A0A5K4F253_SCHMA Loading...

SET domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F253, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,124 aa.

						>A0A5K4F253_SCHMA|A0A5K4F253
MDALIHPHRQVNSLNFFSISRPSSSLNDSSESDAIIEDTPDSPVETTDYSSKAPDVGQTVTINHDGSEISVCDTQRLNKRVFFSYHNESDPDEYPFHAVTYGESEGCWGLPYNDHNYASYEPNPDHNRSVEPDDRLSLLAKLALAKDDDAKDSKETTSRTLQSTLQTNWVLEESSTVSTTKSVSLVEPSALCPSTRRSVVCNSGLNTPSNGQSLVTTTSHVSSLPSRTILISTAGGNANPPLQIHRVSSSLTPHVILRTGLPGLQISTTAPRQVSTDSMDSVRCVCGNTNLDGYLVQCNQCRIWHHSECISSASKSHLSTPYVCEICQTQSKAIATQRPHLTAFNSVGSTTTPNIRISRAPIGTNTSSGRVFLTNTFGGVTHRQVHVCIPANQGMSNVQCGEFNLVSSVISENGSAAALPPNYGSCGRSVRSSKRKQDLLTLTGGSSSANAGIEGFSSSPPVLDDYDDLSNMRPSYATDLKSCFMEGSLNVCQTQGSHPIPVSDKVQIRHSSIVHRLITDCPNNKVQNASTQVNEVCHTSPPCSAPDSVLSPPSDIYEEAQALHLSSRVCKKLSLMFPLFTGIGADCGDIDGIFNEEIPSNLERLFRYQVVSFDFNRRGLIANEDICPRTPIIEYRGNCLLLSEYNDMYDYRKHYNPFVLFYKSFPKLPLCVDARKYGNEARFIRRSCTPNSEVRHCISFSDDQHNGPVPHLRLIVVASRVIPKSSEITLPFDFDYTACRYLVKCACVLKGCPITRWFQRMNQLSNPLRSSTRHSLVCTRKLPHSPHSYGVNGHSRGLSLLQSSQSHYDDKDPSDEQSVLCPKSSVNTNLRNLPVNRTGRYLPSPISNERTSGSHQIGSNRTTRGYLNKSGISCGVRKAIHRRGRGRGRLRSSSSLGVRSKRETERLSSRIVYLRKSNSKSLTTARKRRSQRNFYSHSGQHPVSSSSDSIVNVEKKRDLHNFSGKSSCSYEIECLDRLQSVPVKASDSPQKSFNRDNQEVIDNTDIGCKSNNELLGEDLDADTEPEYDVQPEKLTDRSVGRKYVQPNSRQDRLNSKGTKESYTSNNSPRQSDLDYVKAEMHESHISKRKSVDSSSLVDRRKRRSQISTLDDHFSKSRKRSTSIEQKEDKKSKEDVWMAEVLRRIERMEKKRLKQRVSSISLKSSQNADCTKNHPNLFSPTEKSPEPDSISDNNDVKSTDGAMEPGGSSDINSKALECDKDNKNVIINETYLNDLEPTNVFEKPELFDCESNHCSGLSQNIKQDKNISPSKACNQNISEESDTGFQRKQFKQFTGSKFKYQKHCSVSHKQRRRRSQAAMLSDSLSSVDQGGSREDRWLQMQLRRIAELSDHQEVSQLSSDMENISDKSHMSSGNRIKDGSNMRVTLFEALGVKSESPKNDHNPNSCLQHLPPNLSKFNIASGCDTTVFTGGHESSNQINSNQQALDSDADCGFIVYRTREKDPMAKFSRTRSLDMHSLFPTIHDEISEKTVADTRQDVYTSVDDMSTSCLTQPFMHQTPRPTKKRWLSRALMEEDVESSHNNFSNCSHSINHSLSTKSDSSLVIQNSCATPVNPKKRIISRLSGISEDLPICTYFESDDNLKKESVTILSDRLVNNPNDEQVICNPDCKVISESHEDTEFCDALSTHLAPLPPKKATVKQQAEELRLQEIRKVRVSLSEYRRRRGLPALTSSAERNHKQTKEPLDQSNGNIDNLEIIIPPTLISPDRLLITLPNLHNESKPSSDVKCSDGLLQKITSLNIKPEVLHDFNQPLSLYTNTPKRCEFDGERDFIDAKVNERGPRTPSEPPDDDEDIGVDSINPVSRGALSSSPEPFIRFPGKVLSSHSSPTSAFSDSRIASEKLPFRNSSPPDVNSSKFSDSCFRDNMFTSSKPINRENLLHDIDHTKECDQVRIGSEVVDQKPSVNIPVSTKEIHFDRLAHYYKKTFNLDDSQHLYGLVISTGTPPPPPPPPIPSFSGHPVSSNSPVAPSYDIEKNPEDNPTHLSGSLEYFIQRDNEIRVWQETRSYEREKRNTSPWHHRVSSQPYLNTKKFSCTISKHPSKYSKNNEGFFFYPDVVTGHFDNVEQTLLRIRDSLQAQLDLTKVGCASQKMNSNNDRSSTNNNGAVC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	29	Very low	214 Å²	214	147.6 Å²	147.6	100%	1.054	76%	0.757	S	S	*	*				0	100.8	0	-58.3	-25.9	-158	0	0	106.2
2	D	27.1	Very low	28.8	Very low	151 Å²	151	146.1 Å²	146.1	81%	0.807	75%	0.752	S	S	*	*			trans	57.4	126.6	137.1	-29.6	-40.6	0	0	0	117.2
