-V1849 PolarHBondContact O-N 3.3Å; T1847-R1850 WeakPolarHBondContact O-CB 3.43Å; T1847-R1850 PolarHBondContact O-N 2.89Å; T1847-M1851 HydrophobicContact CG2-CE 3.98Å; T1847-M1851 WeakPolarHBondContact O-CG 3.43Å; T1847-M1851 PolarHBondContact O-N 3.12Å; T1847-M1851 VanDerWaalsContact O-N 3.13Å
1848	L	77.7	Confident	75.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-58.1	-34.8	169.9	-86.8	165.6	0	0	0	113.2	V1822 V1823 L1826 A1844 C1845 R1850 M1851 M1853 V1913	V1822-L1848 HydrophobicContact CG1-CD2 4.33Å; V1823-L1848 HydrophobicContact CG2-CD1 3.78Å; L1826-L1848 HydrophobicContact CD1-CD1 4.23Å; L1826-L1848 HydrophobicContact CD1-CD2 3.71Å; L1826-L1848 HydrophobicContact CD1-CG 4.02Å; A1844-L1848 WeakPolarHBondContact O-CB 3.47Å; A1844-L1848 PolarHBondContact O-N 3.21Å; C1845-L1848 WeakPolarHBondContact O-CB 3.02Å; C1845-L1848 PolarHBondContact O-N 3.28Å; L1848-R1850 VanDerWaalsContact C-N 3.35Å; L1848-M1851 HydrophobicContact CD2-SD 3.98Å; L1848-M1851 PolarHBondContact O-N 3.33Å; L1848-M1853 HydrophobicContact CD2-CE 4.27Å; L1848-V1913 HydrophobicContact CD2-CG1 4.48Å
1849	V	75.9	Confident	76.4	Confident	47 Å²	47	56.9 Å²	56.9	29%	0.285	30%	0.303	S	S	.	.	H	α-helix	trans	-63.1	-40.7	173.2	173.8	0	0	0	0	111.2	C1845 V1846 T1847 M1851 N1852 A1918	C1845-V1849 WeakPolarHBondContact O-CG2 3.25Å; C1845-V1849 PolarHBondContact O-N 3.02Å; V1846-V1849 PolarHBondContact O-N 3.18Å; T1847-V1849 VanDerWaalsContact C-N 3.26Å; T1847-V1849 PolarHBondContact O-N 3.3Å; V1849-M1851 VanDerWaalsContact C-N 3.34Å; V1849-M1851 PolarHBondContact O-N 2.82Å; V1849-N1852 PolarHBondContact O-N 3.26Å; V1849-A1918 HydrophobicContact CG2-CB 4.49Å
1850	R	75.6	Confident	77.1	Confident	180 Å²	180	56.7 Å²	56.7	68%	0.679	30%	0.302	S	S	*	.	H	α-helix	trans	-69.3	-27.2	177.9	-65.1	175.2	175.2	178.5	-3	113.8	V1846 T1847 L1848 N1852	V1846-R1850 PolarHBondContact O-N 3.49Å; T1847-R1850 WeakPolarHBondContact O-CB 3.43Å; T1847-R1850 PolarHBondContact O-N 2.89Å; L1848-R1850 VanDerWaalsContact C-N 3.35Å; R1850-N1852 PolarHBondContact O-N 2.87Å
1851	M	72.3	Confident	77.8	Confident	7 Å²	7	52.8 Å²	52.8	3%	0.034	28%	0.276	C	S	.	.	H	α-helix	trans	-66.4	-25.6	178.2	-69.4	173.2	-170.2	0	0	112.9	F1835 T1847 L1848 V1849 M1853 A1869 L1870 R1872 T1873	F1835-M1851 HydrophobicContact CE1-CE 4.31Å; F1835-M1851 HydrophobicContact CZ-CE 3.83Å; T1847-M1851 HydrophobicContact CG2-CE 3.98Å; T1847-M1851 WeakPolarHBondContact O-CG 3.43Å; T1847-M1851 PolarHBondContact O-N 3.12Å; T1847-M1851 VanDerWaalsContact O-N 3.13Å; L1848-M1851 HydrophobicContact CD2-SD 3.98Å; L1848-M1851 PolarHBondContact O-N 3.33Å; V1849-M1851 VanDerWaalsContact C-N 3.34Å; V1849-M1851 PolarHBondContact O-N 2.82Å; M1851-M1853 VanDerWaalsContact C-N 3.35Å; M1851-M1853 HydrophobicContact CB-CE 4.31Å; M1851-M1853 PolarHBondContact O-N 3.06Å; M1851-M1853 HydrophobicContact SD-CE 3.94Å; M1851-A1869 HydrophobicContact CB-CB 4.25Å; M1851-L1870 HydrophobicContact CE-CD2 3.49Å; M1851-L1870 VanDerWaalsContact CE-CD2 3.49Å; M1851-L1870 HydrophobicContact SD-CD2 3.8Å; M1851-L1870 HydrophobicContact SD-CG 4.49Å; M1851-R1872 PolarHBondContact O-NH2 2.94Å; M1851-T1873 HydrophobicContact CG-CG2 4.38Å
1852	N	73.8	Confident	78.4	Confident	98 Å²	98	49.7 Å²	49.7	52%	0.524	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	45.7	-178	-162.3	34	0	0	0	114.6	V1849 R1850 T1912	V1849-N1852 PolarHBondContact O-N 3.26Å; R1850-N1852 PolarHBondContact O-N 2.87Å; N1852-T1912 WeakPolarHBondContact OD1-CB 3.26Å; N1852-T1912 WeakPolarHBondContact OD1-CG2 3.35Å; N1852-T1912 PolarHBondContact OD1-OG1 2.83Å
1853	M	77.2	Confident	79	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.233	C	C	.	.			trans	-74.9	130.6	-173.4	-159.8	177.8	-68.5	0	0	111.9	L1848 M1851 V1861 T1866 A1869 T1912 V1913	L1848-M1853 HydrophobicContact CD2-CE 4.27Å; M1851-M1853 VanDerWaalsContact C-N 3.35Å; M1851-M1853 HydrophobicContact CB-CE 4.31Å; M1851-M1853 PolarHBondContact O-N 3.06Å; M1851-M1853 HydrophobicContact SD-CE 3.94Å; M1853-V1861 HydrophobicContact CG-CG1 3.77Å; M1853-V1861 HydrophobicContact SD-CG1 3.57Å; M1853-V1861 VanDerWaalsContact SD-CG1 3.57Å; M1853-T1866 HydrophobicContact CE-CG2 3.88Å; M1853-T1866 HydrophobicContact SD-CG2 3.88Å; M1853-A1869 HydrophobicContact CE-CB 4.08Å; M1853-T1912 CarbonylContact O-C 3.52Å; M1853-T1912 VanDerWaalsContact O-CA 3.3Å; M1853-T1912 WeakPolarHBondContact O-CA 3.14Å; M1853-T1912 VanDerWaalsContact O-CB 3.29Å; M1853-T1912 WeakPolarHBondContact O-CB 3.2Å; M1853-V1913 HydrophobicContact CB-CB 4.27Å; M1853-V1913 HydrophobicContact CB-CG2 4.2Å; M1853-V1913 PolarHBondContact O-N 2.98Å
1854	P	76.3	Confident	79.3	Confident	45 Å²	45	39.6 Å²	39.6	29%	0.292	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-71.7	146.1	-178	29	-35	0	0	0	112.5	A1865	P1854-A1865 HydrophobicContact CG-CB 4.02Å
1855	L	76.9	Confident	79.8	Confident	36 Å²	36	39.8 Å²	39.8	19%	0.188	22%	0.22	C	C	.	.			trans	-113.6	127.2	178.8	-171	70	0	0	0	110.3	H1819 V1861 V1911 V1913	H1819-L1855 HydrophobicContact CB-CD1 3.95Å; L1855-V1861 HydrophobicContact CD1-CG2 3.9Å; L1855-V1911 WeakPolarHBondContact CB-O 3.16Å; L1855-V1911 HydrophobicContact CD2-CG1 4.15Å; L1855-V1911 PolarHBondContact N-O 3.21Å; L1855-V1913 HydrophobicContact CB-CG2 4.5Å; L1855-V1913 HydrophobicContact CD1-CG2 4.22Å
1856	N	78.8	Confident	80.3	Confident	33 Å²	33	39.7 Å²	39.7	18%	0.176	22%	0.219	C	C	.	.			trans	-70.1	159.3	172.6	-59.9	-36.5	0	0	0	111	D1858 G1859 T1860 M1862	N1856-D1858 PolarHBondContact O-N 3.5Å; N1856-G1859 PolarHBondContact O-N 2.85Å; N1856-T1860 VanDerWaalsContact CB-O 3.29Å; N1856-T1860 WeakPolarHBondContact CB-O 3.35Å; N1856-T1860 PolarHBondContact N-O 2.9Å; N1856-T1860 PolarHBondContact ND2-O 3.12Å; N1856-T1860 PolarHBondContact ND2-OG1 2.74Å; N1856-T1860 VanDerWaalsContact ND2-OG1 3.13Å; N1856-M1862 PolarHBondContact ND2-SD 3.48Å; N1856-M1862 VanDerWaalsContact ND2-SD 3.44Å
1857	S	77.4	Confident	80.8	Confident	114 Å²	114	37.1 Å²	37.1	80%	0.797	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-42.2	-41.3	170.2	44	0	0	0	0	114	G1859	S1857-G1859 PolarHBondContact O-N 3.35Å; S1857-G1859 VanDerWaalsContact O-N 3.12Å
1858	D	76.5	Confident	81.2	Confident	97 Å²	97	36.1 Å²	36.1	52%	0.519	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	8.9	-173.4	-52.8	19.7	0	0	0	113.2	R1816 N1856 T1860	R1816-D1858 IonicContact CZ-OD2 3.56Å; R1816-D1858 IonicContact NH1-OD2 2.75Å; R1816-D1858 PolarHBondContact NH1-OD2 3.43Å; R1816-D1858 IonicContact NH2-OD2 2.69Å; R1816-D1858 PolarHBondContact NH2-OD2 3.33Å; N1856-D1858 PolarHBondContact O-N 3.5Å; D1858-T1860 HydrophobicContact CB-CG2 4.25Å; D1858-T1860 PolarHBondContact O-N 2.91Å
1859	G	80.4	Confident	81.5	Confident	19 Å²	19	36.4 Å²	36.4	20%	0.196	20%	0.199	C	C	.	.	S	Bend	trans	66.7	20.1	-171.9	0	0	0	0	0	113.7	H1819 N1856 S1857	H1819-G1859 PolarHBondContact N-O 3.45Å; H1819-G1859 PolarHBondContact ND1-O 3.28Å; N1856-G1859 PolarHBondContact O-N 2.85Å; S1857-G1859 PolarHBondContact O-N 3.35Å; S1857-G1859 VanDerWaalsContact O-N 3.12Å
1860	T	87.6	Confident	82	Confident	13 Å²	13	34.2 Å²	34.2	8%	0.08	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	156.1	-178.6	56.3	0	0	0	0	112.3	R1816 I1817 K1818 N1856 D1858	R1816-T1860 PolarHBondContact NH1-OG1 3.13Å; I1817-T1860 CarbonylContact O-C 3.28Å; I1817-T1860 WeakPolarHBondContact O-CA 3.4Å; I1817-T1860 WeakPolarHBondContact O-CB 3.13Å; K1818-T1860 HydrophobicContact CG-CG2 4.4Å; N1856-T1860 VanDerWaalsContact CB-O 3.29Å; N1856-T1860 WeakPolarHBondContact CB-O 3.35Å; N1856-T1860 PolarHBondContact N-O 2.9Å; N1856-T1860 PolarHBondContact ND2-O 3.12Å; N1856-T1860 PolarHBondContact ND2-OG1 2.74Å; N1856-T1860 VanDerWaalsContact ND2-OG1 3.13Å; D1858-T1860 HydrophobicContact CB-CG2 4.25Å; D1858-T1860 PolarHBondContact O-N 2.91Å
1861	V	87.3	Confident	82.5	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.3	-179.2	-172.8	0	0	0	0	109	R1816 I1817 H1819 V1822 M1853 L1855 T1866 V1913	R1816-V1861 VanDerWaalsContact CA-O 3.28Å; R1816-V1861 WeakPolarHBondContact CA-O 3.39Å; I1817-V1861 PolarHBondContact N-O 3.02Å; I1817-V1861 VanDerWaalsContact N-O 3.15Å; I1817-V1861 PolarHBondContact O-N 2.96Å; H1819-V1861 HydrophobicContact CB-CG2 4.19Å; V1822-V1861 HydrophobicContact CG2-CG2 4.47Å; M1853-V1861 HydrophobicContact CG-CG1 3.77Å; M1853-V1861 HydrophobicContact SD-CG1 3.57Å; M1853-V1861 VanDerWaalsContact SD-CG1 3.57Å; L1855-V1861 HydrophobicContact CD1-CG2 3.9Å; V1861-T1866 WeakPolarHBondContact CG1-OG1 3.08Å; V1861-V1913 HydrophobicContact CG2-CG2 3.81Å
1862	M	86.8	Confident	83	Confident	30 Å²	30	27.7 Å²	27.7	15%	0.148	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	141.3	-177.3	-60.3	-65.7	-152.4	0	0	112.3	R1816 N1856 A1865 T1866 L2312	R1816-M1862 HydrophobicContact CB-SD 4.19Å; N1856-M1862 PolarHBondContact ND2-SD 3.48Å; N1856-M1862 VanDerWaalsContact ND2-SD 3.44Å; M1862-A1865 HydrophobicContact CB-CB 4.2Å; M1862-A1865 PolarHBondContact O-N 2.86Å; M1862-T1866 PolarHBondContact O-N 2.92Å; M1862-T1866 PolarHBondContact O-OG1 3.13Å; M1862-L2312 HydrophobicContact CE-CD1 4.23Å
1863	F	90.3	Very high	83.4	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-52.1	-59.8	-179.5	169.3	-102.2	0	0	0	113.2	A1326 F1802 I1803 W1806 G1815 A1865 T1866 L1867	A1326-F1863 HydrophobicContact CB-CE1 3.77Å; A1326-F1863 HydrophobicContact CB-CZ 3.91Å; F1802-F1863 AromaticContact CD1-CE2 3.85Å; F1802-F1863 HydrophobicContact CD1-CE2 3.85Å; F1802-F1863 AromaticContact CE1-CD2 3.75Å; F1802-F1863 HydrophobicContact CE1-CD2 3.75Å; F1802-F1863 AromaticContact CE1-CE2 3.46Å; F1802-F1863 HydrophobicContact CE1-CE2 3.46Å; F1802-F1863 VanDerWaalsContact CE1-CE2 3.46Å; F1802-F1863 HydrophobicContact CE1-CZ 4.35Å; I1803-F1863 HydrophobicContact CD1-CZ 4.41Å; I1803-F1863 HydrophobicContact CG1-CE2 4.01Å; I1803-F1863 HydrophobicContact CG1-CZ 3.71Å; W1806-F1863 HydrophobicContact CB-CD2 4.48Å; W1806-F1863 HydrophobicContact CD2-CB 4.43Å; W1806-F1863 AromaticContact CD2-CD2 3.57Å; W1806-F1863 HydrophobicContact CD2-CD2 3.57Å; W1806-F1863 HydrophobicContact CD2-CE2 4.41Å; W1806-F1863 HydrophobicContact CD2-CG 4.45Å; W1806-F1863 AromaticContact CE2-CD2 3.82Å; W1806-F1863 AromaticContact CE3-CD2 3.9Å; W1806-F1863 HydrophobicContact CE3-CD2 3.9Å; W1806-F1863 AromaticContact CG-CD2 3.82Å; W1806-F1863 HydrophobicContact CG-CD2 3.82Å; W1806-F1863 HydrophobicContact CG-CE2 4.32Å; W1806-F1863 HydrophobicContact CH2-CB 4.06Å; W1806-F1863 HydrophobicContact CZ2-CB 3.64Å; W1806-F1863 HydrophobicContact CZ2-CD2 4.36Å; W1806-F1863 HydrophobicContact CZ3-CD2 4.43Å; G1815-F1863 WeakPolarHBondContact O-CB 3.5Å; G1815-F1863 PolarHBondContact O-N 2.77Å; F1863-A1865 VanDerWaalsContact C-N 3.31Å; F1863-A1865 PolarHBondContact O-N 3.19Å; F1863-T1866 WeakPolarHBondContact O-CB 3.36Å; F1863-T1866 PolarHBondContact O-N 3.49Å; F1863-T1866 VanDerWaalsContact O-N 3.09Å; F1863-L1867 HydrophobicContact CE1-CD2 4.42Å; F1863-L1867 HydrophobicContact CZ-CD2 3.96Å; F1863-L1867 PolarHBondContact O-N 3.06Å
1864	N	86.5	Confident	83.6	Confident	23 Å²	23	28 Å²	28	12%	0.123	16%	0.164	C	C	.	.	H	α-helix	trans	-59.9	-38.3	-179	-72.2	8.1	0	0	0	112.7	A1326 T1866 L1867 F1868 L1897 L1901	A1326-N1864 PolarHBondContact O-OD1 3.44Å; N1864-T1866 VanDerWaalsContact C-N 3.33Å; N1864-T1866 PolarHBondContact O-N 2.86Å; N1864-L1867 PolarHBondContact O-N 3.33Å; N1864-F1868 WeakPolarHBondContact O-CB 3.25Å; N1864-F1868 PolarHBondContact O-N 3.33Å; N1864-L1897 HydrophobicContact CB-CD1 4.02Å; N1864-L1897 HydrophobicContact CB-CD2 4.24Å; N1864-L1897 WeakPolarHBondContact ND2-CD2 3.01Å; N1864-L1901 HydrophobicContact CB-CD2 4.26Å; N1864-L1901 WeakPolarHBondContact O-CD2 3.01Å
1865	A	85.3	Confident	83.6	Confident	4 Å²	4	27.4 Å²	27.4	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-32.9	178.6	0	0	0	0	0	112.4	P1854 M1862 F1863 A1869 L1901	P1854-A1865 HydrophobicContact CG-CB 4.02Å; M1862-A1865 HydrophobicContact CB-CB 4.2Å; M1862-A1865 PolarHBondContact O-N 2.86Å; F1863-A1865 VanDerWaalsContact C-N 3.31Å; F1863-A1865 PolarHBondContact O-N 3.19Å; A1865-A1869 VanDerWaalsContact O-CB 3.24Å; A1865-A1869 WeakPolarHBondContact O-CB 3.46Å; A1865-A1869 PolarHBondContact O-N 3.45Å; A1865-L1901 HydrophobicContact CB-CD2 4.2Å
1866	T	88	Confident	83.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.1	-53.2	173.1	-49.3	0	0	0	0	110.3	F1802 W1806 M1853 V1861 M1862 F1863 N1864 A1869 L1870	F1802-T1866 HydrophobicContact CE2-CG2 3.91Å; F1802-T1866 HydrophobicContact CZ-CG2 3.7Å; W1806-T1866 HydrophobicContact CZ3-CG2 4.15Å; M1853-T1866 HydrophobicContact CE-CG2 3.88Å; M1853-T1866 HydrophobicContact SD-CG2 3.88Å; V1861-T1866 WeakPolarHBondContact CG1-OG1 3.08Å; M1862-T1866 PolarHBondContact O-N 2.92Å; M1862-T1866 PolarHBondContact O-OG1 3.13Å; F1863-T1866 WeakPolarHBondContact O-CB 3.36Å; F1863-T1866 PolarHBondContact O-N 3.49Å; F1863-T1866 VanDerWaalsContact O-N 3.09Å; N1864-T1866 VanDerWaalsContact C-N 3.33Å; N1864-T1866 PolarHBondContact O-N 2.86Å; T1866-A1869 PolarHBondContact O-N 2.58Å; T1866-L1870 HydrophobicContact CG2-CD1 4.19Å; T1866-L1870 WeakPolarHBondContact O-CG 3.37Å; T1866-L1870 PolarHBondContact O-N 3.47Å; T1866-L1870 VanDerWaalsContact O-N 3.13Å
1867	L	88.3	Confident	83.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-47.6	-176.4	-176.1	53.7	0	0	0	112.3	F1322 A1323 A1326 L1799 F1802 F1863 N1864 A1869 L1870 V1871	F1322-L1867 HydrophobicContact CD1-CD2 4.47Å; A1323-L1867 HydrophobicContact CB-CD2 4.34Å; A1323-L1867 HydrophobicContact CB-CG 4.03Å; A1326-L1867 HydrophobicContact CB-CD2 3.83Å; L1799-L1867 HydrophobicContact CD2-CD1 3.77Å; F1802-L1867 HydrophobicContact CD1-CB 4.36Å; F1802-L1867 HydrophobicContact CD1-CD1 3.72Å; F1802-L1867 HydrophobicContact CD1-CD2 4.35Å; F1802-L1867 HydrophobicContact CD1-CG 4.37Å; F1802-L1867 HydrophobicContact CE1-CB 3.81Å; F1802-L1867 HydrophobicContact CE1-CD1 4.03Å; F1802-L1867 HydrophobicContact CE1-CD2 4.44Å; F1802-L1867 HydrophobicContact CE1-CG 4.31Å; F1802-L1867 HydrophobicContact CG-CD1 4.05Å; F1802-L1867 HydrophobicContact CZ-CB 4.24Å; F1863-L1867 HydrophobicContact CE1-CD2 4.42Å; F1863-L1867 HydrophobicContact CZ-CD2 3.96Å; F1863-L1867 PolarHBondContact O-N 3.06Å; N1864-L1867 PolarHBondContact O-N 3.33Å; L1867-A1869 PolarHBondContact O-N 2.88Å; L1867-L1870 PolarHBondContact O-N 3.17Å; L1867-V1871 WeakPolarHBondContact O-CG2 3.29Å; L1867-V1871 PolarHBondContact O-N 2.79Å
1868	F	87.3	Confident	83.1	Confident	7 Å²	7	30.7 Å²	30.7	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-39.4	179	-175	-97	0	0	0	112.5	A1323 L1324 N1864 L1870 V1871 R1872 L1882 I1886 L1901 V1902	A1323-F1868 HydrophobicContact CB-CD2 4.42Å; L1324-F1868 HydrophobicContact CD2-CD2 4.48Å; N1864-F1868 WeakPolarHBondContact O-CB 3.25Å; N1864-F1868 PolarHBondContact O-N 3.33Å; F1868-L1870 VanDerWaalsContact C-N 3.33Å; F1868-L1870 PolarHBondContact O-N 2.04Å; F1868-V1871 PolarHBondContact O-N 2.89Å; F1868-R1872 WeakPolarHBondContact O-CB 3.35Å; F1868-R1872 PolarHBondContact O-N 2.93Å; F1868-L1882 HydrophobicContact CZ-CD2 4.13Å; F1868-I1886 HydrophobicContact CZ-CD1 4.5Å; F1868-L1901 HydrophobicContact CB-CD1 4.33Å; F1868-L1901 HydrophobicContact CB-CD2 3.71Å; F1868-L1901 HydrophobicContact CB-CG 4.45Å; F1868-L1901 HydrophobicContact CD1-CB 3.8Å; F1868-L1901 HydrophobicContact CD1-CD2 4.24Å; F1868-L1901 HydrophobicContact CD1-CG 4.41Å; F1868-L1901 HydrophobicContact CD2-CD1 4.06Å; F1868-L1901 HydrophobicContact CE1-CB 3.95Å; F1868-L1901 WeakPolarHBondContact CE1-O 3.38Å; F1868-L1901 HydrophobicContact CG-CB 4.15Å; F1868-L1901 HydrophobicContact CG-CD1 4.09Å; F1868-L1901 HydrophobicContact CG-CD2 4.03Å; F1868-L1901 HydrophobicContact CG-CG 4.3Å; F1868-L1901 HydrophobicContact CZ-CB 4.41Å; F1868-V1902 HydrophobicContact CE1-CG2 3.64Å; F1868-V1902 HydrophobicContact CZ-CG2 3.62Å
1869	A	83.4	Confident	82.7	Confident	7 Å²	7	28.7 Å²	28.7	6%	0.058	15%	0.147	C	C	.	.	H	α-helix	trans	-67.6	-33.1	177.8	0	0	0	0	0	112.6	M1851 M1853 A1865 T1866 L1867 T1873	M1851-A1869 HydrophobicContact CB-CB 4.25Å; M1853-A1869 HydrophobicContact CE-CB 4.08Å; A1865-A1869 VanDerWaalsContact O-CB 3.24Å; A1865-A1869 WeakPolarHBondContact O-CB 3.46Å; A1865-A1869 PolarHBondContact O-N 3.45Å; T1866-A1869 PolarHBondContact O-N 2.58Å; L1867-A1869 PolarHBondContact O-N 2.88Å; A1869-T1873 VanDerWaalsContact O-CB 3.3Å; A1869-T1873 WeakPolarHBondContact O-CB 3.11Å; A1869-T1873 PolarHBondContact O-N 3.36Å; A1869-T1873 VanDerWaalsContact O-N 3.07Å; A1869-T1873 PolarHBondContact O-OG1 2.03Å
1870	L	86.2	Confident	82	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-50.6	171.5	-68.6	162.6	0	0	0	111.5	F1802 L1826 L1833 M1851 T1866 L1867 F1868 R1872 T1873 N1874	F1802-L1870 HydrophobicContact CD2-CD1 3.84Å; F1802-L1870 HydrophobicContact CE2-CD1 3.47Å; F1802-L1870 VanDerWaalsContact CE2-CD1 3.47Å; F1802-L1870 HydrophobicContact CZ-CD1 4.29Å; L1826-L1870 HydrophobicContact CD2-CD1 3.86Å; L1826-L1870 HydrophobicContact CD2-CD2 3.63Å; L1826-L1870 HydrophobicContact CD2-CG 4.36Å; L1833-L1870 HydrophobicContact CD1-CB 3.77Å; M1851-L1870 HydrophobicContact CE-CD2 3.49Å; M1851-L1870 VanDerWaalsContact CE-CD2 3.49Å; M1851-L1870 HydrophobicContact SD-CD2 3.8Å; M1851-L1870 HydrophobicContact SD-CG 4.49Å; T1866-L1870 HydrophobicContact CG2-CD1 4.19Å; T1866-L1870 WeakPolarHBondContact O-CG 3.37Å; T1866-L1870 PolarHBondContact O-N 3.47Å; T1866-L1870 VanDerWaalsContact O-N 3.13Å; L1867-L1870 PolarHBondContact O-N 3.17Å; F1868-L1870 VanDerWaalsContact C-N 3.33Å; F1868-L1870 PolarHBondContact O-N 2.04Å; L1870-R1872 PolarHBondContact O-N 2.75Å; L1870-T1873 PolarHBondContact O-N 2.94Å; L1870-N1874 PolarHBondContact O-N 2.87Å; L1870-N1874 PolarHBondContact O-ND2 2.83Å
1871	V	85.5	Confident	81.2	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-57	-49.2	177.2	169.6	0	0	0	0	111	C1319 A1323 L1794 L1799 L1867 F1868 T1873 N1874 L1875	C1319-V1871 HydrophobicContact CB-CG1 3.8Å; A1323-V1871 HydrophobicContact CB-CG2 4.37Å; L1794-V1871 HydrophobicContact CD2-CG2 4.5Å; L1799-V1871 HydrophobicContact CD2-CG2 3.69Å; L1867-V1871 WeakPolarHBondContact O-CG2 3.29Å; L1867-V1871 PolarHBondContact O-N 2.79Å; F1868-V1871 PolarHBondContact O-N 2.89Å; V1871-T1873 VanDerWaalsContact C-N 3.33Å; V1871-T1873 PolarHBondContact O-N 3.35Å; V1871-N1874 PolarHBondContact O-N 2.98Å; V1871-L1875 HydrophobicContact CG1-CD1 3.74Å; V1871-L1875 HydrophobicContact CG1-CG 4.48Å; V1871-L1875 WeakPolarHBondContact O-CB 3.28Å; V1871-L1875 WeakPolarHBondContact O-CG 3.13Å; V1871-L1875 PolarHBondContact O-N 3.12Å
1872	R	84.6	Confident	80.7	Confident	50 Å²	50	37.9 Å²	37.9	19%	0.189	18%	0.184	C	C	.	.	H	α-helix	trans	-57.5	-42.2	176.8	-173.4	-174.4	68.9	76.5	-2.4	112.6	M1851 F1868 L1870 K1876 I1877	M1851-R1872 PolarHBondContact O-NH2 2.94Å; F1868-R1872 WeakPolarHBondContact O-CB 3.35Å; F1868-R1872 PolarHBondContact O-N 2.93Å; L1870-R1872 PolarHBondContact O-N 2.75Å; R1872-K1876 CarbonylContact O-C 3.58Å; R1872-K1876 WeakPolarHBondContact O-CA 3.38Å; R1872-K1876 PolarHBondContact O-N 2.98Å; R1872-K1876 VanDerWaalsContact O-N 3.09Å; R1872-I1877 HydrophobicContact CG-CB 4.4Å; R1872-I1877 WeakPolarHBondContact CG-O 3.42Å; R1872-I1877 PolarHBondContact O-N 3.26Å
1873	T	81.5	Confident	80.3	Confident	37 Å²	37	39.7 Å²	39.7	23%	0.227	19%	0.189	C	C	.	.	H	α-helix	trans	-72.7	-39.1	-176.9	-57.3	0	0	0	0	111.9	M1851 A1869 L1870 V1871	M1851-T1873 HydrophobicContact CG-CG2 4.38Å; A1869-T1873 VanDerWaalsContact O-CB 3.3Å; A1869-T1873 WeakPolarHBondContact O-CB 3.11Å; A1869-T1873 PolarHBondContact O-N 3.36Å; A1869-T1873 VanDerWaalsContact O-N 3.07Å; A1869-T1873 PolarHBondContact O-OG1 2.03Å; L1870-T1873 PolarHBondContact O-N 2.94Å; V1871-T1873 VanDerWaalsContact C-N 3.33Å; V1871-T1873 PolarHBondContact O-N 3.35Å
1874	N	81	Confident	79.7	Confident	69 Å²	69	42.8 Å²	42.8	37%	0.369	22%	0.215	S	C	.	.	H	α-helix	trans	-75.1	-41.7	178.6	-74.4	-40.3	0	0	0	112.7	P1832 L1870 V1871 K1876	P1832-N1874 PolarHBondContact O-ND2 3.15Å; P1832-N1874 PolarHBondContact O-OD1 3.41Å; L1870-N1874 PolarHBondContact O-N 2.87Å; L1870-N1874 PolarHBondContact O-ND2 2.83Å; V1871-N1874 PolarHBondContact O-N 2.98Å; N1874-K1876 PolarHBondContact O-N 2.84Å
1875	L	75.8	Confident	79.2	Confident	31 Å²	31	42.2 Å²	42.2	16%	0.162	21%	0.213	C	C	.	.	S	Bend	trans	-80.7	2.6	176.1	-62	178.7	0	0	0	113.7	Q1316 C1319 L1794 V1871 I1877	Q1316-L1875 HydrophobicContact CB-CD1 4.28Å; Q1316-L1875 HydrophobicContact CG-CD1 4.24Å; C1319-L1875 HydrophobicContact CB-CD1 3.7Å; L1794-L1875 HydrophobicContact CB-CD2 4.38Å; L1794-L1875 HydrophobicContact CD2-CD1 4.29Å; L1794-L1875 HydrophobicContact CD2-CD2 4.16Å; L1794-L1875 HydrophobicContact CD2-CG 4.03Å; V1871-L1875 HydrophobicContact CG1-CD1 3.74Å; V1871-L1875 HydrophobicContact CG1-CG 4.48Å; V1871-L1875 WeakPolarHBondContact O-CB 3.28Å; V1871-L1875 WeakPolarHBondContact O-CG 3.13Å; V1871-L1875 PolarHBondContact O-N 3.12Å; L1875-I1877 HydrophobicContact CB-CD1 3.91Å; L1875-I1877 HydrophobicContact CB-CG1 3.78Å; L1875-I1877 HydrophobicContact CD1-CD1 4.1Å; L1875-I1877 PolarHBondContact O-N 3.26Å
1876	K	79.4	Confident	79	Confident	173 Å²	173	42.2 Å²	42.2	75%	0.752	21%	0.212	S	C	*	.			trans	57.5	7.8	-179.5	-61.2	179	-177.4	171.1	0	116.9	R1872 N1874 K1878	R1872-K1876 CarbonylContact O-C 3.58Å; R1872-K1876 WeakPolarHBondContact O-CA 3.38Å; R1872-K1876 PolarHBondContact O-N 2.98Å; R1872-K1876 VanDerWaalsContact O-N 3.09Å; N1874-K1876 PolarHBondContact O-N 2.84Å; K1876-K1878 PolarHBondContact O-N 3.07Å; K1876-K1878 VanDerWaalsContact O-N 3.11Å
1877	I	73.9	Confident	78.6	Confident	3 Å²	3	47 Å²	47	2%	0.015	23%	0.232	C	C	.	.			trans	-54.8	113.5	-175	-53	176.9	0	0	0	110.2	L1312 Q1316 I1320 R1872 L1875 L1882 D2301	L1312-I1877 HydrophobicContact CD1-CD1 4.37Å; Q1316-I1877 HydrophobicContact CB-CD1 4.2Å; Q1316-I1877 HydrophobicContact CG-CD1 4.45Å; I1320-I1877 HydrophobicContact CD1-CD1 3.98Å; I1320-I1877 HydrophobicContact CG1-CD1 4.38Å; R1872-I1877 HydrophobicContact CG-CB 4.4Å; R1872-I1877 WeakPolarHBondContact CG-O 3.42Å; R1872-I1877 PolarHBondContact O-N 3.26Å; L1875-I1877 HydrophobicContact CB-CD1 3.91Å; L1875-I1877 HydrophobicContact CB-CG1 3.78Å; L1875-I1877 HydrophobicContact CD1-CD1 4.1Å; L1875-I1877 PolarHBondContact O-N 3.26Å; I1877-L1882 HydrophobicContact CG2-CD1 4.17Å; I1877-L1882 HydrophobicContact CG2-CD2 3.97Å; I1877-D2301 WeakPolarHBondContact CA-OD2 3.38Å
1878	K	70.4	Confident	78.1	Confident	77 Å²	77	51.4 Å²	51.4	34%	0.335	25%	0.252	S	S	.	.			trans	-78.1	166.1	173.5	-44.5	98.4	128.5	-158.8	0	111.2	K1876 P2299 L2300 D2301	K1876-K1878 PolarHBondContact O-N 3.07Å; K1876-K1878 VanDerWaalsContact O-N 3.11Å; K1878-P2299 WeakPolarHBondContact CE-O 3.35Å; K1878-L2300 HydrophobicContact CB-CB 3.73Å; K1878-L2300 HydrophobicContact CB-CD2 4Å; K1878-L2300 HydrophobicContact CB-CG 3.93Å; K1878-L2300 VanDerWaalsContact CE-C 3.47Å; K1878-L2300 VanDerWaalsContact CE-O 3.32Å; K1878-L2300 WeakPolarHBondContact CE-O 3.02Å; K1878-L2300 HydrophobicContact CG-CB 4.42Å; K1878-L2300 VanDerWaalsContact NZ-C 3.32Å; K1878-L2300 PolarHBondContact NZ-O 2.97Å; K1878-D2301 HydrophobicContact CB-CB 3.89Å; K1878-D2301 HydrophobicContact CD-CB 3.57Å; K1878-D2301 WeakPolarHBondContact CD-OD1 3.29Å; K1878-D2301 WeakPolarHBondContact CD-OD2 3.28Å; K1878-D2301 WeakPolarHBondContact CE-OD1 3.49Å; K1878-D2301 HydrophobicContact CG-CB 4.32Å; K1878-D2301 PolarHBondContact N-OD2 3.24Å; K1878-D2301 IonicContact NZ-OD1 2.74Å; K1878-D2301 PolarHBondContact NZ-OD1 3.22Å
1879	T	68.2	Low	77.6	Confident	55 Å²	55	54.2 Å²	54.2	34%	0.337	27%	0.266	S	S	.	.	S	Bend	trans	-102.1	-14.4	-151.1	41.1	0	0	0	0	118.4	V1902 L2300	T1879-V1902 WeakPolarHBondContact O-CG1 3.38Å; T1879-L2300 WeakPolarHBondContact OG1-CD2 3.34Å
1880	E	65.4	Low	77.5	Confident	125 Å²	125	55.7 Å²	55.7	58%	0.584	27%	0.271	S	S	*	.	H	α-helix	trans	-82.6	-62.2	-167	-86.3	163.6	-152.4	0	0	114.2	L1882 R1883 L2300	E1880-L1882 PolarHBondContact O-N 2.94Å; E1880-R1883 PolarHBondContact O-N 2.89Å; E1880-L2300 HydrophobicContact CB-CB 4.37Å; E1880-L2300 HydrophobicContact CB-CD2 3.93Å; E1880-L2300 HydrophobicContact CG-CD2 3.7Å; E1880-L2300 WeakPolarHBondContact OE1-CD1 2.98Å
1881	E	69.8	Low	77	Confident	99 Å²	99	63.3 Å²	63.3	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-38.1	179.7	-56.2	170.8	-147.1	0	0	110.5	R1883 A1884 V1885 D2301 F2302	E1881-R1883 VanDerWaalsContact C-N 3.25Å; E1881-R1883 PolarHBondContact O-N 3.06Å; E1881-A1884 WeakPolarHBondContact O-CA 3.33Å; E1881-A1884 WeakPolarHBondContact O-CB 2.89Å; E1881-A1884 PolarHBondContact O-N 3.32Å; E1881-V1885 HydrophobicContact CB-CG2 4.42Å; E1881-V1885 WeakPolarHBondContact O-CG2 3.47Å; E1881-V1885 PolarHBondContact O-N 2.82Å; E1881-V1885 VanDerWaalsContact O-N 3.1Å; E1881-D2301 WeakPolarHBondContact CB-O 3.45Å; E1881-D2301 WeakPolarHBondContact CG-O 3.42Å; E1881-D2301 VanDerWaalsContact OE1-C 3.28Å; E1881-F2302 PolarHBondContact OE1-N 2.85Å; E1881-F2302 VanDerWaalsContact OE1-N 3.15Å; E1881-F2302 PolarHBondContact OE2-N 3.37Å
1882	L	76.4	Confident	76.4	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-38.4	-50.9	176	-175.3	63.5	0	0	0	111.8	I1320 F1868 I1877 E1880 A1884 V1885 I1886 V1902 T2303	I1320-L1882 HydrophobicContact CD1-CD1 4.09Å; F1868-L1882 HydrophobicContact CZ-CD2 4.13Å; I1877-L1882 HydrophobicContact CG2-CD1 4.17Å; I1877-L1882 HydrophobicContact CG2-CD2 3.97Å; E1880-L1882 PolarHBondContact O-N 2.94Å; L1882-A1884 VanDerWaalsContact C-N 3.32Å; L1882-A1884 PolarHBondContact O-N 3.06Å; L1882-V1885 PolarHBondContact O-N 3.04Å; L1882-I1886 HydrophobicContact CD1-CD1 3.74Å; L1882-I1886 HydrophobicContact CD1-CG1 3.91Å; L1882-I1886 HydrophobicContact CD2-CD1 4.27Å; L1882-I1886 HydrophobicContact CG-CD1 3.56Å; L1882-I1886 HydrophobicContact CG-CG1 4.09Å; L1882-I1886 WeakPolarHBondContact O-CA 3.22Å; L1882-I1886 WeakPolarHBondContact O-CB 3.49Å; L1882-I1886 WeakPolarHBondContact O-CG1 3.29Å; L1882-I1886 PolarHBondContact O-N 2.96Å; L1882-V1902 HydrophobicContact CD2-CG2 4.06Å; L1882-V1902 HydrophobicContact CG-CG2 4.48Å; L1882-T2303 VanDerWaalsContact CD1-O 3.27Å; L1882-T2303 WeakPolarHBondContact CD1-O 3.24Å
1883	R	79.2	Confident	76	Confident	67 Å²	67	74.1 Å²	74.1	25%	0.253	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-34.5	-179.5	-171.9	169.5	-172.4	-103.3	6.8	114.2	E1880 E1881 L1898 D1899 V1902	E1880-R1883 PolarHBondContact O-N 2.89Å; E1881-R1883 VanDerWaalsContact C-N 3.25Å; E1881-R1883 PolarHBondContact O-N 3.06Å; R1883-L1898 HydrophobicContact CG-CD1 3.92Å; R1883-L1898 HydrophobicContact CG-CD2 3.93Å; R1883-L1898 HydrophobicContact CG-CG 3.98Å; R1883-D1899 IonicContact CZ-OD1 2.73Å; R1883-D1899 IonicContact NE-OD1 2.79Å; R1883-D1899 IonicContact NH2-OD1 2.77Å; R1883-D1899 PolarHBondContact NH2-OD1 3.22Å; R1883-V1902 HydrophobicContact CB-CG1 3.93Å
1884	A	76.8	Confident	75.8	Confident	70 Å²	70	74.5 Å²	74.5	58%	0.579	35%	0.351	S	S	*	.	H	α-helix	trans	-74	-51.2	-179.5	0	0	0	0	0	110.4	E1881 L1882 I1886 K1887	E1881-A1884 WeakPolarHBondContact O-CA 3.33Å; E1881-A1884 WeakPolarHBondContact O-CB 2.89Å; E1881-A1884 PolarHBondContact O-N 3.32Å; L1882-A1884 VanDerWaalsContact C-N 3.32Å; L1882-A1884 PolarHBondContact O-N 3.06Å; A1884-I1886 PolarHBondContact O-N 3.46Å; A1884-K1887 PolarHBondContact O-N 2.94Å; A1884-K1887 VanDerWaalsContact O-N 3.11Å
1885	V	77	Confident	75.5	Confident	11 Å²	11	75.4 Å²	75.4	7%	0.067	36%	0.356	C	S	.	.	H	α-helix	trans	-64.7	-27.6	175.8	-129.8	0	0	0	0	111	E1311 E1881 L1882 K1887 K1888 Y2305	E1311-V1885 VanDerWaalsContact OE2-CG1 3.24Å; E1311-V1885 WeakPolarHBondContact OE2-CG1 3.45Å; E1881-V1885 HydrophobicContact CB-CG2 4.42Å; E1881-V1885 WeakPolarHBondContact O-CG2 3.47Å; E1881-V1885 PolarHBondContact O-N 2.82Å; E1881-V1885 VanDerWaalsContact O-N 3.1Å; L1882-V1885 PolarHBondContact O-N 3.04Å; V1885-K1887 PolarHBondContact O-N 3.45Å; V1885-K1888 HydrophobicContact CG1-CD 4Å; V1885-K1888 PolarHBondContact O-N 3Å; V1885-K1888 VanDerWaalsContact O-N 3.1Å; V1885-Y2305 HydrophobicContact CB-CD2 4.23Å; V1885-Y2305 HydrophobicContact CB-CG 4.46Å; V1885-Y2305 HydrophobicContact CG1-CD2 3.41Å; V1885-Y2305 VanDerWaalsContact CG1-CD2 3.41Å; V1885-Y2305 HydrophobicContact CG1-CE2 3.6Å; V1885-Y2305 HydrophobicContact CG1-CG 4Å; V1885-Y2305 VanDerWaalsContact O-CA 3.26Å; V1885-Y2305 WeakPolarHBondContact O-CA 3.43Å; V1885-Y2305 WeakPolarHBondContact O-CD1 3.43Å; V1885-Y2305 PolarHBondContact O-N 3.5Å
1886	I	81.2	Confident	75.5	Confident	3 Å²	3	77 Å²	77	2%	0.015	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-10.3	174	-78.4	-178.8	0	0	0	114.3	F1868 L1882 A1884 L1898 V1902 T2306	F1868-I1886 HydrophobicContact CZ-CD1 4.5Å; L1882-I1886 HydrophobicContact CD1-CD1 3.74Å; L1882-I1886 HydrophobicContact CD1-CG1 3.91Å; L1882-I1886 HydrophobicContact CD2-CD1 4.27Å; L1882-I1886 HydrophobicContact CG-CD1 3.56Å; L1882-I1886 HydrophobicContact CG-CG1 4.09Å; L1882-I1886 WeakPolarHBondContact O-CA 3.22Å; L1882-I1886 WeakPolarHBondContact O-CB 3.49Å; L1882-I1886 WeakPolarHBondContact O-CG1 3.29Å; L1882-I1886 PolarHBondContact O-N 2.96Å; A1884-I1886 PolarHBondContact O-N 3.46Å; I1886-L1898 HydrophobicContact CB-CD1 4.25Å; I1886-L1898 HydrophobicContact CD1-CD1 4.3Å; I1886-L1898 HydrophobicContact CG2-CD1 3.36Å; I1886-L1898 HydrophobicContact CG2-CD2 3.94Å; I1886-L1898 HydrophobicContact CG2-CG 4.21Å; I1886-V1902 HydrophobicContact CD1-CG2 3.91Å; I1886-T2306 VanDerWaalsContact CD1-O 3.22Å; I1886-T2306 WeakPolarHBondContact CD1-O 3.36Å; I1886-T2306 VanDerWaalsContact CG1-CA 3.49Å; I1886-T2306 VanDerWaalsContact CG1-O 3.27Å; I1886-T2306 WeakPolarHBondContact CG1-O 3.44Å; I1886-T2306 WeakPolarHBondContact O-CA 3.22Å; I1886-T2306 WeakPolarHBondContact O-CB 3.45Å; I1886-T2306 WeakPolarHBondContact O-CG2 3.43Å
1887	K	79.3	Confident	75.4	Confident	100 Å²	100	68.9 Å²	68.9	44%	0.435	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-11	177.1	-65.5	176.9	-179.3	177	0	115.2	A1884 V1885 L1898	A1884-K1887 PolarHBondContact O-N 2.94Å; A1884-K1887 VanDerWaalsContact O-N 3.11Å; V1885-K1887 PolarHBondContact O-N 3.45Å; K1887-L1898 HydrophobicContact CG-CD2 4.15Å
1888	K	78.7	Confident	75.6	Confident	94 Å²	94	68.9 Å²	68.9	41%	0.409	33%	0.326	S	S	.	.	S	Bend	trans	-94.4	-22.7	-152.7	-179	-166.8	168.3	-154.9	0	115.9	E1311 V1885 K1891 Y2305	E1311-K1888 IonicContact OE1-NZ 2.75Å; V1885-K1888 HydrophobicContact CG1-CD 4Å; V1885-K1888 PolarHBondContact O-N 3Å; V1885-K1888 VanDerWaalsContact O-N 3.1Å; K1888-K1891 WeakPolarHBondContact O-CE 3.43Å; K1888-Y2305 VanDerWaalsContact CA-CE1 3.48Å; K1888-Y2305 HydrophobicContact CB-CD1 3.45Å; K1888-Y2305 VanDerWaalsContact CB-CD1 3.45Å; K1888-Y2305 HydrophobicContact CB-CE1 3.1Å; K1888-Y2305 HydrophobicContact CB-CG 4.48Å; K1888-Y2305 HydrophobicContact CD-CD1 4.44Å; K1888-Y2305 HydrophobicContact CD-CE1 3.59Å; K1888-Y2305 HydrophobicContact CD-CE2 3.96Å; K1888-Y2305 VanDerWaalsContact CD-OH 3.3Å; K1888-Y2305 WeakPolarHBondContact CD-OH 3.18Å; K1888-Y2305 WeakPolarHBondContact CE-OH 3.23Å; K1888-Y2305 HydrophobicContact CG-CD1 4.12Å; K1888-Y2305 HydrophobicContact CG-CE1 3.24Å; K1888-Y2305 PolarHBondContact NZ-OH 2.95Å
1889	I	75.6	Confident	75.6	Confident	65 Å²	65	68.2 Å²	68.2	33%	0.333	33%	0.327	S	S	.	.	S	Bend	trans	-118.8	-68.7	-173.9	-88.5	154.7	0	0	0	108	K1891 Y2305	I1889-K1891 PolarHBondContact O-N 3.1Å; I1889-Y2305 HydrophobicContact CB-CD1 3.37Å; I1889-Y2305 HydrophobicContact CB-CE1 3.5Å; I1889-Y2305 HydrophobicContact CB-CG 4.16Å; I1889-Y2305 HydrophobicContact CD1-CD1 3.59Å; I1889-Y2305 HydrophobicContact CD1-CD2 3.9Å; I1889-Y2305 HydrophobicContact CD1-CE1 3.41Å; I1889-Y2305 VanDerWaalsContact CD1-CE1 3.41Å; I1889-Y2305 HydrophobicContact CD1-CE2 3.85Å; I1889-Y2305 HydrophobicContact CD1-CG 3.76Å; I1889-Y2305 HydrophobicContact CG1-CD1 3.51Å; I1889-Y2305 HydrophobicContact CG1-CE1 3.14Å; I1889-Y2305 HydrophobicContact CG1-CE2 4.46Å; I1889-Y2305 HydrophobicContact CG1-CG 4.21Å
1890	W	82	Confident	75.9	Confident	39 Å²	39	67.5 Å²	67.5	15%	0.148	32%	0.32	C	S	.	.	S	Bend	trans	-74.7	78.1	172	-52.8	-138	0	0	0	105.6	R1317 E1321 R1892 T1893 Y2305 T2306 S2307	R1317-W1890 HydrophobicContact CG-CH2 3.58Å; R1317-W1890 HydrophobicContact CG-CZ3 4.03Å; E1321-W1890 HydrophobicContact CB-CH2 4.47Å; E1321-W1890 HydrophobicContact CB-CZ2 3.58Å; E1321-W1890 HydrophobicContact CG-CZ2 3.79Å; W1890-R1892 PolarHBondContact O-N 2.9Å; W1890-T1893 VanDerWaalsContact O-CB 3.25Å; W1890-T1893 WeakPolarHBondContact O-CB 3.36Å; W1890-T1893 PolarHBondContact O-OG1 2.88Å; W1890-Y2305 WeakPolarHBondContact CH2-O 3.43Å; W1890-Y2305 VanDerWaalsContact CZ3-C 3.42Å; W1890-Y2305 WeakPolarHBondContact CZ3-O 3.31Å; W1890-T2306 HydrophobicContact CB-CG2 3.61Å; W1890-T2306 WeakPolarHBondContact CB-OG1 3.27Å; W1890-T2306 HydrophobicContact CD2-CG2 3.81Å; W1890-T2306 HydrophobicContact CE3-CG2 3.47Å; W1890-T2306 VanDerWaalsContact CE3-CG2 3.47Å; W1890-T2306 VanDerWaalsContact CE3-OG1 3.25Å; W1890-T2306 HydrophobicContact CG-CG2 4Å; W1890-T2306 HydrophobicContact CZ3-CG2 4.11Å; W1890-S2307 WeakPolarHBondContact CB-OG 3.2Å
1891	K	75.8	Confident	76.4	Confident	160 Å²	160	62.5 Å²	62.5	70%	0.696	30%	0.296	S	S	*	.			trans	-74.9	-12.9	-175.8	-65.6	171.4	-174.3	-179.6	0	112.6	K1888 I1889 T1893	K1888-K1891 WeakPolarHBondContact O-CE 3.43Å; I1889-K1891 PolarHBondContact O-N 3.1Å; K1891-T1893 PolarHBondContact O-N 3.17Å
1892	R	73.4	Confident	76.7	Confident	252 Å²	252	58.1 Å²	58.1	95%	0.951	28%	0.276	S	S	*	.			trans	-80.3	53.8	-172.9	-69.6	-174.9	171	170.6	-1.5	113	W1890	W1890-R1892 PolarHBondContact O-N 2.9Å
1893	T	74.7	Confident	76.3	Confident	26 Å²	26	61.5 Å²	61.5	16%	0.16	30%	0.298	C	S	.	.			trans	-131.9	85.4	-141.4	-79.6	0	0	0	0	109.8	W1890 K1891 N1895 S2307 I2308	W1890-T1893 VanDerWaalsContact O-CB 3.25Å; W1890-T1893 WeakPolarHBondContact O-CB 3.36Å; W1890-T1893 PolarHBondContact O-OG1 2.88Å; K1891-T1893 PolarHBondContact O-N 3.17Å; T1893-N1895 PolarHBondContact O-N 3.39Å; T1893-S2307 VanDerWaalsContact CG2-CB 3.49Å; T1893-S2307 WeakPolarHBondContact OG1-CB 3.48Å; T1893-I2308 HydrophobicContact CG2-CB 4.09Å; T1893-I2308 HydrophobicContact CG2-CD1 3.24Å; T1893-I2308 HydrophobicContact CG2-CG1 4.18Å; T1893-I2308 HydrophobicContact CG2-CG2 4.43Å
1894	S	78.1	Confident	75.7	Confident	44 Å²	44	61.1 Å²	61.1	31%	0.308	31%	0.305	S	S	.	.			trans	-63.3	80.4	176.9	69.7	0	0	0	0	116.6	K1896 I2308 R2310	S1894-K1896 PolarHBondContact O-N 3.11Å; S1894-I2308 WeakPolarHBondContact OG-CG2 3.29Å; S1894-R2310 WeakPolarHBondContact O-CG 3.43Å; S1894-R2310 PolarHBondContact O-NE 2.64Å
1895	N	75.2	Confident	74.7	Confident	88 Å²	88	62.9 Å²	62.9	47%	0.471	32%	0.319	S	S	.	.	S	Bend	trans	10.6	-67.9	171.5	-62.3	-20.7	0	0	0	119.1	T1893 L1897 L1898 D1899 I2308	T1893-N1895 PolarHBondContact O-N 3.39Å; N1895-L1897 CarbonylContact O-C 3.36Å; N1895-L1897 PolarHBondContact O-N 3.29Å; N1895-L1898 WeakPolarHBondContact O-CA 2.94Å; N1895-L1898 VanDerWaalsContact O-CB 3.23Å; N1895-L1898 WeakPolarHBondContact O-CB 3.27Å; N1895-L1898 PolarHBondContact O-N 3.44Å; N1895-D1899 PolarHBondContact O-N 2.89Å; N1895-D1899 VanDerWaalsContact O-N 3.16Å; N1895-D1899 VanDerWaalsContact O-OD2 3.11Å; N1895-I2308 VanDerWaalsContact N-CD1 3.28Å
1896	K	75.4	Confident	73.6	Confident	66 Å²	66	65.5 Å²	65.5	29%	0.287	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	7	-168.9	161.9	-167	-175.8	-143.4	0	119.3	S1894 D1899 R2310 N2311 L2312	S1894-K1896 PolarHBondContact O-N 3.11Å; K1896-D1899 WeakPolarHBondContact CA-OD2 2.79Å; K1896-D1899 PolarHBondContact N-OD2 3.11Å; K1896-R2310 HydrophobicContact CB-CB 4.16Å; K1896-R2310 HydrophobicContact CB-CG 3.68Å; K1896-R2310 HydrophobicContact CD-CB 3.97Å; K1896-R2310 HydrophobicContact CD-CG 4.11Å; K1896-R2310 HydrophobicContact CG-CB 3.8Å; K1896-R2310 HydrophobicContact CG-CG 3.91Å; K1896-R2310 WeakPolarHBondContact O-CA 3.03Å; K1896-N2311 PolarHBondContact NZ-OD1 3.03Å; K1896-L2312 VanDerWaalsContact CE-N 3.33Å; K1896-L2312 WeakPolarHBondContact CE-O 3.38Å
1897	L	77.2	Confident	72.5	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-18.4	154	170.9	84.3	0	0	0	113.7	N1864 N1895 D1899 Q1900 L1901 I2308 P2309	N1864-L1897 HydrophobicContact CB-CD1 4.02Å; N1864-L1897 HydrophobicContact CB-CD2 4.24Å; N1864-L1897 WeakPolarHBondContact ND2-CD2 3.01Å; N1895-L1897 CarbonylContact O-C 3.36Å; N1895-L1897 PolarHBondContact O-N 3.29Å; L1897-D1899 PolarHBondContact O-N 2.71Å; L1897-Q1900 HydrophobicContact CB-CB 4.41Å; L1897-Q1900 HydrophobicContact CD1-CB 3.93Å; L1897-Q1900 VanDerWaalsContact CD1-CD 3.47Å; L1897-Q1900 HydrophobicContact CD1-CG 3.92Å; L1897-Q1900 CarbonylContact O-C 3.6Å; L1897-Q1900 PolarHBondContact O-N 2.87Å; L1897-L1901 HydrophobicContact CD1-CD1 4.03Å; L1897-L1901 HydrophobicContact CD1-CD2 3.74Å; L1897-L1901 HydrophobicContact CD1-CG 3.55Å; L1897-L1901 HydrophobicContact CD2-CD1 3.8Å; L1897-L1901 HydrophobicContact CD2-CG 4.25Å; L1897-L1901 HydrophobicContact CG-CD1 3.69Å; L1897-L1901 HydrophobicContact CG-CD2 4.34Å; L1897-L1901 HydrophobicContact CG-CG 3.63Å; L1897-L1901 WeakPolarHBondContact O-CB 3.08Å; L1897-L1901 WeakPolarHBondContact O-CG 3.46Å; L1897-L1901 PolarHBondContact O-N 3.4Å; L1897-I2308 HydrophobicContact CB-CG1 4.36Å; L1897-P2309 VanDerWaalsContact CB-CA 3.48Å; L1897-P2309 WeakPolarHBondContact CB-O 3.28Å; L1897-P2309 WeakPolarHBondContact CD2-O 3.26Å
1898	L	76.7	Confident	71.2	Confident	3 Å²	3	69.4 Å²	69.4	2%	0.016	39%	0.386	C	S	.	.	H	α-helix	trans	-58.9	-46.2	162.9	178.9	49.7	0	0	0	107.9	R1883 I1886 K1887 N1895 Q1900 L1901 V1902 I2308	R1883-L1898 HydrophobicContact CG-CD1 3.92Å; R1883-L1898 HydrophobicContact CG-CD2 3.93Å; R1883-L1898 HydrophobicContact CG-CG 3.98Å; I1886-L1898 HydrophobicContact CB-CD1 4.25Å; I1886-L1898 HydrophobicContact CD1-CD1 4.3Å; I1886-L1898 HydrophobicContact CG2-CD1 3.36Å; I1886-L1898 HydrophobicContact CG2-CD2 3.94Å; I1886-L1898 HydrophobicContact CG2-CG 4.21Å; K1887-L1898 HydrophobicContact CG-CD2 4.15Å; N1895-L1898 WeakPolarHBondContact O-CA 2.94Å; N1895-L1898 VanDerWaalsContact O-CB 3.23Å; N1895-L1898 WeakPolarHBondContact O-CB 3.27Å; N1895-L1898 PolarHBondContact O-N 3.44Å; L1898-Q1900 PolarHBondContact O-N 2.93Å; L1898-Q1900 VanDerWaalsContact O-N 3.07Å; L1898-L1901 PolarHBondContact O-N 2.8Å; L1898-V1902 HydrophobicContact CD1-CB 4Å; L1898-V1902 HydrophobicContact CD1-CG2 4.37Å; L1898-V1902 CarbonylContact O-C 3.34Å; L1898-V1902 WeakPolarHBondContact O-CA 3.4Å; L1898-V1902 PolarHBondContact O-N 3.27Å; L1898-I2308 HydrophobicContact CB-CD1 3.38Å; L1898-I2308 HydrophobicContact CB-CG1 3.68Å; L1898-I2308 HydrophobicContact CD2-CD1 4.38Å
1899	D	72.2	Confident	70.1	Confident	63 Å²	63	72.3 Å²	72.3	34%	0.337	41%	0.406	S	S	.	.	H	α-helix	trans	-67.3	-5.9	175.7	-45	-44	0	0	0	113.8	R1883 N1895 K1896 L1897	R1883-D1899 IonicContact CZ-OD1 2.73Å; R1883-D1899 IonicContact NE-OD1 2.79Å; R1883-D1899 IonicContact NH2-OD1 2.77Å; R1883-D1899 PolarHBondContact NH2-OD1 3.22Å; N1895-D1899 PolarHBondContact O-N 2.89Å; N1895-D1899 VanDerWaalsContact O-N 3.16Å; N1895-D1899 VanDerWaalsContact O-OD2 3.11Å; K1896-D1899 WeakPolarHBondContact CA-OD2 2.79Å; K1896-D1899 PolarHBondContact N-OD2 3.11Å; L1897-D1899 PolarHBondContact O-N 2.71Å
1900	Q	73.4	Confident	69.4	Low	41 Å²	41	74.1 Å²	74.1	19%	0.192	42%	0.416	C	S	.	.	H	α-helix	trans	-114.8	-16	179.7	-176.6	-169.5	-20.2	0	0	113	L1897 L1898	L1897-Q1900 HydrophobicContact CB-CB 4.41Å; L1897-Q1900 HydrophobicContact CD1-CB 3.93Å; L1897-Q1900 VanDerWaalsContact CD1-CD 3.47Å; L1897-Q1900 HydrophobicContact CD1-CG 3.92Å; L1897-Q1900 CarbonylContact O-C 3.6Å; L1897-Q1900 PolarHBondContact O-N 2.87Å; L1898-Q1900 PolarHBondContact O-N 2.93Å; L1898-Q1900 VanDerWaalsContact O-N 3.07Å
1901	L	75.5	Confident	68.7	Low	19 Å²	19	76.2 Å²	76.2	10%	0.099	43%	0.433	C	S	.	.	H	α-helix	trans	-107.3	-42.7	176.2	-65.6	-177.6	0	0	0	112.6	L1324 N1864 A1865 F1868 L1897 L1898 P1903	L1324-L1901 HydrophobicContact CD2-CD1 3.45Å; L1324-L1901 VanDerWaalsContact CD2-CD1 3.45Å; N1864-L1901 HydrophobicContact CB-CD2 4.26Å; N1864-L1901 WeakPolarHBondContact O-CD2 3.01Å; A1865-L1901 HydrophobicContact CB-CD2 4.2Å; F1868-L1901 HydrophobicContact CB-CD1 4.33Å; F1868-L1901 HydrophobicContact CB-CD2 3.71Å; F1868-L1901 HydrophobicContact CB-CG 4.45Å; F1868-L1901 HydrophobicContact CD1-CB 3.8Å; F1868-L1901 HydrophobicContact CD1-CD2 4.24Å; F1868-L1901 HydrophobicContact CD1-CG 4.41Å; F1868-L1901 HydrophobicContact CD2-CD1 4.06Å; F1868-L1901 HydrophobicContact CE1-CB 3.95Å; F1868-L1901 WeakPolarHBondContact CE1-O 3.38Å; F1868-L1901 HydrophobicContact CG-CB 4.15Å; F1868-L1901 HydrophobicContact CG-CD1 4.09Å; F1868-L1901 HydrophobicContact CG-CD2 4.03Å; F1868-L1901 HydrophobicContact CG-CG 4.3Å; F1868-L1901 HydrophobicContact CZ-CB 4.41Å; L1897-L1901 HydrophobicContact CD1-CD1 4.03Å; L1897-L1901 HydrophobicContact CD1-CD2 3.74Å; L1897-L1901 HydrophobicContact CD1-CG 3.55Å; L1897-L1901 HydrophobicContact CD2-CD1 3.8Å; L1897-L1901 HydrophobicContact CD2-CG 4.25Å; L1897-L1901 HydrophobicContact CG-CD1 3.69Å; L1897-L1901 HydrophobicContact CG-CD2 4.34Å; L1897-L1901 HydrophobicContact CG-CG 3.63Å; L1897-L1901 WeakPolarHBondContact O-CB 3.08Å; L1897-L1901 WeakPolarHBondContact O-CG 3.46Å; L1897-L1901 PolarHBondContact O-N 3.4Å; L1898-L1901 PolarHBondContact O-N 2.8Å; L1901-P1903 VanDerWaalsContact C-CD 3.48Å
1902	V	76.3	Confident	68.6	Low	7 Å²	7	69.2 Å²	69.2	4%	0.042	40%	0.404	C	S	.	.	S	Bend	trans	-126.2	72.2	173.8	-167.4	0	0	0	0	106.8	F1868 T1879 L1882 R1883 I1886 L1898	F1868-V1902 HydrophobicContact CE1-CG2 3.64Å; F1868-V1902 HydrophobicContact CZ-CG2 3.62Å; T1879-V1902 WeakPolarHBondContact O-CG1 3.38Å; L1882-V1902 HydrophobicContact CD2-CG2 4.06Å; L1882-V1902 HydrophobicContact CG-CG2 4.48Å; R1883-V1902 HydrophobicContact CB-CG1 3.93Å; I1886-V1902 HydrophobicContact CD1-CG2 3.91Å; L1898-V1902 HydrophobicContact CD1-CB 4Å; L1898-V1902 HydrophobicContact CD1-CG2 4.37Å; L1898-V1902 CarbonylContact O-C 3.34Å; L1898-V1902 WeakPolarHBondContact O-CA 3.4Å; L1898-V1902 PolarHBondContact O-N 3.27Å
1903	P	69	Low	68.5	Low	72 Å²	72	57.4 Å²	57.4	47%	0.468	36%	0.36	S	S	.	.			trans	-54.9	143.1	177.4	24.5	-34.5	0	0	0	110	L1901	L1901-P1903 VanDerWaalsContact C-CD 3.48Å
1904	P	65.9	Low	68.4	Low	60 Å²	60	56.4 Å²	56.4	39%	0.39	35%	0.354	S	S	.	.			trans	-62.9	140.8	179.1	27.7	-34.7	0	0	0	110.9	G1906 G1907	P1904-G1906 PolarHBondContact O-N 3.18Å; P1904-G1906 VanDerWaalsContact O-N 3.08Å; P1904-G1907 PolarHBondContact O-N 3.28Å
1905	A	55.4	Low	68.3	Low	106 Å²	106	59.4 Å²	59.4	88%	0.876	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	115.3	170.7	0	0	0	0	0	109.5
1906	G	55	Low	68.4	Low	66 Å²	66	59.8 Å²	59.8	68%	0.68	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.8	-8.5	-173.8	0	0	0	0	0	115.9	P1904 N1908	P1904-G1906 PolarHBondContact O-N 3.18Å; P1904-G1906 VanDerWaalsContact O-N 3.08Å; G1906-N1908 PolarHBondContact O-N 3.46Å
1907	G	57.8	Low	68.5	Low	50 Å²	50	57.3 Å²	57.3	52%	0.515	35%	0.349	S	S	.	.			trans	-75.5	75.2	177.3	0	0	0	0	0	114.8	P1904 N1909	P1904-G1907 PolarHBondContact O-N 3.28Å; G1907-N1909 PolarHBondContact O-N 3Å
1908	N	52.7	Low	68.5	Low	136 Å²	136	58.7 Å²	58.7	73%	0.727	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.9	-170.1	-78.4	-11.7	0	0	0	116.9	G1906	G1906-N1908 PolarHBondContact O-N 3.46Å
1909	N	54.7	Low	68.7	Low	155 Å²	155	62 Å²	62	83%	0.829	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-10.3	-161.6	-69.8	-0.1	0	0	0	116	G1907	G1907-N1909 PolarHBondContact O-N 3Å
1910	D	61	Low	68.9	Low	103 Å²	103	63.8 Å²	63.8	55%	0.551	39%	0.385	S	S	*	.			trans	-82.7	134.3	-171.9	-65.9	-29.3	0	0	0	112.9	K1915	D1910-K1915 PolarHBondContact O-NZ 2.97Å
1911	V	67.6	Low	69.1	Low	83 Å²	83	63.6 Å²	63.6	50%	0.503	39%	0.385	S	S	.	.			trans	-77.5	129.3	167.6	-179.3	0	0	0	0	108	L1855	L1855-V1911 WeakPolarHBondContact CB-O 3.16Å; L1855-V1911 HydrophobicContact CD2-CG1 4.15Å; L1855-V1911 PolarHBondContact N-O 3.21Å
1912	T	73.1	Confident	69.4	Low	13 Å²	13	68.3 Å²	68.3	8%	0.08	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-111.2	152.9	177	70.6	0	0	0	0	110.3	N1852 M1853 G1914 K1915 F1916	N1852-T1912 WeakPolarHBondContact OD1-CB 3.26Å; N1852-T1912 WeakPolarHBondContact OD1-CG2 3.35Å; N1852-T1912 PolarHBondContact OD1-OG1 2.83Å; M1853-T1912 CarbonylContact O-C 3.52Å; M1853-T1912 VanDerWaalsContact O-CA 3.3Å; M1853-T1912 WeakPolarHBondContact O-CA 3.14Å; M1853-T1912 VanDerWaalsContact O-CB 3.29Å; M1853-T1912 WeakPolarHBondContact O-CB 3.2Å; T1912-G1914 PolarHBondContact O-N 3.46Å; T1912-G1914 VanDerWaalsContact O-N 3.13Å; T1912-K1915 WeakPolarHBondContact O-CB 3.2Å; T1912-K1915 PolarHBondContact O-N 3.5Å; T1912-K1915 PolarHBondContact OG1-N 3.18Å; T1912-F1916 PolarHBondContact O-N 3.03Å
1913	V	71.3	Confident	69.7	Low	4 Å²	4	72.5 Å²	72.5	2%	0.024	43%	0.429	C	S	.	.	H	α-helix	trans	-53.1	-34.1	174.7	176.9	0	0	0	0	110.4	L1848 M1853 L1855 V1861 F1916 Y1917	L1848-V1913 HydrophobicContact CD2-CG1 4.48Å; M1853-V1913 HydrophobicContact CB-CB 4.27Å; M1853-V1913 HydrophobicContact CB-CG2 4.2Å; M1853-V1913 PolarHBondContact O-N 2.98Å; L1855-V1913 HydrophobicContact CB-CG2 4.5Å; L1855-V1913 HydrophobicContact CD1-CG2 4.22Å; V1861-V1913 HydrophobicContact CG2-CG2 3.81Å; V1913-F1916 PolarHBondContact O-N 2.99Å; V1913-Y1917 HydrophobicContact CG1-CD2 3.65Å; V1913-Y1917 HydrophobicContact CG1-CE2 3.78Å; V1913-Y1917 WeakPolarHBondContact O-CD2 3.07Å; V1913-Y1917 PolarHBondContact O-N 3.42Å
1914	G	72.3	Confident	70	Confident	4 Å²	4	72 Å²	72	4%	0.041	42%	0.42	C	S	.	.	H	α-helix	trans	-63.7	-43.5	173.3	0	0	0	0	0	114.2	T1912 F1916 A1918	T1912-G1914 PolarHBondContact O-N 3.46Å; T1912-G1914 VanDerWaalsContact O-N 3.13Å; G1914-F1916 VanDerWaalsContact C-N 3.29Å; G1914-F1916 PolarHBondContact O-N 2.69Å; G1914-A1918 WeakPolarHBondContact O-CB 3.45Å; G1914-A1918 PolarHBondContact O-N 3.02Å
1915	K	76.4	Confident	70.4	Confident	108 Å²	108	77.6 Å²	77.6	47%	0.47	43%	0.434	S	S	.	.	H	α-helix	trans	-60	-39.8	174.6	-68.7	175.1	-177.1	174.7	0	111.4	D1910 T1912 T1919	D1910-K1915 PolarHBondContact O-NZ 2.97Å; T1912-K1915 WeakPolarHBondContact O-CB 3.2Å; T1912-K1915 PolarHBondContact O-N 3.5Å; T1912-K1915 PolarHBondContact OG1-N 3.18Å; K1915-T1919 WeakPolarHBondContact O-CB 3.33Å; K1915-T1919 PolarHBondContact O-N 3.49Å; K1915-T1919 PolarHBondContact O-OG1 3Å
1916	F	76.4	Confident	71.7	Confident	96 Å²	96	78.2 Å²	78.2	42%	0.421	42%	0.417	S	S	.	.	H	α-helix	trans	-66.7	-53.8	178	-174.7	-97.3	0	0	0	112.5	H1819 T1912 V1913 G1914 A1918 T1919 F1920	H1819-F1916 AromaticContact CD2-CE1 3.9Å; H1819-F1916 AromaticContact NE2-CE1 3.7Å; H1819-F1916 AromaticContact NE2-CZ 3.88Å; T1912-F1916 PolarHBondContact O-N 3.03Å; V1913-F1916 PolarHBondContact O-N 2.99Å; G1914-F1916 VanDerWaalsContact C-N 3.29Å; G1914-F1916 PolarHBondContact O-N 2.69Å; F1916-A1918 PolarHBondContact O-N 2.87Å; F1916-T1919 WeakPolarHBondContact O-CB 3.29Å; F1916-T1919 PolarHBondContact O-N 2.87Å; F1916-F1920 PolarHBondContact O-N 3.21Å
1917	Y	77.7	Confident	72.9	Confident	14 Å²	14	82.9 Å²	82.9	6%	0.055	41%	0.414	C	S	.	.	H	α-helix	trans	-69	-30.1	179	-80.2	-73.9	0	0	0	113.3	V1823 C1845 V1913 F1920 L1921	V1823-Y1917 HydrophobicContact CG2-CE1 4.47Å; V1823-Y1917 HydrophobicContact CG2-CE2 4.39Å; V1823-Y1917 VanDerWaalsContact CG2-OH 3.24Å; V1823-Y1917 WeakPolarHBondContact CG2-OH 3.33Å; C1845-Y1917 HydrophobicContact CB-CD1 4.16Å; C1845-Y1917 VanDerWaalsContact SG-CD1 3.55Å; V1913-Y1917 HydrophobicContact CG1-CD2 3.65Å; V1913-Y1917 HydrophobicContact CG1-CE2 3.78Å; V1913-Y1917 WeakPolarHBondContact O-CD2 3.07Å; V1913-Y1917 PolarHBondContact O-N 3.42Å; Y1917-F1920 PolarHBondContact O-N 2.68Å; Y1917-L1921 WeakPolarHBondContact O-CB 3.25Å; Y1917-L1921 VanDerWaalsContact O-CG 3.27Å; Y1917-L1921 WeakPolarHBondContact O-CG 3.44Å; Y1917-L1921 PolarHBondContact O-N 2.85Å
1918	A	79	Confident	73.8	Confident	30 Å²	30	87.8 Å²	87.8	25%	0.248	42%	0.417	C	S	.	.	H	α-helix	trans	-64	-43.1	170.3	0	0	0	0	0	111.2	V1849 G1914 F1916 F1920 L1921 I1922	V1849-A1918 HydrophobicContact CG2-CB 4.49Å; G1914-A1918 WeakPolarHBondContact O-CB 3.45Å; G1914-A1918 PolarHBondContact O-N 3.02Å; F1916-A1918 PolarHBondContact O-N 2.87Å; A1918-F1920 VanDerWaalsContact C-N 3.34Å; A1918-F1920 PolarHBondContact O-N 3.18Å; A1918-L1921 PolarHBondContact O-N 3.49Å; A1918-I1922 WeakPolarHBondContact O-CB 3.04Å; A1918-I1922 WeakPolarHBondContact O-CD1 3.25Å; A1918-I1922 WeakPolarHBondContact O-CG1 2.89Å; A1918-I1922 PolarHBondContact O-N 3.33Å
1919	T	80.3	Confident	75.2	Confident	72 Å²	72	87.3 Å²	87.3	44%	0.442	41%	0.405	S	S	.	.	H	α-helix	trans	-60.1	-44.1	174.5	-56.8	0	0	0	0	111.2	K1915 F1916 I1922 Q1923	K1915-T1919 WeakPolarHBondContact O-CB 3.33Å; K1915-T1919 PolarHBondContact O-N 3.49Å; K1915-T1919 PolarHBondContact O-OG1 3Å; F1916-T1919 WeakPolarHBondContact O-CB 3.29Å; F1916-T1919 PolarHBondContact O-N 2.87Å; T1919-I1922 PolarHBondContact O-N 2.89Å; T1919-Q1923 WeakPolarHBondContact O-CB 3.34Å; T1919-Q1923 VanDerWaalsContact O-CG 3.29Å; T1919-Q1923 WeakPolarHBondContact O-CG 3.28Å; T1919-Q1923 PolarHBondContact O-N 2.68Å
1920	F	76.5	Confident	76.5	Confident	100 Å²	100	86.5 Å²	86.5	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-61	-48	174.9	-178.1	-88.5	0	0	0	112.4	F1916 Y1917 A1918 I1922 Q1923 E1924	F1916-F1920 PolarHBondContact O-N 3.21Å; Y1917-F1920 PolarHBondContact O-N 2.68Å; A1918-F1920 VanDerWaalsContact C-N 3.34Å; A1918-F1920 PolarHBondContact O-N 3.18Å; F1920-I1922 PolarHBondContact O-N 3.17Å; F1920-Q1923 PolarHBondContact O-N 3.27Å; F1920-E1924 PolarHBondContact O-N 2.98Å
1921	L	77.7	Confident	77.2	Confident	37 Å²	37	87.1 Å²	87.1	19%	0.194	39%	0.393	C	S	.	.	H	α-helix	trans	-63.6	-38.9	178.7	-74.2	168	0	0	0	112.2	R1842 C1845 V1846 Y1917 A1918 E1924 W1925	R1842-L1921 HydrophobicContact CG-CD2 4.48Å; C1845-L1921 HydrophobicContact CB-CD1 4.49Å; V1846-L1921 HydrophobicContact CG2-CD1 4.1Å; Y1917-L1921 WeakPolarHBondContact O-CB 3.25Å; Y1917-L1921 VanDerWaalsContact O-CG 3.27Å; Y1917-L1921 WeakPolarHBondContact O-CG 3.44Å; Y1917-L1921 PolarHBondContact O-N 2.85Å; A1918-L1921 PolarHBondContact O-N 3.49Å; L1921-E1924 PolarHBondContact O-N 2.79Å; L1921-W1925 WeakPolarHBondContact O-CB 3.16Å; L1921-W1925 PolarHBondContact O-N 3.32Å
1922	I	80.9	Confident	77.6	Confident	118 Å²	118	89.2 Å²	89.2	61%	0.605	40%	0.396	S	S	*	.	H	α-helix	trans	-65.5	-43.6	174.7	-69.8	163.6	0	0	0	110.4	A1918 T1919 F1920 E1924 W1925 F1926	A1918-I1922 WeakPolarHBondContact O-CB 3.04Å; A1918-I1922 WeakPolarHBondContact O-CD1 3.25Å; A1918-I1922 WeakPolarHBondContact O-CG1 2.89Å; A1918-I1922 PolarHBondContact O-N 3.33Å; T1919-I1922 PolarHBondContact O-N 2.89Å; F1920-I1922 PolarHBondContact O-N 3.17Å; I1922-E1924 VanDerWaalsContact C-N 3.34Å; I1922-E1924 PolarHBondContact O-N 3.47Å; I1922-W1925 PolarHBondContact O-N 3.48Å; I1922-F1926 VanDerWaalsContact O-CB 3.28Å; I1922-F1926 WeakPolarHBondContact O-CB 3.41Å; I1922-F1926 PolarHBondContact O-N 2.82Å
1923	Q	82.2	Confident	77.7	Confident	96 Å²	96	93.6 Å²	93.6	45%	0.449	41%	0.414	S	S	.	.	H	α-helix	trans	-62.2	-40.5	174.7	-73.8	178.3	14.5	0	0	112	T1919 F1920 R1927	T1919-Q1923 WeakPolarHBondContact O-CB 3.34Å; T1919-Q1923 VanDerWaalsContact O-CG 3.29Å; T1919-Q1923 WeakPolarHBondContact O-CG 3.28Å; T1919-Q1923 PolarHBondContact O-N 2.68Å; F1920-Q1923 PolarHBondContact O-N 3.27Å; Q1923-R1927 WeakPolarHBondContact O-CB 3.32Å; Q1923-R1927 WeakPolarHBondContact O-CG 3.45Å; Q1923-R1927 PolarHBondContact O-N 2.04Å
1924	E	75.1	Confident	77.8	Confident	61 Å²	61	95.5 Å²	95.5	29%	0.285	43%	0.43	S	S	.	.	H	α-helix	trans	-66.1	-44.9	176	-160.1	-159.9	143.6	0	0	111.5	F1920 L1921 I1922 F1926 R1927 R1928	F1920-E1924 PolarHBondContact O-N 2.98Å; L1921-E1924 PolarHBondContact O-N 2.79Å; I1922-E1924 VanDerWaalsContact C-N 3.34Å; I1922-E1924 PolarHBondContact O-N 3.47Å; E1924-F1926 PolarHBondContact O-N 2.84Å; E1924-R1927 PolarHBondContact O-N 2.81Å; E1924-R1928 WeakPolarHBondContact O-CG 3.17Å; E1924-R1928 PolarHBondContact O-N 3.4Å; E1924-R1928 IonicContact OE1-CZ 3.95Å; E1924-R1928 IonicContact OE1-NE 2.61Å; E1924-R1928 PolarHBondContact OE1-NE 3.46Å; E1924-R1928 IonicContact OE1-NH2 3.95Å; E1924-R1928 PolarHBondContact OE1-NH2 2.72Å
1925	W	75.4	Confident	77.6	Confident	177 Å²	177	101.3 Å²	101.3	67%	0.67	46%	0.456	S	S	*	.	H	α-helix	trans	-64.8	-40.5	178.9	-149.4	83.9	0	0	0	111.7	L1921 I1922 R1928 W1929	L1921-W1925 WeakPolarHBondContact O-CB 3.16Å; L1921-W1925 PolarHBondContact O-N 3.32Å; I1922-W1925 PolarHBondContact O-N 3.48Å; W1925-R1928 PolarHBondContact O-N 3.06Å; W1925-W1929 VanDerWaalsContact O-CB 3.31Å; W1925-W1929 WeakPolarHBondContact O-CB 3.48Å; W1925-W1929 PolarHBondContact O-N 2.82Å
1926	F	82.8	Confident	76.8	Confident	119 Å²	119	100.3 Å²	100.3	52%	0.522	45%	0.453	S	S	.	.	H	α-helix	trans	-64.8	-39.7	173.4	-177.1	-103.7	0	0	0	112.5	I1922 E1924 W1929 K1930	I1922-F1926 VanDerWaalsContact O-CB 3.28Å; I1922-F1926 WeakPolarHBondContact O-CB 3.41Å; I1922-F1926 PolarHBondContact O-N 2.82Å; E1924-F1926 PolarHBondContact O-N 2.84Å; F1926-W1929 HydrophobicContact CD2-CE3 4.24Å; F1926-W1929 HydrophobicContact CE2-CE3 4.18Å; F1926-W1929 HydrophobicContact CE2-CZ3 4.07Å; F1926-K1930 VanDerWaalsContact O-CB 3.31Å; F1926-K1930 WeakPolarHBondContact O-CB 3.29Å; F1926-K1930 PolarHBondContact O-N 3.44Å
1927	R	80.9	Confident	76.1	Confident	164 Å²	164	102.1 Å²	102.1	62%	0.619	46%	0.463	S	S	*	.	H	α-helix	trans	-62	-49.3	173.1	-75	169	-172.8	-161.2	4.5	111.2	Q1923 E1924 W1929 K1930 Q1931	Q1923-R1927 WeakPolarHBondContact O-CB 3.32Å; Q1923-R1927 WeakPolarHBondContact O-CG 3.45Å; Q1923-R1927 PolarHBondContact O-N 2.04Å; E1924-R1927 PolarHBondContact O-N 2.81Å; R1927-W1929 PolarHBondContact O-N 2.76Å; R1927-K1930 PolarHBondContact O-N 2.9Å; R1927-Q1931 WeakPolarHBondContact O-CG 3.31Å; R1927-Q1931 PolarHBondContact O-N 2.86Å; R1927-Q1931 PolarHBondContact O-OE1 3.38Å
1928	R	75.2	Confident	75.3	Confident	154 Å²	154	109 Å²	109	58%	0.581	49%	0.493	S	S	*	.	H	α-helix	trans	-60.5	-43.7	176.7	-71.5	178.6	-176.5	-116	6.5	112.1	E1924 W1925 Q1931 K1932	E1924-R1928 WeakPolarHBondContact O-CG 3.17Å; E1924-R1928 PolarHBondContact O-N 3.4Å; E1924-R1928 IonicContact OE1-CZ 3.95Å; E1924-R1928 IonicContact OE1-NE 2.61Å; E1924-R1928 PolarHBondContact OE1-NE 3.46Å; E1924-R1928 IonicContact OE1-NH2 3.95Å; E1924-R1928 PolarHBondContact OE1-NH2 2.72Å; W1925-R1928 PolarHBondContact O-N 3.06Å; R1928-Q1931 PolarHBondContact O-N 3.12Å; R1928-K1932 WeakPolarHBondContact O-CB 3.27Å; R1928-K1932 PolarHBondContact O-N 2.75Å
1929	W	82.2	Confident	74	Confident	125 Å²	125	111.4 Å²	111.4	47%	0.473	51%	0.513	S	S	.	.	H	α-helix	trans	-61.6	-44.1	175.7	175.8	83.7	0	0	0	111.9	W1925 F1926 R1927 Q1931 K1932 K1933	W1925-W1929 VanDerWaalsContact O-CB 3.31Å; W1925-W1929 WeakPolarHBondContact O-CB 3.48Å; W1925-W1929 PolarHBondContact O-N 2.82Å; F1926-W1929 HydrophobicContact CD2-CE3 4.24Å; F1926-W1929 HydrophobicContact CE2-CE3 4.18Å; F1926-W1929 HydrophobicContact CE2-CZ3 4.07Å; R1927-W1929 PolarHBondContact O-N 2.76Å; W1929-Q1931 PolarHBondContact O-N 3.1Å; W1929-K1932 PolarHBondContact O-N 3.01Å; W1929-K1933 HydrophobicContact CH2-CD 4.31Å; W1929-K1933 HydrophobicContact CZ2-CD 3.95Å; W1929-K1933 PolarHBondContact O-N 2.98Å