3	A	27.7	Very low	28.6	Very low	85 Å²	85	141.3 Å²	141.3	70%	0.702	74%	0.739	S	S	*	*			cis	-139.7	159.6	8.9	0	0	0	0	0	108.5
4	L	29.9	Very low	28.7	Very low	150 Å²	150	141.4 Å²	141.4	79%	0.785	74%	0.739	S	S	*	*				50.1	133	63.7	-44.4	176.5	0	0	0	112
5	I	30	Very low	28.6	Very low	130 Å²	130	140.5 Å²	140.5	67%	0.667	74%	0.736	S	S	*	*			cis	-165.5	155.9	-2.8	-128.6	168.5	0	0	0	110.3
6	H	30.9	Very low	28.5	Very low	156 Å²	156	142.8 Å²	142.8	72%	0.722	74%	0.738	S	S	*	*			trans	57.7	-178.1	164	-72.3	-43.7	0	0	0	118.8
7	P	38.5	Very low	28.6	Very low	106 Å²	106	144.8 Å²	144.8	69%	0.688	74%	0.741	S	S	*	*				-136.1	-170.5	-65	42.4	-27.3	0	0	0	115.1
8	H	26.1	Very low	28.4	Very low	169 Å²	169	142.4 Å²	142.4	78%	0.782	74%	0.739	S	S	*	*			trans	78	128.3	154.6	-100.1	-57.5	0	0	0	122.7
9	R	25.2	Very low	28.5	Very low	204 Å²	204	143.2 Å²	143.2	77%	0.77	74%	0.743	S	S	*	*			trans	67.1	119.9	146.4	-85.7	-177.8	179.5	-178.8	1.3	122.1
10	Q	25.5	Very low	28.4	Very low	158 Å²	158	141.3 Å²	141.3	74%	0.738	74%	0.742	S	S	*	*				85	110.3	129.7	-77.9	178.2	-38.4	0	0	121.7
11	V	26	Very low	28.4	Very low	101 Å²	101	145.7 Å²	145.7	61%	0.612	75%	0.748	S	S	*	*			trans	89.6	107.7	133.2	-179.2	0	0	0	0	118.7	D1869	V11-D1869 WeakPolarHBondContact CG1-OD1 3.28Å
12	N	26.3	Very low	28.3	Very low	129 Å²	129	141.8 Å²	141.8	69%	0.69	74%	0.739	S	S	*	*			trans	52.4	147.5	143.6	-62.6	-19.7	0	0	0	124.3	D1869	N12-D1869 VanDerWaalsContact CB-OD1 3.26Å; N12-D1869 WeakPolarHBondContact CB-OD1 3.28Å; N12-D1869 WeakPolarHBondContact CB-OD2 3.36Å
13	S	27.1	Very low	28.2	Very low	84 Å²	84	140.1 Å²	140.1	59%	0.587	74%	0.739	S	S	*	*			trans	49.6	150.5	149.3	104.4	0	0	0	0	121.6	D1869	S13-D1869 VanDerWaalsContact CB-OD2 3.23Å; S13-D1869 WeakPolarHBondContact CB-OD2 3.24Å; S13-D1869 PolarHBondContact OG-OD2 3.47Å
14	L	29	Very low	28.2	Very low	142 Å²	142	141.8 Å²	141.8	74%	0.743	75%	0.746	S	S	*	*			cis	-146.2	155.6	20.7	-125.6	-176.1	0	0	0	113.3
15	N	27.1	Very low	28.1	Very low	128 Å²	128	139.9 Å²	139.9	68%	0.684	75%	0.745	S	S	*	*			trans	-57.8	153.4	176.3	-51.3	-88.6	0	0	0	115.8
16	F	27.8	Very low	28.1	Very low	177 Å²	177	141.5 Å²	141.5	78%	0.776	75%	0.754	S	S	*	*				-174.6	142.1	119.7	-89.2	-61.4	0	0	0	108.2
17	F	29.7	Very low	27.9	Very low	178 Å²	178	139.3 Å²	139.3	78%	0.781	75%	0.748	S	S	*	*				-141.3	138.4	52.2	-91	-98.1	0	0	0	114.2
18	S	25.6	Very low	27.6	Very low	101 Å²	101	140.6 Å²	140.6	71%	0.706	75%	0.749	S	S	*	*			trans	-114.5	99.1	168.4	-45.7	0	0	0	0	110.8	S20	S18-S20 PolarHBondContact O-N 2.9Å
19	I	29.5	Very low	27.9	Very low	158 Å²	158	137.5 Å²	137.5	81%	0.81	75%	0.746	S	S	*	*			trans	-78.7	91.7	179.5	-59.2	-177.3	0	0	0	110.4
20	S	27	Very low	28.4	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	74%	0.742	S	S	*	*			trans	-86	145.1	173.1	-70.7	0	0	0	0	112.6	S18	S18-S20 PolarHBondContact O-N 2.9Å
21	R	28.4	Very low	28.8	Very low	234 Å²	234	133.1 Å²	133.1	88%	0.883	75%	0.745	S	S	*	*			trans	-52	137.2	-176.3	-60.5	173.5	177.8	176.5	-2.5	114
22	P	29.2	Very low	29.1	Very low	132 Å²	132	132.4 Å²	132.4	86%	0.857	75%	0.745	S	S	*	*			trans	-83.5	112.3	155.3	32.1	-28.9	0	0	0	110.2
23	S	25.3	Very low	29.5	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	75%	0.751	S	S	*	*			trans	-110.8	118.6	166.8	54.7	0	0	0	0	110.6
24	S	28.4	Very low	29.7	Very low	121 Å²	121	134 Å²	134	85%	0.846	76%	0.76	S	S	*	*			trans	-126.1	104.4	175.8	58.2	0	0	0	0	110.8
25	S	27.3	Very low	29.7	Very low	110 Å²	110	134.1 Å²	134.1	77%	0.769	76%	0.759	S	S	*	*			trans	-73.1	151.5	177.8	55	0	0	0	0	113.7
26	L	29.6	Very low	30	Very low	163 Å²	163	134.2 Å²	134.2	85%	0.853	76%	0.759	S	S	*	*			trans	-152.7	97.5	150.7	-109	167	0	0	0	111.9
27	N	27.9	Very low	30.4	Very low	111 Å²	111	133.9 Å²	133.9	59%	0.594	76%	0.76	S	S	*	*			trans	55.4	126.5	135.2	-73.1	60.4	0	0	0	124.1
28	D	32.1	Very low	30.7	Very low	133 Å²	133	132 Å²	132	71%	0.711	76%	0.758	S	S	*	*			trans	66	149.4	132.3	-40.6	-24	0	0	0	119.6
29	S	31.8	Very low	31.2	Very low	103 Å²	103	132.9 Å²	132.9	72%	0.72	76%	0.759	S	S	*	*			cis	-152.2	152.3	17.3	-32.9	0	0	0	0	114.2
30	S	34.9	Very low	31.6	Very low	96 Å²	96	130.3 Å²	130.3	67%	0.671	75%	0.752	S	S	*	*				28.7	147.3	128.7	70.9	0	0	0	0	122.1
31	E	35.2	Very low	31.9	Very low	175 Å²	175	132.8 Å²	132.8	82%	0.818	76%	0.758	S	S	*	*			cis	-169.1	173.4	0	-123.9	172.3	120	0	0	114
32	S	31.5	Very low	32.1	Very low	86 Å²	86	126.4 Å²	126.4	60%	0.601	75%	0.749	S	S	*	*			trans	54.2	104.7	144.8	69.8	0	0	0	0	121.4
33	D	34.5	Very low	32.6	Very low	153 Å²	153	124.6 Å²	124.6	82%	0.818	74%	0.737	S	S	*	*				31.5	130.9	96.9	-48.8	-40.6	0	0	0	119.9
34	A	31.8	Very low	32.8	Very low	94 Å²	94	122.8 Å²	122.8	78%	0.777	72%	0.721	S	S	*	*			trans	-154.1	85.3	140.3	0	0	0	0	0	112.9
35	I	29.5	Very low	33.1	Very low	143 Å²	143	124.7 Å²	124.7	73%	0.733	72%	0.716	S	S	*	*				57.4	94.3	122.8	-61.8	169.5	0	0	0	117.5
36	I	33.5	Very low	33.6	Very low	131 Å²	131	124 Å²	124	67%	0.672	71%	0.708	S	S	*	*				68.1	148.8	101.4	-71.3	163.7	0	0	0	120.1
37	E	34.9	Very low	33.8	Very low	170 Å²	170	121 Å²	121	79%	0.794	70%	0.696	S	S	*	*			trans	70.9	147.2	165.9	-82	143.9	-150.4	0	0	117.1
38	D	36.5	Very low	34	Very low	139 Å²	139	118.2 Å²	118.2	74%	0.743	68%	0.682	S	S	*	*			cis	-139.5	-174.6	4.4	-145.8	-26.6	0	0	0	113.3