1930	K	82.5	Confident	72.8	Confident	138 Å²	138	115.3 Å²	115.3	60%	0.6	53%	0.53	S	S	*	.	H	α-helix	trans	-65.1	-37.3	176.6	-172.6	175.5	-179.7	179.3	0	112.3	F1926 R1927 A1934	F1926-K1930 VanDerWaalsContact O-CB 3.31Å; F1926-K1930 WeakPolarHBondContact O-CB 3.29Å; F1926-K1930 PolarHBondContact O-N 3.44Å; R1927-K1930 PolarHBondContact O-N 2.9Å; K1930-A1934 WeakPolarHBondContact O-CB 3.31Å; K1930-A1934 PolarHBondContact O-N 2.77Å; K1930-A1934 VanDerWaalsContact O-N 3.15Å
1931	Q	76.6	Confident	71.8	Confident	116 Å²	116	117.5 Å²	117.5	54%	0.542	55%	0.546	S	S	.	.	H	α-helix	trans	-64.7	-51.8	172.4	-74.1	171.7	-62.4	0	0	111.1	R1927 R1928 W1929 K1933 A1934 E1935	R1927-Q1931 WeakPolarHBondContact O-CG 3.31Å; R1927-Q1931 PolarHBondContact O-N 2.86Å; R1927-Q1931 PolarHBondContact O-OE1 3.38Å; R1928-Q1931 PolarHBondContact O-N 3.12Å; W1929-Q1931 PolarHBondContact O-N 3.1Å; Q1931-K1933 VanDerWaalsContact C-N 3.33Å; Q1931-K1933 PolarHBondContact O-N 3.06Å; Q1931-A1934 CarbonylContact O-C 3.55Å; Q1931-A1934 WeakPolarHBondContact O-CA 3.42Å; Q1931-A1934 WeakPolarHBondContact O-CB 3.28Å; Q1931-A1934 PolarHBondContact O-N 2.88Å; Q1931-E1935 PolarHBondContact O-N 3.27Å
1932	K	74.3	Confident	70.3	Confident	127 Å²	127	124.2 Å²	124.2	55%	0.552	58%	0.576	S	S	*	*	H	α-helix	trans	-59	-41.1	-179.4	-167.2	171.5	-170.9	-73.1	0	112.5	R1928 W1929 E1935 E1936	R1928-K1932 WeakPolarHBondContact O-CB 3.27Å; R1928-K1932 PolarHBondContact O-N 2.75Å; W1929-K1932 PolarHBondContact O-N 3.01Å; K1932-E1935 PolarHBondContact O-N 3Å; K1932-E1936 IonicContact NZ-OE1 2.61Å; K1932-E1936 PolarHBondContact NZ-OE1 3.41Å; K1932-E1936 WeakPolarHBondContact O-CB 3.26Å; K1932-E1936 VanDerWaalsContact O-CG 3.28Å; K1932-E1936 WeakPolarHBondContact O-CG 3.13Å; K1932-E1936 PolarHBondContact O-N 2.81Å
1933	K	75	Confident	68.2	Low	106 Å²	106	122.3 Å²	122.3	46%	0.461	59%	0.585	S	S	.	*	H	α-helix	trans	-64.4	-37.5	172.4	-103.5	-157.2	170.6	-163.4	0	113.4	W1929 Q1931 E1935 Q1937	W1929-K1933 HydrophobicContact CH2-CD 4.31Å; W1929-K1933 HydrophobicContact CZ2-CD 3.95Å; W1929-K1933 PolarHBondContact O-N 2.98Å; Q1931-K1933 VanDerWaalsContact C-N 3.33Å; Q1931-K1933 PolarHBondContact O-N 3.06Å; K1933-E1935 VanDerWaalsContact C-N 3.33Å; K1933-Q1937 WeakPolarHBondContact O-CB 3.3Å; K1933-Q1937 WeakPolarHBondContact O-CG 3.39Å; K1933-Q1937 PolarHBondContact O-N 2.79Å
1934	A	75	Confident	65.9	Low	44 Å²	44	127.6 Å²	127.6	36%	0.364	61%	0.61	S	S	.	*	H	α-helix	trans	-70.6	-29.9	176.8	0	0	0	0	0	112.5	K1930 Q1931 K1938	K1930-A1934 WeakPolarHBondContact O-CB 3.31Å; K1930-A1934 PolarHBondContact O-N 2.77Å; K1930-A1934 VanDerWaalsContact O-N 3.15Å; Q1931-A1934 CarbonylContact O-C 3.55Å; Q1931-A1934 WeakPolarHBondContact O-CA 3.42Å; Q1931-A1934 WeakPolarHBondContact O-CB 3.28Å; Q1931-A1934 PolarHBondContact O-N 2.88Å; A1934-K1938 WeakPolarHBondContact O-CB 3.41Å; A1934-K1938 VanDerWaalsContact O-CG 3.24Å; A1934-K1938 WeakPolarHBondContact O-CG 3.38Å; A1934-K1938 PolarHBondContact O-N 3.17Å
1935	E	66.7	Low	64.3	Low	126 Å²	126	128.4 Å²	128.4	59%	0.589	63%	0.634	S	S	*	*	H	α-helix	trans	-74.5	-45	172.8	-72	167.2	169.4	0	0	111.4	Q1931 K1932 K1933 Q1937 K1938 A1939	Q1931-E1935 PolarHBondContact O-N 3.27Å; K1932-E1935 PolarHBondContact O-N 3Å; K1933-E1935 VanDerWaalsContact C-N 3.33Å; E1935-Q1937 PolarHBondContact O-N 3.03Å; E1935-K1938 PolarHBondContact O-N 3.38Å; E1935-K1938 VanDerWaalsContact O-N 3.11Å; E1935-A1939 WeakPolarHBondContact O-CB 3.49Å; E1935-A1939 PolarHBondContact O-N 3.02Å
1936	E	61.2	Low	62.5	Low	87 Å²	87	130.3 Å²	130.3	41%	0.407	65%	0.647	S	S	.	*	H	α-helix	trans	-58.6	-43.3	173.5	-74.3	165.6	178.9	0	0	112	K1932 K1938 A1939 L1940	K1932-E1936 IonicContact NZ-OE1 2.61Å; K1932-E1936 PolarHBondContact NZ-OE1 3.41Å; K1932-E1936 WeakPolarHBondContact O-CB 3.26Å; K1932-E1936 VanDerWaalsContact O-CG 3.28Å; K1932-E1936 WeakPolarHBondContact O-CG 3.13Å; K1932-E1936 PolarHBondContact O-N 2.81Å; E1936-K1938 VanDerWaalsContact C-N 3.35Å; E1936-K1938 PolarHBondContact O-N 2.63Å; E1936-A1939 PolarHBondContact O-N 3Å; E1936-L1940 WeakPolarHBondContact O-CG 3.32Å; E1936-L1940 PolarHBondContact O-N 3.45Å
1937	Q	61	Low	60.2	Low	133 Å²	133	135.8 Å²	135.8	62%	0.621	66%	0.664	S	S	*	*	H	α-helix	trans	-68.9	-28.7	174.9	-73.7	-170.9	-86	0	0	113.7	K1933 E1935	K1933-Q1937 WeakPolarHBondContact O-CB 3.3Å; K1933-Q1937 WeakPolarHBondContact O-CG 3.39Å; K1933-Q1937 PolarHBondContact O-N 2.79Å; E1935-Q1937 PolarHBondContact O-N 3.03Å
1938	K	60	Low	58	Low	160 Å²	160	135.5 Å²	135.5	70%	0.696	67%	0.67	S	S	*	*	H	α-helix	trans	-76.5	-38.9	174.2	-79.1	175.4	177	-174	0	112.2	A1934 E1935 E1936 L1940 L1941	A1934-K1938 WeakPolarHBondContact O-CB 3.41Å; A1934-K1938 VanDerWaalsContact O-CG 3.24Å; A1934-K1938 WeakPolarHBondContact O-CG 3.38Å; A1934-K1938 PolarHBondContact O-N 3.17Å; E1935-K1938 PolarHBondContact O-N 3.38Å; E1935-K1938 VanDerWaalsContact O-N 3.11Å; E1936-K1938 VanDerWaalsContact C-N 3.35Å; E1936-K1938 PolarHBondContact O-N 2.63Å; K1938-L1940 VanDerWaalsContact C-N 3.28Å; K1938-L1940 PolarHBondContact O-N 2.8Å; K1938-L1941 PolarHBondContact O-N 3.33Å
1939	A	53.4	Low	56.1	Low	80 Å²	80	130.4 Å²	130.4	66%	0.661	66%	0.658	S	S	*	*	H	α-helix	trans	-64.1	-31.7	177.3	0	0	0	0	0	112.6	E1935 E1936 L1941	E1935-A1939 WeakPolarHBondContact O-CB 3.49Å; E1935-A1939 PolarHBondContact O-N 3.02Å; E1936-A1939 PolarHBondContact O-N 3Å; A1939-L1941 VanDerWaalsContact C-N 3.32Å; A1939-L1941 PolarHBondContact O-N 2.81Å
1940	L	54.6	Low	53.6	Low	153 Å²	153	128.7 Å²	128.7	80%	0.801	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-5.9	177.6	-72.2	169.5	0	0	0	114.8	E1936 K1938	E1936-L1940 WeakPolarHBondContact O-CG 3.32Å; E1936-L1940 PolarHBondContact O-N 3.45Å; K1938-L1940 VanDerWaalsContact C-N 3.28Å; K1938-L1940 PolarHBondContact O-N 2.8Å
1941	L	54.9	Low	51	Low	146 Å²	146	128.5 Å²	128.5	76%	0.764	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.5	3.2	-172.8	-98.7	167.1	0	0	0	114.9	K1938 A1939	K1938-L1941 PolarHBondContact O-N 3.33Å; A1939-L1941 VanDerWaalsContact C-N 3.32Å; A1939-L1941 PolarHBondContact O-N 2.81Å
1942	H	47.1	Very low	48.9	Very low	179 Å²	179	127.7 Å²	127.7	83%	0.829	67%	0.665	S	S	*	*	S	Bend	trans	-147.2	105.2	-172.9	-136.4	-89.7	0	0	0	114.8
1943	G	36.7	Very low	46.9	Very low	77 Å²	77	131.3 Å²	131.3	79%	0.794	68%	0.681	S	S	*	*			trans	101.9	114.1	157.2	0	0	0	0	0	117.4
1944	Q	34.5	Very low	44.4	Very low	208 Å²	208	134.4 Å²	134.4	97%	0.972	69%	0.694	S	S	*	*			trans	-86.9	143.7	158.7	-64.4	173.4	-19.8	0	0	109.6
1945	G	40.6	Very low	41.9	Very low	78 Å²	78	136.4 Å²	136.4	80%	0.804	71%	0.706	S	S	*	*			trans	139.8	128.3	170	0	0	0	0	0	113.8
1946	K	37.4	Very low	40.1	Very low	217 Å²	217	137 Å²	137	94%	0.943	71%	0.707	S	S	*	*			trans	-89	147.1	-175.2	-62.8	178.4	179.2	178.8	0	112.2
1947	R	34.2	Very low	38.5	Very low	233 Å²	233	136.9 Å²	136.9	88%	0.879	73%	0.729	S	S	*	*			trans	-142.7	145.2	169.1	-83.4	-173.6	168.9	-180	-3.7	111.7
1948	H	36	Very low	37.5	Very low	159 Å²	159	139.6 Å²	139.6	74%	0.736	73%	0.733	S	S	*	*			trans	22.5	121	140.2	-68.2	-80	0	0	0	118.8
1949	S	34.2	Very low	35.9	Very low	47 Å²	47	135.9 Å²	135.9	33%	0.329	73%	0.726	S	S	.	*				77.3	144.6	58.3	81.7	0	0	0	0	114.2
1950	I	29.8	Very low	34.7	Very low	88 Å²	88	136.8 Å²	136.8	45%	0.451	72%	0.723	S	S	.	*			trans	80.5	115.2	175.8	-42.6	-167.3	0	0	0	115.2	T1966 Q1967	I1950-T1966 VanDerWaalsContact CD1-O 3.23Å; I1950-T1966 WeakPolarHBondContact CD1-O 3.4Å; I1950-T1966 WeakPolarHBondContact CG1-O 3.33Å; I1950-T1966 WeakPolarHBondContact CG2-O 3.42Å; I1950-Q1967 HydrophobicContact CD1-CG 4.22Å; I1950-Q1967 HydrophobicContact CG1-CG 3.67Å
1951	M	28.5	Very low	33.6	Very low	134 Å²	134	136.4 Å²	136.4	66%	0.66	73%	0.728	S	S	*	*			trans	14.1	153.4	130.6	-108.5	-151.9	-65.9	0	0	120.8	T1966	M1951-T1966 WeakPolarHBondContact CE-OG1 3.35Å
1952	P	32.3	Very low	32.6	Very low	100 Å²	100	132.7 Å²	132.7	65%	0.649	73%	0.725	S	S	*	*				-118.3	-132.2	-99.3	33.9	-16	0	0	0	108.1	K1954	P1952-K1954 PolarHBondContact O-N 3.38Å
1953	F	31.8	Very low	32	Very low	202 Å²	202	129.8 Å²	129.8	89%	0.886	72%	0.722	S	S	*	*			trans	30.6	64.9	141.8	-152.6	-89.5	0	0	0	116.9
1954	K	23	Very low	31.7	Very low	171 Å²	171	133.3 Å²	133.3	74%	0.743	72%	0.721	S	S	*	*			trans	-146.4	140.2	164.2	-105.5	170.3	-175.7	168.2	0	106.9	P1952	P1952-K1954 PolarHBondContact O-N 3.38Å
1955	S	21.9	Very low	31.6	Very low	87 Å²	87	130.7 Å²	130.7	61%	0.608	71%	0.709	S	S	*	*			cis	-163	143.7	11.2	60.2	0	0	0	0	111.9
1956	F	29.4	Very low	31.3	Very low	138 Å²	138	131.4 Å²	131.4	61%	0.605	70%	0.698	S	S	*	*				69.1	161.6	123.2	-67.7	-178.7	0	0	0	118.7	R1958 P1959	F1956-R1958 VanDerWaalsContact CB-N 3.28Å; F1956-R1958 WeakPolarHBondContact CB-O 3.37Å; F1956-R1958 HydrophobicContact CD1-CB 4.38Å; F1956-R1958 WeakPolarHBondContact CD1-O 3.23Å; F1956-R1958 HydrophobicContact CD2-CB 4.05Å; F1956-R1958 HydrophobicContact CE1-CB 4.31Å; F1956-R1958 HydrophobicContact CE2-CB 4.01Å; F1956-R1958 HydrophobicContact CE2-CG 4.5Å; F1956-R1958 HydrophobicContact CG-CB 4.24Å; F1956-R1958 VanDerWaalsContact CG-N 3.28Å; F1956-R1958 WeakPolarHBondContact CG-O 3.37Å; F1956-R1958 HydrophobicContact CZ-CB 4.14Å; F1956-P1959 HydrophobicContact CD1-CB 4.41Å
1957	G	26.9	Very low	31	Very low	85 Å²	85	126.9 Å²	126.9	88%	0.876	68%	0.68	S	S	*	*	S	Bend	cis	-66.4	104.4	18.1	0	0	0	0	0	119.5
1958	R	41.3	Very low	30.8	Very low	189 Å²	189	120.5 Å²	120.5	71%	0.713	66%	0.663	S	S	*	*				-98.9	169.1	102.2	-66.3	-175	179.1	-177.9	0.9	106.4	F1956	F1956-R1958 VanDerWaalsContact CB-N 3.28Å; F1956-R1958 WeakPolarHBondContact CB-O 3.37Å; F1956-R1958 HydrophobicContact CD1-CB 4.38Å; F1956-R1958 WeakPolarHBondContact CD1-O 3.23Å; F1956-R1958 HydrophobicContact CD2-CB 4.05Å; F1956-R1958 HydrophobicContact CE1-CB 4.31Å; F1956-R1958 HydrophobicContact CE2-CB 4.01Å; F1956-R1958 HydrophobicContact CE2-CG 4.5Å; F1956-R1958 HydrophobicContact CG-CB 4.24Å; F1956-R1958 VanDerWaalsContact CG-N 3.28Å; F1956-R1958 WeakPolarHBondContact CG-O 3.37Å; F1956-R1958 HydrophobicContact CZ-CB 4.14Å
1959	P	26.2	Very low	30.6	Very low	82 Å²	82	119.2 Å²	119.2	53%	0.532	67%	0.667	S	S	.	*				-152.8	103.7	121.2	30.4	-9.5	0	0	0	113.6	F1956	F1956-P1959 HydrophobicContact CD1-CB 4.41Å
1960	T	28.4	Very low	30.4	Very low	99 Å²	99	120.7 Å²	120.7	61%	0.607	68%	0.678	S	S	*	*			trans	-143.8	119.6	156.6	35.1	0	0	0	0	110.1	I2505	T1960-I2505 HydrophobicContact CG2-CD1 4.41Å
1961	T	30	Very low	30.2	Very low	146 Å²	146	123.5 Å²	123.5	90%	0.896	69%	0.691	S	S	*	*			trans	48.6	122.4	150	57.3	0	0	0	0	121.8
1962	G	34.3	Very low	30.1	Very low	68 Å²	68	121.8 Å²	121.8	70%	0.701	68%	0.684	S	S	*	*			trans	147.7	120.1	164.2	0	0	0	0	0	115
1963	P	34	Very low	29.9	Very low	118 Å²	118	122 Å²	122	77%	0.766	68%	0.679	S	S	*	*			trans	-128.7	171.8	-167.2	44.2	-32.4	0	0	0	118.9
1964	L	30.5	Very low	29.7	Very low	150 Å²	150	116.4 Å²	116.4	79%	0.785	66%	0.658	S	S	*	*			trans	102.1	128.4	155.7	-64.8	161	0	0	0	123.1
1965	E	34	Very low	30.2	Very low	153 Å²	153	113.4 Å²	113.4	72%	0.715	65%	0.649	S	S	*	*			trans	71.2	177.3	143.1	-65.9	-173.2	121.2	0	0	125.4
1966	T	33.1	Very low	30.9	Very low	93 Å²	93	114 Å²	114	57%	0.571	65%	0.651	S	S	*	*			trans	83.4	155.6	-175.1	74.3	0	0	0	0	119	I1950 M1951	I1950-T1966 VanDerWaalsContact CD1-O 3.23Å; I1950-T1966 WeakPolarHBondContact CD1-O 3.4Å; I1950-T1966 WeakPolarHBondContact CG1-O 3.33Å; I1950-T1966 WeakPolarHBondContact CG2-O 3.42Å; M1951-T1966 WeakPolarHBondContact CE-OG1 3.35Å
1967	Q	31.5	Very low	30.9	Very low	122 Å²	122	112.8 Å²	112.8	57%	0.57	66%	0.657	S	S	*	*			trans	-155.7	147	-163.1	-95	-169	89.4	0	0	119.4	I1950	I1950-Q1967 HydrophobicContact CD1-CG 4.22Å; I1950-Q1967 HydrophobicContact CG1-CG 3.67Å
1968	N	30.2	Very low	30.9	Very low	99 Å²	99	113.1 Å²	113.1	53%	0.529	65%	0.646	S	S	.	*			trans	66.6	153.2	149.3	-56.6	-24.8	0	0	0	122.6
1969	T	32	Very low	30.2	Very low	132 Å²	132	113.2 Å²	113.2	81%	0.81	65%	0.654	S	S	*	*			trans	74.3	168.3	178.2	79	0	0	0	0	115.2
1970	S	28.9	Very low	30.2	Very low	79 Å²	79	117.7 Å²	117.7	55%	0.552	67%	0.668	S	S	*	*			cis	-150.2	-159.9	5.4	-157.2	0	0	0	0	112.8	N54	N54-S1970 WeakPolarHBondContact ND2-CB 3.49Å
1971	M	26	Very low	30.3	Very low	147 Å²	147	119.2 Å²	119.2	72%	0.724	68%	0.677	S	S	*	*			trans	-133.8	147.3	172.4	-123.6	-177.9	-175.6	0	0	112.5
1972	N	26.7	Very low	30.3	Very low	97 Å²	97	116.5 Å²	116.5	52%	0.519	66%	0.664	S	S	.	*			trans	73.8	111.2	158.2	-59.5	-5.1	0	0	0	122	N56	N56-N1972 PolarHBondContact ND2-O 3.29Å; N56-N1972 VanDerWaalsContact OD1-CB 3.22Å; N56-N1972 WeakPolarHBondContact OD1-CB 3.24Å; N56-N1972 PolarHBondContact OD1-O 2.76Å
1973	I	28.5	Very low	30.1	Very low	105 Å²	105	122 Å²	122	54%	0.538	67%	0.669	S	S	.	*			trans	58	169	153.3	-4.2	-176.1	0	0	0	118.6	I55	I55-I1973 PolarHBondContact N-O 2.83Å
1974	L	27	Very low	29.8	Very low	85 Å²	85	128.1 Å²	128.1	45%	0.445	68%	0.677	S	S	.	*				-150.2	170.8	68.1	77	166.5	0	0	0	117.4	I55 P1976	I55-L1974 WeakPolarHBondContact O-CB 3.46Å; I55-L1974 WeakPolarHBondContact O-CD1 3.49Å; L1974-P1976 HydrophobicContact CD1-CB 3.98Å
1975	L	34.3	Very low	30	Very low	108 Å²	108	124.6 Å²	124.6	57%	0.565	68%	0.676	S	S	*	*			trans	-88.1	127.7	140.1	-82.7	67.7	0	0	0	109.6	G57 P58	G57-L1975 PolarHBondContact O-N 3.15Å; P58-L1975 HydrophobicContact CB-CD1 4.46Å
1976	P	35	Very low	29.8	Very low	100 Å²	100	122.9 Å²	122.9	65%	0.649	68%	0.681	S	S	*	*			trans	-85.5	166.2	164.3	35.2	-32.5	0	0	0	111.3	L1974	L1974-P1976 HydrophobicContact CD1-CB 3.98Å
1977	P	31.2	Very low	29.7	Very low	112 Å²	112	124 Å²	124	73%	0.727	69%	0.693	S	S	*	*			cis	-133.5	175.9	12.7	40.9	-23.7	0	0	0	117.1
1978	S	26.4	Very low	29.9	Very low	92 Å²	92	122 Å²	122	64%	0.643	71%	0.705	S	S	*	*			trans	54.9	103.2	147.7	60.9	0	0	0	0	122.6
1979	E	25.8	Very low	29.9	Very low	191 Å²	191	123 Å²	123	89%	0.893	72%	0.72	S	S	*	*				80.6	145.8	122.8	-66.1	179.2	132.4	0	0	123.9
1980	E	26.8	Very low	30	Very low	175 Å²	175	124.9 Å²	124.9	82%	0.818	72%	0.724	S	S	*	*			trans	76.5	86.1	162.4	-58.6	-153.6	147.8	0	0	124.6
1981	T	29.9	Very low	30.2	Very low	132 Å²	132	124.5 Å²	124.5	81%	0.81	73%	0.733	S	S	*	*				94.6	117.6	127.4	70.3	0	0	0	0	125.3
1982	S	30.1	Very low	30.6	Very low	88 Å²	88	125.9 Å²	125.9	62%	0.615	74%	0.743	S	S	*	*				87.3	95.6	124.9	-174.6	0	0	0	0	125.3
1983	K	30.2	Very low	30.9	Very low	183 Å²	183	124.2 Å²	124.2	80%	0.796	75%	0.749	S	S	*	*			trans	86.2	118.8	130.9	-64.1	170.2	-167	159.1	0	124.9
1984	R	28.3	Very low	31.1	Very low	248 Å²	248	126 Å²	126	94%	0.936	76%	0.76	S	S	*	*			trans	68.3	130	132.6	-68.5	-178.4	169.9	-177.3	-3.6	123.7
1985	G	33.2	Very low	31.4	Very low	75 Å²	75	127.3 Å²	127.3	77%	0.773	77%	0.771	S	S	*	*				149.3	94.1	127.6	0	0	0	0	0	123.8
1986	S	31.4	Very low	31.2	Very low	118 Å²	118	129.2 Å²	129.2	83%	0.825	78%	0.776	S	S	*	*			trans	56.8	111.5	137.3	-74.4	0	0	0	0	127.7
1987	S	30.2	Very low	31.1	Very low	117 Å²	117	132.2 Å²	132.2	82%	0.818	78%	0.781	S	S	*	*				50.3	142.1	122.3	67.2	0	0	0	0	126.9
1988	G	35	Very low	31.1	Very low	79 Å²	79	131.2 Å²	131.2	81%	0.814	78%	0.777	S	S	*	*			trans	163.8	74.6	149.4	0	0	0	0	0	124.7
1989	S	31.6	Very low	31.2	Very low	120 Å²	120	134.8 Å²	134.8	84%	0.839	79%	0.788	S	S	*	*			trans	35.7	132	139	-96.2	0	0	0	0	128.7
1990	L	32.7	Very low	31.4	Very low	171 Å²	171	133.1 Å²	133.1	90%	0.895	79%	0.785	S	S	*	*				92.7	120.8	116.2	-157.1	74.4	0	0	0	125.9
1991	G	33.2	Very low	31.5	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	78%	0.781	S	S	*	*			trans	75.3	168.7	137.4	0	0	0	0	0	122.3
1992	D	34.1	Very low	31.5	Very low	175 Å²	175	130 Å²	130	94%	0.936	78%	0.776	S	S	*	*			cis	-168.9	168	-36.5	-156.2	-7.2	0	0	0	110.2
1993	G	34.3	Very low	31.6	Very low	62 Å²	62	131.7 Å²	131.7	64%	0.639	78%	0.783	S	S	*	*			trans	131.4	97.7	158.2	0	0	0	0	0	123.1
1994	D	33	Very low	31.7	Very low	144 Å²	144	131.6 Å²	131.6	77%	0.77	78%	0.783	S	S	*	*				70.5	104.5	119.9	-64.4	-16.7	0	0	0	129.7
1995	T	32.2	Very low	31.9	Very low	111 Å²	111	125 Å²	125	68%	0.681	77%	0.766	S	S	*	*				96.4	148.3	112.4	66.9	0	0	0	0	128.3
1996	H	31	Very low	31.9	Very low	148 Å²	148	123.2 Å²	123.2	69%	0.685	74%	0.74	S	S	*	*			trans	86.4	109.1	145.5	-74.2	-61.9	0	0	0	126.3
1997	H	31.5	Very low	32	Very low	163 Å²	163	119.9 Å²	119.9	76%	0.755	71%	0.712	S	S	*	*				67.2	161.4	129.9	-77.6	-141.4	0	0	0	122.5
1998	S	31.3	Very low	32.1	Very low	92 Å²	92	119 Å²	119	64%	0.643	70%	0.695	S	S	*	*			cis	-169.1	152.5	-29.1	55.9	0	0	0	0	112.7
1999	L	30.1	Very low	31.8	Very low	166 Å²	166	123.6 Å²	123.6	87%	0.869	69%	0.688	S	S	*	*			trans	22.3	119.1	152.5	-74	160.6	0	0	0	121.3
2000	L	28.4	Very low	32	Very low	157 Å²	157	123.9 Å²	123.9	82%	0.822	68%	0.684	S	S	*	*				-170.5	171.1	127.3	-106.1	166.5	0	0	0	112.3
2001	D	29.4	Very low	32	Very low	139 Å²	139	117.9 Å²	117.9	74%	0.743	66%	0.664	S	S	*	*			trans	-38.2	139.4	-169.9	-59.9	-41.9	0	0	0	117.8
2002	S	30.8	Very low	32.4	Very low	101 Å²	101	118.9 Å²	118.9	71%	0.706	66%	0.66	S	S	*	*			cis	81.7	114.9	44.7	-162.1	0	0	0	0	114.8
2003	V	32.6	Very low	32.6	Very low	125 Å²	125	114 Å²	114	76%	0.758	64%	0.64	S	S	*	*			trans	55.1	94.9	156.3	-178.3	0	0	0	0	118.6
2004	K	32.4	Very low	33.3	Very low	181 Å²	181	120.4 Å²	120.4	79%	0.787	64%	0.644	S	S	*	*				-176.8	137.2	121.7	-99.9	157.7	-175.8	177.4	0	115.5
2005	N	31.5	Very low	33.6	Very low	110 Å²	110	118.1 Å²	118.1	59%	0.588	63%	0.625	S	S	*	*			trans	61.4	96.7	139.3	-58.7	0.6	0	0	0	123.4	R2076	N2005-R2076 PolarHBondContact O-NH1 2.9Å
2006	V	33.2	Very low	33.5	Very low	37 Å²	37	115.8 Å²	115.8	22%	0.224	61%	0.606	C	S	.	*				75.5	134.5	105.3	165.1	0	0	0	0	122.7	P2072 T2073 Q2075 R2076	V2006-P2072 HydrophobicContact CG1-CB 4.12Å; V2006-T2073 HydrophobicContact CB-CG2 4.45Å; V2006-T2073 HydrophobicContact CG1-CG2 4.02Å; V2006-T2073 HydrophobicContact CG2-CG2 3.51Å; V2006-Q2075 VanDerWaalsContact N-NE2 3.12Å; V2006-R2076 PolarHBondContact O-NE 2.77Å; V2006-R2076 PolarHBondContact O-NH2 2.68Å
2007	I	33.5	Very low	33.5	Very low	47 Å²	47	111.1 Å²	111.1	24%	0.241	59%	0.59	C	S	.	*			trans	66.6	126.5	166.2	-79	165.8	0	0	0	116.4	N2071 P2072 A2074 R2076	I2007-N2071 WeakPolarHBondContact CD1-OD1 3.13Å; I2007-P2072 HydrophobicContact CD1-CB 3.62Å; I2007-A2074 VanDerWaalsContact N-CA 3.29Å; I2007-A2074 VanDerWaalsContact N-N 3.18Å; I2007-R2076 VanDerWaalsContact O-CB 3.24Å; I2007-R2076 WeakPolarHBondContact O-CB 3.46Å; I2007-R2076 WeakPolarHBondContact O-CD 3.49Å; I2007-R2076 WeakPolarHBondContact O-CG 3.12Å; I2007-R2076 PolarHBondContact O-NE 3.5Å
2008	H	31.8	Very low	33.7	Very low	99 Å²	99	110.2 Å²	110.2	46%	0.458	59%	0.586	S	S	.	*			cis	-155.1	151.2	15.3	-149	-152.4	0	0	0	115	R2076	H2008-R2076 WeakPolarHBondContact O-CA 3.49Å; H2008-R2076 PolarHBondContact O-N 3.15Å
2009	R	30.1	Very low	33.8	Very low	175 Å²	175	109.4 Å²	109.4	66%	0.66	58%	0.577	S	S	*	*			trans	38.3	122.5	154.7	-69.8	-178.3	-166.3	172.2	7.3	124.4
2010	V	34.3	Very low	34	Very low	126 Å²	126	106.5 Å²	106.5	76%	0.764	57%	0.571	S	S	*	*			trans	44.2	144.1	133.8	87.3	0	0	0	0	124.2
2011	G	33.8	Very low	33.9	Very low	46 Å²	46	107 Å²	107	47%	0.474	57%	0.569	S	S	.	*			trans	142.5	110.7	168.6	0	0	0	0	0	112.8
2012	S	42.1	Very low	33.9	Very low	93 Å²	93	104.6 Å²	104.6	65%	0.65	56%	0.562	S	S	*	*			trans	-161.4	126.3	-166.7	177.2	0	0	0	0	118.2
2013	S	36.6	Very low	33.9	Very low	73 Å²	73	106 Å²	106	51%	0.51	56%	0.562	S	S	.	*			trans	71.6	150.1	154	-84.6	0	0	0	0	118
2014	R	49.1	Very low	33.9	Very low	196 Å²	196	106.8 Å²	106.8	74%	0.74	56%	0.557	S	S	*	*			cis	-141.2	-150.2	8.2	-68	-162.5	171.4	165.1	-3.1	112.9	K2289	R2014-K2289 PolarHBondContact O-N 3.25Å
2015	R	39.5	Very low	34.1	Very low	95 Å²	95	106.3 Å²	106.3	36%	0.358	55%	0.55	S	S	.	*				179.9	122	-93.8	-177.6	-162.6	-75.2	-148.1	-0.9	110.5	N2236 E2287 N2288	R2015-N2236 PolarHBondContact NH1-OD1 3.28Å; R2015-E2287 WeakPolarHBondContact CA-OE1 3.34Å; R2015-E2287 PolarHBondContact N-OE1 3.44Å; R2015-N2288 WeakPolarHBondContact CA-OD1 3.07Å
2016	H	30.5	Very low	34.3	Very low	62 Å²	62	106.4 Å²	106.4	29%	0.287	55%	0.547	S	S	.	.			trans	-48	142.6	179.1	-80.4	-35	0	0	0	113.2	D2239 E2287 N2288	H2016-D2239 WeakPolarHBondContact CB-OD1 3.22Å; H2016-E2287 WeakPolarHBondContact CA-OE2 3.49Å; H2016-E2287 HydrophobicContact CB-CG 4.07Å; H2016-E2287 WeakPolarHBondContact CE1-CB 3.41Å; H2016-E2287 IonicContact CE1-OE2 3.41Å; H2016-E2287 IonicContact CG-OE2 3.48Å; H2016-E2287 PolarHBondContact N-OE1 3.17Å; H2016-E2287 VanDerWaalsContact N-OE1 3.12Å; H2016-E2287 PolarHBondContact N-OE2 2.8Å; H2016-E2287 WeakPolarHBondContact ND1-CB 3.17Å; H2016-E2287 VanDerWaalsContact ND1-CD 3.33Å; H2016-E2287 WeakPolarHBondContact ND1-CG 3.46Å; H2016-E2287 IonicContact ND1-OE2 2.87Å; H2016-E2287 PolarHBondContact ND1-OE2 3.23Å; H2016-N2288 PolarHBondContact CD2-ND2 3.29Å; H2016-N2288 PolarHBondContact N-OD1 3.22Å; H2016-N2288 PolarHBondContact NE2-ND2 2.97Å
2017	S	31.7	Very low	34.5	Very low	50 Å²	50	112.6 Å²	112.6	35%	0.35	57%	0.571	S	S	.	*			trans	164.6	142	139.6	-84.1	0	0	0	0	114.1	E2237 R2238 D2239	S2017-E2237 VanDerWaalsContact OG-C 3.3Å; S2017-E2237 WeakPolarHBondContact OG-CA 3.3Å; S2017-R2238 CarbonylContact C-O 3.48Å; S2017-R2238 VanDerWaalsContact CA-O 3.27Å; S2017-R2238 WeakPolarHBondContact CA-O 3.5Å; S2017-R2238 WeakPolarHBondContact CB-O 3.2Å; S2017-R2238 VanDerWaalsContact OG-C 3.3Å; S2017-R2238 WeakPolarHBondContact OG-CA 3.46Å; S2017-R2238 PolarHBondContact OG-N 2.89Å; S2017-R2238 PolarHBondContact OG-O 2.84Å; S2017-D2239 VanDerWaalsContact CA-OD1 3.29Å; S2017-D2239 WeakPolarHBondContact CA-OD1 3.48Å; S2017-D2239 PolarHBondContact OG-OD1 2.96Å
2018	E	35.4	Very low	34.8	Very low	144 Å²	144	116.7 Å²	116.7	67%	0.673	59%	0.592	S	S	*	*			trans	-156.3	146.5	143.9	-116.3	-68.1	43.9	0	0	108.5	R2238 D2239	E2018-R2238 CarbonylContact C-O 3.56Å; E2018-R2238 WeakPolarHBondContact CA-O 3.3Å; E2018-R2238 PolarHBondContact N-O 2.98Å; E2018-R2238 CarbonylContact O-C 3.25Å; E2018-D2239 CarbonylContact O-C 3.59Å; E2018-D2239 WeakPolarHBondContact O-CA 3.48Å; E2018-D2239 PolarHBondContact O-N 2.86Å
2019	V	32.2	Very low	35.2	Very low	76 Å²	76	117 Å²	117	46%	0.461	60%	0.597	S	S	.	*			trans	-153.9	125.8	-168	55.1	0	0	0	0	118	R2238	V2019-R2238 HydrophobicContact CB-CB 4.15Å; V2019-R2238 WeakPolarHBondContact CB-O 3.26Å; V2019-R2238 HydrophobicContact CG1-CB 3.96Å; V2019-R2238 WeakPolarHBondContact CG1-O 3.25Å; V2019-R2238 HydrophobicContact CG2-CB 4.28Å
2020	S	34.6	Very low	35.4	Very low	105 Å²	105	112.5 Å²	112.5	73%	0.734	58%	0.583	S	S	*	*			trans	-152.6	101	133.7	-179.6	0	0	0	0	108	C2022	S2020-C2022 PolarHBondContact OG-N 3.1Å
2021	Q	27.4	Very low	35.4	Very low	166 Å²	166	109.9 Å²	109.9	78%	0.776	57%	0.571	S	S	*	*	S	Bend		-68.4	142.2	100.8	-167.3	-174.5	-14.4	0	0	112.8	N2023	Q2021-N2023 PolarHBondContact O-N 2.97Å
2022	C	28.9	Very low	35.3	Very low	90 Å²	90	113.7 Å²	113.7	61%	0.608	57%	0.571	S	S	*	*	S	Bend	trans	-56.2	122.7	163.8	-55.8	0	0	0	0	110.9	S2020	S2020-C2022 PolarHBondContact OG-N 3.1Å
2023	N	30	Very low	34.9	Very low	131 Å²	131	114.1 Å²	114.1	70%	0.701	56%	0.561	S	S	*	*	S	Bend	trans	69.4	128.9	162.3	-45.9	-29.9	0	0	0	117	Q2021	Q2021-N2023 PolarHBondContact O-N 2.97Å
2024	E	34	Very low	34.8	Very low	141 Å²	141	112.2 Å²	112.2	66%	0.659	55%	0.547	S	S	*	.			trans	54.3	116	140.6	-68.7	-167.4	85.8	0	0	121.5
2025	R	35.6	Very low	33.8	Very low	170 Å²	170	104.7 Å²	104.7	64%	0.642	53%	0.525	S	S	*	.			trans	83.6	138.6	139	-61.7	164.8	-167.7	-123.5	4.3	121.4
2026	E	35.1	Very low	33.2	Very low	112 Å²	112	104.9 Å²	104.9	52%	0.523	53%	0.533	S	S	.	.			trans	77.8	135.5	134.8	-79.6	170.4	-121.5	0	0	123.1
2027	K	38	Very low	32.9	Very low	168 Å²	168	108.7 Å²	108.7	73%	0.73	55%	0.55	S	S	*	*			trans	74.1	144.3	141.6	-73.5	167.7	-180	153	0	118.7
2028	I	40.1	Very low	32.6	Very low	133 Å²	133	112.1 Å²	112.1	68%	0.682	57%	0.574	S	S	*	*			cis	-164.8	152.8	-20.9	-132.9	-178.7	0	0	0	110.6
2029	L	40.1	Very low	32.3	Very low	104 Å²	104	107.4 Å²	107.4	55%	0.545	56%	0.56	S	S	.	*			trans	64	147	157.2	-94.2	54.6	0	0	0	123.6	A114	A114-L2029 HydrophobicContact CB-CD2 4.14Å
2030	H	34.8	Very low	32	Very low	81 Å²	81	110.2 Å²	110.2	38%	0.375	57%	0.573	S	S	.	*			trans	56.4	146.1	157.2	-61.3	-50.1	0	0	0	122.5	N115	N115-H2030 VanDerWaalsContact CA-CE1 3.47Å; N115-H2030 WeakPolarHBondContact CA-CE1 3.2Å; N115-H2030 WeakPolarHBondContact CA-NE2 3.36Å; N115-H2030 PolarHBondContact N-CE1 3.14Å; N115-H2030 VanDerWaalsContact N-CE1 3.35Å; N115-H2030 PolarHBondContact N-NE2 3.29Å
2031	S	35.1	Very low	31.5	Very low	72 Å²	72	115.6 Å²	115.6	50%	0.503	58%	0.583	S	S	.	*			cis	-148.3	152.1	-22.6	-111.4	0	0	0	0	109.3	Q116	Q116-S2031 PolarHBondContact O-OG 2.73Å
2032	Y	30.7	Very low	31.4	Very low	125 Å²	125	115.3 Å²	115.3	49%	0.49	58%	0.579	S	S	.	*			cis	98.2	77	7.3	-138.4	-134.4	0	0	0	116	Q117 G118 K119	Q117-Y2032 VanDerWaalsContact C-CD1 3.42Å; Q117-Y2032 CarbonylContact C-O 3.6Å; Q117-Y2032 WeakPolarHBondContact CA-O 3.03Å; Q117-Y2032 HydrophobicContact CB-CD1 4.05Å; Q117-Y2032 HydrophobicContact CB-CE1 4.45Å; Q117-Y2032 HydrophobicContact CG-CD1 4.41Å; Q117-Y2032 PolarHBondContact N-O 3.12Å; G118-Y2032 PolarHBondContact N-O 2.98Å; G118-Y2032 WeakPolarHBondContact O-CD2 3.47Å; G118-Y2032 WeakPolarHBondContact O-CE2 3.22Å; G118-Y2032 PolarHBondContact O-OH 3.48Å; K119-Y2032 VanDerWaalsContact N-CD2 3.26Å; K119-Y2032 CarbonylContact O-C 2.89Å; K119-Y2032 WeakPolarHBondContact O-CA 3.35Å; K119-Y2032 PolarHBondContact O-N 3.47Å
2033	K	33.4	Very low	31.4	Very low	102 Å²	102	118 Å²	118	44%	0.443	59%	0.587	S	S	.	*			trans	-167.1	-165.1	143	-143	105.6	-151.7	-178.5	0	112.3	Q117 K119 L923	Q117-K2033 VanDerWaalsContact C-CD 3.5Å; Q117-K2033 WeakPolarHBondContact O-CD 3.42Å; Q117-K2033 WeakPolarHBondContact O-CE 3.49Å; Q117-K2033 PolarHBondContact O-NZ 2.59Å; K119-K2033 CarbonylContact C-O 3.18Å; K119-K2033 WeakPolarHBondContact CA-O 3.21Å; K119-K2033 WeakPolarHBondContact CB-O 3.28Å; K119-K2033 PolarHBondContact N-O 3.34Å; K119-K2033 PolarHBondContact O-N 3.36Å; K119-K2033 VanDerWaalsContact O-N 3.13Å; K119-K2033 VanDerWaalsContact O-O 3.07Å; L923-K2033 HydrophobicContact CD1-CB 3.67Å; L923-K2033 HydrophobicContact CD2-CB 4.17Å; L923-K2033 HydrophobicContact CG-CB 4.38Å; L923-K2033 CarbonylContact O-C 3.48Å; L923-K2033 VanDerWaalsContact O-C 3.22Å
2034	P	34.9	Very low	31.5	Very low	33 Å²	33	115.7 Å²	115.7	21%	0.214	58%	0.58	C	S	.	*			trans	-135.6	-177.9	-139.6	44.3	-20.4	0	0	0	119.1	K119 L923 N924	K119-P2034 HydrophobicContact CD-CB 3.87Å; K119-P2034 HydrophobicContact CG-CB 3.97Å; L923-P2034 VanDerWaalsContact C-C 3.48Å; L923-P2034 CarbonylContact C-O 3.22Å; L923-P2034 WeakPolarHBondContact CB-O 3.44Å; L923-P2034 CarbonylContact O-C 3.54Å; L923-P2034 WeakPolarHBondContact O-CA 3.4Å; L923-P2034 VanDerWaalsContact O-N 3.12Å; N924-P2034 CarbonylContact O-C 3.07Å; N924-P2034 VanDerWaalsContact O-C 3.24Å; N924-P2034 WeakPolarHBondContact O-CA 3.1Å
2035	S	28.6	Very low	31.4	Very low	38 Å²	38	116.8 Å²	116.8	27%	0.266	59%	0.588	S	S	.	*			trans	176.6	92.9	137.3	59.2	0	0	0	0	113	N924 L925 D926	N924-S2035 PolarHBondContact O-N 3.27Å; N924-S2035 VanDerWaalsContact O-N 3.07Å; L925-S2035 VanDerWaalsContact C-C 3.48Å; L925-S2035 CarbonylContact C-O 3.55Å; L925-S2035 CarbonylContact O-C 3.01Å; L925-S2035 PolarHBondContact O-N 3.18Å; L925-S2035 VanDerWaalsContact O-N 3.12Å; D926-S2035 PolarHBondContact N-O 2.68Å
2036	L	25.7	Very low	31.3	Very low	100 Å²	100	115.9 Å²	115.9	52%	0.524	59%	0.594	S	S	.	*				55.9	125.2	96.7	-92	56.3	0	0	0	116.8	L925	L925-L2036 PolarHBondContact O-N 2.96Å
2037	E	24.3	Very low	31.4	Very low	141 Å²	141	114.8 Å²	114.8	66%	0.659	60%	0.599	S	S	*	*			trans	71.3	161.1	134.2	-67.9	171.9	143.5	0	0	119.2
2038	S	26.1	Very low	31.2	Very low	122 Å²	122	113 Å²	113	85%	0.853	60%	0.597	S	S	*	*	S	Bend	cis	-20.5	123.5	8.7	-169.8	0	0	0	0	117.5
2039	A	28.4	Very low	30.8	Very low	45 Å²	45	112.7 Å²	112.7	37%	0.372	60%	0.597	S	S	.	*	S	Bend	cis	-84.8	172.6	31.8	0	0	0	0	0	118.5