39	T	35.8	Very low	34.2	Very low	118 Å²	118	120.4 Å²	120.4	72%	0.724	68%	0.681	S	S	*	*			trans	-101.3	-153.8	-147.7	-31.4	0	0	0	0	112.5
40	P	37.7	Very low	34.4	Very low	104 Å²	104	119.2 Å²	119.2	68%	0.675	67%	0.673	S	S	*	*			trans	-115.3	176.1	-134.3	42.1	-25.8	0	0	0	115.7
41	D	33.4	Very low	34.3	Very low	157 Å²	157	118.8 Å²	118.8	84%	0.84	67%	0.67	S	S	*	*			trans	-166.1	129.2	132.9	-108.3	-28	0	0	0	117.2
42	S	32.7	Very low	34.3	Very low	100 Å²	100	119.5 Å²	119.5	70%	0.699	67%	0.67	S	S	*	*			trans	-12.8	172.4	143.6	-113.5	0	0	0	0	121.7
43	P	39.6	Very low	34.5	Very low	93 Å²	93	118.8 Å²	118.8	60%	0.604	67%	0.67	S	S	*	*				-141.9	-136.1	-51.9	39.9	-17.5	0	0	0	112.1
44	V	30.6	Very low	34.4	Very low	79 Å²	79	117.6 Å²	117.6	48%	0.479	67%	0.67	S	S	.	*			trans	80	111.8	171.5	-171.6	0	0	0	0	114.4
45	E	35	Very low	34.4	Very low	160 Å²	160	119.8 Å²	119.8	75%	0.748	67%	0.669	S	S	*	*				69	153.2	72.5	-57.9	179.2	141.1	0	0	113.2
46	T	37.3	Very low	34.6	Very low	96 Å²	96	119.5 Å²	119.5	59%	0.589	67%	0.674	S	S	*	*			cis	-164.5	-179.7	24.5	-22.1	0	0	0	0	112.6
47	T	33	Very low	34.4	Very low	100 Å²	100	116.1 Å²	116.1	61%	0.613	67%	0.671	S	S	*	*			trans	70.1	155	148.2	45.8	0	0	0	0	121.3
48	D	32.9	Very low	34.2	Very low	53 Å²	53	115 Å²	115	28%	0.283	67%	0.666	S	S	.	*			cis	-169.7	-178.9	-29.6	-113.1	23.4	0	0	0	109.8	K1522 W1525	D48-K1522 VanDerWaalsContact OD1-O 3.1Å; D48-W1525 PolarHBondContact O-NE1 3.2Å
49	Y	36.1	Very low	33.9	Very low	178 Å²	178	113 Å²	113	70%	0.698	66%	0.658	S	S	*	*			trans	100.4	83.6	168.3	-68.6	-87.3	0	0	0	119	W1525	Y49-W1525 PolarHBondContact O-NE1 3.28Å
50	S	35	Very low	33.6	Very low	78 Å²	78	113.3 Å²	113.3	55%	0.545	66%	0.66	S	S	.	*				62.7	101.8	76.3	-178.9	0	0	0	0	117.3
51	S	34.1	Very low	33.3	Very low	87 Å²	87	112.9 Å²	112.9	61%	0.608	66%	0.656	S	S	*	*				171.4	158.7	119.7	46.7	0	0	0	0	110
52	K	35.4	Very low	33.1	Very low	191 Å²	191	108.6 Å²	108.6	83%	0.83	63%	0.632	S	S	*	*			cis	-142.6	179.3	-13.5	-120.7	168.9	-177.2	179.4	0	108.1
53	A	35.1	Very low	33.1	Very low	71 Å²	71	109.2 Å²	109.2	59%	0.587	63%	0.628	S	S	*	*			trans	-108.1	168.1	169.8	0	0	0	0	0	110.2	D55	A53-D55 HydrophobicContact CB-CB 4.04Å
54	P	33.6	Very low	33	Very low	128 Å²	128	110.6 Å²	110.6	83%	0.831	63%	0.626	S	S	*	*				-124.4	154.3	92	4.1	17.9	0	0	0	112
55	D	31	Very low	33.3	Very low	139 Å²	139	113.5 Å²	113.5	74%	0.743	64%	0.639	S	S	*	*			cis	70.2	142.8	0.4	-135	-14	0	0	0	117.6	A53	A53-D55 HydrophobicContact CB-CB 4.04Å
56	V	32.8	Very low	33.3	Very low	138 Å²	138	109.1 Å²	109.1	84%	0.836	64%	0.636	S	S	*	*			trans	71	138.8	-164.4	-169	0	0	0	0	114
57	G	30.5	Very low	32.8	Very low	60 Å²	60	109.7 Å²	109.7	62%	0.619	64%	0.644	S	S	*	*			cis	137.8	132.1	-17.1	0	0	0	0	0	116.7