2040	D	26.6	Very low	30.5	Very low	136 Å²	136	115.2 Å²	115.2	73%	0.727	61%	0.606	S	S	*	*			trans	70.2	74.5	148.4	-54.8	-22.4	0	0	0	121
2041	K	23.7	Very low	30.5	Very low	217 Å²	217	117.2 Å²	117.2	94%	0.943	62%	0.618	S	S	*	*	S	Bend		-100.3	60.7	120.8	-137.8	178.2	-167.3	178.1	0	113.2
2042	K	24.9	Very low	30.5	Very low	160 Å²	160	121.6 Å²	121.6	70%	0.696	63%	0.631	S	S	*	*	S	Bend	trans	-156	133.4	140.7	-121.7	-179	-177.5	-171.3	0	114.4
2043	L	29.3	Very low	30.4	Very low	147 Å²	147	119.2 Å²	119.2	77%	0.77	63%	0.633	S	S	*	*			trans	21.5	128.3	146.5	-87	56.5	0	0	0	117.9
2044	S	31.3	Very low	30.4	Very low	82 Å²	82	119.9 Å²	119.9	57%	0.573	64%	0.641	S	S	*	*			cis	145.5	139.2	2.8	44.1	0	0	0	0	105.7
2045	M	33.7	Very low	30.2	Very low	164 Å²	164	125 Å²	125	81%	0.808	66%	0.662	S	S	*	*			trans	63.3	147.7	145.1	-63.6	169.2	71.8	0	0	119.5
2046	I	33.7	Very low	30.3	Very low	151 Å²	151	128.4 Å²	128.4	77%	0.774	68%	0.682	S	S	*	*			trans	66.7	82.9	169.2	-54.4	146.7	0	0	0	111.3
2047	S	35.2	Very low	30.5	Very low	89 Å²	89	129 Å²	129	62%	0.622	69%	0.689	S	S	*	*				61.5	125.4	67.8	-158.6	0	0	0	0	112
2048	N	34.4	Very low	31	Very low	132 Å²	132	130.8 Å²	130.8	71%	0.706	70%	0.695	S	S	*	*			trans	63.8	117	170.3	-51.4	13.9	0	0	0	111.6
2049	D	31.7	Very low	31.2	Very low	126 Å²	126	130.7 Å²	130.7	67%	0.674	68%	0.684	S	S	*	*			cis	-168.5	133.7	42.2	-104.6	-24	0	0	0	107.4
2050	H	34	Very low	31.3	Very low	156 Å²	156	134.1 Å²	134.1	72%	0.722	70%	0.696	S	S	*	*				71.3	151.3	106	-95.1	-50.7	0	0	0	116.5
2051	L	35.3	Very low	31.3	Very low	123 Å²	123	132.6 Å²	132.6	64%	0.644	69%	0.692	S	S	*	*			trans	73.1	123.9	149.1	-94.8	58.8	0	0	0	115.8
2052	Q	34	Very low	31.6	Very low	164 Å²	164	125.6 Å²	125.6	77%	0.766	67%	0.671	S	S	*	*				63.9	135.5	99.9	-74.3	179.1	-3	0	0	113.2
2053	S	30.4	Very low	31.6	Very low	76 Å²	76	124.8 Å²	124.8	53%	0.531	67%	0.667	S	S	.	*			cis	173.3	-178.9	6.3	46.2	0	0	0	0	106.5
2054	N	33	Very low	31.6	Very low	115 Å²	115	120.9 Å²	120.9	62%	0.615	65%	0.649	S	S	*	*			trans	66.5	156.3	153.7	-68.1	-47.1	0	0	0	115.5
2055	Q	29.5	Very low	31.4	Very low	140 Å²	140	120.6 Å²	120.6	65%	0.654	64%	0.641	S	S	*	*			cis	-139.8	124.3	-16	-112.3	143.8	19	0	0	104.9
2056	T	31	Very low	31.6	Very low	111 Å²	111	116.9 Å²	116.9	68%	0.681	62%	0.623	S	S	*	*				57.2	175.5	96.8	74.1	0	0	0	0	115.5
2057	T	30.4	Very low	31.4	Very low	111 Å²	111	112.1 Å²	112.1	68%	0.681	60%	0.602	S	S	*	*			trans	69.5	106	172.6	17.5	0	0	0	0	113.8
2058	K	35	Very low	31.2	Very low	179 Å²	179	112.8 Å²	112.8	78%	0.778	60%	0.599	S	S	*	*				70.1	142.1	54.3	-57.1	169.2	178.4	175	0	110.8
2059	L	29.8	Very low	31	Very low	121 Å²	121	114.7 Å²	114.7	63%	0.634	60%	0.603	S	S	*	*			cis	-166.3	161.6	13.1	-148.7	64	0	0	0	111.5
2060	N	30.5	Very low	30.9	Very low	116 Å²	116	115.2 Å²	115.2	62%	0.62	61%	0.605	S	S	*	*			trans	62.3	126	148.6	-74.6	-10.6	0	0	0	123
2061	T	27.5	Very low	31	Very low	105 Å²	105	113.5 Å²	113.5	64%	0.644	60%	0.601	S	S	*	*			trans	64.1	135.6	142.6	60.3	0	0	0	0	119.6
2062	S	28.5	Very low	30.9	Very low	70 Å²	70	111.7 Å²	111.7	49%	0.49	60%	0.597	S	S	.	*			cis	-179	127.2	-8.5	-94.2	0	0	0	0	108.6	D952	D952-S2062 VanDerWaalsContact OD2-CA 3.22Å; D952-S2062 WeakPolarHBondContact OD2-CA 3.24Å; D952-S2062 PolarHBondContact OD2-N 3.3Å
2063	K	26.5	Very low	30.7	Very low	143 Å²	143	108.3 Å²	108.3	62%	0.622	59%	0.587	S	S	*	*				-163.6	109	105.7	-95.5	-163.4	-175.8	166.7	0	113.2	D952 D953 G954	D952-K2063 PolarHBondContact OD2-N 2.96Å; D953-K2063 WeakPolarHBondContact CB-O 3.29Å; D953-K2063 WeakPolarHBondContact OD2-CA 3.17Å; D953-K2063 PolarHBondContact OD2-N 3.46Å; D953-K2063 VanDerWaalsContact OD2-O 3.11Å; G954-K2063 WeakPolarHBondContact CA-O 3.13Å
2064	V	29.2	Very low	30.7	Very low	65 Å²	65	107 Å²	107	39%	0.394	58%	0.581	S	S	.	*				66.5	114.9	78.1	165.6	0	0	0	0	111.2	D953 D955 S2209	D953-V2064 PolarHBondContact OD2-N 2.98Å; D955-V2064 WeakPolarHBondContact CB-O 3.42Å; V2064-S2209 CarbonylContact C-O 3.53Å; V2064-S2209 VanDerWaalsContact C-O 3.29Å; V2064-S2209 WeakPolarHBondContact CA-O 3.43Å; V2064-S2209 PolarHBondContact N-O 3.08Å
2065	L	27.2	Very low	30.3	Very low	76 Å²	76	105.4 Å²	105.4	40%	0.398	57%	0.57	S	S	.	*			cis	-160.9	-164.1	10.3	-125.7	-179.4	0	0	0	113.1	D955 S2209 K2210 S2211	D955-L2065 PolarHBondContact OD2-N 3.11Å; L2065-S2209 WeakPolarHBondContact CA-O 3.28Å; L2065-S2209 PolarHBondContact N-O 2.95Å; L2065-K2210 PolarHBondContact O-N 3.25Å; L2065-S2211 WeakPolarHBondContact CD2-O 3.27Å
2066	I	37.3	Very low	30	Very low	86 Å²	86	103.4 Å²	103.4	44%	0.441	56%	0.557	S	S	.	*			trans	78.5	132	164.6	-47	-164.1	0	0	0	112.8	G2099 K2210	I2066-G2099 VanDerWaalsContact CG2-CA 3.42Å; I2066-K2210 PolarHBondContact O-N 3.04Å
2067	P	29.4	Very low	29.9	Very low	51 Å²	51	102.1 Å²	102.1	33%	0.331	55%	0.545	S	S	.	.			trans	-121.3	-145.8	-136.4	40.5	-25.3	0	0	0	113.6
2068	D	31.6	Very low	29.9	Very low	103 Å²	103	103 Å²	103	55%	0.551	54%	0.543	S	S	*	.			trans	71.1	42.6	165.8	-56.3	-15.3	0	0	0	117.2	L2070 G2098	D2068-L2070 VanDerWaalsContact C-N 3.32Å; D2068-L2070 PolarHBondContact O-N 2.93Å; D2068-G2098 WeakPolarHBondContact OD2-CA 3.49Å; D2068-G2098 PolarHBondContact OD2-N 3.46Å
2069	H	28.8	Very low	30.1	Very low	172 Å²	172	102.3 Å²	102.3	80%	0.796	55%	0.547	S	S	*	.				-60.9	106.9	117.8	-116.4	-85	0	0	0	106.8
2070	L	29.6	Very low	30.2	Very low	137 Å²	137	101.7 Å²	101.7	72%	0.717	55%	0.55	S	S	*	.				-178.9	112.1	116.7	-114.5	99	0	0	0	112.3	D2068	D2068-L2070 VanDerWaalsContact C-N 3.32Å; D2068-L2070 PolarHBondContact O-N 2.93Å
2071	N	35.7	Very low	30.3	Very low	119 Å²	119	102.1 Å²	102.1	64%	0.636	56%	0.557	S	S	*	*				61.8	-166.3	129.5	-111.4	-7.6	0	0	0	115.7	I2007	I2007-N2071 WeakPolarHBondContact CD1-OD1 3.13Å
2072	P	34.5	Very low	30.4	Very low	85 Å²	85	104.6 Å²	104.6	55%	0.552	57%	0.565	S	S	*	*			cis	-98	-137.5	-28.5	9.6	14.4	0	0	0	108.3	V2006 I2007	V2006-P2072 HydrophobicContact CG1-CB 4.12Å; I2007-P2072 HydrophobicContact CD1-CB 3.62Å
2073	T	28.5	Very low	30.3	Very low	93 Å²	93	105.4 Å²	105.4	57%	0.571	57%	0.571	S	S	*	*			cis	-161.8	145.2	15.9	17.8	0	0	0	0	109.8	V2006	V2006-T2073 HydrophobicContact CB-CG2 4.45Å; V2006-T2073 HydrophobicContact CG1-CG2 4.02Å; V2006-T2073 HydrophobicContact CG2-CG2 3.51Å
2074	A	31.6	Very low	30.3	Very low	49 Å²	49	107.6 Å²	107.6	41%	0.405	58%	0.583	S	S	.	*			trans	60.7	143.7	158.8	0	0	0	0	0	119.7	I2007	I2007-A2074 VanDerWaalsContact N-CA 3.29Å; I2007-A2074 VanDerWaalsContact N-N 3.18Å
2075	Q	24.6	Very low	30.2	Very low	82 Å²	82	108.2 Å²	108.2	38%	0.383	60%	0.602	S	S	.	*			cis	-153.3	132	-23.9	-115.2	147.9	-27.2	0	0	104.8	V2006	V2006-Q2075 VanDerWaalsContact N-NE2 3.12Å
2076	R	22.7	Very low	30.2	Very low	97 Å²	97	109.6 Å²	109.6	37%	0.366	62%	0.618	S	S	.	*				66.8	127.8	67.6	-148.5	-170.1	-92.3	-157.7	-7.1	110.6	N2005 V2006 I2007 H2008 H2293	N2005-R2076 PolarHBondContact O-NH1 2.9Å; V2006-R2076 PolarHBondContact O-NE 2.77Å; V2006-R2076 PolarHBondContact O-NH2 2.68Å; I2007-R2076 VanDerWaalsContact O-CB 3.24Å; I2007-R2076 WeakPolarHBondContact O-CB 3.46Å; I2007-R2076 WeakPolarHBondContact O-CD 3.49Å; I2007-R2076 WeakPolarHBondContact O-CG 3.12Å; I2007-R2076 PolarHBondContact O-NE 3.5Å; H2008-R2076 WeakPolarHBondContact O-CA 3.49Å; H2008-R2076 PolarHBondContact O-N 3.15Å; R2076-H2293 CarbonylContact C-O 3.14Å
2077	I	30.1	Very low	29.7	Very low	85 Å²	85	113.1 Å²	113.1	44%	0.436	63%	0.632	S	S	.	*				-175.1	92.2	114.3	-90.8	152.6	0	0	0	110.6	H2293	I2077-H2293 HydrophobicContact CB-CB 4.44Å
2078	M	29.7	Very low	29.7	Very low	128 Å²	128	118.5 Å²	118.5	63%	0.631	65%	0.653	S	S	*	*				62.3	108.8	122.7	-74.5	155.5	155.6	0	0	119.3
2079	L	38.3	Very low	29.6	Very low	165 Å²	165	120.5 Å²	120.5	86%	0.864	66%	0.664	S	S	*	*				-26.9	136	119.5	-87.6	153.7	0	0	0	112.2
2080	P	33	Very low	29.6	Very low	108 Å²	108	120.8 Å²	120.8	70%	0.701	67%	0.666	S	S	*	*				-141	138.5	122.6	35.8	-24.3	0	0	0	114
2081	T	31.2	Very low	29.5	Very low	125 Å²	125	120.1 Å²	120.1	77%	0.767	66%	0.663	S	S	*	*			trans	-155.5	101.4	135	-3.2	0	0	0	0	111.5
2082	I	29.9	Very low	29.3	Very low	157 Å²	157	120.7 Å²	120.7	81%	0.805	67%	0.665	S	S	*	*				49.2	123.9	125.8	-64	172.2	0	0	0	119.4
2083	S	26.6	Very low	29	Very low	88 Å²	88	120.8 Å²	120.8	62%	0.615	66%	0.66	S	S	*	*			trans	108.4	99	144.8	-157.2	0	0	0	0	120.6
2084	Q	26.1	Very low	29.2	Very low	189 Å²	189	120.9 Å²	120.9	88%	0.883	66%	0.657	S	S	*	*			trans	67	107.6	131	-62.8	177.4	-11.1	0	0	121.7
2085	G	27.7	Very low	29.2	Very low	77 Å²	77	121.9 Å²	121.9	79%	0.794	67%	0.672	S	S	*	*			trans	98.6	146.8	142.3	0	0	0	0	0	117
2086	S	27.4	Very low	29.5	Very low	106 Å²	106	121 Å²	121	74%	0.741	69%	0.686	S	S	*	*			cis	-172	135.7	-11.5	49.8	0	0	0	0	111
2087	H	27.7	Very low	29.8	Very low	159 Å²	159	124.3 Å²	124.3	74%	0.736	71%	0.709	S	S	*	*			trans	65.9	140.5	178.3	-67.7	-125.8	0	0	0	114.4
2088	E	28.7	Very low	29.8	Very low	164 Å²	164	122.3 Å²	122.3	77%	0.766	71%	0.71	S	S	*	*			cis	-145.7	161.6	5	-133.5	151.7	-123	0	0	110.6
2089	D	29.1	Very low	29.9	Very low	145 Å²	145	119.3 Å²	119.3	78%	0.775	71%	0.711	S	S	*	*			trans	-130.3	-154.2	-152.8	-61.1	-100.9	0	0	0	113.8
2090	E	28.2	Very low	29.4	Very low	178 Å²	178	117.9 Å²	117.9	83%	0.832	70%	0.704	S	S	*	*			trans	73	135.5	173.4	-62.4	-176.6	179.8	0	0	117.1
2091	D	27.4	Very low	29	Very low	124 Å²	124	118.5 Å²	118.5	66%	0.663	70%	0.701	S	S	*	*			cis	-169.3	165.5	-6.4	-127	-10.4	0	0	0	115.2
2092	I	32.2	Very low	29	Very low	131 Å²	131	116.5 Å²	116.5	67%	0.672	68%	0.682	S	S	*	*			trans	70.3	127.6	139.4	-73.6	166	0	0	0	125.4
2093	D	29	Very low	28.9	Very low	86 Å²	86	110.2 Å²	110.2	46%	0.46	65%	0.65	S	S	.	*			trans	64.2	170.1	145.6	-77.5	32.6	0	0	0	126	L2214	D2093-L2214 HydrophobicContact CB-CD2 4.03Å
2094	N	31.9	Very low	29.2	Very low	95 Å²	95	108.7 Å²	108.7	51%	0.508	63%	0.634	S	S	.	*			cis	-172.5	91.9	-46.3	-97.9	-27	0	0	0	115	L2214 I2215	N2094-L2214 HydrophobicContact CB-CG 4.38Å; N2094-L2214 VanDerWaalsContact O-CD1 3.23Å; N2094-L2214 WeakPolarHBondContact O-CD1 3.36Å; N2094-L2214 VanDerWaalsContact O-CG 3.25Å; N2094-L2214 WeakPolarHBondContact O-CG 3.5Å; N2094-I2215 PolarHBondContact O-N 2.84Å
2095	G	32	Very low	29.5	Very low	70 Å²	70	103.4 Å²	103.4	72%	0.722	61%	0.612	S	S	*	*			trans	72.7	149.1	150.6	0	0	0	0	0	125.1
2096	G	30.3	Very low	29.9	Very low	65 Å²	65	102 Å²	102	67%	0.67	60%	0.597	S	S	*	*			trans	130	106.7	144.2	0	0	0	0	0	124.9
2097	I	29.1	Very low	30.3	Very low	165 Å²	165	104.8 Å²	104.8	85%	0.846	60%	0.604	S	S	*	*			trans	64.7	89	139.6	-36.1	177.4	0	0	0	124.3
2098	G	30.4	Very low	30.8	Very low	44 Å²	44	104.3 Å²	104.3	45%	0.454	61%	0.605	S	S	.	*				72.9	143.9	122.6	0	0	0	0	0	125.7	D2068	D2068-G2098 WeakPolarHBondContact OD2-CA 3.49Å; D2068-G2098 PolarHBondContact OD2-N 3.46Å
2099	G	31.2	Very low	30.8	Very low	64 Å²	64	104.1 Å²	104.1	66%	0.66	61%	0.606	S	S	*	*			trans	168.2	-160.5	165.2	0	0	0	0	0	120.8	I2066	I2066-G2099 VanDerWaalsContact CG2-CA 3.42Å
2100	L	27.6	Very low	30.7	Very low	136 Å²	136	103.5 Å²	103.5	71%	0.712	60%	0.603	S	S	*	*			trans	-158.2	135.7	-156.1	-162.1	93.3	0	0	0	116.6
2101	N	25.7	Very low	30.6	Very low	121 Å²	121	101.7 Å²	101.7	65%	0.647	60%	0.597	S	S	*	*			trans	67.4	121.1	155	-67.2	-20.1	0	0	0	127.1
2102	K	31.4	Very low	30.5	Very low	83 Å²	83	103 Å²	103	36%	0.361	60%	0.599	S	S	.	*				83	93.5	106.8	-176.1	-137.2	65.4	165.2	0	127.2	D956 L957 K958 E959	D956-K2102 VanDerWaalsContact CG-C 3.49Å; D956-K2102 WeakPolarHBondContact OD1-CA 3.44Å; D956-K2102 PolarHBondContact OD1-N 3.29Å; D956-K2102 PolarHBondContact OD2-N 3.09Å; L957-K2102 CarbonylContact C-O 3.11Å; L957-K2102 VanDerWaalsContact CA-O 3.31Å; L957-K2102 WeakPolarHBondContact CA-O 3.45Å; L957-K2102 PolarHBondContact N-O 3.43Å; L957-K2102 WeakPolarHBondContact O-CE 3.12Å; L957-K2102 PolarHBondContact O-NZ 3.16Å; L957-K2102 VanDerWaalsContact O-NZ 3.11Å; K958-K2102 HydrophobicContact CD-CD 3.73Å; K958-K2102 HydrophobicContact CD-CG 4.08Å; K958-K2102 HydrophobicContact CG-CD 4Å; K958-K2102 HydrophobicContact CG-CG 4.16Å; E959-K2102 IonicContact OE2-NZ 3.56Å; E959-K2102 PolarHBondContact OE2-NZ 3.35Å
2103	L	28	Very low	30.2	Very low	24 Å²	24	104.1 Å²	104.1	13%	0.126	60%	0.599	C	S	.	*			trans	154.7	-134.6	154	-175.7	-106.6	0	0	0	118.7	D956 L957 K958 N2204 K2205 Y2206 N2207	D956-L2103 VanDerWaalsContact C-C 3.44Å; D956-L2103 VanDerWaalsContact CG-N 3.31Å; D956-L2103 CarbonylContact O-C 3.48Å; D956-L2103 VanDerWaalsContact O-C 3.25Å; D956-L2103 WeakPolarHBondContact O-CA 3.42Å; D956-L2103 WeakPolarHBondContact O-CB 3.22Å; D956-L2103 WeakPolarHBondContact O-CD1 3.37Å; D956-L2103 PolarHBondContact OD1-N 3.32Å; L957-L2103 HydrophobicContact CB-CD1 4.26Å; K958-L2103 HydrophobicContact CB-CB 4.09Å; K958-L2103 HydrophobicContact CB-CG 4.13Å; K958-L2103 HydrophobicContact CG-CB 3.46Å; K958-L2103 VanDerWaalsContact CG-CB 3.46Å; K958-L2103 HydrophobicContact CG-CD2 4.25Å; K958-L2103 HydrophobicContact CG-CG 3.7Å; K958-L2103 VanDerWaalsContact N-CD1 3.27Å; L2103-N2204 VanDerWaalsContact CD2-C 3.45Å; L2103-N2204 HydrophobicContact CD2-CB 3.78Å; L2103-N2204 WeakPolarHBondContact CD2-O 3.42Å; L2103-K2205 HydrophobicContact CD2-CB 3.5Å; L2103-K2205 VanDerWaalsContact CD2-CB 3.5Å; L2103-K2205 CarbonylContact O-C 3.56Å; L2103-Y2206 VanDerWaalsContact C-N 3.34Å; L2103-Y2206 CarbonylContact O-C 3.53Å; L2103-Y2206 WeakPolarHBondContact O-CA 3.43Å; L2103-Y2206 PolarHBondContact O-N 3.23Å; L2103-N2207 PolarHBondContact O-N 3.22Å
2104	M	32.4	Very low	30	Very low	57 Å²	57	108.8 Å²	108.8	28%	0.281	62%	0.616	S	S	.	*			trans	-154.4	175.9	-158.5	-134.6	-154.2	164.2	0	0	114	D955 D956 K2205 Y2206 N2207	D955-M2104 CarbonylContact O-C 3.46Å; D955-M2104 VanDerWaalsContact O-C 3.32Å; D955-M2104 VanDerWaalsContact O-CA 3.24Å; D955-M2104 WeakPolarHBondContact O-CA 3.33Å; D955-M2104 PolarHBondContact O-N 3.28Å; D956-M2104 PolarHBondContact O-N 2.89Å; M2104-K2205 HydrophobicContact CB-CB 3.51Å; M2104-K2205 HydrophobicContact CB-CD 4.22Å; M2104-K2205 HydrophobicContact CG-CB 3.65Å; M2104-K2205 HydrophobicContact CG-CD 4.32Å; M2104-K2205 HydrophobicContact CG-CG 4.48Å; M2104-K2205 HydrophobicContact SD-CB 3.68Å; M2104-K2205 HydrophobicContact SD-CD 3.48Å; M2104-K2205 WeakPolarHBondContact SD-CD 3.48Å; M2104-K2205 HydrophobicContact SD-CG 3.86Å; M2104-Y2206 WeakPolarHBondContact CG-O 3.46Å; M2104-N2207 HydrophobicContact CG-CB 4.49Å
2105	D	32.5	Very low	29.8	Very low	78 Å²	78	109.6 Å²	109.6	42%	0.417	62%	0.62	S	S	.	*				-177.6	-168.7	60.2	-137.2	-49.8	0	0	0	111.7	K2205	D2105-K2205 IonicContact OD1-NZ 2.9Å; D2105-K2205 PolarHBondContact OD1-NZ 3.28Å; D2105-K2205 VanDerWaalsContact OD2-CD 3.29Å; D2105-K2205 WeakPolarHBondContact OD2-CD 3.35Å; D2105-K2205 IonicContact OD2-NZ 3.42Å; D2105-K2205 PolarHBondContact OD2-NZ 3.15Å
2106	G	36.6	Very low	29.6	Very low	48 Å²	48	112.2 Å²	112.2	50%	0.495	62%	0.623	S	S	.	*			trans	-110.5	-174.1	171.4	0	0	0	0	0	114.1
2107	N	35.8	Very low	29.5	Very low	163 Å²	163	113.3 Å²	113.3	87%	0.872	62%	0.62	S	S	*	*			cis	-155.5	177.6	5.3	-49.1	-92	0	0	0	109.6
2108	I	38	Very low	29.5	Very low	149 Å²	149	113 Å²	113	76%	0.764	62%	0.62	S	S	*	*			trans	-109.6	128.1	176.4	-77.8	-178.7	0	0	0	114
2109	M	28.2	Very low	29.4	Very low	161 Å²	161	114.4 Å²	114.4	79%	0.793	64%	0.635	S	S	*	*			trans	58.8	150.3	162.6	-76.6	-170.9	-72.4	0	0	119.3
2110	N	27.6	Very low	29.2	Very low	132 Å²	132	120.1 Å²	120.1	71%	0.706	64%	0.641	S	S	*	*			cis	-144.6	163.7	18.5	-142.8	-23.1	0	0	0	114.7
2111	I	25.9	Very low	29.1	Very low	140 Å²	140	122.3 Å²	122.3	72%	0.718	64%	0.642	S	S	*	*			trans	73	116.1	167.8	-58.1	173.8	0	0	0	117.9
2112	E	25.4	Very low	29.2	Very low	150 Å²	150	124.5 Å²	124.5	70%	0.701	65%	0.648	S	S	*	*			trans	53	141.6	158.2	-66.7	-170.4	178.1	0	0	120.2
2113	K	24.6	Very low	28.9	Very low	155 Å²	155	125.1 Å²	125.1	67%	0.674	66%	0.662	S	S	*	*			cis	-153.6	141.3	13.1	-130.7	155.7	-173.8	141.1	0	110.3
2114	F	24.9	Very low	28.8	Very low	184 Å²	184	130.8 Å²	130.8	81%	0.807	69%	0.691	S	S	*	*			trans	35.5	146.9	142	-79.7	-114	0	0	0	122.1
2115	N	27.6	Very low	28.9	Very low	112 Å²	112	135.5 Å²	135.5	60%	0.599	72%	0.717	S	S	*	*			cis	179.4	152.2	-22.1	-146.1	-28	0	0	0	107.6
2116	T	29.1	Very low	28.7	Very low	126 Å²	126	137.3 Å²	137.3	77%	0.773	73%	0.734	S	S	*	*			trans	59.5	168	163.4	68.3	0	0	0	0	117.8
2117	S	26.9	Very low	28.2	Very low	88 Å²	88	140.5 Å²	140.5	62%	0.615	75%	0.748	S	S	*	*			cis	-165.1	170.2	-37.4	59.8	0	0	0	0	110.9
2118	N	28.7	Very low	27.6	Very low	157 Å²	157	141.6 Å²	141.6	84%	0.84	75%	0.745	S	S	*	*			trans	62.8	106.1	148.4	-66.8	-43	0	0	0	121.5
2119	G	29.3	Very low	27	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	75%	0.747	S	S	*	*			trans	118.9	153.2	141	0	0	0	0	0	117.2
2120	K	26.1	Very low	26.9	Very low	183 Å²	183	142.8 Å²	142.8	80%	0.796	74%	0.739	S	S	*	*			cis	-157.8	139.6	-9.5	-98.9	-162.2	179.6	176.5	0	110.9
2121	Y	25.7	Very low	26.7	Very low	183 Å²	183	142.9 Å²	142.9	72%	0.718	74%	0.735	S	S	*	*			trans	61.1	137.4	138.3	-73.8	-128.2	0	0	0	120.6
2122	H	28	Very low	26.7	Very low	167 Å²	167	142.4 Å²	142.4	77%	0.773	73%	0.734	S	S	*	*			trans	34.2	143.2	141.5	-55.3	-41	0	0	0	121
2123	S	25.6	Very low	26.7	Very low	95 Å²	95	138 Å²	138	66%	0.664	73%	0.729	S	S	*	*			cis	-161.3	141.1	25.5	75.9	0	0	0	0	114.6
2124	I	26.2	Very low	26.7	Very low	143 Å²	143	137.1 Å²	137.1	73%	0.733	73%	0.725	S	S	*	*				59.5	115.5	121.7	-62.4	172.1	0	0	0	119.7
2125	N	33.4	Very low	26.7	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	71%	0.711	S	S	*	*			trans	-35.9	141.8	151.4	-84.1	-42.5	0	0	0	112.9
2126	P	29.4	Very low	26.6	Very low	117 Å²	117	131.2 Å²	131.2	76%	0.76	71%	0.708	S	S	*	*				-155.5	166.3	101.5	38.2	-20.9	0	0	0	117.8
2127	S	26.5	Very low	26.5	Very low	114 Å²	114	129.6 Å²	129.6	80%	0.797	70%	0.695	S	S	*	*			trans	-54.9	126.9	158.2	-49.9	0	0	0	0	114
2128	K	23.6	Very low	26.6	Very low	187 Å²	187	129.3 Å²	129.3	81%	0.813	71%	0.705	S	S	*	*			trans	-161.4	130.9	143.3	-103.3	152.9	-174.7	178.8	0	106.3
2129	R	24.3	Very low	26.5	Very low	213 Å²	213	128.2 Å²	128.2	80%	0.804	70%	0.699	S	S	*	*			cis	66.3	134.8	46.1	-162.7	-160.1	-164.8	-146.5	8.3	110.2
2130	I	25	Very low	26.5	Very low	121 Å²	121	129.5 Å²	129.5	62%	0.621	69%	0.694	S	S	*	*			trans	70.8	132.1	175.1	-73.3	157	0	0	0	111.5
2131	E	24.1	Very low	26.3	Very low	135 Å²	135	127.5 Å²	127.5	63%	0.631	69%	0.687	S	S	*	*			cis	-161.1	-171.8	-3.6	-124.3	167.7	-138	0	0	110.8
2132	N	26	Very low	26.4	Very low	129 Å²	129	129.1 Å²	129.1	69%	0.69	70%	0.698	S	S	*	*			trans	21.1	105.1	147.9	-42.7	-30.1	0	0	0	115.8
2133	G	26.3	Very low	26.3	Very low	57 Å²	57	127.3 Å²	127.3	59%	0.588	69%	0.69	S	S	*	*			cis	80.4	166.1	40.8	0	0	0	0	0	110.9
2134	F	24.2	Very low	26.8	Very low	138 Å²	138	132.8 Å²	132.8	61%	0.605	70%	0.697	S	S	*	*			trans	69	127.2	-179.2	-72.6	-101.8	0	0	0	111.7	T2324 S2325	F2134-T2324 VanDerWaalsContact CA-OG1 3.26Å; F2134-T2324 WeakPolarHBondContact CA-OG1 3.41Å; F2134-T2324 HydrophobicContact CB-CG2 4.17Å; F2134-T2324 HydrophobicContact CD1-CG2 4.18Å; F2134-T2324 HydrophobicContact CD2-CG2 3.42Å; F2134-T2324 VanDerWaalsContact CD2-CG2 3.42Å; F2134-T2324 HydrophobicContact CE1-CG2 4.43Å; F2134-T2324 HydrophobicContact CE2-CG2 3.68Å; F2134-T2324 HydrophobicContact CG-CG2 3.64Å; F2134-T2324 HydrophobicContact CZ-CG2 4.18Å; F2134-T2324 PolarHBondContact N-OG1 3.09Å; F2134-T2324 VanDerWaalsContact N-OG1 3.15Å; F2134-S2325 WeakPolarHBondContact CD1-OG 3.43Å; F2134-S2325 WeakPolarHBondContact CE1-OG 3.49Å
2135	T	24.6	Very low	27	Very low	83 Å²	83	131.2 Å²	131.2	51%	0.509	70%	0.696	S	S	.	*			cis	-172.8	172.3	14.8	-6.6	0	0	0	0	112.6	S2325	T2135-S2325 CarbonylContact C-O 2.77Å; T2135-S2325 WeakPolarHBondContact CA-O 3.33Å; T2135-S2325 WeakPolarHBondContact CG2-O 3.38Å
2136	V	26.4	Very low	26.4	Very low	89 Å²	89	130.2 Å²	130.2	54%	0.539	69%	0.691	S	S	.	*			trans	84.7	87.7	150.8	179.4	0	0	0	0	118.2	S2325 G2326	V2136-S2325 PolarHBondContact N-O 2.88Å; V2136-G2326 WeakPolarHBondContact CA-O 3.39Å; V2136-G2326 WeakPolarHBondContact CG2-O 3.45Å
2137	N	26.1	Very low	26.3	Very low	92 Å²	92	131.7 Å²	131.7	49%	0.492	69%	0.685	S	S	.	*				41.5	127.3	123.8	-73.1	19.2	0	0	0	122.3	G2326 Y2327	N2137-G2326 PolarHBondContact ND2-O 2.7Å; N2137-G2326 WeakPolarHBondContact OD1-CA 3.02Å; N2137-G2326 PolarHBondContact OD1-N 2.89Å; N2137-G2326 PolarHBondContact OD1-O 3.32Å; N2137-Y2327 WeakPolarHBondContact CB-O 3.36Å; N2137-Y2327 PolarHBondContact ND2-N 2.78Å; N2137-Y2327 PolarHBondContact ND2-O 2.72Å
2138	G	29.8	Very low	26.2	Very low	81 Å²	81	131.1 Å²	131.1	84%	0.835	68%	0.677	S	S	*	*			trans	-161.8	44.4	169.2	0	0	0	0	0	113.8
2139	L	26.5	Very low	26.4	Very low	135 Å²	135	126.6 Å²	126.6	71%	0.707	67%	0.665	S	S	*	*			trans	-74.4	164.5	168.6	-89.8	107.3	0	0	0	110.8
2140	P	27.7	Very low	26.5	Very low	101 Å²	101	122 Å²	122	66%	0.656	66%	0.656	S	S	*	*			cis	-136.2	167.4	14.1	30.7	-7.7	0	0	0	117.5
2141	Q	23.8	Very low	26.6	Very low	142 Å²	142	125.2 Å²	125.2	66%	0.664	66%	0.661	S	S	*	*				30.2	137.3	128	-50.5	158.3	-5	0	0	118.5
2142	K	27	Very low	26.8	Very low	217 Å²	217	125.8 Å²	125.8	94%	0.943	67%	0.668	S	S	*	*				-116.3	113.9	54.5	-77.2	179.2	176.5	171.3	0	115.4
2143	Q	25	Very low	26.8	Very low	129 Å²	129	125.6 Å²	125.6	60%	0.603	67%	0.672	S	S	*	*			trans	-66	157.8	156.1	-94.3	96.4	-11.6	0	0	112.3
2144	Y	37.8	Very low	26.9	Very low	209 Å²	209	128.4 Å²	128.4	82%	0.82	68%	0.677	S	S	*	*			trans	-2.6	147.4	144.1	-32.6	-62.9	0	0	0	117.9
2145	P	28.5	Very low	26.8	Very low	110 Å²	110	128.2 Å²	128.2	71%	0.714	68%	0.681	S	S	*	*				-133.4	-169.2	68.3	34.6	-15	0	0	0	112.7
2146	L	22.6	Very low	26.9	Very low	136 Å²	136	134.2 Å²	134.2	71%	0.712	70%	0.696	S	S	*	*				-166.7	129.4	76.5	-84.7	153.2	0	0	0	112.8
2147	K	26.6	Very low	26.8	Very low	148 Å²	148	136.2 Å²	136.2	64%	0.643	71%	0.709	S	S	*	*			trans	70.5	70	146.9	-60.2	168.6	179.3	169.5	0	118.3	T2149	K2147-T2149 HydrophobicContact CB-CG2 4.34Å; K2147-T2149 HydrophobicContact CG-CG2 4.36Å
2148	T	24	Very low	26.8	Very low	102 Å²	102	138.6 Å²	138.6	63%	0.626	72%	0.722	S	S	*	*				-96.4	144.3	79.8	58.4	0	0	0	0	107.5
2149	T	28.2	Very low	26.7	Very low	92 Å²	92	145.5 Å²	145.5	56%	0.564	72%	0.722	S	S	*	*			cis	60.7	40.7	26.5	82.6	0	0	0	0	114.1	K2147	K2147-T2149 HydrophobicContact CB-CG2 4.34Å; K2147-T2149 HydrophobicContact CG-CG2 4.36Å
2150	D	25.4	Very low	26.7	Very low	115 Å²	115	146.6 Å²	146.6	62%	0.615	73%	0.729	S	S	*	*				-89.7	107.5	119	-70.6	-49.5	0	0	0	104.8
2151	W	27.1	Very low	26.7	Very low	190 Å²	190	149.1 Å²	149.1	72%	0.72	74%	0.737	S	S	*	*				80	141	73.9	-82.8	63.7	0	0	0	112.4
2152	N	29.8	Very low	27	Very low	147 Å²	147	147 Å²	147	79%	0.786	74%	0.736	S	S	*	*			trans	-49.1	136	-169.4	-55.4	-20.7	0	0	0	113.4
2153	T	25.9	Very low	27	Very low	124 Å²	124	145.4 Å²	145.4	76%	0.761	73%	0.729	S	S	*	*			trans	-129.8	96.3	145.3	-51.8	0	0	0	0	108.7	I2155	T2153-I2155 HydrophobicContact CG2-CG1 4.32Å; T2153-I2155 PolarHBondContact O-N 3.44Å
2154	T	27.2	Very low	27.3	Very low	116 Å²	116	146.8 Å²	146.8	71%	0.712	74%	0.74	S	S	*	*			trans	-58.9	101.4	161.1	41.2	0	0	0	0	109.5
2155	I	23.6	Very low	26.9	Very low	134 Å²	134	148.3 Å²	148.3	69%	0.687	75%	0.745	S	S	*	*			trans	-102.9	103.3	146.6	-62.3	179.3	0	0	0	103.2	T2153 T2157	T2153-I2155 HydrophobicContact CG2-CG1 4.32Å; T2153-I2155 PolarHBondContact O-N 3.44Å; I2155-T2157 PolarHBondContact O-N 2.91Å
2156	Y	26.3	Very low	27.1	Very low	209 Å²	209	148.7 Å²	148.7	82%	0.82	75%	0.747	S	S	*	*				51.1	33.1	64.1	-102.3	-67.9	0	0	0	112.9	D2158	Y2156-D2158 PolarHBondContact O-N 3.25Å
2157	T	24.5	Very low	27.3	Very low	132 Å²	132	149.9 Å²	149.9	81%	0.81	75%	0.753	S	S	*	*			trans	-65.5	96.9	131.3	52.1	0	0	0	0	107.8	I2155	I2155-T2157 PolarHBondContact O-N 2.91Å
2158	D	26.1	Very low	27.2	Very low	142 Å²	142	148 Å²	148	76%	0.759	76%	0.759	S	S	*	*				-135.6	148.9	115	-155.5	4.4	0	0	0	110.2	Y2156	Y2156-D2158 PolarHBondContact O-N 3.25Å
2159	R	26.9	Very low	27.2	Very low	225 Å²	225	148.7 Å²	148.7	85%	0.849	76%	0.763	S	S	*	*			trans	-109.3	154.1	173.8	-79	178.4	169.3	175.8	-3.6	108.5	N2161	R2159-N2161 PolarHBondContact O-N 3.39Å
2160	N	26.9	Very low	27	Very low	158 Å²	158	151.3 Å²	151.3	85%	0.845	77%	0.773	S	S	*	*	S	Bend	trans	-31.3	108.2	162.9	-46.5	-19.9	0	0	0	113.7
2161	N	28.4	Very low	27	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	78%	0.777	S	S	*	*				-170.5	160.1	122.7	-104.2	-19.7	0	0	0	113.9	R2159	R2159-N2161 PolarHBondContact O-N 3.39Å
2162	P	28.9	Very low	26.9	Very low	97 Å²	97	150.9 Å²	150.9	63%	0.63	78%	0.783	S	S	*	*			trans	-97.4	153.9	-178.8	38.2	-34.5	0	0	0	113.8
2163	K	27.4	Very low	26.8	Very low	184 Å²	184	146.5 Å²	146.5	80%	0.8	77%	0.772	S	S	*	*			trans	77.4	140.3	154.4	-66	164.4	179.9	178.7	0	120.5
2164	N	30.9	Very low	26.7	Very low	158 Å²	158	145.5 Å²	145.5	85%	0.845	77%	0.77	S	S	*	*			trans	96.8	148.9	147	-65.7	-9.8	0	0	0	122.2
2165	R	30	Very low	26.6	Very low	241 Å²	241	146.8 Å²	146.8	91%	0.909	77%	0.773	S	S	*	*			trans	-86.5	-174.2	179.4	-53.9	177.5	176	-176.9	-2.1	110.4
2166	P	32.9	Very low	26.7	Very low	118 Å²	118	146 Å²	146	77%	0.766	78%	0.779	S	S	*	*			cis	-116	175.8	11.3	10.3	18.1	0	0	0	114.1
2167	L	25.9	Very low	26.7	Very low	161 Å²	161	139.9 Å²	139.9	84%	0.843	77%	0.772	S	S	*	*			cis	82.8	134.5	42.1	-156	78.9	0	0	0	115.2
2168	S	24.5	Very low	26.6	Very low	109 Å²	109	141 Å²	141	76%	0.762	77%	0.772	S	S	*	*			trans	64.2	154.1	178.3	68.2	0	0	0	0	116.1
2169	T	24.3	Very low	26.4	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	77%	0.77	S	S	*	*			cis	-150.5	125.2	11.9	-34.3	0	0	0	0	106.8
2170	L	25	Very low	26.4	Very low	147 Å²	147	138 Å²	138	77%	0.77	77%	0.77	S	S	*	*				61.9	144.6	88.9	-130.2	166.1	0	0	0	115
2171	T	24.9	Very low	26.2	Very low	116 Å²	116	135.1 Å²	135.1	71%	0.712	76%	0.763	S	S	*	*			trans	76.9	147.4	174.7	80.6	0	0	0	0	115.7
2172	H	25.1	Very low	25.9	Very low	181 Å²	181	133.4 Å²	133.4	84%	0.838	76%	0.758	S	S	*	*			cis	-158.8	163	-21.3	-132.3	-102.1	0	0	0	109.4
2173	G	26.2	Very low	25.7	Very low	55 Å²	55	134.8 Å²	134.8	57%	0.567	76%	0.76	S	S	*	*			trans	100.9	113.1	136.1	0	0	0	0	0	119.9
2174	S	25.5	Very low	25.5	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	76%	0.76	S	S	*	*				88.5	95.1	115.4	-53.9	0	0	0	0	121.2
2175	N	25.2	Very low	25.2	Very low	143 Å²	143	131.1 Å²	131.1	77%	0.765	75%	0.747	S	S	*	*				79.7	145.6	118	-58.7	-8.6	0	0	0	121.3
2176	S	25.3	Very low	24.9	Very low	117 Å²	117	124 Å²	124	82%	0.818	73%	0.728	S	S	*	*			trans	62.9	142.5	147.2	51.2	0	0	0	0	119.6
2177	A	25.3	Very low	25.2	Very low	82 Å²	82	120.3 Å²	120.3	68%	0.678	70%	0.702	S	S	*	*			cis	-175.1	178	-13.3	0	0	0	0	0	108.3
2178	L	23.4	Very low	25.4	Very low	154 Å²	154	116.4 Å²	116.4	81%	0.806	69%	0.687	S	S	*	*			trans	41.6	114	150.1	-90	63.5	0	0	0	118.9
2179	C	22.3	Very low	25.5	Very low	105 Å²	105	117.3 Å²	117.3	71%	0.709	67%	0.674	S	S	*	*				84	132.2	69.8	-77	0	0	0	0	116.4
2180	K	25	Very low	25.4	Very low	200 Å²	200	117 Å²	117	87%	0.87	67%	0.673	S	S	*	*			trans	68.7	-179.6	147.4	-72.9	-174.5	173.7	-175	0	118.1
2181	S	23.4	Very low	25.4	Very low	98 Å²	98	117 Å²	117	69%	0.685	67%	0.668	S	S	*	*			trans	68.6	119.9	-176.8	37.6	0	0	0	0	114.6
2182	T	22.8	Very low	25.4	Very low	118 Å²	118	117.7 Å²	117.7	72%	0.724	67%	0.668	S	S	*	*				62.6	134.7	67.8	66.7	0	0	0	0	111.8
2183	D	23.5	Very low	25.5	Very low	126 Å²	126	113.7 Å²	113.7	67%	0.674	66%	0.658	S	S	*	*			cis	-164	171.1	5.5	-119.7	-25.5	0	0	0	111.9
2184	F	24.7	Very low	25.5	Very low	182 Å²	182	115.9 Å²	115.9	80%	0.798	66%	0.66	S	S	*	*			trans	58.2	174.2	147.6	-89.9	-112.9	0	0	0	122.7
2185	S	23.7	Very low	25.6	Very low	83 Å²	83	118.8 Å²	118.8	58%	0.58	67%	0.667	S	S	*	*			trans	-38.3	159.9	163.1	53.8	0	0	0	0	116.7
2186	D	23.9	Very low	25.9	Very low	93 Å²	93	116.2 Å²	116.2	50%	0.497	66%	0.658	S	S	.	*			cis	-163.5	166.7	3.3	-124.5	-38.5	0	0	0	112.8