58	Q	30.7	Very low	32.5	Very low	146 Å²	146	113 Å²	113	68%	0.682	65%	0.653	S	S	*	*			trans	78.9	135	150.1	-65.6	-177.5	6.4	0	0	122.2
59	T	29.3	Very low	32.2	Very low	96 Å²	96	116.7 Å²	116.7	59%	0.589	67%	0.671	S	S	*	*			trans	83.2	157.8	137.9	45.8	0	0	0	0	122.2	T351	T59-T351 HydrophobicContact CG2-CG2 4.28Å
60	V	29.7	Very low	31.7	Very low	125 Å²	125	113 Å²	113	76%	0.758	67%	0.671	S	S	*	*			trans	79.9	141.9	171.7	-166.4	0	0	0	0	115.3
61	T	30.8	Very low	31.4	Very low	96 Å²	96	114.4 Å²	114.4	59%	0.589	68%	0.676	S	S	*	*				170.5	139.9	-68.4	45.8	0	0	0	0	109.9
62	I	29.8	Very low	30.9	Very low	67 Å²	67	115.9 Å²	115.9	34%	0.344	69%	0.685	S	S	.	*			trans	78.1	96.1	142.1	-67.1	162.4	0	0	0	118.9	V347	I62-V347 HydrophobicContact CB-CG1 4.34Å; I62-V347 HydrophobicContact CG1-CB 4.28Å; I62-V347 HydrophobicContact CG1-CG1 3.77Å; I62-V347 HydrophobicContact CG2-CG1 4.12Å
63	N	33.4	Very low	30.6	Very low	113 Å²	113	112.7 Å²	112.7	60%	0.604	68%	0.677	S	S	*	*				172.5	167.6	112.7	-86.3	-28.9	0	0	0	110.8	S346 V347	N63-S346 PolarHBondContact N-OG 2.78Å; N63-S346 WeakPolarHBondContact O-CB 3.36Å; N63-S346 PolarHBondContact O-OG 2.69Å; N63-V347 VanDerWaalsContact CA-CG2 3.49Å
64	H	37.6	Very low	30.2	Very low	121 Å²	121	114.1 Å²	114.1	56%	0.56	68%	0.679	S	S	*	*			cis	170.5	159	-42.1	-141.9	-66.3	0	0	0	105.3	V347	H64-V347 HydrophobicContact CB-CG2 4.06Å
65	D	37.2	Very low	30	Very low	141 Å²	141	114 Å²	114	75%	0.754	67%	0.667	S	S	*	*			trans	77.6	151.5	160.2	-50.1	-35.8	0	0	0	120.5
66	G	33.9	Very low	29.9	Very low	67 Å²	67	114 Å²	114	69%	0.691	66%	0.657	S	S	*	*			trans	77	91.2	178.7	0	0	0	0	0	114.2
67	S	27.6	Very low	29.7	Very low	109 Å²	109	111.4 Å²	111.4	76%	0.762	64%	0.638	S	S	*	*			cis	64.2	133.5	27.4	81.7	0	0	0	0	116.6
68	E	26.9	Very low	29.7	Very low	170 Å²	170	112.4 Å²	112.4	79%	0.794	63%	0.629	S	S	*	*			trans	85.3	138.7	160.2	-66.7	-168.6	159.4	0	0	122.2
69	I	25.1	Very low	29.7	Very low	129 Å²	129	109.4 Å²	109.4	66%	0.662	61%	0.614	S	S	*	*			trans	64.8	100.1	150.8	-65.1	158.8	0	0	0	116
70	S	26.2	Very low	29.6	Very low	100 Å²	100	113.2 Å²	113.2	70%	0.699	62%	0.617	S	S	*	*				78.2	-173.5	50.4	92.6	0	0	0	0	113.7
71	V	27.9	Very low	29.4	Very low	108 Å²	108	111.7 Å²	111.7	66%	0.655	61%	0.608	S	S	*	*			trans	67.1	90.5	-165.5	-167.5	0	0	0	0	110.5
72	C	25.1	Very low	29.2	Very low	118 Å²	118	115.1 Å²	115.1	80%	0.797	62%	0.615	S	S	*	*				50.5	75.6	50.4	-54.8	0	0	0	0	112.9
73	D	28	Very low	28.9	Very low	124 Å²	124	118.7 Å²	118.7	66%	0.663	63%	0.628	S	S	*	*			trans	-147.4	117.6	139.7	-103.6	-36.3	0	0	0	108.4