2187	V	38.9	Very low	26	Very low	39 Å²	39	118 Å²	118	24%	0.236	66%	0.656	C	S	.	*			trans	6	128.4	130.9	166.7	0	0	0	0	117.6	Y1031 I1035	Y1031-V2187 HydrophobicContact CD1-CB 4.03Å; Y1031-V2187 HydrophobicContact CD1-CG1 3.56Å; Y1031-V2187 HydrophobicContact CD1-CG2 3.54Å; Y1031-V2187 HydrophobicContact CD2-CG1 4.19Å; Y1031-V2187 HydrophobicContact CE1-CB 4.49Å; Y1031-V2187 HydrophobicContact CE1-CG1 4.34Å; Y1031-V2187 HydrophobicContact CE1-CG2 4.01Å; Y1031-V2187 HydrophobicContact CG-CB 4.41Å; Y1031-V2187 HydrophobicContact CG-CG1 3.46Å; Y1031-V2187 VanDerWaalsContact CG-CG1 3.46Å; Y1031-V2187 HydrophobicContact CG-CG2 4.32Å; I1035-V2187 HydrophobicContact CD1-CG1 3.69Å; I1035-V2187 HydrophobicContact CG1-CB 4.44Å; I1035-V2187 HydrophobicContact CG1-CG1 3.99Å
2188	P	31.4	Very low	26	Very low	79 Å²	79	118.3 Å²	118.3	51%	0.513	65%	0.654	S	S	.	*				-159	-157.7	86	45.6	-23.8	0	0	0	118	Y1031	Y1031-P2188 VanDerWaalsContact CD2-C 3.46Å; Y1031-P2188 WeakPolarHBondContact CE2-O 3.18Å; Y1031-P2188 PolarHBondContact OH-O 3.46Å
2189	Y	25.9	Very low	26	Very low	128 Å²	128	115 Å²	115	50%	0.502	64%	0.643	S	S	.	*			trans	-20.5	157	-177	-56.2	-74.5	0	0	0	120.2	H1029 Y1031	H1029-Y2189 AromaticContact CD2-CE1 3.94Å; H1029-Y2189 AromaticContact NE2-CD1 3.88Å; Y1031-Y2189 VanDerWaalsContact CE2-N 3.28Å
2190	T	22.9	Very low	26.2	Very low	109 Å²	109	115.5 Å²	115.5	67%	0.669	64%	0.638	S	S	*	*			cis	-157.6	179.7	49.6	46.2	0	0	0	0	114.6
2191	H	24.1	Very low	26.1	Very low	146 Å²	146	113 Å²	113	68%	0.676	63%	0.625	S	S	*	*			trans	20.9	144.6	140.3	-69.9	-80.5	0	0	0	120
2192	D	24.7	Very low	26.2	Very low	132 Å²	132	112.9 Å²	112.9	71%	0.706	61%	0.612	S	S	*	*			cis	-158.7	-170	23.5	-131.7	4.6	0	0	0	111.7
2193	P	26.9	Very low	26.3	Very low	97 Å²	97	108.6 Å²	108.6	63%	0.63	59%	0.587	S	S	*	*				-132.5	-155.1	-128	43	-20.8	0	0	0	114.2
2194	V	25.7	Very low	26.4	Very low	100 Å²	100	106.3 Å²	106.3	61%	0.606	57%	0.574	S	S	*	*			trans	45.8	94.5	151.8	174.5	0	0	0	0	115.6	P2196	V2194-P2196 HydrophobicContact CG1-CG 4.04Å
2195	L	28.3	Very low	26.5	Very low	164 Å²	164	103 Å²	103	86%	0.859	56%	0.56	S	S	*	*				64.9	-152.9	87.1	-64.7	165.1	0	0	0	111
2196	P	31.6	Very low	26.6	Very low	89 Å²	89	107.9 Å²	107.9	58%	0.578	57%	0.567	S	S	*	*			cis	-116.9	-156.9	-45.6	15.4	8.3	0	0	0	110.8	V2194	V2194-P2196 HydrophobicContact CG1-CG 4.04Å
2197	I	26.9	Very low	26.7	Very low	154 Å²	154	106.2 Å²	106.2	79%	0.79	56%	0.558	S	S	*	*			trans	75.9	117.6	152.7	-46.2	-169.2	0	0	0	116.1
2198	S	26	Very low	26.1	Very low	89 Å²	89	113.1 Å²	113.1	62%	0.622	59%	0.585	S	S	*	*			cis	-155.3	173	-15.2	61	0	0	0	0	109.4
2199	S	24.6	Very low	25.9	Very low	83 Å²	83	110.2 Å²	110.2	58%	0.58	57%	0.566	S	S	*	*				35.7	141.2	90.6	108	0	0	0	0	115.2
2200	L	24.4	Very low	26	Very low	117 Å²	117	110.3 Å²	110.3	61%	0.613	57%	0.569	S	S	*	*			cis	-108.4	147.4	17.5	-80	98.1	0	0	0	112.9
2201	Y	23.9	Very low	26.3	Very low	147 Å²	147	107.4 Å²	107.4	58%	0.576	55%	0.553	S	S	*	*				64.8	138.8	69.4	-121.3	-98.7	0	0	0	109.8	D960 Q961	D960-Y2201 VanDerWaalsContact OD1-C 3.26Å; D960-Y2201 WeakPolarHBondContact OD1-CD1 3.23Å; Q961-Y2201 HydrophobicContact CB-CE1 4.43Å; Q961-Y2201 HydrophobicContact CG-CD1 3.3Å; Q961-Y2201 HydrophobicContact CG-CE1 3.49Å; Q961-Y2201 VanDerWaalsContact CG-CE1 3.49Å; Q961-Y2201 HydrophobicContact CG-CG 4.37Å
2202	K	24.9	Very low	26.5	Very low	95 Å²	95	107 Å²	107	41%	0.413	55%	0.554	S	S	.	*			cis	-178.1	170.4	-11.7	171.2	-113.4	-154.3	-168.3	0	107.3	D960	D960-K2202 PolarHBondContact N-O 2.95Å; D960-K2202 WeakPolarHBondContact O-CD 3.36Å; D960-K2202 WeakPolarHBondContact O-CE 3.36Å; D960-K2202 PolarHBondContact O-NZ 2.9Å; D960-K2202 WeakPolarHBondContact OD1-CB 3.4Å; D960-K2202 PolarHBondContact OD1-N 2.82Å; D960-K2202 VanDerWaalsContact OD1-N 3.1Å
2203	S	25	Very low	26.7	Very low	29 Å²	29	106.4 Å²	106.4	20%	0.203	55%	0.551	C	S	.	*			trans	66.6	168	164.1	141.5	0	0	0	0	114.6	K958 D960	K958-S2203 WeakPolarHBondContact CD-O 3.25Å; K958-S2203 VanDerWaalsContact CE-O 3.23Å; K958-S2203 WeakPolarHBondContact CE-O 3.48Å; K958-S2203 PolarHBondContact NZ-O 3.21Å; D960-S2203 PolarHBondContact N-OG 3.4Å; D960-S2203 VanDerWaalsContact O-CB 3.29Å; D960-S2203 WeakPolarHBondContact O-CB 3.17Å; D960-S2203 PolarHBondContact O-OG 2.89Å
2204	N	26.3	Very low	26.8	Very low	77 Å²	77	105 Å²	105	41%	0.412	54%	0.538	S	S	.	.			cis	-139.9	160.8	-32.8	-106.9	-6.4	0	0	0	109.5	K958 L2103	K958-N2204 WeakPolarHBondContact CE-O 3.39Å; L2103-N2204 VanDerWaalsContact CD2-C 3.45Å; L2103-N2204 HydrophobicContact CD2-CB 3.78Å; L2103-N2204 WeakPolarHBondContact CD2-O 3.42Å
2205	K	26.5	Very low	26.9	Very low	114 Å²	114	104.9 Å²	104.9	50%	0.496	53%	0.533	S	S	.	.			trans	48.2	-161.1	141.9	-56.7	164.9	143	-154.3	0	119.5	L2103 M2104 D2105	L2103-K2205 HydrophobicContact CD2-CB 3.5Å; L2103-K2205 VanDerWaalsContact CD2-CB 3.5Å; L2103-K2205 CarbonylContact O-C 3.56Å; M2104-K2205 HydrophobicContact CB-CB 3.51Å; M2104-K2205 HydrophobicContact CB-CD 4.22Å; M2104-K2205 HydrophobicContact CG-CB 3.65Å; M2104-K2205 HydrophobicContact CG-CD 4.32Å; M2104-K2205 HydrophobicContact CG-CG 4.48Å; M2104-K2205 HydrophobicContact SD-CB 3.68Å; M2104-K2205 HydrophobicContact SD-CD 3.48Å; M2104-K2205 WeakPolarHBondContact SD-CD 3.48Å; M2104-K2205 HydrophobicContact SD-CG 3.86Å; D2105-K2205 IonicContact OD1-NZ 2.9Å; D2105-K2205 PolarHBondContact OD1-NZ 3.28Å; D2105-K2205 VanDerWaalsContact OD2-CD 3.29Å; D2105-K2205 WeakPolarHBondContact OD2-CD 3.35Å; D2105-K2205 IonicContact OD2-NZ 3.42Å; D2105-K2205 PolarHBondContact OD2-NZ 3.15Å
2206	Y	25.9	Very low	26.9	Very low	184 Å²	184	103.5 Å²	103.5	72%	0.722	53%	0.527	S	S	*	.				-169.1	104.4	-121.2	-171.6	-61.5	0	0	0	116.6	L2103 M2104	L2103-Y2206 VanDerWaalsContact C-N 3.34Å; L2103-Y2206 CarbonylContact O-C 3.53Å; L2103-Y2206 WeakPolarHBondContact O-CA 3.43Å; L2103-Y2206 PolarHBondContact O-N 3.23Å; M2104-Y2206 WeakPolarHBondContact CG-O 3.46Å
2207	N	26.2	Very low	26.7	Very low	58 Å²	58	106.1 Å²	106.1	31%	0.31	53%	0.531	S	S	.	.			trans	-175.4	177.4	166.5	-110.1	4.3	0	0	0	111.2	G954 D955 L2103 M2104	G954-N2207 WeakPolarHBondContact O-CB 3.3Å; G954-N2207 PolarHBondContact O-ND2 2.68Å; D955-N2207 WeakPolarHBondContact O-CB 3.4Å; L2103-N2207 PolarHBondContact O-N 3.22Å; M2104-N2207 HydrophobicContact CG-CB 4.49Å
2208	K	27.2	Very low	26.6	Very low	185 Å²	185	105.1 Å²	105.1	80%	0.804	53%	0.527	S	S	*	.			trans	-169.1	103.1	-162.6	167.3	-158.1	172.6	-166	0	112.4	D955	D955-K2208 VanDerWaalsContact N-N 3.13Å
2209	S	25.5	Very low	26.7	Very low	17 Å²	17	107.6 Å²	107.6	12%	0.119	53%	0.528	C	S	.	.			trans	-163.3	97	163	-151.7	0	0	0	0	117.6	D953 D955 V2064 L2065	D953-S2209 WeakPolarHBondContact OD1-CB 3.07Å; D953-S2209 PolarHBondContact OD1-OG 2.84Å; D955-S2209 PolarHBondContact OD1-N 3.19Å; V2064-S2209 CarbonylContact C-O 3.53Å; V2064-S2209 VanDerWaalsContact C-O 3.29Å; V2064-S2209 WeakPolarHBondContact CA-O 3.43Å; V2064-S2209 PolarHBondContact N-O 3.08Å; L2065-S2209 WeakPolarHBondContact CA-O 3.28Å; L2065-S2209 PolarHBondContact N-O 2.95Å
2210	K	28.2	Very low	26.8	Very low	130 Å²	130	108.7 Å²	108.7	57%	0.565	53%	0.528	S	S	*	.				67.8	146.2	102.3	-148.3	-169.9	-173.6	-176.3	0	119.9	L2065 I2066	L2065-K2210 PolarHBondContact O-N 3.25Å; I2066-K2210 PolarHBondContact O-N 3.04Å
2211	S	29.2	Very low	27.1	Very low	48 Å²	48	111.6 Å²	111.6	34%	0.336	54%	0.538	S	S	.	.			trans	95.9	150.2	138.2	85.9	0	0	0	0	120.5	L2065	L2065-S2211 WeakPolarHBondContact CD2-O 3.27Å
2212	I	28.6	Very low	27.4	Very low	137 Å²	137	107.3 Å²	107.3	70%	0.703	54%	0.539	S	S	*	.			trans	67.8	136.4	149.4	-72.1	165	0	0	0	115.4
2213	N	29.5	Very low	27.6	Very low	120 Å²	120	110.2 Å²	110.2	64%	0.642	56%	0.559	S	S	*	*			cis	-164.4	162.9	-4.4	-108.7	12.9	0	0	0	107.4
2214	L	29.3	Very low	27.9	Very low	68 Å²	68	114.6 Å²	114.6	36%	0.356	58%	0.58	S	S	.	*			cis	-175.2	-177.6	-21.6	-149.3	59.9	0	0	0	107.1	D2093 N2094	D2093-L2214 HydrophobicContact CB-CD2 4.03Å; N2094-L2214 HydrophobicContact CB-CG 4.38Å; N2094-L2214 VanDerWaalsContact O-CD1 3.23Å; N2094-L2214 WeakPolarHBondContact O-CD1 3.36Å; N2094-L2214 VanDerWaalsContact O-CG 3.25Å; N2094-L2214 WeakPolarHBondContact O-CG 3.5Å
2215	I	27.3	Very low	28	Very low	97 Å²	97	117.7 Å²	117.7	50%	0.497	60%	0.596	S	S	.	*			trans	75.6	156.7	151.3	-80.9	166.8	0	0	0	117.7	N2094	N2094-I2215 PolarHBondContact O-N 2.84Å
2216	N	28.7	Very low	28.2	Very low	136 Å²	136	117.8 Å²	117.8	73%	0.727	61%	0.607	S	S	*	*			trans	68.8	143.5	176.3	-70.7	-2.9	0	0	0	117.9
2217	E	26.4	Very low	28.3	Very low	143 Å²	143	115 Å²	115	67%	0.668	60%	0.604	S	S	*	*			cis	179.9	134.4	-29.8	-124.5	-168.1	143.5	0	0	105.8
2218	L	25.7	Very low	28.4	Very low	134 Å²	134	119 Å²	119	70%	0.702	63%	0.625	S	S	*	*			trans	62.1	165.2	159.9	-49.9	171.9	0	0	0	114.7
2219	Q	26.6	Very low	28.6	Very low	140 Å²	140	116.5 Å²	116.5	65%	0.654	62%	0.619	S	S	*	*			cis	-153.2	176.3	-24	-119.2	179.1	-86.1	0	0	108
2220	N	27.9	Very low	28.6	Very low	107 Å²	107	121 Å²	121	57%	0.572	65%	0.646	S	S	*	*			trans	37.7	112	150.4	-61.4	31	0	0	0	117.8
2221	E	30.1	Very low	28.5	Very low	177 Å²	177	119.7 Å²	119.7	83%	0.827	65%	0.648	S	S	*	*				142.9	149.8	65.9	-99.8	164	-135	0	0	104.1
2222	G	30.7	Very low	28.4	Very low	58 Å²	58	127.8 Å²	127.8	60%	0.598	67%	0.672	S	S	*	*			cis	176.7	175.8	-6.7	0	0	0	0	0	109.8
2223	N	29.4	Very low	28.3	Very low	155 Å²	155	124.6 Å²	124.6	83%	0.829	66%	0.656	S	S	*	*			trans	51.5	130.4	135.3	-63.7	19.9	0	0	0	120.3
2224	D	31.1	Very low	28.2	Very low	121 Å²	121	124.3 Å²	124.3	65%	0.647	65%	0.654	S	S	*	*			cis	-170.3	-164	-2.1	-144	-37.3	0	0	0	111.8
2225	L	28	Very low	28	Very low	143 Å²	143	127.5 Å²	127.5	75%	0.749	67%	0.669	S	S	*	*			trans	74	60.8	167.8	-92.9	68.4	0	0	0	115.5
2226	T	29.7	Very low	28	Very low	116 Å²	116	127.2 Å²	127.2	71%	0.712	67%	0.668	S	S	*	*				-15.5	139.9	118.7	54.1	0	0	0	0	115.2
2227	N	28.5	Very low	28	Very low	124 Å²	124	125.3 Å²	125.3	66%	0.663	66%	0.655	S	S	*	*			trans	-161.9	151	135.8	-113.2	-59.8	0	0	0	113.4
2228	L	29.5	Very low	28	Very low	143 Å²	143	123.4 Å²	123.4	75%	0.749	64%	0.642	S	S	*	*			trans	57.3	95.3	-177.9	-80.9	69.9	0	0	0	115.4
2229	I	29.7	Very low	28.1	Very low	132 Å²	132	120 Å²	120	68%	0.677	63%	0.625	S	S	*	*			cis	81.4	150.8	43.4	-50.4	157.8	0	0	0	112.9
2230	T	26.3	Very low	28.2	Very low	112 Å²	112	117.6 Å²	117.6	69%	0.687	62%	0.623	S	S	*	*			trans	74.5	121.5	171.8	28.8	0	0	0	0	116
2231	V	25.3	Very low	28.2	Very low	102 Å²	102	122.8 Å²	122.8	62%	0.618	63%	0.634	S	S	*	*			cis	63	97.4	40.7	-170.8	0	0	0	0	110.3
2232	R	29.1	Very low	28.2	Very low	219 Å²	219	117.4 Å²	117.4	83%	0.826	62%	0.617	S	S	*	*				-149	141	80.6	-100.6	176.1	178.3	83.7	-2.4	109.4
2233	D	25.2	Very low	28	Very low	70 Å²	70	120.3 Å²	120.3	37%	0.374	62%	0.618	S	S	.	*			cis	57.7	128.4	33.3	-68.2	-20.7	0	0	0	115.6	R2294	D2233-R2294 IonicContact OD1-CZ 2.66Å; D2233-R2294 VanDerWaalsContact OD1-CZ 3.31Å; D2233-R2294 IonicContact OD1-NH1 2.88Å; D2233-R2294 PolarHBondContact OD1-NH1 3.41Å; D2233-R2294 IonicContact OD1-NH2 2.78Å; D2233-R2294 PolarHBondContact OD1-NH2 2.86Å
2234	N	27.1	Very low	27.7	Very low	114 Å²	114	114.8 Å²	114.8	61%	0.61	59%	0.589	S	S	*	*			trans	67.7	119.2	157.5	-66	-11.9	0	0	0	116.9
2235	M	25.9	Very low	27.4	Very low	134 Å²	134	111.6 Å²	111.6	66%	0.66	57%	0.571	S	S	*	*				85.5	137.9	102.3	-67.9	169.9	-179.5	0	0	111.7
2236	N	28	Very low	27.2	Very low	91 Å²	91	107.2 Å²	107.2	49%	0.487	55%	0.547	S	S	.	.			cis	-160.7	156	-1.3	-116.8	7.6	0	0	0	110.8	R2015	R2015-N2236 PolarHBondContact NH1-OD1 3.28Å
2237	E	27	Very low	26.9	Very low	97 Å²	97	108.8 Å²	108.8	45%	0.453	55%	0.546	S	S	.	.			trans	64.7	173.7	144.5	-68.4	164.1	-151.1	0	0	117	S2017	S2017-E2237 VanDerWaalsContact OG-C 3.3Å; S2017-E2237 WeakPolarHBondContact OG-CA 3.3Å
2238	R	28	Very low	26.7	Very low	103 Å²	103	106.2 Å²	106.2	39%	0.389	53%	0.53	S	S	.	.			cis	-131.7	-168.5	-5	-146.9	163.3	-71.3	120	5.6	110.8	S2017 E2018 V2019	S2017-R2238 CarbonylContact C-O 3.48Å; S2017-R2238 VanDerWaalsContact CA-O 3.27Å; S2017-R2238 WeakPolarHBondContact CA-O 3.5Å; S2017-R2238 WeakPolarHBondContact CB-O 3.2Å; S2017-R2238 VanDerWaalsContact OG-C 3.3Å; S2017-R2238 WeakPolarHBondContact OG-CA 3.46Å; S2017-R2238 PolarHBondContact OG-N 2.89Å; S2017-R2238 PolarHBondContact OG-O 2.84Å; E2018-R2238 CarbonylContact C-O 3.56Å; E2018-R2238 WeakPolarHBondContact CA-O 3.3Å; E2018-R2238 PolarHBondContact N-O 2.98Å; E2018-R2238 CarbonylContact O-C 3.25Å; V2019-R2238 HydrophobicContact CB-CB 4.15Å; V2019-R2238 WeakPolarHBondContact CB-O 3.26Å; V2019-R2238 HydrophobicContact CG1-CB 3.96Å; V2019-R2238 WeakPolarHBondContact CG1-O 3.25Å; V2019-R2238 HydrophobicContact CG2-CB 4.28Å
2239	D	26.5	Very low	26.5	Very low	63 Å²	63	103.9 Å²	103.9	34%	0.337	52%	0.516	S	S	.	.			trans	-129.7	164.3	-130.3	-60.2	-56.9	0	0	0	117.9	H2016 S2017 E2018	H2016-D2239 WeakPolarHBondContact CB-OD1 3.22Å; S2017-D2239 VanDerWaalsContact CA-OD1 3.29Å; S2017-D2239 WeakPolarHBondContact CA-OD1 3.48Å; S2017-D2239 PolarHBondContact OG-OD1 2.96Å; E2018-D2239 CarbonylContact O-C 3.59Å; E2018-D2239 WeakPolarHBondContact O-CA 3.48Å; E2018-D2239 PolarHBondContact O-N 2.86Å
2240	S	28.4	Very low	26.2	Very low	88 Å²	88	103.7 Å²	103.7	62%	0.615	51%	0.512	S	S	*	.			trans	98.1	172.8	154.2	83.6	0	0	0	0	119.2
2241	R	29.5	Very low	26.4	Very low	216 Å²	216	105.5 Å²	105.5	82%	0.815	51%	0.512	S	S	*	.			trans	60.4	149	164.8	-75.1	-156.2	156.8	96.3	-2.3	121
2242	S	29.1	Very low	26.5	Very low	65 Å²	65	107 Å²	107	46%	0.455	51%	0.512	S	S	.	.			cis	-175.8	178.6	-44	42.8	0	0	0	0	107.8
2243	D	27	Very low	26.3	Very low	118 Å²	118	102.6 Å²	102.6	63%	0.631	50%	0.501	S	S	*	.			trans	70.8	103.3	154.3	-45.9	-43.6	0	0	0	118.3
2244	D	23.4	Very low	26.2	Very low	40 Å²	40	103.3 Å²	103.3	21%	0.214	50%	0.503	C	S	.	.				46.9	111.5	105.4	-60.7	50.8	0	0	0	118	A130	A130-D2244 WeakPolarHBondContact CB-OD1 3.34Å; A130-D2244 VanDerWaalsContact O-OD2 3.13Å
2245	I	25.1	Very low	26	Very low	53 Å²	53	105.5 Å²	105.5	27%	0.272	51%	0.509	S	S	.	.				167	138.9	122.3	-75.9	157.7	0	0	0	112.3	A134 K137 R138	A134-I2245 CarbonylContact O-C 3.18Å; A134-I2245 VanDerWaalsContact O-C 3.24Å; A134-I2245 VanDerWaalsContact O-CA 3.29Å; A134-I2245 WeakPolarHBondContact O-CA 3.4Å; K137-I2245 HydrophobicContact CB-CB 4.24Å; K137-I2245 HydrophobicContact CB-CD1 4.48Å; K137-I2245 HydrophobicContact CB-CG1 3.71Å; K137-I2245 HydrophobicContact CB-CG2 3.76Å; K137-I2245 HydrophobicContact CD-CG1 4.28Å; R138-I2245 VanDerWaalsContact CA-CG2 3.48Å; R138-I2245 HydrophobicContact CB-CG2 3.6Å; R138-I2245 WeakPolarHBondContact CD-O 3.5Å; R138-I2245 HydrophobicContact CG-CB 4.38Å; R138-I2245 HydrophobicContact CG-CG2 3.53Å; R138-I2245 PolarHBondContact NH1-O 3.36Å
2246	E	22.9	Very low	26	Very low	51 Å²	51	105.3 Å²	105.3	24%	0.238	51%	0.511	C	S	.	.			trans	-72.8	118.3	-159.3	-175.4	179.7	-163.5	0	0	124.9	A134 A135 K136 K137 R138 A139 E2248	A134-E2246 VanDerWaalsContact O-CA 3.3Å; A134-E2246 WeakPolarHBondContact O-CA 3.4Å; A134-E2246 WeakPolarHBondContact O-CB 3.24Å; A134-E2246 PolarHBondContact O-N 3.48Å; A135-E2246 HydrophobicContact CB-CB 4.49Å; A135-E2246 HydrophobicContact CB-CG 4.29Å; K136-E2246 WeakPolarHBondContact CA-OE2 3.45Å; K136-E2246 PolarHBondContact N-OE2 2.87Å; K137-E2246 PolarHBondContact N-OE2 3.43Å; R138-E2246 CarbonylContact C-O 3.47Å; R138-E2246 WeakPolarHBondContact CA-O 3.16Å; R138-E2246 HydrophobicContact CB-CB 4.31Å; R138-E2246 WeakPolarHBondContact CB-O 3.45Å; A139-E2246 VanDerWaalsContact CB-CD 3.41Å; A139-E2246 HydrophobicContact CB-CG 3.94Å; A139-E2246 VanDerWaalsContact CB-OE2 3.26Å; A139-E2246 WeakPolarHBondContact CB-OE2 3.14Å; A139-E2246 PolarHBondContact N-O 2.96Å; E2246-E2248 PolarHBondContact O-N 3.06Å
2247	E	24.2	Very low	26.2	Very low	149 Å²	149	108.4 Å²	108.4	70%	0.696	53%	0.527	S	S	*	.			trans	37.5	-135.7	166.9	-67.3	-165.6	-126.9	0	0	114.4	R138	R138-E2247 WeakPolarHBondContact CB-O 3.18Å; R138-E2247 WeakPolarHBondContact CD-O 3.38Å
2248	E	23.5	Very low	26.4	Very low	71 Å²	71	111.4 Å²	111.4	33%	0.332	54%	0.538	S	S	.	.			trans	49	171.9	179.9	-89.3	-147.3	151.8	0	0	118.8	R138 A139 R142 A143 E2246	R138-E2248 WeakPolarHBondContact O-CB 3.38Å; A139-E2248 WeakPolarHBondContact CA-OE2 2.86Å; A139-E2248 HydrophobicContact CB-CG 4.01Å; R142-E2248 WeakPolarHBondContact CA-OE2 3.5Å; R142-E2248 HydrophobicContact CB-CB 4.17Å; R142-E2248 WeakPolarHBondContact CB-OE2 3.28Å; R142-E2248 VanDerWaalsContact CD-OE1 3.31Å; R142-E2248 WeakPolarHBondContact CD-OE1 3.01Å; R142-E2248 VanDerWaalsContact CD-OE2 3.29Å; R142-E2248 WeakPolarHBondContact CD-OE2 2.99Å; R142-E2248 IonicContact CZ-OE1 3.5Å; R142-E2248 PolarHBondContact N-OE2 3.04Å; R142-E2248 IonicContact NE-OE1 2.75Å; R142-E2248 IonicContact NH1-OE1 3.13Å; R142-E2248 PolarHBondContact NH1-OE1 2.69Å; A143-E2248 PolarHBondContact N-OE2 2.87Å; E2246-E2248 PolarHBondContact O-N 3.06Å
2249	E	25.2	Very low	26.6	Very low	94 Å²	94	112 Å²	112	44%	0.439	55%	0.554	S	S	.	*			trans	-64.8	158.9	-159.8	-112.3	135.7	-104.4	0	0	114.2	R142	R142-E2249 HydrophobicContact CB-CB 3.7Å; R142-E2249 HydrophobicContact CG-CB 3.49Å; R142-E2249 VanDerWaalsContact CG-CB 3.49Å; R142-E2249 HydrophobicContact CG-CG 4.34Å; R142-E2249 VanDerWaalsContact CZ-CD 3.41Å; R142-E2249 IonicContact CZ-OE1 2.9Å; R142-E2249 IonicContact CZ-OE2 3.77Å; R142-E2249 VanDerWaalsContact NE-CD 3.3Å; R142-E2249 IonicContact NE-OE1 3.81Å; R142-E2249 PolarHBondContact NE-OE1 3.37Å; R142-E2249 IonicContact NE-OE2 2.82Å; R142-E2249 PolarHBondContact NE-OE2 3.48Å; R142-E2249 IonicContact NH1-OE1 3.63Å; R142-E2249 IonicContact NH2-OE1 2.64Å; R142-E2249 PolarHBondContact NH2-OE1 3.18Å; R142-E2249 IonicContact NH2-OE2 3.92Å; R142-E2249 PolarHBondContact NH2-OE2 3.1Å
2250	E	24.4	Very low	26.7	Very low	128 Å²	128	114.4 Å²	114.4	60%	0.598	57%	0.57	S	S	*	*			cis	-142.2	-153.7	27.8	-154	128.4	-147.5	0	0	113.7
2251	E	29.8	Very low	26.8	Very low	150 Å²	150	116.7 Å²	116.7	70%	0.701	58%	0.575	S	S	*	*			trans	-79.4	-152.2	-174.8	-58	174.3	110.9	0	0	112.3
2252	E	27.5	Very low	26.7	Very low	132 Å²	132	116.8 Å²	116.8	62%	0.617	58%	0.575	S	S	*	*			trans	74.3	143.5	150.8	-71.8	175.1	173.6	0	0	118.4
2253	E	25.2	Very low	26.5	Very low	127 Å²	127	117.8 Å²	117.8	59%	0.593	58%	0.582	S	S	*	*			cis	-156.5	-159.5	-3.5	-141.9	-178.8	-179	0	0	110.1	L2277	E2253-L2277 WeakPolarHBondContact O-CB 3.04Å; E2253-L2277 VanDerWaalsContact O-CD1 3.29Å; E2253-L2277 WeakPolarHBondContact O-CD1 3.36Å
2254	E	22.7	Very low	26.5	Very low	86 Å²	86	120.1 Å²	120.1	40%	0.402	59%	0.589	S	S	.	*			trans	77.5	120.7	166	-52	151.9	158.7	0	0	116.1	I2276 L2277 R2278	E2254-I2276 WeakPolarHBondContact O-CG2 3.43Å; E2254-L2277 HydrophobicContact CB-CD1 3.95Å; E2254-L2277 WeakPolarHBondContact O-CD1 3.45Å; E2254-R2278 VanDerWaalsContact CD-NH2 3.32Å; E2254-R2278 IonicContact OE1-NH2 2.81Å; E2254-R2278 PolarHBondContact OE1-NH2 3.44Å; E2254-R2278 IonicContact OE2-CZ 2.89Å; E2254-R2278 IonicContact OE2-NE 3.32Å; E2254-R2278 PolarHBondContact OE2-NE 3.3Å; E2254-R2278 IonicContact OE2-NH2 2.75Å; E2254-R2278 PolarHBondContact OE2-NH2 2.92Å
2255	E	23	Very low	26.7	Very low	160 Å²	160	124.6 Å²	124.6	75%	0.748	62%	0.618	S	S	*	*			cis	-161.9	163.9	13	-104.9	163.3	169.9	0	0	108.2
2256	D	24.9	Very low	27	Very low	130 Å²	130	127 Å²	127	70%	0.695	64%	0.637	S	S	*	*			trans	40.7	114.6	161.2	-63.1	-13.1	0	0	0	119
2257	L	32.9	Very low	27.2	Very low	156 Å²	156	128.2 Å²	128.2	82%	0.817	65%	0.651	S	S	*	*			cis	-152.3	113.6	35.8	-166.9	78	0	0	0	110
2258	F	31.8	Very low	27.5	Very low	160 Å²	160	125.2 Å²	125.2	70%	0.702	65%	0.645	S	S	*	*				54.4	98	94.6	-108	-98.7	0	0	0	116.3
2259	T	31.5	Very low	27.7	Very low	116 Å²	116	126 Å²	126	71%	0.712	66%	0.663	S	S	*	*			trans	67.4	170.1	139.8	70.8	0	0	0	0	120.5
2260	T	29.2	Very low	28	Very low	112 Å²	112	127.1 Å²	127.1	69%	0.687	68%	0.679	S	S	*	*			trans	86.2	92.2	151.2	-52.2	0	0	0	0	118.1
2261	I	29.8	Very low	28.2	Very low	137 Å²	137	126.2 Å²	126.2	70%	0.703	69%	0.687	S	S	*	*			trans	84	100	134.9	-67.6	178.7	0	0	0	119
2262	R	27.3	Very low	28.2	Very low	218 Å²	218	125 Å²	125	82%	0.823	68%	0.683	S	S	*	*				88.7	132.1	112.7	-162	-150.9	-154.1	140	1.6	120.4
2263	S	25.8	Very low	28.3	Very low	86 Å²	86	123.2 Å²	123.2	60%	0.601	69%	0.692	S	S	*	*			trans	62.2	150.5	148.3	56.4	0	0	0	0	120.1
2264	E	26.2	Very low	28.3	Very low	167 Å²	167	121.7 Å²	121.7	78%	0.78	70%	0.7	S	S	*	*			cis	-170.2	142.4	-15.5	-113.4	164.9	-171.5	0	0	109.4
2265	T	27.4	Very low	28.5	Very low	133 Å²	133	121.7 Å²	121.7	82%	0.816	72%	0.715	S	S	*	*			trans	64.4	-179.9	160.4	75.8	0	0	0	0	116.5
2266	P	32.2	Very low	28.6	Very low	104 Å²	104	119.6 Å²	119.6	68%	0.675	71%	0.708	S	S	*	*				-136.1	173.8	-101.7	37.2	-15.6	0	0	0	118.1
2267	S	26.3	Very low	28.6	Very low	77 Å²	77	118.4 Å²	118.4	54%	0.538	70%	0.701	S	S	.	*			trans	78	161.1	162.1	92	0	0	0	0	116.7	Y1353	Y1353-S2267 WeakPolarHBondContact CE1-OG 3.48Å; Y1353-S2267 PolarHBondContact OH-OG 2.9Å
2268	P	30.1	Very low	28.1	Very low	86 Å²	86	118 Å²	118	56%	0.558	69%	0.689	S	S	*	*				-130.7	137.8	-98.8	29.4	-9.3	0	0	0	115.7
2269	A	29.3	Very low	27.9	Very low	88 Å²	88	116.4 Å²	116.4	73%	0.727	69%	0.694	S	S	*	*			trans	-162.9	152.2	163.3	0	0	0	0	0	110.4
2270	P	30.9	Very low	27.7	Very low	117 Å²	117	116.6 Å²	116.6	76%	0.76	69%	0.691	S	S	*	*			trans	-92.8	135.3	-170.7	34.8	-33.8	0	0	0	114.2
2271	S	28.2	Very low	27.9	Very low	109 Å²	109	119.6 Å²	119.6	76%	0.762	69%	0.691	S	S	*	*			trans	-162.1	126.6	173.3	-75.7	0	0	0	0	108.6
2272	I	29.1	Very low	27.7	Very low	123 Å²	123	121.4 Å²	121.4	63%	0.631	69%	0.69	S	S	*	*				84.9	112.5	64.1	-68.9	166.5	0	0	0	113.3
2273	A	29.7	Very low	27.9	Very low	96 Å²	96	113.5 Å²	113.5	79%	0.793	67%	0.667	S	S	*	*			trans	62	109.8	151.1	0	0	0	0	0	122.2
2274	A	26.3	Very low	27.9	Very low	94 Å²	94	113.3 Å²	113.3	78%	0.777	66%	0.659	S	S	*	*				-125.5	134.1	124.5	0	0	0	0	0	105.3
2275	A	25.9	Very low	28	Very low	87 Å²	87	110.8 Å²	110.8	72%	0.719	65%	0.651	S	S	*	*				72.4	131.7	63.6	0	0	0	0	0	111.4
2276	I	26.2	Very low	28.1	Very low	116 Å²	116	107.9 Å²	107.9	60%	0.595	63%	0.632	S	S	*	*			cis	-158.8	163.3	3.4	-132.8	167.7	0	0	0	112.1	E2254	E2254-I2276 WeakPolarHBondContact O-CG2 3.43Å
2277	L	24	Very low	27.8	Very low	104 Å²	104	104.9 Å²	104.9	55%	0.545	61%	0.609	S	S	.	*			trans	66.3	165.8	171.7	-96.7	179.1	0	0	0	120.3	E2253 E2254	E2253-L2277 WeakPolarHBondContact O-CB 3.04Å; E2253-L2277 VanDerWaalsContact O-CD1 3.29Å; E2253-L2277 WeakPolarHBondContact O-CD1 3.36Å; E2254-L2277 HydrophobicContact CB-CD1 3.95Å; E2254-L2277 WeakPolarHBondContact O-CD1 3.45Å
2278	R	23.6	Very low	27.8	Very low	149 Å²	149	103.1 Å²	103.1	56%	0.562	59%	0.594	S	S	*	*			trans	28.1	118.4	173.4	-54	174.6	-162.6	-142.6	6.8	116.7	E2254	E2254-R2278 VanDerWaalsContact CD-NH2 3.32Å; E2254-R2278 IonicContact OE1-NH2 2.81Å; E2254-R2278 PolarHBondContact OE1-NH2 3.44Å; E2254-R2278 IonicContact OE2-CZ 2.89Å; E2254-R2278 IonicContact OE2-NE 3.32Å; E2254-R2278 PolarHBondContact OE2-NE 3.3Å; E2254-R2278 IonicContact OE2-NH2 2.75Å; E2254-R2278 PolarHBondContact OE2-NH2 2.92Å
2279	P	27.6	Very low	27.6	Very low	125 Å²	125	105.1 Å²	105.1	81%	0.812	59%	0.594	S	S	*	*				-125.9	105.8	78.4	35.4	-29.3	0	0	0	113.8	Y2281	P2279-Y2281 VanDerWaalsContact C-N 3.32Å; P2279-Y2281 PolarHBondContact O-N 3.06Å
2280	N	26.7	Very low	27.5	Very low	120 Å²	120	105 Å²	105	64%	0.642	59%	0.587	S	S	*	*			trans	-78.5	86.6	148.7	-83.3	-25	0	0	0	107.9	Y2282	N2280-Y2282 HydrophobicContact CB-CD2 4.3Å; N2280-Y2282 HydrophobicContact CB-CE2 4.33Å
2281	Y	32.5	Very low	27.4	Very low	176 Å²	176	101.6 Å²	101.6	69%	0.69	56%	0.563	S	S	*	*			trans	-148.3	113	132.4	-105	-79.1	0	0	0	108.2	P2279	P2279-Y2281 VanDerWaalsContact C-N 3.32Å; P2279-Y2281 PolarHBondContact O-N 3.06Å
2282	Y	26.8	Very low	27.5	Very low	175 Å²	175	103.4 Å²	103.4	69%	0.686	56%	0.557	S	S	*	*			cis	67.6	151.9	48.9	-77.3	-113.3	0	0	0	113	N2280	N2280-Y2282 HydrophobicContact CB-CD2 4.3Å; N2280-Y2282 HydrophobicContact CB-CE2 4.33Å
2283	P	30.3	Very low	27.6	Very low	51 Å²	51	99.9 Å²	99.9	33%	0.331	54%	0.537	S	S	.	.			cis	-154.3	-160.8	-34.9	42.7	-24.1	0	0	0	115.2	Q131	Q131-P2283 PolarHBondContact NE2-O 2.74Å
2284	N	27.3	Very low	27.7	Very low	82 Å²	82	100.8 Å²	100.8	44%	0.439	52%	0.52	S	S	.	.			trans	66.9	101.5	141.9	-64.3	-15.2	0	0	0	118.8	T127	T127-N2284 PolarHBondContact OG1-O 3.24Å
2285	L	28.1	Very low	27.9	Very low	115 Å²	115	102.4 Å²	102.4	60%	0.602	52%	0.516	S	S	*	.				87.8	131.7	57.7	-89	65.6	0	0	0	111.7
2286	V	28.6	Very low	28	Very low	72 Å²	72	104 Å²	104	44%	0.436	52%	0.517	S	S	.	.				40.4	128.3	126.8	-164.9	0	0	0	0	116.7
2287	E	26	Very low	28.1	Very low	41 Å²	41	105.3 Å²	105.3	19%	0.192	52%	0.523	C	S	.	.				179.9	153.4	119.1	-109.2	85.7	-125.1	0	0	110.9	R2015 H2016	R2015-E2287 WeakPolarHBondContact CA-OE1 3.34Å; R2015-E2287 PolarHBondContact N-OE1 3.44Å; H2016-E2287 WeakPolarHBondContact CA-OE2 3.49Å; H2016-E2287 HydrophobicContact CB-CG 4.07Å; H2016-E2287 WeakPolarHBondContact CE1-CB 3.41Å; H2016-E2287 IonicContact CE1-OE2 3.41Å; H2016-E2287 IonicContact CG-OE2 3.48Å; H2016-E2287 PolarHBondContact N-OE1 3.17Å; H2016-E2287 VanDerWaalsContact N-OE1 3.12Å; H2016-E2287 PolarHBondContact N-OE2 2.8Å; H2016-E2287 WeakPolarHBondContact ND1-CB 3.17Å; H2016-E2287 VanDerWaalsContact ND1-CD 3.33Å; H2016-E2287 WeakPolarHBondContact ND1-CG 3.46Å; H2016-E2287 IonicContact ND1-OE2 2.87Å; H2016-E2287 PolarHBondContact ND1-OE2 3.23Å
2288	N	26	Very low	28.4	Very low	40 Å²	40	106.9 Å²	106.9	21%	0.214	53%	0.533	C	S	.	.			cis	-158.4	141.7	16.5	-131.9	-28	0	0	0	111.6	R2015 H2016	R2015-N2288 WeakPolarHBondContact CA-OD1 3.07Å; H2016-N2288 PolarHBondContact CD2-ND2 3.29Å; H2016-N2288 PolarHBondContact N-OD1 3.22Å; H2016-N2288 PolarHBondContact NE2-ND2 2.97Å
2289	K	26.7	Very low	28.8	Very low	127 Å²	127	104.1 Å²	104.1	55%	0.552	53%	0.534	S	S	*	.			trans	64	151.5	142.2	-73.7	159.4	-168.4	154.5	0	119.1	R2014	R2014-K2289 PolarHBondContact O-N 3.25Å
2290	S	27.6	Very low	28.7	Very low	85 Å²	85	100.7 Å²	100.7	59%	0.594	51%	0.508	S	S	*	.			cis	-167.2	115.6	-10.2	164.3	0	0	0	0	115.7
2291	I	29.2	Very low	28.6	Very low	47 Å²	47	96 Å²	96	24%	0.241	48%	0.484	C	S	.	.				54.4	117.9	127	-47.5	165.3	0	0	0	120
2292	K	28.9	Very low	28.2	Very low	146 Å²	146	93.8 Å²	93.8	64%	0.635	48%	0.477	S	S	*	.				176.9	143.8	124.6	-92.8	157.9	-174	179.4	0	107.6
2293	H	30.8	Very low	28.2	Very low	49 Å²	49	85.4 Å²	85.4	23%	0.227	45%	0.445	C	S	.	.			cis	-176.4	160.6	-11.4	-109	9.7	0	0	0	107.5	R2076 I2077	R2076-H2293 CarbonylContact C-O 3.14Å; I2077-H2293 HydrophobicContact CB-CB 4.44Å
2294	R	32	Very low	28	Very low	116 Å²	116	83 Å²	83	44%	0.438	43%	0.429	S	S	.	.			cis	-167.4	122	-14.6	-131.2	176.9	160.2	140.8	-15.2	105.8	D2233	D2233-R2294 IonicContact OD1-CZ 2.66Å; D2233-R2294 VanDerWaalsContact OD1-CZ 3.31Å; D2233-R2294 IonicContact OD1-NH1 2.88Å; D2233-R2294 PolarHBondContact OD1-NH1 3.41Å; D2233-R2294 IonicContact OD1-NH2 2.78Å; D2233-R2294 PolarHBondContact OD1-NH2 2.86Å
2295	N	31.3	Very low	27.9	Very low	127 Å²	127	79.9 Å²	79.9	68%	0.679	41%	0.411	S	S	*	.				162.4	149.6	98.5	-90.2	-22.7	0	0	0	113.3
2296	T	28.5	Very low	27.8	Very low	120 Å²	120	74.4 Å²	74.4	74%	0.736	38%	0.382	S	S	*	.			trans	42.7	144.1	145.9	60.4	0	0	0	0	123.1
2297	I	28.1	Very low	27.8	Very low	144 Å²	144	71.4 Å²	71.4	74%	0.738	37%	0.365	S	S	*	.			cis	-155.2	115.7	-8.8	-105.1	158	0	0	0	104.9
2298	N	30.6	Very low	28.1	Very low	138 Å²	138	70.2 Å²	70.2	74%	0.738	36%	0.359	S	S	*	.				76.6	141.9	95.9	-111.4	10	0	0	0	115.7
2299	P	31.8	Very low	28.7	Very low	90 Å²	90	71.2 Å²	71.2	58%	0.584	37%	0.368	S	S	*	.				-133.5	151.9	-109.5	37.2	-20.4	0	0	0	115.6	K1878	K1878-P2299 WeakPolarHBondContact CE-O 3.35Å