74	T	26.9	Very low	28.5	Very low	101 Å²	101	116.7 Å²	116.7	62%	0.62	62%	0.623	S	S	*	*				45	117.6	89.8	87.8	0	0	0	0	113.2
75	Q	29.1	Very low	27.9	Very low	127 Å²	127	116.5 Å²	116.5	59%	0.593	62%	0.618	S	S	*	*				176.7	147.5	101.5	-98.1	156.2	72	0	0	113.4
76	R	30.2	Very low	27.5	Very low	139 Å²	139	113.7 Å²	113.7	53%	0.525	60%	0.6	S	S	.	*			trans	46.4	104	138.4	-61.2	162.9	167.6	124.2	0.1	114.9	E1181	R76-E1181 HydrophobicContact CG-CG 3.94Å; R76-E1181 IonicContact CZ-OE1 2.7Å; R76-E1181 IonicContact NE-OE1 2.99Å; R76-E1181 PolarHBondContact NE-OE1 3.43Å; R76-E1181 IonicContact NH2-OE1 3.66Å; R76-E1181 PolarHBondContact NH2-OE1 3.05Å
77	L	27.5	Very low	27.2	Very low	83 Å²	83	111.7 Å²	111.7	44%	0.435	57%	0.574	S	S	.	*				49.1	113.3	82.7	-58.2	160.5	0	0	0	110.9
78	N	30.9	Very low	27.3	Very low	80 Å²	80	108.3 Å²	108.3	43%	0.428	55%	0.546	S	S	.	.			trans	-166.9	97.3	143.7	-88.3	-32.5	0	0	0	113.2	S1178 P1179 T1180	N78-S1178 VanDerWaalsContact ND2-CB 3.33Å; N78-S1178 WeakPolarHBondContact ND2-CB 3.26Å; N78-P1179 WeakPolarHBondContact OD1-CA 3.32Å; N78-P1179 PolarHBondContact OD1-O 3.3Å; N78-T1180 VanDerWaalsContact OD1-CA 3.27Å; N78-T1180 WeakPolarHBondContact OD1-CA 3.42Å; N78-T1180 PolarHBondContact OD1-N 3.1Å; N78-T1180 PolarHBondContact OD1-O 3.09Å
79	K	30.5	Very low	27.6	Very low	84 Å²	84	103.9 Å²	103.9	37%	0.365	53%	0.534	S	S	.	.				40.5	138.6	118.7	-79.4	-142.3	-165.7	74.1	0	120.2	P1179 T1180 E1181	K79-P1179 VanDerWaalsContact CD-O 3.24Å; K79-P1179 WeakPolarHBondContact CD-O 3.47Å; K79-P1179 PolarHBondContact NZ-O 2.92Å; K79-T1180 WeakPolarHBondContact CG-O 3.33Å; K79-T1180 PolarHBondContact NZ-O 3.2Å; K79-T1180 PolarHBondContact NZ-OG1 2.85Å; K79-E1181 PolarHBondContact NZ-O 2.81Å; K79-E1181 VanDerWaalsContact NZ-O 3.16Å
80	R	27	Very low	28	Very low	175 Å²	175	102.8 Å²	102.8	66%	0.66	53%	0.53	S	S	*	.			trans	84.2	143.5	133.5	-78.9	174.7	174.4	171.4	-0.2	119
81	V	26.9	Very low	28.5	Very low	93 Å²	93	102 Å²	102	56%	0.564	52%	0.522	S	S	*	.			cis	-167.2	144.8	-23.4	100.7	0	0	0	0	110.7
82	F	25.5	Very low	28.7	Very low	168 Å²	168	101.7 Å²	101.7	74%	0.737	52%	0.517	S	S	*	.			trans	54.2	-171.3	167.8	-57.4	-167.2	0	0	0	112.4
83	F	23.8	Very low	29.2	Very low	142 Å²	142	103 Å²	103	62%	0.623	51%	0.511	S	S	*	.			cis	-111.7	142.5	-22.3	-78.6	-100.4	0	0	0	105.7	Y85	F83-Y85 HydrophobicContact CB-CD2 4.41Å; F83-Y85 HydrophobicContact CD1-CD2 4.11Å; F83-Y85 AromaticContact CD1-CE2 3.57Å; F83-Y85 HydrophobicContact CD1-CE2 3.57Å; F83-Y85 HydrophobicContact CE1-CE2 4.08Å; F83-Y85 HydrophobicContact CG-CE2 4.49Å
84	S	24.5	Very low	29.5	Very low	72 Å²	72	105.7 Å²	105.7	50%	0.503	51%	0.513	S	S	.	.				52.3	124.9	69.2	-176	0	0	0	0	113.2