2300	L	25.1	Very low	28.9	Very low	53 Å²	53	71 Å²	71	28%	0.277	36%	0.364	S	S	.	.			trans	-123.5	-171.9	-170.5	-64	96.6	0	0	0	113.4	K1878 T1879 E1880	K1878-L2300 HydrophobicContact CB-CB 3.73Å; K1878-L2300 HydrophobicContact CB-CD2 4Å; K1878-L2300 HydrophobicContact CB-CG 3.93Å; K1878-L2300 VanDerWaalsContact CE-C 3.47Å; K1878-L2300 VanDerWaalsContact CE-O 3.32Å; K1878-L2300 WeakPolarHBondContact CE-O 3.02Å; K1878-L2300 HydrophobicContact CG-CB 4.42Å; K1878-L2300 VanDerWaalsContact NZ-C 3.32Å; K1878-L2300 PolarHBondContact NZ-O 2.97Å; T1879-L2300 WeakPolarHBondContact OG1-CD2 3.34Å; E1880-L2300 HydrophobicContact CB-CB 4.37Å; E1880-L2300 HydrophobicContact CB-CD2 3.93Å; E1880-L2300 HydrophobicContact CG-CD2 3.7Å; E1880-L2300 WeakPolarHBondContact OE1-CD1 2.98Å
2301	D	25.3	Very low	29	Very low	23 Å²	23	69.7 Å²	69.7	12%	0.123	35%	0.35	C	S	.	.			trans	-118.6	144.2	-166.6	-98.1	-10	0	0	0	107.4	I1877 K1878 E1881	I1877-D2301 WeakPolarHBondContact CA-OD2 3.38Å; K1878-D2301 HydrophobicContact CB-CB 3.89Å; K1878-D2301 HydrophobicContact CD-CB 3.57Å; K1878-D2301 WeakPolarHBondContact CD-OD1 3.29Å; K1878-D2301 WeakPolarHBondContact CD-OD2 3.28Å; K1878-D2301 WeakPolarHBondContact CE-OD1 3.49Å; K1878-D2301 HydrophobicContact CG-CB 4.32Å; K1878-D2301 PolarHBondContact N-OD2 3.24Å; K1878-D2301 IonicContact NZ-OD1 2.74Å; K1878-D2301 PolarHBondContact NZ-OD1 3.22Å; E1881-D2301 WeakPolarHBondContact CB-O 3.45Å; E1881-D2301 WeakPolarHBondContact CG-O 3.42Å; E1881-D2301 VanDerWaalsContact OE1-C 3.28Å
2302	F	24.3	Very low	29	Very low	128 Å²	128	72.3 Å²	72.3	56%	0.561	36%	0.364	S	S	*	.				60	137.6	67.7	-141.7	-130.2	0	0	0	110.3	E1881	E1881-F2302 PolarHBondContact OE1-N 2.85Å; E1881-F2302 VanDerWaalsContact OE1-N 3.15Å; E1881-F2302 PolarHBondContact OE2-N 3.37Å
2303	T	26	Very low	29.1	Very low	0 Å²	0	71.8 Å²	71.8	0%	0	37%	0.367	C	S	.	.			trans	82.2	90.3	152.6	90.8	0	0	0	0	120.9	E1311 L1312 L1882	E1311-T2303 WeakPolarHBondContact O-CA 3.4Å; E1311-T2303 VanDerWaalsContact O-CG2 3.29Å; E1311-T2303 WeakPolarHBondContact O-CG2 3.46Å; E1311-T2303 PolarHBondContact O-N 2.88Å; L1312-T2303 HydrophobicContact CB-CG2 4.23Å; L1312-T2303 HydrophobicContact CD1-CG2 4.01Å; L1312-T2303 VanDerWaalsContact CD1-OG1 3.28Å; L1312-T2303 WeakPolarHBondContact CD1-OG1 3.46Å; L1882-T2303 VanDerWaalsContact CD1-O 3.27Å; L1882-T2303 WeakPolarHBondContact CD1-O 3.24Å
2304	V	26.3	Very low	29	Very low	0 Å²	0	76.1 Å²	76.1	0%	0	39%	0.39	C	S	.	.				41.5	125.3	128	173.2	0	0	0	0	122.4	C1310 E1311 L1312 R1317	C1310-V2304 HydrophobicContact CB-CG2 3.84Å; E1311-V2304 HydrophobicContact CB-CG2 4.19Å; E1311-V2304 PolarHBondContact OE2-N 2.94Å; L1312-V2304 HydrophobicContact CB-CB 3.14Å; L1312-V2304 HydrophobicContact CB-CG1 3.61Å; L1312-V2304 HydrophobicContact CB-CG2 3.2Å; L1312-V2304 HydrophobicContact CD1-CB 4.45Å; L1312-V2304 HydrophobicContact CD2-CB 3.49Å; L1312-V2304 VanDerWaalsContact CD2-CB 3.49Å; L1312-V2304 HydrophobicContact CD2-CG1 3.21Å; L1312-V2304 HydrophobicContact CD2-CG2 4.46Å; L1312-V2304 HydrophobicContact CG-CB 3.82Å; L1312-V2304 HydrophobicContact CG-CG1 4Å; L1312-V2304 HydrophobicContact CG-CG2 4.39Å; R1317-V2304 HydrophobicContact CG-CG1 4.42Å
2305	Y	25	Very low	28.9	Very low	16 Å²	16	78 Å²	78	6%	0.063	41%	0.409	C	S	.	.				35.6	121.1	121.5	-45	-104.2	0	0	0	117.9	C1310 V1885 K1888 I1889 W1890	C1310-Y2305 HydrophobicContact CB-CE2 4.02Å; C1310-Y2305 VanDerWaalsContact SG-CE2 3.56Å; V1885-Y2305 HydrophobicContact CB-CD2 4.23Å; V1885-Y2305 HydrophobicContact CB-CG 4.46Å; V1885-Y2305 HydrophobicContact CG1-CD2 3.41Å; V1885-Y2305 VanDerWaalsContact CG1-CD2 3.41Å; V1885-Y2305 HydrophobicContact CG1-CE2 3.6Å; V1885-Y2305 HydrophobicContact CG1-CG 4Å; V1885-Y2305 VanDerWaalsContact O-CA 3.26Å; V1885-Y2305 WeakPolarHBondContact O-CA 3.43Å; V1885-Y2305 WeakPolarHBondContact O-CD1 3.43Å; V1885-Y2305 PolarHBondContact O-N 3.5Å; K1888-Y2305 VanDerWaalsContact CA-CE1 3.48Å; K1888-Y2305 HydrophobicContact CB-CD1 3.45Å; K1888-Y2305 VanDerWaalsContact CB-CD1 3.45Å; K1888-Y2305 HydrophobicContact CB-CE1 3.1Å; K1888-Y2305 HydrophobicContact CB-CG 4.48Å; K1888-Y2305 HydrophobicContact CD-CD1 4.44Å; K1888-Y2305 HydrophobicContact CD-CE1 3.59Å; K1888-Y2305 HydrophobicContact CD-CE2 3.96Å; K1888-Y2305 VanDerWaalsContact CD-OH 3.3Å; K1888-Y2305 WeakPolarHBondContact CD-OH 3.18Å; K1888-Y2305 WeakPolarHBondContact CE-OH 3.23Å; K1888-Y2305 HydrophobicContact CG-CD1 4.12Å; K1888-Y2305 HydrophobicContact CG-CE1 3.24Å; K1888-Y2305 PolarHBondContact NZ-OH 2.95Å; I1889-Y2305 HydrophobicContact CB-CD1 3.37Å; I1889-Y2305 HydrophobicContact CB-CE1 3.5Å; I1889-Y2305 HydrophobicContact CB-CG 4.16Å; I1889-Y2305 HydrophobicContact CD1-CD1 3.59Å; I1889-Y2305 HydrophobicContact CD1-CD2 3.9Å; I1889-Y2305 HydrophobicContact CD1-CE1 3.41Å; I1889-Y2305 VanDerWaalsContact CD1-CE1 3.41Å; I1889-Y2305 HydrophobicContact CD1-CE2 3.85Å; I1889-Y2305 HydrophobicContact CD1-CG 3.76Å; I1889-Y2305 HydrophobicContact CG1-CD1 3.51Å; I1889-Y2305 HydrophobicContact CG1-CE1 3.14Å; I1889-Y2305 HydrophobicContact CG1-CE2 4.46Å; I1889-Y2305 HydrophobicContact CG1-CG 4.21Å; W1890-Y2305 WeakPolarHBondContact CH2-O 3.43Å; W1890-Y2305 VanDerWaalsContact CZ3-C 3.42Å; W1890-Y2305 WeakPolarHBondContact CZ3-O 3.31Å
2306	T	26.3	Very low	28.8	Very low	0 Å²	0	81.7 Å²	81.7	0%	0	42%	0.419	C	S	.	.			cis	-149.6	-127	-6.6	60.9	0	0	0	0	111.9	L1324 I1886 W1890	L1324-T2306 WeakPolarHBondContact CD1-O 3.33Å; I1886-T2306 VanDerWaalsContact CD1-O 3.22Å; I1886-T2306 WeakPolarHBondContact CD1-O 3.36Å; I1886-T2306 VanDerWaalsContact CG1-CA 3.49Å; I1886-T2306 VanDerWaalsContact CG1-O 3.27Å; I1886-T2306 WeakPolarHBondContact CG1-O 3.44Å; I1886-T2306 WeakPolarHBondContact O-CA 3.22Å; I1886-T2306 WeakPolarHBondContact O-CB 3.45Å; I1886-T2306 WeakPolarHBondContact O-CG2 3.43Å; W1890-T2306 HydrophobicContact CB-CG2 3.61Å; W1890-T2306 WeakPolarHBondContact CB-OG1 3.27Å; W1890-T2306 HydrophobicContact CD2-CG2 3.81Å; W1890-T2306 HydrophobicContact CE3-CG2 3.47Å; W1890-T2306 VanDerWaalsContact CE3-CG2 3.47Å; W1890-T2306 VanDerWaalsContact CE3-OG1 3.25Å; W1890-T2306 HydrophobicContact CG-CG2 4Å; W1890-T2306 HydrophobicContact CZ3-CG2 4.11Å
2307	S	28.4	Very low	29	Very low	9 Å²	9	83 Å²	83	6%	0.063	42%	0.421	C	S	.	.				-158.3	116.6	-61.9	43.8	0	0	0	0	109.2	L1324 W1890 T1893	L1324-S2307 VanDerWaalsContact CB-O 3.31Å; L1324-S2307 WeakPolarHBondContact CB-O 3.38Å; L1324-S2307 VanDerWaalsContact CD2-C 3.43Å; L1324-S2307 WeakPolarHBondContact CD2-O 3.34Å; W1890-S2307 WeakPolarHBondContact CB-OG 3.2Å; T1893-S2307 VanDerWaalsContact CG2-CB 3.49Å; T1893-S2307 WeakPolarHBondContact OG1-CB 3.48Å
2308	I	32.9	Very low	29.2	Very low	16 Å²	16	85 Å²	85	8%	0.082	43%	0.429	C	S	.	.				48.4	136.4	122.8	-81.4	156.9	0	0	0	121.1	T1893 S1894 N1895 L1897 L1898	T1893-I2308 HydrophobicContact CG2-CB 4.09Å; T1893-I2308 HydrophobicContact CG2-CD1 3.24Å; T1893-I2308 HydrophobicContact CG2-CG1 4.18Å; T1893-I2308 HydrophobicContact CG2-CG2 4.43Å; S1894-I2308 WeakPolarHBondContact OG-CG2 3.29Å; N1895-I2308 VanDerWaalsContact N-CD1 3.28Å; L1897-I2308 HydrophobicContact CB-CG1 4.36Å; L1898-I2308 HydrophobicContact CB-CD1 3.38Å; L1898-I2308 HydrophobicContact CB-CG1 3.68Å; L1898-I2308 HydrophobicContact CD2-CD1 4.38Å
2309	P	37.1	Very low	29.3	Very low	62 Å²	62	85.4 Å²	85.4	40%	0.403	43%	0.431	S	S	.	.				-145.9	150.8	56	38.9	-18.5	0	0	0	120.1	L1897	L1897-P2309 VanDerWaalsContact CB-CA 3.48Å; L1897-P2309 WeakPolarHBondContact CB-O 3.28Å; L1897-P2309 WeakPolarHBondContact CD2-O 3.26Å
2310	R	31.7	Very low	29.3	Very low	123 Å²	123	88.9 Å²	88.9	46%	0.464	44%	0.437	S	S	.	.			trans	1.9	139.5	168.4	-42.4	-175.2	151.3	168.9	-9.1	121	S1894 K1896	S1894-R2310 WeakPolarHBondContact O-CG 3.43Å; S1894-R2310 PolarHBondContact O-NE 2.64Å; K1896-R2310 HydrophobicContact CB-CB 4.16Å; K1896-R2310 HydrophobicContact CB-CG 3.68Å; K1896-R2310 HydrophobicContact CD-CB 3.97Å; K1896-R2310 HydrophobicContact CD-CG 4.11Å; K1896-R2310 HydrophobicContact CG-CB 3.8Å; K1896-R2310 HydrophobicContact CG-CG 3.91Å; K1896-R2310 WeakPolarHBondContact O-CA 3.03Å
2311	N	29.5	Very low	29.6	Very low	57 Å²	57	97.2 Å²	97.2	31%	0.305	47%	0.467	S	S	.	.				178.2	119.5	97.9	-96.4	-21.1	0	0	0	117.1	K1896	K1896-N2311 PolarHBondContact NZ-OD1 3.03Å
2312	L	29.7	Very low	29.9	Very low	102 Å²	102	99.3 Å²	99.3	53%	0.534	49%	0.494	S	S	.	.				-172.2	160.9	123.8	-119.9	66.6	0	0	0	108.2	M1862 K1896	M1862-L2312 HydrophobicContact CE-CD1 4.23Å; K1896-L2312 VanDerWaalsContact CE-N 3.33Å; K1896-L2312 WeakPolarHBondContact CE-O 3.38Å
2313	I	30.3	Very low	30.2	Very low	134 Å²	134	100.4 Å²	100.4	69%	0.687	51%	0.506	S	S	*	.			cis	-136.4	-129.9	-10	-163.9	165.3	0	0	0	109.8
2314	I	29.4	Very low	30.3	Very low	140 Å²	140	103.2 Å²	103.2	72%	0.718	52%	0.523	S	S	*	.			trans	-139.2	142	-175.4	-67.7	163.9	0	0	0	108.5
2315	N	28.8	Very low	30.4	Very low	157 Å²	157	105.8 Å²	105.8	84%	0.84	54%	0.541	S	S	*	.			trans	177.1	-21.4	146.8	-103.2	-22.9	0	0	0	116.7
2316	K	30	Very low	30.7	Very low	204 Å²	204	105.7 Å²	105.7	89%	0.887	55%	0.545	S	S	*	.	S	Bend	trans	-130	57.4	-161.2	-150.8	174.9	-172.6	178.9	0	116.5
2317	L	33.1	Very low	30.7	Very low	148 Å²	148	114.7 Å²	114.7	78%	0.775	58%	0.58	S	S	*	*			trans	-166.8	30.4	143.9	-108.7	165.7	0	0	0	114.4	N2319 K2320	L2317-N2319 PolarHBondContact O-N 3.13Å; L2317-K2320 HydrophobicContact CD2-CB 4.31Å
2318	M	30.7	Very low	30.6	Very low	185 Å²	185	118.1 Å²	118.1	91%	0.911	60%	0.604	S	S	*	*	S	Bend	trans	-72.4	34.8	171.5	-117.7	-85.1	-80	0	0	111.9
2319	N	34.1	Very low	30.4	Very low	146 Å²	146	125.4 Å²	125.4	78%	0.781	64%	0.643	S	S	*	*	S	Bend	trans	-166.1	52.5	-161.1	-149.5	3.9	0	0	0	115.9	L2317	L2317-N2319 PolarHBondContact O-N 3.13Å
2320	K	30.9	Very low	30.1	Very low	163 Å²	163	125.7 Å²	125.7	71%	0.709	66%	0.658	S	S	*	*	S	Bend	trans	-154.3	-15.1	162.8	-129.1	-165.6	175.4	-173.5	0	121.8	L2317	L2317-K2320 HydrophobicContact CD2-CB 4.31Å
2321	Y	31.2	Very low	30	Very low	228 Å²	228	126 Å²	126	89%	0.894	67%	0.673	S	S	*	*			trans	-136.7	112.8	171.3	-74.8	-74.4	0	0	0	111.3
2322	G	32.3	Very low	30	Very low	68 Å²	68	129.3 Å²	129.3	70%	0.701	70%	0.695	S	S	*	*			trans	-130.4	168.1	167.2	0	0	0	0	0	109.2
2323	N	29.6	Very low	30.2	Very low	151 Å²	151	131.2 Å²	131.2	81%	0.807	71%	0.706	S	S	*	*			trans	66.4	122.3	-178.6	-67.4	-5.2	0	0	0	113.2
2324	T	29	Very low	30.1	Very low	58 Å²	58	133 Å²	133	36%	0.356	71%	0.708	S	S	.	*			cis	-151	159.6	34.8	39.1	0	0	0	0	118.2	F2134	F2134-T2324 VanDerWaalsContact CA-OG1 3.26Å; F2134-T2324 WeakPolarHBondContact CA-OG1 3.41Å; F2134-T2324 HydrophobicContact CB-CG2 4.17Å; F2134-T2324 HydrophobicContact CD1-CG2 4.18Å; F2134-T2324 HydrophobicContact CD2-CG2 3.42Å; F2134-T2324 VanDerWaalsContact CD2-CG2 3.42Å; F2134-T2324 HydrophobicContact CE1-CG2 4.43Å; F2134-T2324 HydrophobicContact CE2-CG2 3.68Å; F2134-T2324 HydrophobicContact CG-CG2 3.64Å; F2134-T2324 HydrophobicContact CZ-CG2 4.18Å; F2134-T2324 PolarHBondContact N-OG1 3.09Å; F2134-T2324 VanDerWaalsContact N-OG1 3.15Å
2325	S	28.6	Very low	29.9	Very low	55 Å²	55	131.6 Å²	131.6	39%	0.385	70%	0.703	S	S	.	*			trans	-22.2	167.7	146.3	34.9	0	0	0	0	117.2	F2134 T2135 V2136	F2134-S2325 WeakPolarHBondContact CD1-OG 3.43Å; F2134-S2325 WeakPolarHBondContact CE1-OG 3.49Å; T2135-S2325 CarbonylContact C-O 2.77Å; T2135-S2325 WeakPolarHBondContact CA-O 3.33Å; T2135-S2325 WeakPolarHBondContact CG2-O 3.38Å; V2136-S2325 PolarHBondContact N-O 2.88Å
2326	G	30.4	Very low	30.3	Very low	13 Å²	13	131.3 Å²	131.3	13%	0.134	70%	0.7	C	S	.	*			cis	175.4	-176.7	0.7	0	0	0	0	0	111.8	V2136 N2137	V2136-G2326 WeakPolarHBondContact CA-O 3.39Å; V2136-G2326 WeakPolarHBondContact CG2-O 3.45Å; N2137-G2326 PolarHBondContact ND2-O 2.7Å; N2137-G2326 WeakPolarHBondContact OD1-CA 3.02Å; N2137-G2326 PolarHBondContact OD1-N 2.89Å; N2137-G2326 PolarHBondContact OD1-O 3.32Å
2327	Y	26.4	Very low	30.3	Very low	190 Å²	190	129.1 Å²	129.1	75%	0.745	69%	0.693	S	S	*	*			trans	65.2	140	177.1	-63.8	-88.7	0	0	0	119.5	N2137	N2137-Y2327 WeakPolarHBondContact CB-O 3.36Å; N2137-Y2327 PolarHBondContact ND2-N 2.78Å; N2137-Y2327 PolarHBondContact ND2-O 2.72Å
2328	S	27.5	Very low	30.1	Very low	81 Å²	81	129.3 Å²	129.3	57%	0.566	69%	0.69	S	S	*	*			cis	-171.7	145.2	-27.8	45.9	0	0	0	0	111.1
2329	N	28.1	Very low	30.4	Very low	168 Å²	168	127.5 Å²	127.5	90%	0.898	68%	0.684	S	S	*	*			trans	60.7	131	152.1	-54.5	-11	0	0	0	119.6
2330	G	30.4	Very low	30.1	Very low	69 Å²	69	127 Å²	127	71%	0.711	68%	0.68	S	S	*	*			trans	-175.2	33.3	-179.7	0	0	0	0	0	117.8
2331	T	29.9	Very low	29.9	Very low	130 Å²	130	126.1 Å²	126.1	80%	0.798	68%	0.683	S	S	*	*			trans	42.8	120.6	157.1	48.4	0	0	0	0	122.7
2332	V	30.5	Very low	30.3	Very low	125 Å²	125	122.9 Å²	122.9	76%	0.758	68%	0.681	S	S	*	*				80.1	102.8	127.9	177.5	0	0	0	0	119.8
2333	N	32.5	Very low	30.4	Very low	143 Å²	143	124.2 Å²	124.2	77%	0.765	68%	0.676	S	S	*	*				9.9	139.8	126.5	-46.7	-15.8	0	0	0	117.3
2334	K	28.2	Very low	30.2	Very low	170 Å²	170	125.8 Å²	125.8	74%	0.739	68%	0.676	S	S	*	*				-159.3	154.4	68	-102.5	174.7	151.3	-84.9	0	113.3
2335	D	26.7	Very low	30	Very low	112 Å²	112	128.5 Å²	128.5	60%	0.599	69%	0.693	S	S	*	*			trans	42.4	113.2	142.8	-43	-21.4	0	0	0	117.1
2336	L	36.8	Very low	30	Very low	150 Å²	150	132.6 Å²	132.6	79%	0.785	71%	0.708	S	S	*	*				66.2	135.3	61.6	-161.6	76.9	0	0	0	111.1
2337	E	29	Very low	29.6	Very low	158 Å²	158	134.7 Å²	134.7	74%	0.738	71%	0.712	S	S	*	*			trans	74.3	138.9	-154.2	-57.2	178.6	158.5	0	0	111.8
2338	E	30.2	Very low	29.6	Very low	152 Å²	152	130 Å²	130	71%	0.71	70%	0.703	S	S	*	*			cis	-141.7	120.5	-16	-114	173.3	146.6	0	0	107.7
2339	L	35.8	Very low	29.6	Very low	148 Å²	148	128.6 Å²	128.6	78%	0.775	70%	0.696	S	S	*	*			cis	74.7	12.5	47.4	-58.1	176.5	0	0	0	115.9
2340	L	28	Very low	29.4	Very low	136 Å²	136	123.4 Å²	123.4	71%	0.712	67%	0.672	S	S	*	*			trans	-143.7	174.3	164.6	-107.2	150.5	0	0	0	112.5
2341	N	27.1	Very low	29.9	Very low	143 Å²	143	123.8 Å²	123.8	77%	0.765	66%	0.657	S	S	*	*			trans	71.5	72.5	165.2	-55.4	-22.3	0	0	0	119.3
2342	L	39.9	Very low	30	Very low	161 Å²	161	120.6 Å²	120.6	84%	0.843	64%	0.639	S	S	*	*				-24.9	154.9	115.9	-80.2	145.7	0	0	0	113.6
2343	P	33.2	Very low	29.7	Very low	95 Å²	95	119.2 Å²	119.2	62%	0.617	63%	0.628	S	S	*	*				-159.8	-169.8	52.4	46.1	-25	0	0	0	118.1
2344	K	26.6	Very low	29.4	Very low	184 Å²	184	116.8 Å²	116.8	80%	0.8	62%	0.617	S	S	*	*			trans	67.6	148.4	156.5	-68.7	168	-169.1	177.5	0	117.7
2345	T	25.2	Very low	29.5	Very low	116 Å²	116	115.7 Å²	115.7	71%	0.712	62%	0.615	S	S	*	*			cis	-162	154.4	-19.1	14.5	0	0	0	0	111
2346	M	27.1	Very low	29.8	Very low	140 Å²	140	114.8 Å²	114.8	69%	0.69	62%	0.615	S	S	*	*			trans	50.4	122.7	144.3	-80	163.4	59	0	0	123.9	P1478	P1478-M2346 HydrophobicContact CB-CE 4.08Å
2347	W	23.4	Very low	29.2	Very low	58 Å²	58	113.6 Å²	113.6	22%	0.22	61%	0.614	C	S	.	*			trans	62.1	154.4	158.8	-58.9	50	0	0	0	117.4	F1474 L1477 P1478 Y1479 V1480 A1481	F1474-W2347 PolarHBondContact O-NE1 3.1Å; L1477-W2347 HydrophobicContact CB-CH2 3.44Å; L1477-W2347 VanDerWaalsContact CB-CH2 3.44Å; L1477-W2347 HydrophobicContact CB-CZ2 3.43Å; L1477-W2347 VanDerWaalsContact CB-CZ2 3.43Å; L1477-W2347 HydrophobicContact CB-CZ3 4.33Å; L1477-W2347 WeakPolarHBondContact O-CH2 3.4Å; L1477-W2347 WeakPolarHBondContact O-CZ3 3.33Å; P1478-W2347 VanDerWaalsContact CA-CG 3.43Å; P1478-W2347 VanDerWaalsContact CA-NE1 3.33Å; P1478-W2347 HydrophobicContact CB-CB 3.49Å; P1478-W2347 VanDerWaalsContact CB-CB 3.49Å; P1478-W2347 HydrophobicContact CB-CD2 2.17Å; P1478-W2347 HydrophobicContact CB-CE3 3.2Å; P1478-W2347 HydrophobicContact CB-CG 2.33Å; P1478-W2347 HydrophobicContact CB-CH2 3.85Å; P1478-W2347 HydrophobicContact CB-CZ2 3.24Å; P1478-W2347 HydrophobicContact CB-CZ3 3.84Å; P1478-W2347 HydrophobicContact CG-CB 3.65Å; P1478-W2347 HydrophobicContact CG-CD2 2.18Å; P1478-W2347 HydrophobicContact CG-CE3 3.65Å; P1478-W2347 HydrophobicContact CG-CG 2.32Å; P1478-W2347 HydrophobicContact CG-CZ2 3.66Å; P1478-W2347 WeakPolarHBondContact O-CH2 3.29Å; P1478-W2347 WeakPolarHBondContact O-CZ3 3.31Å; Y1479-W2347 HydrophobicContact CD2-CD2 4.35Å; Y1479-W2347 AromaticContact CD2-CE3 3.43Å; Y1479-W2347 HydrophobicContact CD2-CE3 3.43Å; Y1479-W2347 VanDerWaalsContact CD2-CE3 3.43Å; Y1479-W2347 HydrophobicContact CE2-CB 3.64Å; Y1479-W2347 HydrophobicContact CE2-CD2 4.23Å; Y1479-W2347 AromaticContact CE2-CE3 3.87Å; Y1479-W2347 HydrophobicContact CE2-CE3 3.87Å; Y1479-W2347 HydrophobicContact CE2-CG 4.37Å; Y1479-W2347 AromaticContact CG-CE3 3.82Å; Y1479-W2347 HydrophobicContact CG-CE3 3.82Å; Y1479-W2347 WeakPolarHBondContact OH-CB 3.26Å; Y1479-W2347 PolarHBondContact OH-O 2.86Å; V1480-W2347 HydrophobicContact CB-CH2 4.23Å; V1480-W2347 HydrophobicContact CB-CZ3 4.05Å; V1480-W2347 HydrophobicContact CG2-CZ3 4.06Å; A1481-W2347 HydrophobicContact CB-CH2 4.06Å; A1481-W2347 HydrophobicContact CB-CZ2 4.34Å
2348	T	26.1	Very low	29	Very low	92 Å²	92	113.3 Å²	113.3	56%	0.564	62%	0.617	S	S	*	*			trans	171.9	112.5	135.7	-52.1	0	0	0	0	112.7	K1143 Y1479	K1143-T2348 HydrophobicContact CB-CG2 3.74Å; K1143-T2348 HydrophobicContact CG-CG2 4.42Å; Y1479-T2348 HydrophobicContact CE2-CG2 4.49Å; Y1479-T2348 WeakPolarHBondContact OH-CA 3.33Å; Y1479-T2348 VanDerWaalsContact OH-CB 3.3Å; Y1479-T2348 WeakPolarHBondContact OH-CB 3.41Å; Y1479-T2348 PolarHBondContact OH-N 3.18Å; Y1479-T2348 PolarHBondContact OH-OG1 2.85Å
2349	A	26.1	Very low	28.8	Very low	51 Å²	51	109.2 Å²	109.2	42%	0.421	62%	0.616	S	S	.	*			trans	-91.6	-179	179.2	0	0	0	0	0	115	K1143 G1144	K1143-A2349 CarbonylContact C-O 3.56Å; K1143-A2349 VanDerWaalsContact C-O 3.28Å; K1143-A2349 WeakPolarHBondContact CB-O 3.43Å; G1144-A2349 WeakPolarHBondContact CA-O 3.31Å; G1144-A2349 PolarHBondContact N-O 3.22Å
2350	C	25.2	Very low	28.3	Very low	59 Å²	59	109.3 Å²	109.3	40%	0.399	62%	0.617	S	S	.	*			trans	22.3	137.9	157	-62.2	0	0	0	0	123.6	K1143 H1147	K1143-C2350 CarbonylContact C-O 3.59Å; K1143-C2350 VanDerWaalsContact CB-O 3.28Å; K1143-C2350 WeakPolarHBondContact CB-O 3.18Å; H1147-C2350 HydrophobicContact CB-CB 3.64Å; H1147-C2350 WeakPolarHBondContact CD2-CB 3.47Å; H1147-C2350 PolarHBondContact CD2-SG 3.49Å
2351	L	41	Very low	28.2	Very low	76 Å²	76	106.2 Å²	106.2	40%	0.398	61%	0.607	S	S	.	*			trans	66.4	177.1	162.4	-91.5	82.1	0	0	0	115.7	K1143	K1143-L2351 WeakPolarHBondContact CB-O 3.45Å; K1143-L2351 WeakPolarHBondContact CD-O 3.3Å; K1143-L2351 VanDerWaalsContact CG-O 3.3Å; K1143-L2351 WeakPolarHBondContact CG-O 3.43Å; K1143-L2351 PolarHBondContact NZ-O 3.33Å
2352	P	31.3	Very low	28.2	Very low	64 Å²	64	103.6 Å²	103.6	42%	0.416	59%	0.59	S	S	.	*			cis	-127.7	-168.8	9.6	45.7	-28.5	0	0	0	116.2	K1146	K1146-P2352 HydrophobicContact CD-CB 3.94Å
2353	D	24.7	Very low	27.7	Very low	96 Å²	96	100.3 Å²	100.3	51%	0.513	58%	0.58	S	S	.	*			trans	-87.6	-163	-156.7	-39.6	-104	0	0	0	117.1	K1146	K1146-D2353 IonicContact NZ-OD2 2.64Å; K1146-D2353 PolarHBondContact NZ-OD2 2.95Å
2354	V	26.2	Very low	27.5	Very low	91 Å²	91	98.4 Å²	98.4	55%	0.552	57%	0.567	S	S	*	*			trans	97.1	103.1	163.5	-173	0	0	0	0	113.7
2355	Q	30.3	Very low	27.6	Very low	147 Å²	147	100.6 Å²	100.6	69%	0.687	57%	0.57	S	S	*	*				70.9	163.3	57	-66.8	-133.7	-5.3	0	0	114.5
2356	P	31.7	Very low	27.7	Very low	93 Å²	93	98.4 Å²	98.4	60%	0.604	57%	0.571	S	S	*	*			cis	-132.8	-168	-4.4	23.4	2.8	0	0	0	114.4
2357	V	24.2	Very low	27.8	Very low	125 Å²	125	97.4 Å²	97.4	76%	0.758	57%	0.568	S	S	*	*			trans	60	152.6	156.2	-81.4	0	0	0	0	120
2358	N	25.4	Very low	28	Very low	152 Å²	152	99 Å²	99	81%	0.813	58%	0.577	S	S	*	*			cis	-111.1	167.1	6	-82.3	-47.2	0	0	0	113
2359	G	25.5	Very low	28	Very low	66 Å²	66	97.1 Å²	97.1	68%	0.68	56%	0.563	S	S	*	*			trans	-78.5	-149.4	179.3	0	0	0	0	0	114.3
2360	N	25.2	Very low	28	Very low	150 Å²	150	105.8 Å²	105.8	80%	0.802	59%	0.587	S	S	*	*			cis	-154.8	147.6	7.3	-106	-0.4	0	0	0	108.2
2361	S	26.7	Very low	28.1	Very low	71 Å²	71	111.5 Å²	111.5	50%	0.497	61%	0.605	S	S	.	*			trans	76.3	157.2	152	100	0	0	0	0	119.9
2362	H	28.1	Very low	27.4	Very low	89 Å²	89	111.4 Å²	111.4	41%	0.412	60%	0.599	S	S	.	*			cis	-174.5	132.3	-32.3	-106.2	-94.2	0	0	0	109.7	N2382 K2383	H2362-N2382 WeakPolarHBondContact CA-OD1 3.5Å; H2362-N2382 HydrophobicContact CB-CB 4.45Å; H2362-N2382 PolarHBondContact N-OD1 2.84Å; H2362-N2382 VanDerWaalsContact ND1-CA 3.26Å; H2362-N2382 WeakPolarHBondContact ND1-CA 3.4Å; H2362-N2382 PolarHBondContact ND1-O 2.94Å; H2362-K2383 VanDerWaalsContact C-CB 3.46Å; H2362-K2383 VanDerWaalsContact CA-N 3.31Å; H2362-K2383 HydrophobicContact CB-CB 3.44Å; H2362-K2383 VanDerWaalsContact CB-CB 3.44Å; H2362-K2383 HydrophobicContact CB-CD 3.83Å; H2362-K2383 HydrophobicContact CB-CG 3.4Å; H2362-K2383 VanDerWaalsContact CB-CG 3.4Å; H2362-K2383 VanDerWaalsContact CG-N 3.3Å; H2362-K2383 WeakPolarHBondContact ND1-CA 3.43Å; H2362-K2383 PolarHBondContact ND1-N 3.02Å; H2362-K2383 WeakPolarHBondContact O-CE 3.48Å
2363	S	29	Very low	27.2	Very low	91 Å²	91	111.7 Å²	111.7	64%	0.636	60%	0.595	S	S	*	*			trans	-157.4	168.2	155.7	-169.5	0	0	0	0	114.1	N2382 K2383	S2363-N2382 VanDerWaalsContact N-CB 3.29Å; S2363-N2382 CarbonylContact O-C 3.26Å; S2363-N2382 WeakPolarHBondContact O-CB 3.05Å; S2363-K2383 VanDerWaalsContact C-N 3.34Å; S2363-K2383 CarbonylContact C-O 3.17Å; S2363-K2383 VanDerWaalsContact CA-N 3.26Å; S2363-K2383 WeakPolarHBondContact CA-O 3.44Å; S2363-K2383 PolarHBondContact O-N 3.33Å; S2363-K2383 VanDerWaalsContact O-N 3.15Å
2364	T	28.7	Very low	27.4	Very low	55 Å²	55	111.2 Å²	111.2	34%	0.337	59%	0.592	S	S	.	*			trans	-145.2	176.5	-170.2	48.4	0	0	0	0	117.7	N2382 K2383 I2384	T2364-N2382 VanDerWaalsContact CG2-O 3.29Å; T2364-N2382 WeakPolarHBondContact CG2-O 3.49Å; T2364-K2383 WeakPolarHBondContact CB-O 3.36Å; T2364-K2383 WeakPolarHBondContact CG2-O 3.43Å; T2364-K2383 PolarHBondContact N-O 2.66Å; T2364-K2383 PolarHBondContact OG1-O 3.26Å; T2364-I2384 WeakPolarHBondContact OG1-CD1 3.4Å; T2364-I2384 WeakPolarHBondContact OG1-CG1 3.41Å
2365	R	29.3	Very low	27.2	Very low	230 Å²	230	110 Å²	110	87%	0.868	59%	0.586	S	S	*	*			trans	109.5	137.6	155	-72.8	-176.2	163.8	-174.4	-4.7	118.2
2366	G	27.3	Very low	27	Very low	71 Å²	71	108 Å²	108	73%	0.732	58%	0.576	S	S	*	*			trans	125.1	107.1	140.7	0	0	0	0	0	120.7
2367	L	28.8	Very low	27.1	Very low	119 Å²	119	109.2 Å²	109.2	62%	0.623	58%	0.577	S	S	*	*			trans	58.5	119.4	143.6	-82.8	75.8	0	0	0	124	E863	E863-L2367 WeakPolarHBondContact OE1-CA 3.09Å
2368	K	27.5	Very low	27.7	Very low	91 Å²	91	107 Å²	107	40%	0.396	57%	0.565	S	S	.	*				55.5	90.4	118.6	-104.7	166.7	-160.8	115.6	0	121.7	E863 N864	E863-K2368 PolarHBondContact OE1-N 3.41Å; E863-K2368 WeakPolarHBondContact OE2-CD 3.48Å; E863-K2368 WeakPolarHBondContact OE2-CE 3.08Å; E863-K2368 WeakPolarHBondContact OE2-CG 3.37Å; E863-K2368 IonicContact OE2-NZ 3.26Å; E863-K2368 PolarHBondContact OE2-NZ 3.18Å; N864-K2368 PolarHBondContact OD1-NZ 3.16Å
2369	N	26.6	Very low	27.8	Very low	52 Å²	52	101.2 Å²	101.2	28%	0.278	54%	0.536	S	S	.	.				59.2	100.9	118	-50.5	-15	0	0	0	121.2	S859 N860	S859-N2369 WeakPolarHBondContact CB-OD1 3.43Å; S859-N2369 PolarHBondContact O-ND2 3.19Å; S859-N2369 PolarHBondContact O-OD1 3.34Å; S859-N2369 PolarHBondContact OG-OD1 2.99Å; N860-N2369 WeakPolarHBondContact CA-ND2 3.38Å; N860-N2369 PolarHBondContact N-ND2 3.27Å; N860-N2369 PolarHBondContact OD1-ND2 3.46Å
2370	Y	24.6	Very low	27.7	Very low	234 Å²	234	103.4 Å²	103.4	92%	0.918	53%	0.529	S	S	*	.				-163.4	169	115	-120.3	-87.2	0	0	0	110.5
2371	K	27	Very low	27.7	Very low	179 Å²	179	100.4 Å²	100.4	78%	0.778	52%	0.516	S	S	*	.			trans	71.3	148.2	-178.7	-68	-178	176.6	173.5	0	117.4	Q2373	K2371-Q2373 PolarHBondContact O-NE2 3.13Å
2372	R	27.4	Very low	27.7	Very low	73 Å²	73	100.7 Å²	100.7	28%	0.275	51%	0.512	S	S	.	.			trans	-151.4	152.9	-154.5	-108.6	157.4	157.5	-172.1	-28	113.5	E851 E852 T853 D854 N855 G856	E851-R2372 PolarHBondContact O-NH2 3.24Å; E852-R2372 HydrophobicContact CB-CB 4.09Å; E852-R2372 HydrophobicContact CB-CG 4.16Å; E852-R2372 HydrophobicContact CG-CB 3.74Å; E852-R2372 HydrophobicContact CG-CG 4.03Å; E852-R2372 WeakPolarHBondContact O-CD 3.08Å; E852-R2372 PolarHBondContact O-NE 2.84Å; E852-R2372 PolarHBondContact O-NH1 3.24Å; E852-R2372 PolarHBondContact O-NH2 3.03Å; T853-R2372 VanDerWaalsContact CA-NH2 3.25Å; T853-R2372 VanDerWaalsContact O-CZ 3.3Å; T853-R2372 PolarHBondContact O-NH1 3.14Å; T853-R2372 PolarHBondContact O-NH2 2.96Å; D854-R2372 VanDerWaalsContact C-NH2 3.26Å; N855-R2372 VanDerWaalsContact C-CZ 3.41Å; N855-R2372 PolarHBondContact O-NE 2.76Å; G856-R2372 VanDerWaalsContact CA-CZ 3.41Å; G856-R2372 VanDerWaalsContact CA-NH1 3.34Å; G856-R2372 VanDerWaalsContact N-CZ 3.3Å
2373	Q	26.6	Very low	27.8	Very low	70 Å²	70	100 Å²	100	33%	0.327	51%	0.507	S	S	.	.				-144.9	106.9	-74	-109.5	162.4	47.3	0	0	117.4	E852 K2371	E852-Q2373 PolarHBondContact OE1-N 2.9Å; K2371-Q2373 PolarHBondContact O-NE2 3.13Å
2374	L	28.5	Very low	27.6	Very low	87 Å²	87	100.7 Å²	100.7	46%	0.455	50%	0.503	S	S	.	.				57.8	108.6	125.1	-86	60.5	0	0	0	120.8	Q2376	L2374-Q2376 HydrophobicContact CB-CB 4.06Å; L2374-Q2376 HydrophobicContact CB-CG 4.25Å; L2374-Q2376 HydrophobicContact CD2-CB 4.08Å; L2374-Q2376 HydrophobicContact CG-CB 3.93Å; L2374-Q2376 HydrophobicContact CG-CG 3.99Å; L2374-Q2376 PolarHBondContact O-N 3.33Å; L2374-Q2376 VanDerWaalsContact O-N 3.15Å
2375	P	22.4	Very low	27.3	Very low	66 Å²	66	103.1 Å²	103.1	43%	0.429	51%	0.514	S	S	.	.	S	Bend	trans	-82.4	57.5	151.8	37.7	-36.8	0	0	0	110.6
2376	Q	26	Very low	27.2	Very low	104 Å²	104	96 Å²	96	49%	0.486	51%	0.505	S	S	.	.			trans	-131.5	137.5	-166.5	-61.4	-172.6	0.5	0	0	115.4	L2374	L2374-Q2376 HydrophobicContact CB-CB 4.06Å; L2374-Q2376 HydrophobicContact CB-CG 4.25Å; L2374-Q2376 HydrophobicContact CD2-CB 4.08Å; L2374-Q2376 HydrophobicContact CG-CB 3.93Å; L2374-Q2376 HydrophobicContact CG-CG 3.99Å; L2374-Q2376 PolarHBondContact O-N 3.33Å; L2374-Q2376 VanDerWaalsContact O-N 3.15Å
2377	I	34.2	Very low	27.3	Very low	119 Å²	119	103.3 Å²	103.3	61%	0.61	51%	0.51	S	S	*	.			trans	-96	170.4	-158.5	-26	-179.6	0	0	0	111.1	R991	R991-I2377 CarbonylContact C-O 3.36Å
2378	P	36.1	Very low	27.4	Very low	78 Å²	78	103.6 Å²	103.6	51%	0.506	51%	0.512	S	S	.	.				-110.2	-57.9	-67.3	31	-27.2	0	0	0	120.6	R990 R991 H992	R990-P2378 WeakPolarHBondContact CA-O 3.06Å; R990-P2378 PolarHBondContact N-O 3.2Å; R990-P2378 VanDerWaalsContact N-O 3.17Å; R991-P2378 VanDerWaalsContact N-C 3.27Å; R991-P2378 PolarHBondContact N-O 3.49Å; R991-P2378 CarbonylContact O-C 3.43Å; R991-P2378 WeakPolarHBondContact O-CA 3.48Å; R991-P2378 WeakPolarHBondContact O-CD 3.02Å; H992-P2378 WeakPolarHBondContact O-CD 3.44Å
2379	S	28.7	Very low	27.3	Very low	31 Å²	31	104.3 Å²	104.3	22%	0.217	52%	0.524	C	S	.	.			trans	-68.9	150.7	-154.3	70.5	0	0	0	0	121.2	R990 R991 H992	R990-S2379 CarbonylContact C-O 3.52Å; R991-S2379 PolarHBondContact N-O 3.46Å; R991-S2379 WeakPolarHBondContact O-CB 3.37Å; R991-S2379 PolarHBondContact O-N 2.62Å; R991-S2379 PolarHBondContact O-OG 3.24Å; H992-S2379 PolarHBondContact CD2-OG 3.14Å; H992-S2379 VanDerWaalsContact CD2-OG 3.28Å
2380	E	22.3	Very low	27.4	Very low	111 Å²	111	106.2 Å²	106.2	52%	0.519	54%	0.542	S	S	.	.				-103.9	134.3	118.4	-80.8	-176.5	115.4	0	0	109.9	S988	S988-E2380 PolarHBondContact OG-OE2 2.96Å
2381	V	25.2	Very low	27.7	Very low	87 Å²	87	98.8 Å²	98.8	53%	0.527	52%	0.518	S	S	.	.			trans	-136.3	106.4	146.7	167.4	0	0	0	0	102.5
2382	N	27.1	Very low	27.8	Very low	78 Å²	78	93.9 Å²	93.9	42%	0.417	50%	0.5	S	S	.	.			trans	177.3	155.8	151.4	-85.6	-1.9	0	0	0	112.6	H2362 S2363 T2364	H2362-N2382 WeakPolarHBondContact CA-OD1 3.5Å; H2362-N2382 HydrophobicContact CB-CB 4.45Å; H2362-N2382 PolarHBondContact N-OD1 2.84Å; H2362-N2382 VanDerWaalsContact ND1-CA 3.26Å; H2362-N2382 WeakPolarHBondContact ND1-CA 3.4Å; H2362-N2382 PolarHBondContact ND1-O 2.94Å; S2363-N2382 VanDerWaalsContact N-CB 3.29Å; S2363-N2382 CarbonylContact O-C 3.26Å; S2363-N2382 WeakPolarHBondContact O-CB 3.05Å; T2364-N2382 VanDerWaalsContact CG2-O 3.29Å; T2364-N2382 WeakPolarHBondContact CG2-O 3.49Å
2383	K	29.8	Very low	27.6	Very low	73 Å²	73	94.2 Å²	94.2	32%	0.317	51%	0.512	S	S	.	.			trans	-71.9	139.6	-153.5	-110.1	163.1	-87	171.5	0	116.6	H2362 S2363 T2364 D2385	H2362-K2383 VanDerWaalsContact C-CB 3.46Å; H2362-K2383 VanDerWaalsContact CA-N 3.31Å; H2362-K2383 HydrophobicContact CB-CB 3.44Å; H2362-K2383 VanDerWaalsContact CB-CB 3.44Å; H2362-K2383 HydrophobicContact CB-CD 3.83Å; H2362-K2383 HydrophobicContact CB-CG 3.4Å; H2362-K2383 VanDerWaalsContact CB-CG 3.4Å; H2362-K2383 VanDerWaalsContact CG-N 3.3Å; H2362-K2383 WeakPolarHBondContact ND1-CA 3.43Å; H2362-K2383 PolarHBondContact ND1-N 3.02Å; H2362-K2383 WeakPolarHBondContact O-CE 3.48Å; S2363-K2383 VanDerWaalsContact C-N 3.34Å; S2363-K2383 CarbonylContact C-O 3.17Å; S2363-K2383 VanDerWaalsContact CA-N 3.26Å; S2363-K2383 WeakPolarHBondContact CA-O 3.44Å; S2363-K2383 PolarHBondContact O-N 3.33Å; S2363-K2383 VanDerWaalsContact O-N 3.15Å; T2364-K2383 WeakPolarHBondContact CB-O 3.36Å; T2364-K2383 WeakPolarHBondContact CG2-O 3.43Å; T2364-K2383 PolarHBondContact N-O 2.66Å; T2364-K2383 PolarHBondContact OG1-O 3.26Å; K2383-D2385 VanDerWaalsContact CD-CG 3.48Å; K2383-D2385 WeakPolarHBondContact CD-OD1 3.32Å; K2383-D2385 WeakPolarHBondContact CD-OD2 3.33Å
2384	I	24.8	Very low	27.8	Very low	106 Å²	106	96.6 Å²	96.6	54%	0.544	52%	0.523	S	S	.	.				-124.9	123.4	101.3	-102.5	169.9	0	0	0	103.2	T2364	T2364-I2384 WeakPolarHBondContact OG1-CD1 3.4Å; T2364-I2384 WeakPolarHBondContact OG1-CG1 3.41Å
2385	D	22.4	Very low	28	Very low	107 Å²	107	99.2 Å²	99.2	57%	0.572	54%	0.536	S	S	*	.				59	119.6	74.5	-65.4	-49.1	0	0	0	110.1	K2383	K2383-D2385 VanDerWaalsContact CD-CG 3.48Å; K2383-D2385 WeakPolarHBondContact CD-OD1 3.32Å; K2383-D2385 WeakPolarHBondContact CD-OD2 3.33Å
2386	A	28.4	Very low	28.1	Very low	81 Å²	81	99.7 Å²	99.7	67%	0.669	54%	0.542	S	S	*	.			cis	-147.2	-135.5	5.3	0	0	0	0	0	108.7
2387	R	29.6	Very low	28	Very low	223 Å²	223	99.9 Å²	99.9	84%	0.842	55%	0.55	S	S	*	*			trans	18.7	123.2	140.1	-60.1	-175.8	-160.5	140.4	3.3	117
2388	D	31	Very low	27.7	Very low	125 Å²	125	99.7 Å²	99.7	67%	0.668	56%	0.559	S	S	*	*			cis	-155.7	166.1	7.4	-120.8	-49.6	0	0	0	115.3
2389	T	25.1	Very low	27.2	Very low	106 Å²	106	105.2 Å²	105.2	65%	0.65	58%	0.58	S	S	*	*			trans	-32.5	157.4	147.1	56.6	0	0	0	0	115
2390	S	28.9	Very low	27.2	Very low	93 Å²	93	106.8 Å²	106.8	65%	0.65	60%	0.602	S	S	*	*			trans	80.8	144.6	145.1	85.8	0	0	0	0	119.5
2391	N	30	Very low	27.3	Very low	77 Å²	77	109.7 Å²	109.7	41%	0.412	62%	0.619	S	S	.	*			trans	87.7	161.6	145.7	-54.1	-9.3	0	0	0	120	V977 D978 E979	V977-N2391 PolarHBondContact O-ND2 3.29Å; V977-N2391 PolarHBondContact O-OD1 3.01Å; V977-N2391 VanDerWaalsContact O-OD1 3.05Å; D978-N2391 PolarHBondContact N-ND2 3.03Å; D978-N2391 PolarHBondContact N-OD1 3.31Å; D978-N2391 VanDerWaalsContact O-CG 3.24Å; D978-N2391 PolarHBondContact O-ND2 3.46Å; E979-N2391 WeakPolarHBondContact O-CB 3.36Å
2392	L	28.8	Very low	27.6	Very low	76 Å²	76	115.3 Å²	115.3	40%	0.398	64%	0.636	S	S	.	*				-106.6	-172	-126.4	-121.6	70.3	0	0	0	116.6	N980 D981	N980-L2392 CarbonylContact C-O 3.59Å; N980-L2392 WeakPolarHBondContact CA-O 3.25Å; D981-L2392 PolarHBondContact N-O 2.79Å
2393	C	24.8	Very low	27.7	Very low	80 Å²	80	113.4 Å²	113.4	54%	0.541	64%	0.635	S	S	.	*			trans	175.7	123.5	167.2	163.5	0	0	0	0	109.2
2394	Q	30.8	Very low	27.8	Very low	120 Å²	120	121.5 Å²	121.5	56%	0.561	66%	0.664	S	S	*	*			cis	72.6	91.7	-14.3	-66.6	-168.3	-4.4	0	0	122.3
2395	I	31.2	Very low	28	Very low	142 Å²	142	125.1 Å²	125.1	73%	0.728	67%	0.672	S	S	*	*			trans	77.8	99.9	137.6	-51.8	159.3	0	0	0	116.6
2396	S	25	Very low	28.6	Very low	77 Å²	77	125.7 Å²	125.7	54%	0.538	68%	0.684	S	S	.	*				-146.1	150.7	112.6	-164.2	0	0	0	0	111
2397	T	24.8	Very low	28.6	Very low	108 Å²	108	128 Å²	128	66%	0.663	68%	0.684	S	S	*	*			trans	-6.3	137.3	177.5	57.2	0	0	0	0	119.4
2398	S	27.5	Very low	28.6	Very low	115 Å²	115	124.9 Å²	124.9	80%	0.804	68%	0.684	S	S	*	*			cis	66.6	34.8	37.8	90	0	0	0	0	117
2399	M	24.9	Very low	28.3	Very low	193 Å²	193	122.7 Å²	122.7	95%	0.951	68%	0.678	S	S	*	*			trans	-141	124.7	139.1	-115.2	-169.2	-177.4	0	0	110.6
2400	G	29.9	Very low	28.3	Very low	65 Å²	65	124.7 Å²	124.7	67%	0.67	69%	0.685	S	S	*	*			cis	-169.6	169.4	-6.1	0	0	0	0	0	114.3	K2402	G2400-K2402 PolarHBondContact O-N 3.1Å
2401	I	24.1	Very low	28.1	Very low	172 Å²	172	126.4 Å²	126.4	88%	0.882	69%	0.691	S	S	*	*			trans	-26.8	123	164.2	-59.7	154.2	0	0	0	110.6
2402	K	31.5	Very low	27.9	Very low	204 Å²	204	129.2 Å²	129.2	89%	0.887	71%	0.705	S	S	*	*			cis	-102.9	144	43	-72.5	-178.1	-179.6	178.3	0	114.9	G2400	G2400-K2402 PolarHBondContact O-N 3.1Å
2403	G	28.4	Very low	27.7	Very low	38 Å²	38	134.3 Å²	134.3	39%	0.392	72%	0.724	S	S	.	*			cis	70.2	108.2	-1.2	0	0	0	0	0	114
2404	R	31.8	Very low	27.7	Very low	244 Å²	244	138.6 Å²	138.6	92%	0.921	74%	0.739	S	S	*	*				-145.4	150	51.6	-69.8	172.9	-173.3	169.2	0.4	109.6
2405	Y	28.8	Very low	27.5	Very low	182 Å²	182	139.9 Å²	139.9	71%	0.714	75%	0.75	S	S	*	*			cis	66.3	102.4	23	-67.4	-65.3	0	0	0	117.9	L2407	Y2405-L2407 HydrophobicContact CD1-CD1 4.41Å; Y2405-L2407 HydrophobicContact CD1-CG 3.88Å; Y2405-L2407 HydrophobicContact CG-CD1 4.04Å; Y2405-L2407 HydrophobicContact CG-CG 4Å
2406	S	36.6	Very low	27.4	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	75%	0.746	S	S	*	*				-95.3	133.9	106.4	48.1	0	0	0	0	106.7
2407	L	28.4	Very low	27.5	Very low	129 Å²	129	140.4 Å²	140.4	68%	0.675	76%	0.756	S	S	*	*			cis	64.7	103.1	10.6	-76.7	174.6	0	0	0	116.6	Y2405	Y2405-L2407 HydrophobicContact CD1-CD1 4.41Å; Y2405-L2407 HydrophobicContact CD1-CG 3.88Å; Y2405-L2407 HydrophobicContact CG-CD1 4.04Å; Y2405-L2407 HydrophobicContact CG-CG 4Å
2408	L	28.8	Very low	27.7	Very low	158 Å²	158	144.2 Å²	144.2	83%	0.827	76%	0.764	S	S	*	*				-152.8	140.8	122	-139.6	78.4	0	0	0	110.9
2409	S	25.1	Very low	28	Very low	79 Å²	79	144.3 Å²	144.3	55%	0.552	77%	0.765	S	S	*	*			trans	44.7	144.2	144.3	68.1	0	0	0	0	121
2410	D	24.1	Very low	28.3	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	76%	0.757	S	S	*	*				44.5	134.5	71	-37.3	-66.6	0	0	0	112.1
2411	V	25.4	Very low	28.5	Very low	129 Å²	129	144.1 Å²	144.1	78%	0.782	77%	0.769	S	S	*	*			cis	-147.1	164.2	43.6	164.1	0	0	0	0	111.8
2412	L	25.2	Very low	28.6	Very low	136 Å²	136	143.7 Å²	143.7	71%	0.712	77%	0.765	S	S	*	*			trans	-55.9	152.3	176.2	-49.4	83.4	0	0	0	115.5
2413	K	25.9	Very low	28.2	Very low	183 Å²	183	144.1 Å²	144.1	80%	0.796	76%	0.761	S	S	*	*			trans	66.9	173.7	156.1	-65.6	169.8	178.9	177.6	0	116.5
2414	M	23.4	Very low	28.3	Very low	170 Å²	170	146.1 Å²	146.1	84%	0.837	77%	0.774	S	S	*	*			trans	67.9	110.5	170.5	-67.9	172.5	178.9	0	0	113.6
2415	N	27.6	Very low	27.9	Very low	148 Å²	148	139.8 Å²	139.8	79%	0.791	77%	0.765	S	S	*	*			cis	60.5	141.7	32.9	-150.5	7.1	0	0	0	112.9
2416	T	28.1	Very low	27.7	Very low	105 Å²	105	139.4 Å²	139.4	64%	0.644	77%	0.77	S	S	*	*			trans	65.9	101.2	178.4	64.2	0	0	0	0	118.9
2417	T	27.7	Very low	27	Very low	125 Å²	125	140 Å²	140	77%	0.767	77%	0.769	S	S	*	*				37.8	143.9	123	61.5	0	0	0	0	123.5
2418	K	28.1	Very low	26.8	Very low	187 Å²	187	140 Å²	140	81%	0.813	77%	0.769	S	S	*	*			trans	87.8	109.1	141.1	-88.4	-178.8	177.5	-177.6	0	121.4
2419	S	34.1	Very low	26.6	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	75%	0.749	S	S	*	*				54.2	119.1	127	64.4	0	0	0	0	122.4
2420	G	31.3	Very low	26.5	Very low	77 Å²	77	138 Å²	138	79%	0.794	75%	0.745	S	S	*	*			trans	168.7	110	160.4	0	0	0	0	0	108.4
2421	L	34.4	Very low	26.6	Very low	176 Å²	176	134 Å²	134	92%	0.921	73%	0.729	S	S	*	*			cis	87.4	63.6	30.2	-153.4	95.4	0	0	0	115.5
2422	M	26.1	Very low	26.6	Very low	163 Å²	163	132.7 Å²	132.7	80%	0.803	71%	0.714	S	S	*	*			trans	-145.6	141.4	150.6	-85.6	-158.9	-173.2	0	0	107.8
2423	R	22.7	Very low	26.7	Very low	213 Å²	213	131.8 Å²	131.8	80%	0.804	71%	0.709	S	S	*	*			cis	-151	145.5	-13.9	-172.3	-177	-81.8	167.6	-6.2	108.7
2424	A	31.4	Very low	26.6	Very low	80 Å²	80	124.7 Å²	124.7	66%	0.661	68%	0.68	S	S	*	*			trans	-56.4	168.8	167	0	0	0	0	0	111.9
2425	P	23.8	Very low	26.7	Very low	111 Å²	111	122 Å²	122	72%	0.721	67%	0.669	S	S	*	*			cis	-121.5	162.6	32.7	48.1	-36.2	0	0	0	112.1
2426	Q	23.8	Very low	26.6	Very low	175 Å²	175	117 Å²	117	82%	0.818	65%	0.651	S	S	*	*				44.4	92	65.3	-89.1	-166.9	-8.1	0	0	113.5
2427	T	22.2	Very low	26.5	Very low	131 Å²	131	119.3 Å²	119.3	80%	0.804	66%	0.658	S	S	*	*				-168.2	166.7	109.3	18.2	0	0	0	0	109.4
2428	N	24.3	Very low	26.3	Very low	127 Å²	127	115.9 Å²	115.9	68%	0.679	64%	0.64	S	S	*	*			trans	-48.9	143	154.4	-41.9	-33.8	0	0	0	108.7
2429	E	23.4	Very low	26.1	Very low	87 Å²	87	112.6 Å²	112.6	41%	0.407	64%	0.635	S	S	.	*				-162.3	156.5	110.5	-127.7	54.6	-97.4	0	0	112.9	Q1698	Q1698-E2429 HydrophobicContact CG-CG 3.88Å; Q1698-E2429 WeakPolarHBondContact CG-OE1 3.29Å; Q1698-E2429 WeakPolarHBondContact CG-OE2 3.28Å; Q1698-E2429 PolarHBondContact NE2-OE2 3.27Å
2430	K	24.4	Very low	25.5	Very low	109 Å²	109	109.1 Å²	109.1	47%	0.474	61%	0.609	S	S	.	*			trans	-69.6	132.7	-179.5	-55.9	139	171.3	-169.5	0	110.9	N1696 D1697 Q1698 N1699	N1696-K2430 CarbonylContact C-O 3.59Å; N1696-K2430 VanDerWaalsContact CA-O 3.26Å; N1696-K2430 WeakPolarHBondContact CA-O 3.06Å; D1697-K2430 PolarHBondContact N-O 3.49Å; D1697-K2430 WeakPolarHBondContact O-CD 3.27Å; D1697-K2430 WeakPolarHBondContact O-CE 3.42Å; D1697-K2430 PolarHBondContact O-NZ 2.97Å; Q1698-K2430 PolarHBondContact O-NZ 3.33Å; N1699-K2430 PolarHBondContact O-NZ 2.87Å
2431	S	24.8	Very low	25.2	Very low	65 Å²	65	109.3 Å²	109.3	46%	0.455	60%	0.596	S	S	.	*			trans	147.3	152.7	146.5	61.9	0	0	0	0	111	I1695 N1696	I1695-S2431 VanDerWaalsContact C-CB 3.49Å; N1696-S2431 PolarHBondContact N-OG 3.26Å
2432	Q	24.9	Very low	24.7	Very low	100 Å²	100	103.5 Å²	103.5	47%	0.467	56%	0.562	S	S	.	*			cis	76.4	120.3	25	-66.4	-172.6	-27.9	0	0	113.6	R1693 E1694 I1695 N2434	R1693-Q2432 WeakPolarHBondContact O-CB 3.47Å; E1694-Q2432 WeakPolarHBondContact CA-O 3.24Å; E1694-Q2432 WeakPolarHBondContact CG-O 3.46Å; I1695-Q2432 PolarHBondContact N-O 3.49Å; Q2432-N2434 HydrophobicContact CB-CB 4.36Å; Q2432-N2434 HydrophobicContact CG-CB 4.37Å; Q2432-N2434 PolarHBondContact NE2-ND2 3.31Å; Q2432-N2434 VanDerWaalsContact NE2-ND2 3.17Å
2433	I	28	Very low	24.6	Very low	118 Å²	118	98.1 Å²	98.1	61%	0.605	54%	0.535	S	S	*	.			cis	-45.5	144.6	15.6	-155.1	170.7	0	0	0	117.6	E1694	E1694-I2433 HydrophobicContact CG-CB 4.2Å
2434	N	23.9	Very low	24.6	Very low	34 Å²	34	93.1 Å²	93.1	18%	0.182	53%	0.53	C	S	.	.			cis	75.4	71.5	-16.1	-90.6	26.4	0	0	0	121.4	R1690 Q1691 S1692 R1693 Q2432	R1690-N2434 PolarHBondContact O-ND2 2.88Å; R1690-N2434 PolarHBondContact O-OD1 2.94Å; Q1691-N2434 WeakPolarHBondContact CA-OD1 3.38Å; Q1691-N2434 CarbonylContact O-C 3.43Å; Q1691-N2434 WeakPolarHBondContact O-CA 3.38Å; Q1691-N2434 WeakPolarHBondContact O-CB 3.48Å; S1692-N2434 PolarHBondContact N-ND2 3.33Å; R1693-N2434 PolarHBondContact N-ND2 3.49Å; R1693-N2434 WeakPolarHBondContact O-CB 3.49Å; Q2432-N2434 HydrophobicContact CB-CB 4.36Å; Q2432-N2434 HydrophobicContact CG-CB 4.37Å; Q2432-N2434 PolarHBondContact NE2-ND2 3.31Å; Q2432-N2434 VanDerWaalsContact NE2-ND2 3.17Å
2435	D	25.8	Very low	24.4	Very low	113 Å²	113	91 Å²	91	60%	0.604	51%	0.51	S	S	*	.			trans	177.3	137.5	137.3	-89.6	-37.4	0	0	0	107.1	Q1691 S1692	Q1691-D2435 VanDerWaalsContact O-CA 3.26Å; Q1691-D2435 WeakPolarHBondContact O-CA 3.44Å; Q1691-D2435 PolarHBondContact O-N 2.81Å; Q1691-D2435 VanDerWaalsContact O-N 3.14Å; S1692-D2435 WeakPolarHBondContact CA-OD1 3.32Å; S1692-D2435 WeakPolarHBondContact CB-OD1 3.17Å; S1692-D2435 PolarHBondContact OG-OD1 3.14Å
2436	G	24.8	Very low	24.5	Very low	42 Å²	42	87.1 Å²	87.1	43%	0.433	49%	0.485	S	S	.	.			cis	-176.8	-169.4	-4.8	0	0	0	0	0	109
2437	I	25.8	Very low	24.6	Very low	154 Å²	154	83.6 Å²	83.6	79%	0.79	47%	0.471	S	S	*	.			trans	65	97.7	174.6	-45.5	176.5	0	0	0	114.1	V2439	I2437-V2439 HydrophobicContact CG2-CG2 3.92Å
2438	S	24.2	Very low	24.7	Very low	54 Å²	54	78.4 Å²	78.4	38%	0.378	44%	0.438	S	S	.	.			cis	70.3	55.4	7.2	-160.6	0	0	0	0	117.2	R1688	R1688-S2438 WeakPolarHBondContact CG-OG 3.31Å; R1688-S2438 PolarHBondContact NE-OG 3.37Å; R1688-S2438 PolarHBondContact NH2-O 2.97Å
2439	V	23.2	Very low	24.9	Very low	117 Å²	117	73.5 Å²	73.5	71%	0.709	41%	0.413	S	S	*	.			trans	-134.3	108.5	157	177.5	0	0	0	0	106.7	I2437	I2437-V2439 HydrophobicContact CG2-CG2 3.92Å
2440	V	23.1	Very low	25.1	Very low	45 Å²	45	75 Å²	75	27%	0.273	42%	0.42	S	S	.	.				73.9	93.4	56.1	179.4	0	0	0	0	112.9	H1547	H1547-V2440 VanDerWaalsContact CE1-CA 3.5Å; H1547-V2440 WeakPolarHBondContact CE1-CA 3.25Å
2441	P	23.9	Very low	25.1	Very low	81 Å²	81	71.7 Å²	71.7	53%	0.526	42%	0.417	S	S	.	.			trans	-93.9	24.3	161.2	0.5	16.5	0	0	0	115.4	D1546	D1546-P2441 HydrophobicContact CB-CB 4.07Å; D1546-P2441 HydrophobicContact CB-CG 3.95Å; D1546-P2441 VanDerWaalsContact OD1-CB 3.25Å; D1546-P2441 WeakPolarHBondContact OD1-CB 3.49Å; D1546-P2441 WeakPolarHBondContact OD1-CD 3.43Å; D1546-P2441 WeakPolarHBondContact OD1-CG 3.38Å
2442	Y	24	Very low	25.1	Very low	54 Å²	54	69.3 Å²	69.3	21%	0.212	40%	0.4	C	S	.	.			trans	-76	164.7	176.7	-131.2	-75.1	0	0	0	110.5	D1508 H1547 T1548 K1550	D1508-Y2442 PolarHBondContact OD2-OH 2.91Å; H1547-Y2442 AromaticContact CD2-CD2 3.89Å; H1547-Y2442 VanDerWaalsContact CE1-CB 3.49Å; H1547-Y2442 WeakPolarHBondContact CE1-CB 3.41Å; H1547-Y2442 AromaticContact CE1-CD2 3.66Å; H1547-Y2442 PolarHBondContact CE1-N 2.94Å; H1547-Y2442 VanDerWaalsContact CE1-N 3.26Å; H1547-Y2442 AromaticContact CG-CD2 3.8Å; H1547-Y2442 AromaticContact ND1-CD2 3.64Å; H1547-Y2442 AromaticContact NE2-CD2 3.83Å; T1548-Y2442 HydrophobicContact CG2-CD1 3.66Å; T1548-Y2442 HydrophobicContact CG2-CD2 3.68Å; T1548-Y2442 HydrophobicContact CG2-CE1 3.81Å; T1548-Y2442 HydrophobicContact CG2-CE2 3.84Å; T1548-Y2442 HydrophobicContact CG2-CG 3.57Å; K1550-Y2442 PolarHBondContact NZ-OH 3.11Å
2443	Q	23.3	Very low	25.1	Very low	50 Å²	50	65.3 Å²	65.3	23%	0.234	38%	0.384	C	S	.	.			trans	75.8	107.7	158.1	-78.5	172.6	-77.1	0	0	116.5	V1220 L1222 P2445	V1220-Q2443 VanDerWaalsContact CB-OE1 3.27Å; V1220-Q2443 VanDerWaalsContact CG2-OE1 3.25Å; L1222-Q2443 HydrophobicContact CD1-CB 3.9Å; L1222-Q2443 WeakPolarHBondContact CD1-O 3.44Å; L1222-Q2443 HydrophobicContact CD2-CB 3.38Å; L1222-Q2443 HydrophobicContact CD2-CG 4.38Å; L1222-Q2443 HydrophobicContact CG-CB 4.28Å; Q2443-P2445 VanDerWaalsContact CB-CD 3.5Å
2444	P	24.4	Very low	25	Very low	108 Å²	108	62.8 Å²	62.8	70%	0.701	38%	0.375	S	S	*	.			trans	-99.7	82.1	142.2	35.5	-26.3	0	0	0	109.9
2445	P	25.5	Very low	25.1	Very low	37 Å²	37	64 Å²	64	24%	0.24	38%	0.381	C	S	.	.			trans	-124.4	121.9	137.6	-0.2	19	0	0	0	112.5	T1189 L1222 Q2443	T1189-P2445 WeakPolarHBondContact CA-O 3.36Å; T1189-P2445 HydrophobicContact CG2-CB 3.94Å; T1189-P2445 HydrophobicContact CG2-CG 3.83Å; T1189-P2445 VanDerWaalsContact CG2-O 3.25Å; T1189-P2445 WeakPolarHBondContact CG2-O 3.26Å; L1222-P2445 WeakPolarHBondContact CD1-O 3.11Å; Q2443-P2445 VanDerWaalsContact CB-CD 3.5Å
2446	S	26.3	Very low	25	Very low	28 Å²	28	59.4 Å²	59.4	20%	0.196	36%	0.358	C	S	.	.			trans	-136.6	48.6	148.2	76.6	0	0	0	0	110.1	S1187 C1188 D2448	S1187-S2446 VanDerWaalsContact CB-CB 3.43Å; S1187-S2446 WeakPolarHBondContact OG-CB 3.37Å; S1187-S2446 PolarHBondContact OG-OG 3.22Å; C1188-S2446 WeakPolarHBondContact O-CA 3.34Å; C1188-S2446 WeakPolarHBondContact O-CB 3.18Å; S2446-D2448 WeakPolarHBondContact O-CB 3.4Å
2447	I	25.6	Very low	24.9	Very low	102 Å²	102	60.7 Å²	60.7	52%	0.523	36%	0.359	S	S	.	.			trans	-106.9	131.2	143.1	-67.5	175	0	0	0	106.8	E768	E768-I2447 VanDerWaalsContact OE1-CG2 3.23Å; E768-I2447 WeakPolarHBondContact OE1-CG2 3.49Å
2448	D	24.5	Very low	24.8	Very low	22 Å²	22	56.1 Å²	56.1	12%	0.118	34%	0.338	C	S	.	.				173.8	96.7	-102	-164.4	55.9	0	0	0	98.7	T1189 D1190 S1191 S2446	T1189-D2448 VanDerWaalsContact CA-OD1 3.31Å; T1189-D2448 WeakPolarHBondContact CA-OD1 3.44Å; T1189-D2448 PolarHBondContact N-OD1 3.48Å; D1190-D2448 WeakPolarHBondContact CA-OD1 3.11Å; D1190-D2448 PolarHBondContact N-OD1 2.85Å; S1191-D2448 WeakPolarHBondContact CA-OD2 3.3Å; S1191-D2448 VanDerWaalsContact CB-C 3.41Å; S1191-D2448 WeakPolarHBondContact CB-O 3.44Å; S1191-D2448 WeakPolarHBondContact CB-OD2 3.21Å; S1191-D2448 VanDerWaalsContact N-C 3.32Å; S1191-D2448 PolarHBondContact N-OD1 2.79Å; S1191-D2448 PolarHBondContact N-OD2 3.02Å; S1191-D2448 PolarHBondContact OG-O 3.21Å; S2446-D2448 WeakPolarHBondContact O-CB 3.4Å
2449	P	29	Very low	24.9	Very low	23 Å²	23	57.3 Å²	57.3	15%	0.149	34%	0.335	C	S	.	.	S	Bend		-119.5	-170.5	-87.6	43	-31	0	0	0	114.1	D1190 S1191 Y1203	D1190-P2449 HydrophobicContact CB-CG 4.34Å; D1190-P2449 WeakPolarHBondContact OD1-CD 3.49Å; S1191-P2449 VanDerWaalsContact N-CD 3.28Å; Y1203-P2449 HydrophobicContact CD2-CB 3.75Å; Y1203-P2449 HydrophobicContact CD2-CG 3.75Å; Y1203-P2449 HydrophobicContact CE2-CB 3.97Å; Y1203-P2449 HydrophobicContact CE2-CG 4.39Å
2450	H	27.1	Very low	24.9	Very low	118 Å²	118	54.3 Å²	54.3	55%	0.546	32%	0.319	S	S	.	.	S	Bend	trans	81.2	67.4	-179.4	-53.4	-77.8	0	0	0	117.6	Y1206	Y1206-H2450 HydrophobicContact CE2-CB 4.02Å; Y1206-H2450 AromaticContact CE2-ND1 3.33Å; Y1206-H2450 VanDerWaalsContact CE2-ND1 3.33Å; Y1206-H2450 WeakPolarHBondContact CE2-ND1 3.28Å; Y1206-H2450 AromaticContact CZ-ND1 3.47Å; Y1206-H2450 PolarHBondContact OH-ND1 3.02Å; Y1206-H2450 VanDerWaalsContact OH-ND1 3.12Å
2451	G	24.5	Very low	24.9	Very low	40 Å²	40	54 Å²	54	41%	0.412	32%	0.319	S	S	.	.	S	Bend	trans	156.2	101.8	161.2	0	0	0	0	0	113.4	N2562	G2451-N2562 PolarHBondContact O-ND2 3.3Å; G2451-N2562 PolarHBondContact O-OD1 3.41Å
2452	P	25.6	Very low	25	Very low	16 Å²	16	51.4 Å²	51.4	10%	0.104	30%	0.302	C	S	.	.				-140	88.3	-79.2	33.7	-15.3	0	0	0	117.3	Y1206 G1209 K2560 F2561 N2562	Y1206-P2452 VanDerWaalsContact CB-CB 3.42Å; Y1206-P2452 HydrophobicContact CD2-CB 3.63Å; Y1206-P2452 HydrophobicContact CG-CB 3.94Å; G1209-P2452 CarbonylContact C-O 3.49Å; G1209-P2452 WeakPolarHBondContact CA-O 3.21Å; G1209-P2452 PolarHBondContact N-O 3.01Å; P2452-K2560 HydrophobicContact CB-CD 3.25Å; P2452-K2560 HydrophobicContact CB-CG 3.86Å; P2452-K2560 HydrophobicContact CG-CB 3.97Å; P2452-K2560 HydrophobicContact CG-CD 3.4Å; P2452-K2560 VanDerWaalsContact CG-CD 3.4Å; P2452-K2560 HydrophobicContact CG-CG 3.36Å; P2452-F2561 CarbonylContact O-C 3.58Å; P2452-N2562 VanDerWaalsContact C-CG 3.41Å; P2452-N2562 VanDerWaalsContact C-N 3.29Å; P2452-N2562 WeakPolarHBondContact CD-OD1 3.22Å; P2452-N2562 PolarHBondContact O-N 3.33Å
2453	A	25	Very low	25.1	Very low	16 Å²	16	49 Å²	49	13%	0.132	29%	0.292	C	S	.	.			trans	176.1	174.9	155.5	0	0	0	0	0	112.3	Y1206 L1208 N2562 Y2563	Y1206-A2453 WeakPolarHBondContact O-CA 3.37Å; Y1206-A2453 PolarHBondContact O-N 2.86Å; L1208-A2453 VanDerWaalsContact CA-CB 3.45Å; A2453-N2562 HydrophobicContact CB-CB 3.43Å; A2453-N2562 VanDerWaalsContact CB-CB 3.43Å; A2453-N2562 VanDerWaalsContact CB-O 3.26Å; A2453-N2562 WeakPolarHBondContact CB-O 3.25Å; A2453-N2562 VanDerWaalsContact N-CB 3.28Å; A2453-N2562 PolarHBondContact N-ND2 2.83Å; A2453-N2562 PolarHBondContact O-ND2 3.35Å; A2453-Y2563 HydrophobicContact CB-CD1 4.36Å
2454	P	25.7	Very low	25.2	Very low	64 Å²	64	46.7 Å²	46.7	42%	0.416	28%	0.282	S	S	.	.			trans	-126.8	117.5	157.4	35.8	-20	0	0	0	114.3	Y2563	P2454-Y2563 WeakPolarHBondContact CA-OXT 3.25Å; P2454-Y2563 VanDerWaalsContact O-CD1 3.29Å; P2454-Y2563 WeakPolarHBondContact O-CD1 3.49Å; P2454-Y2563 WeakPolarHBondContact O-CE1 3.42Å
2455	N	25.2	Very low	25.4	Very low	59 Å²	59	44.9 Å²	44.9	32%	0.316	26%	0.264	S	S	.	.			trans	-62.2	152.7	152.6	-110.1	-35.9	0	0	0	107.9	E767 Y2563	E767-N2455 PolarHBondContact OE1-ND2 3.39Å; N2455-Y2563 HydrophobicContact CB-CD1 4.43Å; N2455-Y2563 HydrophobicContact CB-CG 4.29Å; N2455-Y2563 WeakPolarHBondContact CB-O 2.96Å; N2455-Y2563 VanDerWaalsContact CG-CB 3.48Å; N2455-Y2563 PolarHBondContact N-OXT 3.37Å; N2455-Y2563 PolarHBondContact ND2-O 3.28Å; N2455-Y2563 WeakPolarHBondContact OD1-CD2 3.36Å
2456	P	23.3	Very low	25.3	Very low	18 Å²	18	43.1 Å²	43.1	12%	0.117	25%	0.253	C	S	.	.				-140.4	124.9	-106.7	30.7	-10.4	0	0	0	111.6	D348 N349 V2458 Y2563	D348-P2456 VanDerWaalsContact C-CG 3.41Å; D348-P2456 HydrophobicContact CB-CB 3.97Å; D348-P2456 VanDerWaalsContact O-CB 3.22Å; D348-P2456 WeakPolarHBondContact O-CB 3.29Å; D348-P2456 WeakPolarHBondContact O-CG 3.43Å; N349-P2456 WeakPolarHBondContact CA-O 3.26Å; N349-P2456 HydrophobicContact CB-CB 4.44Å; N349-P2456 WeakPolarHBondContact CB-O 3.11Å; N349-P2456 VanDerWaalsContact CG-C 3.4Å; P2456-V2458 PolarHBondContact O-N 2.64Å; P2456-Y2563 HydrophobicContact CB-CE1 4.42Å
2457	P	23.5	Very low	25.4	Very low	69 Å²	69	42.6 Å²	42.6	45%	0.448	25%	0.248	S	C	.	.			trans	-49	87.5	-148.9	-31.3	34.1	0	0	0	118.9	N349 Y2459	N349-P2457 VanDerWaalsContact CG-N 3.3Å; N349-P2457 WeakPolarHBondContact ND2-CA 3.45Å; N349-P2457 PolarHBondContact ND2-O 2.71Å; N349-P2457 WeakPolarHBondContact OD1-CD 3.47Å; P2457-Y2459 HydrophobicContact CB-CD2 3.84Å; P2457-Y2459 HydrophobicContact CB-CE2 3.76Å
2458	V	24.6	Very low	25.3	Very low	57 Å²	57	38.9 Å²	38.9	35%	0.345	23%	0.228	S	C	.	.			trans	-72.1	124	131.7	-167.7	0	0	0	0	105.3	W440 P2456 C2460	W440-V2458 HydrophobicContact CZ2-CG1 4.14Å; P2456-V2458 PolarHBondContact O-N 2.64Å; V2458-C2460 WeakPolarHBondContact CG1-SG 3.34Å; V2458-C2460 PolarHBondContact O-N 3.42Å
2459	Y	24.9	Very low	25.4	Very low	79 Å²	79	38.8 Å²	38.8	31%	0.31	23%	0.226	S	C	.	.			trans	-73.6	75.3	176.2	-100.1	-112.8	0	0	0	110.4	P1507 P2457	P1507-Y2459 WeakPolarHBondContact O-CE2 3.4Å; P1507-Y2459 PolarHBondContact O-OH 3.27Å; P2457-Y2459 HydrophobicContact CB-CD2 3.84Å; P2457-Y2459 HydrophobicContact CB-CE2 3.76Å
2460	C	24	Very low	25.3	Very low	55 Å²	55	38.3 Å²	38.3	37%	0.372	22%	0.224	S	C	.	.			trans	-102.2	70	171	-64.8	0	0	0	0	108.2	Q436 V2458	Q436-C2460 PolarHBondContact OE1-SG 3.45Å; Q436-C2460 VanDerWaalsContact OE1-SG 3.38Å; V2458-C2460 WeakPolarHBondContact CG1-SG 3.34Å; V2458-C2460 PolarHBondContact O-N 3.42Å
2461	S	23.8	Very low	25.3	Very low	39 Å²	39	33 Å²	33	27%	0.273	20%	0.2	S	C	.	.			trans	-105.1	169.8	172.1	50.2	0	0	0	0	110	A1535 E1538	A1535-S2461 WeakPolarHBondContact CB-O 3.39Å; E1538-S2461 VanDerWaalsContact CD-CB 3.44Å; E1538-S2461 WeakPolarHBondContact OE1-CB 3.14Å; E1538-S2461 WeakPolarHBondContact OE2-CA 3.44Å; E1538-S2461 WeakPolarHBondContact OE2-CB 3.38Å; E1538-S2461 PolarHBondContact OE2-OG 2.83Å
2462	S	26.1	Very low	25.5	Very low	26 Å²	26	31.2 Å²	31.2	18%	0.182	18%	0.181	C	C	.	.			trans	-79.4	158	-130	59.9	0	0	0	0	118.2	G1246 A1535 Q1537 E1538	G1246-S2462 WeakPolarHBondContact CA-OG 3.39Å; A1535-S2462 WeakPolarHBondContact CA-O 3.43Å; A1535-S2462 WeakPolarHBondContact CB-O 3.13Å; A1535-S2462 PolarHBondContact N-O 2.74Å; Q1537-S2462 PolarHBondContact NE2-O 2.82Å; Q1537-S2462 PolarHBondContact NE2-OG 2.81Å; E1538-S2462 PolarHBondContact OE1-N 3.33Å; E1538-S2462 PolarHBondContact OE1-OG 3.38Å; E1538-S2462 PolarHBondContact OE2-N 3.41Å; E1538-S2462 VanDerWaalsContact OE2-N 3.17Å
2463	F	25.1	Very low	25.6	Very low	2 Å²	2	30.5 Å²	30.5	1%	0.009	18%	0.176	C	C	.	.			trans	-108.2	-171.7	-140.5	-144.7	-91.6	0	0	0	117.7	M431 E432 E791 F1244 E1245 E1534	M431-F2463 WeakPolarHBondContact O-CE1 3.22Å; M431-F2463 VanDerWaalsContact O-CZ 3.3Å; M431-F2463 WeakPolarHBondContact O-CZ 3.27Å; E432-F2463 VanDerWaalsContact CA-CE1 3.46Å; E432-F2463 HydrophobicContact CB-CE1 4.34Å; E432-F2463 VanDerWaalsContact CD-CG 3.49Å; E432-F2463 HydrophobicContact CG-CD1 4.49Å; E432-F2463 VanDerWaalsContact OE1-CD1 3.3Å; E432-F2463 WeakPolarHBondContact OE1-CD1 3.42Å; E432-F2463 WeakPolarHBondContact OE1-CD2 3.45Å; E432-F2463 WeakPolarHBondContact OE1-CE2 3.46Å; E432-F2463 WeakPolarHBondContact OE1-CG 3.44Å; E432-F2463 WeakPolarHBondContact OE2-CD1 3.41Å; E432-F2463 VanDerWaalsContact OE2-CG 3.3Å; E432-F2463 WeakPolarHBondContact OE2-CG 3.46Å; E791-F2463 VanDerWaalsContact OE2-CA 3.28Å; E791-F2463 WeakPolarHBondContact OE2-CA 3.5Å; E791-F2463 VanDerWaalsContact OE2-CB 3.23Å; E791-F2463 WeakPolarHBondContact OE2-CB 3.35Å; E791-F2463 PolarHBondContact OE2-N 3.48Å; F1244-F2463 CarbonylContact C-O 3.38Å; E1245-F2463 WeakPolarHBondContact CB-O 3.44Å; E1245-F2463 WeakPolarHBondContact CG-O 3.37Å; E1245-F2463 PolarHBondContact N-O 3.37Å; E1534-F2463 HydrophobicContact CB-CD2 4.47Å; E1534-F2463 HydrophobicContact CB-CE1 3.92Å; E1534-F2463 HydrophobicContact CB-CE2 3.67Å; E1534-F2463 HydrophobicContact CB-CZ 3.3Å; E1534-F2463 HydrophobicContact CG-CD2 4.17Å; E1534-F2463 HydrophobicContact CG-CE1 4.41Å; E1534-F2463 HydrophobicContact CG-CE2 3.24Å; E1534-F2463 HydrophobicContact CG-CZ 3.37Å; E1534-F2463 WeakPolarHBondContact OE1-CE2 3.5Å; E1534-F2463 WeakPolarHBondContact OE2-CZ 3.44Å
2464	T	25	Very low	25.7	Very low	3 Å²	3	30.5 Å²	30.5	2%	0.018	17%	0.173	C	C	.	.			trans	-173	162.1	166.4	9.5	0	0	0	0	117.8	T1243 F1244 E1245 G1533 E1534 P2466	T1243-T2464 WeakPolarHBondContact O-CG2 3.42Å; F1244-T2464 VanDerWaalsContact C-CG2 3.43Å; F1244-T2464 VanDerWaalsContact O-CG2 3.29Å; F1244-T2464 WeakPolarHBondContact O-CG2 3.01Å; E1245-T2464 HydrophobicContact CB-CG2 4.37Å; E1245-T2464 HydrophobicContact CG-CG2 3.48Å; E1245-T2464 VanDerWaalsContact CG-CG2 3.48Å; E1245-T2464 WeakPolarHBondContact CG-OG1 3.26Å; E1245-T2464 PolarHBondContact OE2-OG1 2.99Å; G1533-T2464 VanDerWaalsContact C-OG1 3.24Å; G1533-T2464 WeakPolarHBondContact CA-OG1 3.27Å; E1534-T2464 PolarHBondContact N-OG1 3.5Å; T2464-P2466 VanDerWaalsContact CG2-CA 3.41Å; T2464-P2466 HydrophobicContact CG2-CB 3.56Å; T2464-P2466 HydrophobicContact CG2-CG 3.59Å
2465	E	28.2	Very low	25.9	Very low	69 Å²	69	28.2 Å²	28.2	32%	0.322	16%	0.158	S	C	.	.				-109.2	121.3	112.3	-174.8	-131.4	-86.3	0	0	108.7	M431 T1532 I2467 M2468	M431-E2465 HydrophobicContact CE-CB 4Å; M431-E2465 HydrophobicContact CE-CG 3.67Å; T1532-E2465 WeakPolarHBondContact O-CA 3.5Å; E2465-I2467 PolarHBondContact O-N 2.88Å; E2465-I2467 WeakPolarHBondContact OE2-CA 3.33Å; E2465-I2467 PolarHBondContact OE2-N 3.28Å; E2465-I2467 VanDerWaalsContact OE2-N 3.17Å; E2465-M2468 PolarHBondContact OE2-N 2.97Å
2466	P	25.2	Very low	25.9	Very low	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.173	C	C	.	.			trans	-82.4	31.3	-162.7	-1.5	19.1	0	0	0	116.1	T1243 Y1765 T2464	T1243-P2466 VanDerWaalsContact CB-CB 3.5Å; T1243-P2466 WeakPolarHBondContact CB-O 3.46Å; T1243-P2466 HydrophobicContact CG2-CB 4.08Å; T1243-P2466 VanDerWaalsContact CG2-O 3.31Å; T1243-P2466 WeakPolarHBondContact CG2-O 2.98Å; Y1765-P2466 HydrophobicContact CD1-CB 4.28Å; Y1765-P2466 HydrophobicContact CD2-CB 4.22Å; Y1765-P2466 HydrophobicContact CD2-CG 3.93Å; Y1765-P2466 HydrophobicContact CE1-CB 3.62Å; Y1765-P2466 HydrophobicContact CE1-CG 4.27Å; Y1765-P2466 VanDerWaalsContact CE1-O 3.26Å; Y1765-P2466 WeakPolarHBondContact CE1-O 3.35Å; Y1765-P2466 HydrophobicContact CE2-CB 3.58Å; Y1765-P2466 HydrophobicContact CE2-CG 3.25Å; Y1765-P2466 VanDerWaalsContact CZ-CG 3.45Å; Y1765-P2466 WeakPolarHBondContact OH-CA 3.35Å; Y1765-P2466 WeakPolarHBondContact OH-CB 3.47Å; Y1765-P2466 VanDerWaalsContact OH-CD 3.29Å; Y1765-P2466 WeakPolarHBondContact OH-CD 3.38Å; Y1765-P2466 PolarHBondContact OH-O 2.93Å; T2464-P2466 VanDerWaalsContact CG2-CA 3.41Å; T2464-P2466 HydrophobicContact CG2-CB 3.56Å; T2464-P2466 HydrophobicContact CG2-CG 3.59Å