85	Y	25.7	Very low	30	Very low	117 Å²	117	105.8 Å²	105.8	46%	0.459	52%	0.516	S	S	.	.				164.5	135.9	114.2	-94.1	-57.4	0	0	0	116.2	F83 K1460 D1461 P1462	F83-Y85 HydrophobicContact CB-CD2 4.41Å; F83-Y85 HydrophobicContact CD1-CD2 4.11Å; F83-Y85 AromaticContact CD1-CE2 3.57Å; F83-Y85 HydrophobicContact CD1-CE2 3.57Å; F83-Y85 HydrophobicContact CE1-CE2 4.08Å; F83-Y85 HydrophobicContact CG-CE2 4.49Å; Y85-K1460 HydrophobicContact CD1-CD 3.7Å; Y85-K1460 HydrophobicContact CE1-CD 4.1Å; Y85-D1461 CarbonylContact C-O 3.49Å; Y85-D1461 VanDerWaalsContact C-O 3.25Å; Y85-D1461 PolarHBondContact N-O 2.82Å; Y85-D1461 CarbonylContact O-C 3.56Å; Y85-P1462 VanDerWaalsContact O-CD 3.25Å; Y85-P1462 WeakPolarHBondContact O-CD 3.35Å; Y85-P1462 VanDerWaalsContact O-N 3.1Å
86	H	29.4	Very low	29.9	Very low	81 Å²	81	107.9 Å²	107.9	38%	0.375	52%	0.523	S	S	.	.			trans	56.3	127.5	152.9	-78	-89.4	0	0	0	119.4	E1459 K1460 P1462 N2119	H86-E1459 IonicContact CE1-OE1 2.79Å; H86-E1459 IonicContact ND1-OE1 2.85Å; H86-K1460 WeakPolarHBondContact CE1-CE 3.38Å; H86-K1460 PolarHBondContact CE1-NZ 2.63Å; H86-K1460 WeakPolarHBondContact ND1-CE 3Å; H86-K1460 WeakPolarHBondContact NE2-CE 3.01Å; H86-K1460 PolarHBondContact NE2-NZ 2.68Å; H86-P1462 WeakPolarHBondContact O-CD 3.31Å; H86-N2119 VanDerWaalsContact O-CB 3.23Å; H86-N2119 WeakPolarHBondContact O-CB 3.48Å; H86-N2119 PolarHBondContact O-ND2 2.74Å
87	N	26.6	Very low	30.1	Very low	25 Å²	25	110.3 Å²	110.3	13%	0.134	54%	0.54	C	S	.	.			cis	-165.2	147.8	-9.9	-107	2.9	0	0	0	107	E1459 K1460 N2119	N87-E1459 PolarHBondContact ND2-OE1 3.43Å; N87-K1460 VanDerWaalsContact OD1-CA 3.25Å; N87-K1460 WeakPolarHBondContact OD1-CA 3.46Å; N87-K1460 WeakPolarHBondContact OD1-CE 3.31Å; N87-K1460 PolarHBondContact OD1-N 3.23Å; N87-N2119 CarbonylContact O-C 3.6Å
88	E	30.5	Very low	30.2	Very low	39 Å²	39	110.7 Å²	110.7	18%	0.182	56%	0.555	C	S	.	*				51.1	165.4	122.4	-48.7	178.6	123.1	0	0	125.3	R1458 E1459	E88-R1458 VanDerWaalsContact OE1-CB 3.25Å; E88-R1458 WeakPolarHBondContact OE1-CB 3.46Å; E88-R1458 WeakPolarHBondContact OE1-CD 3.37Å; E88-R1458 WeakPolarHBondContact OE1-CG 3.41Å; E88-R1458 IonicContact OE1-CZ 2.82Å; E88-R1458 IonicContact OE1-NE 3.31Å; E88-R1458 PolarHBondContact OE1-NE 2.89Å; E88-R1458 IonicContact OE1-NH2 3.23Å; E88-R1458 IonicContact OE2-CZ 3.18Å; E88-R1458 IonicContact OE2-NE 3.8Å; E88-R1458 PolarHBondContact OE2-NE 2.64Å; E88-R1458 IonicContact OE2-NH2 3.25Å; E88-R1458 PolarHBondContact OE2-NH2 3.33Å; E88-E1459 VanDerWaalsContact CD-CG 3.44Å; E88-E1459 HydrophobicContact CG-CG 4.33Å; E88-E1459 VanDerWaalsContact OE1-CA 3.28Å; E88-E1459 WeakPolarHBondContact OE1-CA 3.41Å; E88-E1459 WeakPolarHBondContact OE1-CG 3.44Å; E88-E1459 PolarHBondContact OE1-N 2.81Å