2467	I	26.5	Very low	26.2	Very low	17 Å²	17	33.5 Å²	33.5	9%	0.087	19%	0.188	C	C	.	.			trans	65.1	90.8	164.3	-47.2	-178.5	0	0	0	115.6	S1242 T1243 F1244 A1284 I1288 E2465 W2469	S1242-I2467 WeakPolarHBondContact O-CD1 3.34Å; T1243-I2467 WeakPolarHBondContact O-CG1 3.44Å; F1244-I2467 HydrophobicContact CD1-CD1 3.89Å; F1244-I2467 HydrophobicContact CD2-CD1 3.62Å; F1244-I2467 HydrophobicContact CD2-CG1 4.36Å; F1244-I2467 HydrophobicContact CE1-CD1 3.61Å; F1244-I2467 HydrophobicContact CE2-CD1 3.38Å; F1244-I2467 HydrophobicContact CE2-CG1 4.39Å; F1244-I2467 HydrophobicContact CG-CD1 3.87Å; F1244-I2467 HydrophobicContact CZ-CD1 3.37Å; A1284-I2467 HydrophobicContact CB-CD1 3.71Å; I1288-I2467 HydrophobicContact CB-CG2 4.46Å; I1288-I2467 HydrophobicContact CD1-CB 4.19Å; I1288-I2467 HydrophobicContact CD1-CG2 3.69Å; I1288-I2467 HydrophobicContact CG2-CG2 4.26Å; E2465-I2467 PolarHBondContact O-N 2.88Å; E2465-I2467 WeakPolarHBondContact OE2-CA 3.33Å; E2465-I2467 PolarHBondContact OE2-N 3.28Å; E2465-I2467 VanDerWaalsContact OE2-N 3.17Å; I2467-W2469 HydrophobicContact CG2-CG 4.33Å
2468	M	25	Very low	26.2	Very low	23 Å²	23	34.6 Å²	34.6	11%	0.113	19%	0.193	C	C	.	.				-145.7	78.2	128.7	-154.2	158.1	-37.9	0	0	116.2	I1288 F1291 V1292 I1773 E2465	I1288-M2468 HydrophobicContact CG2-CB 4.25Å; I1288-M2468 HydrophobicContact CG2-CE 3.7Å; I1288-M2468 HydrophobicContact CG2-CG 3.44Å; I1288-M2468 VanDerWaalsContact CG2-CG 3.44Å; I1288-M2468 HydrophobicContact CG2-SD 3.63Å; F1291-M2468 HydrophobicContact CB-SD 4.18Å; F1291-M2468 HydrophobicContact CD1-CE 4.21Å; F1291-M2468 HydrophobicContact CD1-SD 3.28Å; F1291-M2468 WeakPolarHBondContact CD1-SD 3.31Å; F1291-M2468 HydrophobicContact CD2-CE 4.3Å; F1291-M2468 HydrophobicContact CD2-SD 4.33Å; F1291-M2468 HydrophobicContact CE1-CE 4.2Å; F1291-M2468 HydrophobicContact CE1-SD 3.55Å; F1291-M2468 VanDerWaalsContact CE1-SD 3.55Å; F1291-M2468 HydrophobicContact CE2-CE 4.27Å; F1291-M2468 HydrophobicContact CG-CE 4.27Å; F1291-M2468 HydrophobicContact CG-SD 3.72Å; F1291-M2468 HydrophobicContact CZ-CE 4.22Å; F1291-M2468 HydrophobicContact CZ-SD 4.18Å; V1292-M2468 HydrophobicContact CG2-CG 3.35Å; V1292-M2468 HydrophobicContact CG2-SD 3.68Å; I1773-M2468 HydrophobicContact CD1-CB 3.58Å; I1773-M2468 HydrophobicContact CD1-CE 4.16Å; I1773-M2468 HydrophobicContact CD1-CG 3.38Å; I1773-M2468 HydrophobicContact CD1-SD 3.2Å; I1773-M2468 WeakPolarHBondContact CD1-SD 3.5Å; I1773-M2468 HydrophobicContact CG1-CB 3.61Å; I1773-M2468 HydrophobicContact CG1-CG 3.56Å; I1773-M2468 WeakPolarHBondContact CG1-O 3.38Å; I1773-M2468 HydrophobicContact CG1-SD 4.06Å; E2465-M2468 PolarHBondContact OE2-N 2.97Å
2469	W	25.5	Very low	26.4	Very low	20 Å²	20	33.6 Å²	33.6	8%	0.076	20%	0.195	C	C	.	.			trans	40.2	112.4	130.9	-72.9	97.2	0	0	0	119	L829 F832 L833 A1284 F1285 I1288 N1289 V1292 I2467	L829-W2469 HydrophobicContact CD1-CH2 4.43Å; L829-W2469 HydrophobicContact CD2-CD2 4.43Å; L829-W2469 HydrophobicContact CD2-CE3 3.67Å; L829-W2469 HydrophobicContact CD2-CH2 3.38Å; L829-W2469 HydrophobicContact CD2-CZ2 4.09Å; L829-W2469 HydrophobicContact CD2-CZ3 3.15Å; L829-W2469 HydrophobicContact CG-CH2 3.5Å; L829-W2469 HydrophobicContact CG-CZ2 4.19Å; L829-W2469 HydrophobicContact CG-CZ3 3.8Å; L829-W2469 VanDerWaalsContact O-CZ3 3.25Å; L829-W2469 WeakPolarHBondContact O-CZ3 3.46Å; F832-W2469 HydrophobicContact CD1-CH2 4.06Å; L833-W2469 HydrophobicContact CB-CE3 3.88Å; L833-W2469 HydrophobicContact CB-CZ3 3.75Å; L833-W2469 HydrophobicContact CD1-CB 4.12Å; L833-W2469 HydrophobicContact CD1-CD2 4.4Å; L833-W2469 HydrophobicContact CD1-CE3 3.63Å; L833-W2469 HydrophobicContact CD1-CZ3 4.39Å; L833-W2469 HydrophobicContact CG-CD2 4.47Å; L833-W2469 HydrophobicContact CG-CE3 3.6Å; L833-W2469 HydrophobicContact CG-CZ3 3.97Å; A1284-W2469 PolarHBondContact O-NE1 3.3Å; F1285-W2469 HydrophobicContact CB-CZ2 4.48Å; F1285-W2469 AromaticContact CD1-CH2 3.75Å; F1285-W2469 HydrophobicContact CD1-CH2 3.75Å; F1285-W2469 AromaticContact CD1-CZ2 3.61Å; F1285-W2469 HydrophobicContact CD1-CZ2 3.61Å; F1285-W2469 HydrophobicContact CE1-CH2 4.26Å; F1285-W2469 HydrophobicContact CE1-CZ2 4.22Å; F1285-W2469 HydrophobicContact CG-CZ2 4.35Å; I1288-W2469 VanDerWaalsContact CG2-CD1 3.47Å; I1288-W2469 HydrophobicContact CG2-CG 4.4Å; N1289-W2469 WeakPolarHBondContact ND2-CH2 3.26Å; N1289-W2469 WeakPolarHBondContact ND2-CZ3 3.29Å; N1289-W2469 WeakPolarHBondContact OD1-CH2 3.18Å; N1289-W2469 VanDerWaalsContact OD1-CZ2 3.3Å; N1289-W2469 WeakPolarHBondContact OD1-CZ2 3.36Å; N1289-W2469 WeakPolarHBondContact OD1-CZ3 3.48Å; V1292-W2469 HydrophobicContact CB-CB 4.36Å; V1292-W2469 WeakPolarHBondContact CG1-O 3.39Å; V1292-W2469 HydrophobicContact CG2-CB 3.7Å; V1292-W2469 WeakPolarHBondContact CG2-O 3.3Å; I2467-W2469 HydrophobicContact CG2-CG 4.33Å
2470	S	28.1	Very low	26.4	Very low	14 Å²	14	32.8 Å²	32.8	10%	0.098	20%	0.195	C	C	.	.				-145.1	168.2	127.1	-88.8	0	0	0	0	109	L470	L470-S2470 WeakPolarHBondContact CD1-O 3.4Å; L470-S2470 WeakPolarHBondContact CD2-O 3.18Å
2471	P	26.9	Very low	26.6	Very low	6 Å²	6	36 Å²	36	4%	0.039	21%	0.208	C	C	.	.			trans	-124.8	122	-153.1	39.9	-29	0	0	0	118.2	L470 N830 L833	L470-P2471 CarbonylContact C-O 3.58Å; L470-P2471 VanDerWaalsContact CA-C 3.44Å; L470-P2471 WeakPolarHBondContact CA-O 3.23Å; L470-P2471 VanDerWaalsContact CB-C 3.46Å; L470-P2471 WeakPolarHBondContact CB-O 3.37Å; N830-P2471 HydrophobicContact CB-CB 3.58Å; N830-P2471 VanDerWaalsContact CG-CA 3.4Å; N830-P2471 WeakPolarHBondContact OD1-CA 3.46Å; N830-P2471 WeakPolarHBondContact OD1-CB 3.14Å; L833-P2471 HydrophobicContact CB-CB 3.54Å; L833-P2471 HydrophobicContact CB-CG 3.78Å; L833-P2471 HydrophobicContact CD1-CB 3.65Å; L833-P2471 HydrophobicContact CD1-CG 3.44Å; L833-P2471 VanDerWaalsContact CD1-CG 3.44Å; L833-P2471 HydrophobicContact CG-CB 4.19Å; L833-P2471 HydrophobicContact CG-CG 4.11Å
2472	R	27.7	Very low	26.8	Very low	3 Å²	3	42.8 Å²	42.8	1%	0.011	23%	0.228	C	C	.	.			trans	168	142.7	133.9	-99.2	100.4	166.9	-128.4	132.2	122.2	V469 L473 S474 F477 Y826 N830 A834	V469-R2472 WeakPolarHBondContact CB-O 3.33Å; V469-R2472 WeakPolarHBondContact CG1-O 3.27Å; L473-R2472 VanDerWaalsContact C-CZ 3.44Å; L473-R2472 HydrophobicContact CB-CB 3.76Å; L473-R2472 HydrophobicContact CB-CG 3.35Å; L473-R2472 HydrophobicContact CD1-CB 4.43Å; L473-R2472 HydrophobicContact CD1-CG 4.39Å; L473-R2472 HydrophobicContact CD2-CG 3.98Å; L473-R2472 VanDerWaalsContact CD2-NH1 3.31Å; L473-R2472 HydrophobicContact CG-CG 4.08Å; L473-R2472 PolarHBondContact O-NH1 2.9Å; L473-R2472 PolarHBondContact O-NH2 3.26Å; S474-R2472 VanDerWaalsContact CA-NH2 3.3Å; S474-R2472 VanDerWaalsContact N-NH2 3.18Å; F477-R2472 VanDerWaalsContact CE2-NH1 3.28Å; Y826-R2472 WeakPolarHBondContact CD1-O 3.15Å; N830-R2472 VanDerWaalsContact CB-CA 3.45Å; N830-R2472 HydrophobicContact CB-CB 4.23Å; N830-R2472 HydrophobicContact CB-CG 3.72Å; N830-R2472 VanDerWaalsContact CG-N 3.28Å; N830-R2472 WeakPolarHBondContact ND2-CA 3.4Å; N830-R2472 PolarHBondContact ND2-N 3.4Å; N830-R2472 PolarHBondContact O-NE 3.21Å; N830-R2472 VanDerWaalsContact O-NE 3.08Å; A834-R2472 VanDerWaalsContact CB-NH2 3.31Å
2473	H	28.7	Very low	26.8	Very low	1 Å²	1	48 Å²	48	1%	0.005	25%	0.249	C	C	.	.			trans	26.5	135	130.4	-58.5	-148	0	0	0	118.1	L308 V469 L473 Y826 I827 V831	L308-H2473 HydrophobicContact CD1-CB 3.4Å; L308-H2473 VanDerWaalsContact CD1-O 3.27Å; L308-H2473 WeakPolarHBondContact CD1-O 3.32Å; L308-H2473 HydrophobicContact CD2-CB 4.41Å; L308-H2473 WeakPolarHBondContact CD2-O 3.36Å; L308-H2473 HydrophobicContact CG-CB 4.46Å; V469-H2473 WeakPolarHBondContact CG1-O 3.27Å; L473-H2473 HydrophobicContact CD1-CB 3.96Å; L473-H2473 HydrophobicContact CD2-CB 4.47Å; L473-H2473 WeakPolarHBondContact CD2-ND1 3.26Å; Y826-H2473 VanDerWaalsContact C-CA 3.46Å; Y826-H2473 VanDerWaalsContact CB-CA 3.44Å; Y826-H2473 PolarHBondContact O-CD2 3.28Å; Y826-H2473 PolarHBondContact O-N 3.48Å; I827-H2473 WeakPolarHBondContact CA-CD2 3.33Å; I827-H2473 HydrophobicContact CG1-CB 4.24Å; I827-H2473 WeakPolarHBondContact CG1-ND1 3.2Å; I827-H2473 PolarHBondContact O-CD2 3.13Å; I827-H2473 VanDerWaalsContact O-CD2 3.31Å; I827-H2473 PolarHBondContact O-NE2 2.81Å; V831-H2473 VanDerWaalsContact CG2-NE2 3.34Å; V831-H2473 WeakPolarHBondContact CG2-NE2 3.35Å
2474	D	26.4	Very low	26.9	Very low	15 Å²	15	55.2 Å²	55.2	8%	0.08	29%	0.287	C	S	.	.			cis	-173.7	174.3	-12.1	-145.1	47.4	0	0	0	113.1	L308 C823 Y826 I827	L308-D2474 HydrophobicContact CD1-CB 4.36Å; C823-D2474 VanDerWaalsContact CA-OD1 3.3Å; C823-D2474 WeakPolarHBondContact CA-OD1 3.29Å; C823-D2474 PolarHBondContact SG-OD2 3.22Å; Y826-D2474 WeakPolarHBondContact CB-OD1 3.41Å; I827-D2474 HydrophobicContact CD1-CB 4.02Å; I827-D2474 WeakPolarHBondContact CD1-OD2 3.42Å; I827-D2474 HydrophobicContact CG1-CB 3.77Å; I827-D2474 WeakPolarHBondContact CG1-OD2 3.29Å; I827-D2474 PolarHBondContact N-OD1 2.94Å
2475	I	29.7	Very low	26.9	Very low	16 Å²	16	59.2 Å²	59.2	8%	0.082	32%	0.315	C	S	.	.			trans	-21.3	124.8	155.3	-64.8	-77.6	0	0	0	115	M305 V818 I819 I822 C823	M305-I2475 WeakPolarHBondContact CE-O 3.42Å; V818-I2475 WeakPolarHBondContact O-CD1 3.38Å; I819-I2475 VanDerWaalsContact CA-CD1 3.42Å; I819-I2475 HydrophobicContact CB-CD1 4.26Å; I819-I2475 HydrophobicContact CG1-CD1 4.39Å; I819-I2475 HydrophobicContact CG2-CD1 4.35Å; I819-I2475 WeakPolarHBondContact O-CD1 3.34Å; I822-I2475 HydrophobicContact CB-CD1 3.49Å; I822-I2475 VanDerWaalsContact CB-CD1 3.49Å; I822-I2475 HydrophobicContact CB-CG1 3.68Å; I822-I2475 HydrophobicContact CD1-CD1 4.17Å; I822-I2475 HydrophobicContact CG1-CD1 4.16Å; I822-I2475 HydrophobicContact CG2-CD1 4.41Å; I822-I2475 HydrophobicContact CG2-CG1 4.18Å; C823-I2475 HydrophobicContact CB-CD1 4.44Å; C823-I2475 HydrophobicContact CB-CG1 3.76Å
2476	E	26.5	Very low	26.8	Very low	136 Å²	136	63.5 Å²	63.5	64%	0.636	34%	0.335	S	S	*	.				-173.3	142.7	103	-89.4	-160.2	160.3	0	0	108.9	M305	M305-E2476 HydrophobicContact CE-CG 4Å
2477	A	28.6	Very low	27	Very low	52 Å²	52	69.3 Å²	69.3	43%	0.43	37%	0.365	S	S	.	.			cis	-164.6	-179.6	-10.2	0	0	0	0	0	110.3
2478	T	23.9	Very low	26.9	Very low	92 Å²	92	78.3 Å²	78.3	56%	0.564	40%	0.399	S	S	*	.			trans	16	105.2	146.5	58.4	0	0	0	0	118	L815 I819	L815-T2478 HydrophobicContact CD1-CG2 4.23Å; I819-T2478 HydrophobicContact CD1-CG2 3.95Å
2479	G	27.8	Very low	27	Very low	37 Å²	37	83.9 Å²	83.9	38%	0.381	43%	0.429	S	S	.	.			trans	-117.1	-44.8	-168.9	0	0	0	0	0	118.4	N2481	G2479-N2481 WeakPolarHBondContact O-CB 3.34Å; G2479-N2481 PolarHBondContact O-N 3.37Å; G2479-N2481 PolarHBondContact O-ND2 2.81Å
2480	M	25.2	Very low	27.3	Very low	61 Å²	61	92.1 Å²	92.1	30%	0.3	47%	0.465	S	S	.	.			trans	-78.5	103.1	173.5	-102.3	-174.9	48.4	0	0	108.2	I811 M812	I811-M2480 HydrophobicContact CB-CE 3.92Å; I811-M2480 HydrophobicContact CB-SD 4.45Å; I811-M2480 HydrophobicContact CG2-CE 3.59Å; I811-M2480 HydrophobicContact CG2-SD 3.47Å; I811-M2480 WeakPolarHBondContact CG2-SD 3.28Å; M812-M2480 HydrophobicContact CE-CB 4.11Å; M812-M2480 HydrophobicContact CE-CE 3.6Å; M812-M2480 HydrophobicContact SD-CB 3.7Å; M812-M2480 HydrophobicContact SD-CE 4.02Å
2481	N	28.2	Very low	27.5	Very low	122 Å²	122	99.3 Å²	99.3	65%	0.652	50%	0.497	S	S	*	.				36.3	107.7	58.3	-78.9	-67.4	0	0	0	109.3	G2479	G2479-N2481 WeakPolarHBondContact O-CB 3.34Å; G2479-N2481 PolarHBondContact O-N 3.37Å; G2479-N2481 PolarHBondContact O-ND2 2.81Å
2482	R	29.1	Very low	27.7	Very low	182 Å²	182	105.3 Å²	105.3	69%	0.687	54%	0.536	S	S	*	.				163.5	148.7	58.9	-110.2	178.8	148.9	151.4	1	105.3
2483	E	25.3	Very low	27.6	Very low	135 Å²	135	110.3 Å²	110.3	63%	0.631	57%	0.567	S	S	*	*			cis	-144.2	163.4	-11.5	-67.6	-179	168.2	0	0	106.4
2484	L	27	Very low	27.6	Very low	154 Å²	154	116.4 Å²	116.4	81%	0.806	61%	0.605	S	S	*	*				-165.1	133.8	103.8	-99.5	164.4	0	0	0	110.8
2485	S	25.6	Very low	27.7	Very low	88 Å²	88	121.1 Å²	121.1	62%	0.615	64%	0.636	S	S	*	*			trans	9.4	137.5	152.7	61.1	0	0	0	0	118.2
2486	Q	26.4	Very low	27.6	Very low	158 Å²	158	130.2 Å²	130.2	74%	0.738	67%	0.67	S	S	*	*				-158.2	146.2	65.4	-89.7	-175.9	17.2	0	0	116.3
2487	I	28.4	Very low	27.8	Very low	123 Å²	123	130.3 Å²	130.3	63%	0.631	67%	0.67	S	S	*	*			trans	68.8	102.9	140	-65.7	169.3	0	0	0	116.8
2488	Y	25.2	Very low	27.7	Very low	206 Å²	206	133.4 Å²	133.4	81%	0.808	68%	0.679	S	S	*	*				90.8	141.3	53.3	-90.2	-74.4	0	0	0	113.3
2489	L	26.6	Very low	28	Very low	141 Å²	141	139.5 Å²	139.5	74%	0.738	69%	0.692	S	S	*	*			trans	75.2	147.7	165.2	-57.7	141.7	0	0	0	114.9
2490	K	32.6	Very low	28.5	Very low	193 Å²	193	143.7 Å²	143.7	84%	0.839	71%	0.705	S	S	*	*			cis	-143.1	144.8	12.6	-146.3	161	-173.4	174.8	0	112.7
2491	Q	32.4	Very low	28.4	Very low	165 Å²	165	146.9 Å²	146.9	77%	0.771	72%	0.723	S	S	*	*			trans	-81	171.9	173.2	-55.6	149.9	-49.1	0	0	110.1
2492	P	29.9	Very low	28.4	Very low	131 Å²	131	148.1 Å²	148.1	85%	0.851	73%	0.725	S	S	*	*				-138.8	177.7	84.4	39.7	-26.4	0	0	0	114.8
2493	T	26.3	Very low	28.3	Very low	109 Å²	109	145.8 Å²	145.8	67%	0.669	73%	0.726	S	S	*	*			trans	-108.7	172	-177.7	48.8	0	0	0	0	112.5
2494	T	27.7	Very low	28.3	Very low	128 Å²	128	143.3 Å²	143.3	79%	0.785	72%	0.72	S	S	*	*			trans	75.7	163.8	169.1	80.1	0	0	0	0	116.6
2495	P	29.7	Very low	28.4	Very low	115 Å²	115	141.2 Å²	141.2	75%	0.747	71%	0.708	S	S	*	*			cis	-130.7	-177.7	-47	34.5	-18.1	0	0	0	113.7
2496	R	26.5	Very low	28.3	Very low	207 Å²	207	142 Å²	142	78%	0.781	71%	0.706	S	S	*	*			trans	-4.9	128	151.2	-162.1	-168.7	-173.4	164.2	7.4	117.9
2497	Q	30.4	Very low	28.3	Very low	137 Å²	137	141.4 Å²	141.4	64%	0.64	71%	0.707	S	S	*	*			trans	54.3	130.5	147.3	-70.4	-178.9	-90.2	0	0	117.9
2498	N	28.2	Very low	28.2	Very low	118 Å²	118	142.6 Å²	142.6	63%	0.631	71%	0.714	S	S	*	*			cis	-172.6	156.5	48	-121.7	2	0	0	0	108.4
2499	W	30.4	Very low	28.3	Very low	220 Å²	220	138.4 Å²	138.4	83%	0.833	71%	0.706	S	S	*	*				30.2	93.6	92.6	-79.5	62.1	0	0	0	112.8
2500	L	37.7	Very low	28.6	Very low	125 Å²	125	139.6 Å²	139.6	65%	0.654	71%	0.707	S	S	*	*				175.9	150.3	57.6	-89	147.7	0	0	0	105.8
2501	N	23.6	Very low	28.8	Very low	128 Å²	128	135 Å²	135	68%	0.684	70%	0.7	S	S	*	*				-169.8	116.6	110.7	-98.6	-26.5	0	0	0	111.5
2502	Q	27.5	Very low	28.8	Very low	147 Å²	147	134.1 Å²	134.1	69%	0.687	70%	0.7	S	S	*	*			trans	69.5	142.7	130.1	-62.3	-178.4	44.5	0	0	119.1
2503	L	27.3	Very low	28.8	Very low	134 Å²	134	134.1 Å²	134.1	70%	0.702	69%	0.692	S	S	*	*			cis	-172.8	171.1	-19.5	-116.3	176	0	0	0	104.4
2504	V	25.1	Very low	28.9	Very low	83 Å²	83	134.8 Å²	134.8	50%	0.503	69%	0.691	S	S	.	*			trans	46.8	89.8	146.4	-176.2	0	0	0	0	116.6	N2506	V2504-N2506 HydrophobicContact CG1-CB 3.94Å; V2504-N2506 WeakPolarHBondContact CG2-ND2 3.48Å; V2504-N2506 WeakPolarHBondContact CG2-OD1 2.89Å
2505	I	28.1	Very low	28.8	Very low	110 Å²	110	136.1 Å²	136.1	56%	0.564	69%	0.69	S	S	*	*				-99.5	101.3	104.5	-68.7	-179.4	0	0	0	104.3	T1960	T1960-I2505 HydrophobicContact CG2-CD1 4.41Å
2506	N	24.3	Very low	28.7	Very low	105 Å²	105	136.2 Å²	136.2	56%	0.561	68%	0.684	S	S	*	*			trans	-73.6	172.8	172.8	-82.8	-24.2	0	0	0	109.7	V2504	V2504-N2506 HydrophobicContact CG1-CB 3.94Å; V2504-N2506 WeakPolarHBondContact CG2-ND2 3.48Å; V2504-N2506 WeakPolarHBondContact CG2-OD1 2.89Å
2507	D	25.9	Very low	28.7	Very low	144 Å²	144	135.4 Å²	135.4	77%	0.77	68%	0.683	S	S	*	*	S	Bend	trans	-38.9	138.8	136.1	-64.7	-72.2	0	0	0	112.6
2508	L	26	Very low	28.5	Very low	149 Å²	149	136.6 Å²	136.6	78%	0.78	69%	0.686	S	S	*	*	S	Bend	trans	73.8	148.9	158.9	-54.3	152.5	0	0	0	118.2
2509	N	28.9	Very low	28.5	Very low	118 Å²	118	134.5 Å²	134.5	63%	0.631	68%	0.68	S	S	*	*			trans	13.9	152.6	141.5	-46.4	-3.7	0	0	0	122.2
2510	E	31.8	Very low	28.4	Very low	165 Å²	165	131.4 Å²	131.4	77%	0.771	68%	0.678	S	S	*	*			trans	72	118.7	149.4	-71.6	148.7	151.7	0	0	115.4
2511	S	37.1	Very low	27.9	Very low	98 Å²	98	131.2 Å²	131.2	69%	0.685	67%	0.674	S	S	*	*				85	135.5	67.4	-63.7	0	0	0	0	112.7
2512	D	32.1	Very low	28.3	Very low	145 Å²	145	133 Å²	133	78%	0.775	68%	0.678	S	S	*	*			trans	66.1	162.8	162.7	-60.4	-23.9	0	0	0	117.4
2513	L	29.5	Very low	28.3	Very low	131 Å²	131	131.5 Å²	131.5	69%	0.686	68%	0.675	S	S	*	*			cis	-163.7	164.5	-25.3	-104.8	168.7	0	0	0	109.1
2514	I	29	Very low	28.3	Very low	124 Å²	124	136 Å²	136	64%	0.636	68%	0.683	S	S	*	*			trans	68.8	115	143.8	-75.7	163.1	0	0	0	121.5
2515	M	26.6	Very low	28.7	Very low	156 Å²	156	136.6 Å²	136.6	77%	0.768	69%	0.687	S	S	*	*			trans	56.6	167.5	139.4	-58.6	-164.8	-77.7	0	0	120.1
2516	N	26.8	Very low	28.6	Very low	117 Å²	117	138.2 Å²	138.2	63%	0.626	69%	0.692	S	S	*	*			cis	-158.3	162.6	10.4	-139.5	-14.9	0	0	0	113.2
2517	Y	25.9	Very low	28.7	Very low	190 Å²	190	141.1 Å²	141.1	75%	0.745	71%	0.706	S	S	*	*			trans	64.4	155.3	159	-90.6	-132	0	0	0	120.4
2518	K	26.8	Very low	28.6	Very low	162 Å²	162	139 Å²	139	70%	0.704	70%	0.695	S	S	*	*			cis	-166	160	-34.5	-164.9	164.9	-179.9	-174.7	0	110.5
2519	S	27.4	Very low	28.7	Very low	73 Å²	73	139.4 Å²	139.4	51%	0.51	70%	0.697	S	S	.	*			trans	-32.2	143.4	167.3	-152.2	0	0	0	0	118.2	E2521	S2519-E2521 VanDerWaalsContact CB-OE2 3.26Å; S2519-E2521 WeakPolarHBondContact CB-OE2 3.33Å; S2519-E2521 PolarHBondContact OG-OE2 3.02Å
2520	I	28.2	Very low	28.6	Very low	155 Å²	155	138.4 Å²	138.4	80%	0.795	70%	0.697	S	S	*	*				-160.2	106	117.2	-93.1	151.1	0	0	0	104.7
2521	E	28.1	Very low	28.3	Very low	121 Å²	121	137 Å²	137	57%	0.565	69%	0.694	S	S	*	*				70.3	121.3	84.8	-76.5	142.9	103.5	0	0	110.3	S2519	S2519-E2521 VanDerWaalsContact CB-OE2 3.26Å; S2519-E2521 WeakPolarHBondContact CB-OE2 3.33Å; S2519-E2521 PolarHBondContact OG-OE2 3.02Å
2522	E	32.2	Very low	27.7	Very low	167 Å²	167	138.9 Å²	138.9	78%	0.78	69%	0.692	S	S	*	*				57.8	114.8	76.9	-62.3	177.8	168.3	0	0	108.1
2523	D	27.9	Very low	27.5	Very low	115 Å²	115	138.4 Å²	138.4	62%	0.615	69%	0.685	S	S	*	*			cis	-155	-175.8	46.2	-82.4	-54.7	0	0	0	109.6
2524	W	27.3	Very low	27.5	Very low	227 Å²	227	140.3 Å²	140.3	86%	0.86	70%	0.695	S	S	*	*			cis	-146.6	131.1	28.2	-79.7	81.3	0	0	0	113.9
2525	T	32	Very low	27.4	Very low	97 Å²	97	137.6 Å²	137.6	60%	0.595	69%	0.691	S	S	*	*			trans	-71.3	167.2	149.4	45.3	0	0	0	0	111.6
2526	H	26.3	Very low	27.7	Very low	144 Å²	144	135.5 Å²	135.5	67%	0.667	69%	0.689	S	S	*	*			trans	68.9	94.4	171.5	-58.5	-79.6	0	0	0	117.2	D2528	H2526-D2528 IonicContact ND1-OD2 3.77Å
2527	L	26.1	Very low	27.7	Very low	166 Å²	166	134.6 Å²	134.6	87%	0.869	69%	0.692	S	S	*	*				-146.3	102.4	109.3	-124.8	65.5	0	0	0	105.3
2528	D	24.7	Very low	27.8	Very low	100 Å²	100	131 Å²	131	54%	0.535	69%	0.694	S	S	.	*				61.1	109.9	77.2	-68.6	-48.8	0	0	0	113.5	H2526	H2526-D2528 IonicContact ND1-OD2 3.77Å
2529	L	27.1	Very low	28	Very low	157 Å²	157	127.8 Å²	127.8	82%	0.822	69%	0.693	S	S	*	*			trans	67.9	163.2	140.4	-68.8	164	0	0	0	117.7
2530	P	28.7	Very low	28	Very low	97 Å²	97	129.3 Å²	129.3	63%	0.63	70%	0.703	S	S	*	*			cis	-127	-167.2	-27.1	35	-16.3	0	0	0	111.6
2531	L	24.7	Very low	28.4	Very low	135 Å²	135	127.2 Å²	127.2	71%	0.707	70%	0.699	S	S	*	*				9.4	136.1	125.3	-51.3	169.2	0	0	0	114.9
2532	Q	24.7	Very low	28.4	Very low	137 Å²	137	126.9 Å²	126.9	64%	0.64	71%	0.708	S	S	*	*			cis	178.4	-160.9	26.3	-123.2	165.3	-24.5	0	0	108.3
2533	H	27.3	Very low	28.6	Very low	136 Å²	136	124 Å²	124	63%	0.63	70%	0.704	S	S	*	*			trans	-7.5	134.3	150.5	-41.4	-55.8	0	0	0	116.4	A2535	H2533-A2535 HydrophobicContact CB-CB 4.15Å
2534	L	29.2	Very low	28.8	Very low	171 Å²	171	124.2 Å²	124.2	90%	0.895	71%	0.711	S	S	*	*			cis	-119.5	134	37.5	-53.6	100.8	0	0	0	112.2
2535	A	28.2	Very low	28.9	Very low	67 Å²	67	118.3 Å²	118.3	55%	0.554	70%	0.702	S	S	*	*			cis	70.8	154.8	28.9	0	0	0	0	0	114.6	H2533	H2533-A2535 HydrophobicContact CB-CB 4.15Å
2536	P	32.8	Very low	29.1	Very low	112 Å²	112	118.4 Å²	118.4	73%	0.727	71%	0.713	S	S	*	*			cis	-130.6	-143.9	-47.6	34.8	-16.9	0	0	0	109.2
2537	S	25.7	Very low	29.4	Very low	97 Å²	97	116.4 Å²	116.4	68%	0.678	71%	0.713	S	S	*	*			trans	41.4	121	149.8	59	0	0	0	0	117.9
2538	S	27.7	Very low	29.5	Very low	114 Å²	114	118 Å²	118	80%	0.797	71%	0.713	S	S	*	*			cis	167.5	164	46.4	33.3	0	0	0	0	106.4
2539	S	31.2	Very low	29.8	Very low	96 Å²	96	118.5 Å²	118.5	67%	0.671	72%	0.721	S	S	*	*			cis	-163.6	139.2	-2.4	38.5	0	0	0	0	105.1
2540	S	28.9	Very low	29.7	Very low	104 Å²	104	118.6 Å²	118.6	73%	0.727	72%	0.721	S	S	*	*				51.9	146.7	65.6	75.4	0	0	0	0	115.3
2541	P	36.7	Very low	29.4	Very low	111 Å²	111	121.5 Å²	121.5	72%	0.721	73%	0.73	S	S	*	*			cis	-128.9	-8.4	1.7	29.6	-8.6	0	0	0	121.2	P2543	P2541-P2543 WeakPolarHBondContact O-CD 3.27Å
2542	P	27.8	Very low	29.4	Very low	114 Å²	114	122.3 Å²	122.3	74%	0.74	74%	0.735	S	S	*	*				-108.9	120.3	-125.2	34.9	-23.8	0	0	0	117.2
2543	P	36.2	Very low	29.4	Very low	108 Å²	108	121.6 Å²	121.6	70%	0.701	74%	0.735	S	S	*	*			trans	-80	-160.6	141	41.4	-37.4	0	0	0	108.5	P2541	P2541-P2543 WeakPolarHBondContact O-CD 3.27Å
2544	P	31.3	Very low	29.3	Very low	118 Å²	118	121.7 Å²	121.7	77%	0.766	74%	0.739	S	S	*	*			cis	-124	-104.9	-6	22.6	4.3	0	0	0	116.2
2545	P	30.4	Very low	29.1	Very low	103 Å²	103	119 Å²	119	67%	0.669	73%	0.726	S	S	*	*				-133.5	143.1	-119.5	40.5	-21.6	0	0	0	119.2
2546	A	35.1	Very low	29.1	Very low	100 Å²	100	123.1 Å²	123.1	83%	0.826	73%	0.733	S	S	*	*			trans	53.2	-154.1	149.2	0	0	0	0	0	116
2547	P	33.8	Very low	28.9	Very low	102 Å²	102	123 Å²	123	66%	0.662	73%	0.727	S	S	*	*			cis	-125.7	156.6	-41.8	34.1	-20.9	0	0	0	113.6
2548	K	27.3	Very low	29	Very low	199 Å²	199	125 Å²	125	87%	0.865	73%	0.729	S	S	*	*				164.8	156.1	119.7	-91.9	167.6	-177.1	178.5	0	114.7
2549	P	30.8	Very low	28.9	Very low	111 Å²	111	122.9 Å²	122.9	72%	0.721	71%	0.714	S	S	*	*			trans	-98.4	155.4	174.4	38.7	-34.1	0	0	0	114
2550	I	24.6	Very low	28.6	Very low	159 Å²	159	118.9 Å²	118.9	82%	0.815	69%	0.685	S	S	*	*			trans	-158.8	114.5	149	-82.1	122.7	0	0	0	102.5
2551	L	23.9	Very low	28.4	Very low	157 Å²	157	117 Å²	117	82%	0.822	66%	0.663	S	S	*	*			cis	76.1	69.9	44.9	-145.1	-173.1	0	0	0	113.3
2552	L	24.4	Very low	27.8	Very low	152 Å²	152	112 Å²	112	80%	0.796	63%	0.631	S	S	*	*			trans	-164.5	106	155.8	-93.5	160.9	0	0	0	103.9
2553	N	23.4	Very low	27.8	Very low	123 Å²	123	109 Å²	109	66%	0.658	61%	0.605	S	S	*	*				78.3	132.4	59.9	-169.2	47.5	0	0	0	112.3
2554	I	25.7	Very low	27.4	Very low	138 Å²	138	109 Å²	109	71%	0.708	60%	0.6	S	S	*	*			trans	72.7	132.3	-176.3	-49.7	154.1	0	0	0	112.4
2555	N	25.6	Very low	27.2	Very low	114 Å²	114	108.5 Å²	108.5	61%	0.61	59%	0.591	S	S	*	*			cis	-168	-172	-23.6	-108.2	17.6	0	0	0	106.5
2556	E	28.1	Very low	27	Very low	153 Å²	153	108.8 Å²	108.8	72%	0.715	59%	0.587	S	S	*	*			trans	22.4	131.4	136.8	-61.6	152.7	145.2	0	0	118.6
2557	D	29	Very low	26.5	Very low	111 Å²	111	109.4 Å²	109.4	59%	0.594	57%	0.573	S	S	*	*			cis	-142.9	136.6	0.4	-90.3	-40.3	0	0	0	107.7
2558	L	26.6	Very low	26.1	Very low	137 Å²	137	109.8 Å²	109.8	72%	0.717	57%	0.567	S	S	*	*				65.6	112.2	65.8	-167	149.8	0	0	0	111.6
2559	S	26.6	Very low	26	Very low	71 Å²	71	103.9 Å²	103.9	50%	0.497	55%	0.548	S	S	.	.			trans	59.5	175.3	-174	78.7	0	0	0	0	110.9
2560	K	24.7	Very low	25.7	Very low	11 Å²	11	103.4 Å²	103.4	5%	0.048	54%	0.535	C	S	.	.			cis	-145.8	140.7	19.2	-122.8	-125.4	-101.8	122.5	0	104.2	Y1206 G1209 D1210 I1211 R1213 P2452	Y1206-K2560 HydrophobicContact CD1-CD 4.11Å; Y1206-K2560 HydrophobicContact CD2-CD 3.7Å; Y1206-K2560 VanDerWaalsContact CE1-CE 3.48Å; Y1206-K2560 HydrophobicContact CE2-CD 4.2Å; Y1206-K2560 HydrophobicContact CG-CD 3.6Å; G1209-K2560 CarbonylContact O-C 3.48Å; G1209-K2560 VanDerWaalsContact O-CA 3.25Å; G1209-K2560 WeakPolarHBondContact O-CA 3.37Å; G1209-K2560 WeakPolarHBondContact O-CB 3.33Å; G1209-K2560 WeakPolarHBondContact O-CD 3.35Å; D1210-K2560 VanDerWaalsContact CA-O 3.27Å; D1210-K2560 WeakPolarHBondContact CA-O 3.47Å; D1210-K2560 PolarHBondContact O-NZ 3.25Å; I1211-K2560 VanDerWaalsContact CA-CB 3.48Å; I1211-K2560 VanDerWaalsContact CA-CE 3.48Å; I1211-K2560 HydrophobicContact CB-CB 3.8Å; I1211-K2560 HydrophobicContact CB-CG 4.03Å; I1211-K2560 HydrophobicContact CG1-CB 4.37Å; I1211-K2560 HydrophobicContact CG1-CD 4.5Å; I1211-K2560 HydrophobicContact CG1-CG 4.03Å; I1211-K2560 PolarHBondContact O-NZ 2.99Å; R1213-K2560 PolarHBondContact O-NZ 3.21Å; P2452-K2560 HydrophobicContact CB-CD 3.25Å; P2452-K2560 HydrophobicContact CB-CG 3.86Å; P2452-K2560 HydrophobicContact CG-CB 3.97Å; P2452-K2560 HydrophobicContact CG-CD 3.4Å; P2452-K2560 VanDerWaalsContact CG-CD 3.4Å; P2452-K2560 HydrophobicContact CG-CG 3.36Å
2561	F	25.3	Very low	25.7	Very low	64 Å²	64	99.1 Å²	99.1	28%	0.281	51%	0.514	S	S	.	.			trans	-179	123.9	162.7	-112.5	-101.1	0	0	0	101	R766 L1208 G1209 D1210 P2452	R766-F2561 WeakPolarHBondContact CA-O 3.49Å; R766-F2561 HydrophobicContact CB-CB 4.03Å; R766-F2561 WeakPolarHBondContact CB-O 3.24Å; R766-F2561 VanDerWaalsContact CD-CB 3.46Å; R766-F2561 HydrophobicContact CG-CB 3.58Å; R766-F2561 WeakPolarHBondContact CG-O 3.09Å; R766-F2561 VanDerWaalsContact NH1-CD2 3.35Å; L1208-F2561 HydrophobicContact CD2-CD1 3.33Å; L1208-F2561 HydrophobicContact CD2-CE1 3.17Å; L1208-F2561 HydrophobicContact CD2-CG 4.21Å; L1208-F2561 HydrophobicContact CD2-CZ 3.92Å; L1208-F2561 HydrophobicContact CG-CE1 4.49Å; L1208-F2561 WeakPolarHBondContact O-CA 3.29Å; G1209-F2561 WeakPolarHBondContact O-CA 3.13Å; G1209-F2561 PolarHBondContact O-N 3.35Å; D1210-F2561 HydrophobicContact CB-CD2 4.39Å; P2452-F2561 CarbonylContact O-C 3.58Å
2562	N	23.5	Very low	25.9	Very low	7 Å²	7	94.3 Å²	94.3	4%	0.037	49%	0.488	C	S	.	.				-92.8	-174.5	128.9	-52.8	-13.7	0	0	0	105.4	R766 G2451 P2452 A2453	R766-N2562 PolarHBondContact O-OD1 3.45Å; G2451-N2562 PolarHBondContact O-ND2 3.3Å; G2451-N2562 PolarHBondContact O-OD1 3.41Å; P2452-N2562 VanDerWaalsContact C-CG 3.41Å; P2452-N2562 VanDerWaalsContact C-N 3.29Å; P2452-N2562 WeakPolarHBondContact CD-OD1 3.22Å; P2452-N2562 PolarHBondContact O-N 3.33Å; A2453-N2562 HydrophobicContact CB-CB 3.43Å; A2453-N2562 VanDerWaalsContact CB-CB 3.43Å; A2453-N2562 VanDerWaalsContact CB-O 3.26Å; A2453-N2562 WeakPolarHBondContact CB-O 3.25Å; A2453-N2562 VanDerWaalsContact N-CB 3.28Å; A2453-N2562 PolarHBondContact N-ND2 2.83Å; A2453-N2562 PolarHBondContact O-ND2 3.35Å
2563	Y	27.8	Very low	26	Very low	50 Å²	50	89 Å²	89	20%	0.196	46%	0.46	C	S	.	.				-137.7	0	129.3	-142.1	1	0	0	0	100.6	D348 E767 L1208 A2453 P2454 N2455 P2456	D348-Y2563 VanDerWaalsContact CA-OH 3.27Å; D348-Y2563 WeakPolarHBondContact CA-OH 3.4Å; D348-Y2563 PolarHBondContact OD1-OH 3.3Å; E767-Y2563 WeakPolarHBondContact CG-O 3.34Å; E767-Y2563 VanDerWaalsContact OE1-O 3.1Å; L1208-Y2563 HydrophobicContact CB-CE1 4.19Å; L1208-Y2563 HydrophobicContact CD1-CE2 4.2Å; L1208-Y2563 HydrophobicContact CD2-CD1 3.9Å; L1208-Y2563 HydrophobicContact CD2-CD2 3.73Å; L1208-Y2563 HydrophobicContact CD2-CE1 4.01Å; L1208-Y2563 HydrophobicContact CD2-CE2 3.82Å; L1208-Y2563 HydrophobicContact CD2-CG 3.74Å; L1208-Y2563 HydrophobicContact CG-CD1 3.97Å; L1208-Y2563 HydrophobicContact CG-CD2 4.19Å; L1208-Y2563 HydrophobicContact CG-CE1 3.57Å; L1208-Y2563 HydrophobicContact CG-CE2 3.8Å; L1208-Y2563 HydrophobicContact CG-CG 4.25Å; L1208-Y2563 VanDerWaalsContact CG-CZ 3.42Å; A2453-Y2563 HydrophobicContact CB-CD1 4.36Å; P2454-Y2563 WeakPolarHBondContact CA-OXT 3.25Å; P2454-Y2563 VanDerWaalsContact O-CD1 3.29Å; P2454-Y2563 WeakPolarHBondContact O-CD1 3.49Å; P2454-Y2563 WeakPolarHBondContact O-CE1 3.42Å; N2455-Y2563 HydrophobicContact CB-CD1 4.43Å; N2455-Y2563 HydrophobicContact CB-CG 4.29Å; N2455-Y2563 WeakPolarHBondContact CB-O 2.96Å; N2455-Y2563 VanDerWaalsContact CG-CB 3.48Å; N2455-Y2563 PolarHBondContact N-OXT 3.37Å; N2455-Y2563 PolarHBondContact ND2-O 3.28Å; N2455-Y2563 WeakPolarHBondContact OD1-CD2 3.36Å; P2456-Y2563 HydrophobicContact CB-CE1 4.42Å

Retrieved 2,563 of 2,563 residues in 3431.3 ms (Link to these results)

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