89	S	32.7	Very low	30.3	Very low	77 Å²	77	113.4 Å²	113.4	54%	0.538	57%	0.574	S	S	.	*			trans	88	115.1	157.3	-24.1	0	0	0	0	115	G2121 A2122	S89-G2121 WeakPolarHBondContact O-CA 3.18Å; S89-G2121 PolarHBondContact O-N 2.86Å; S89-A2122 CarbonylContact C-O 3.59Å
90	D	33	Very low	30.2	Very low	106 Å²	106	114.6 Å²	114.6	57%	0.567	59%	0.589	S	S	*	*			cis	67.7	142.7	49.2	-154.2	72.8	0	0	0	112	A2122	D90-A2122 PolarHBondContact N-O 3.31Å
91	P	36.7	Very low	30.5	Very low	83 Å²	83	115.1 Å²	115.1	54%	0.539	59%	0.592	S	S	.	*			cis	-132.7	143	-29.4	35.6	-19.5	0	0	0	115.7	V2123	P91-V2123 CarbonylContact C-O 3.53Å; P91-V2123 WeakPolarHBondContact CA-O 3.21Å
92	D	32.6	Very low	30.6	Very low	102 Å²	102	114.5 Å²	114.5	55%	0.545	60%	0.604	S	S	.	*			trans	66.8	175.6	132	-139.8	-23.6	0	0	0	120.6	V2123 C2124	D92-V2123 PolarHBondContact N-O 3.35Å; D92-C2124 HydrophobicContact CB-CB 3.77Å; D92-C2124 WeakPolarHBondContact OD2-CB 3.04Å
93	E	36.1	Very low	30.8	Very low	146 Å²	146	115.2 Å²	115.2	68%	0.682	61%	0.61	S	S	*	*			trans	74.9	102	148.4	-80.1	-160	96.1	0	0	121.3
94	Y	32.9	Very low	31.2	Very low	180 Å²	180	114.2 Å²	114.2	71%	0.706	62%	0.62	S	S	*	*				68.9	178.4	111.4	-118.1	-155	0	0	0	118.7	F96	Y94-F96 HydrophobicContact CD2-CD2 4.47Å; Y94-F96 HydrophobicContact CE2-CD2 4.02Å; Y94-F96 AromaticContact CE2-CE2 3.97Å; Y94-F96 HydrophobicContact CE2-CE2 3.97Å
95	P	38.1	Very low	31.4	Very low	103 Å²	103	120.2 Å²	120.2	67%	0.669	64%	0.641	S	S	*	*			cis	-113.8	164.7	-27.2	6.7	15.5	0	0	0	113.6
96	F	26.9	Very low	31.6	Very low	170 Å²	170	118.1 Å²	118.1	75%	0.746	65%	0.654	S	S	*	*			trans	-43.2	144.9	157	-61.4	-102.3	0	0	0	113.6	Y94	Y94-F96 HydrophobicContact CD2-CD2 4.47Å; Y94-F96 HydrophobicContact CE2-CD2 4.02Å; Y94-F96 AromaticContact CE2-CE2 3.97Å; Y94-F96 HydrophobicContact CE2-CE2 3.97Å
97	H	33.8	Very low	31.7	Very low	190 Å²	190	119.7 Å²	119.7	88%	0.88	67%	0.673	S	S	*	*			trans	-152.8	137.9	131.5	-102.8	-64.7	0	0	0	112.5
98	A	29.6	Very low	31.9	Very low	91 Å²	91	128.6 Å²	128.6	75%	0.752	71%	0.705	S	S	*	*			trans	-45.5	128.2	-169.6	0	0	0	0	0	117.5
99	V	33.2	Very low	31.8	Very low	137 Å²	137	130.3 Å²	130.3	83%	0.83	73%	0.733	S	S	*	*			trans	-130.2	98.7	145.9	-178.4	0	0	0	0	108.9	Y101	V99-Y101 PolarHBondContact O-N 3.08Å
100	T	27.8	Very low	31.8	Very low	109 Å²	109	133.5 Å²	133.5	67%	0.669	74%	0.744	S	S	*	*			trans	-78	108.3	165.8	48	0	0	0	0	109.9
101	Y	33.2	Very low	31.6	Very low	187 Å²	187	133 Å²	133	73%	0.733	75%	0.746	S	S	*	*			trans	-159.2	134.5	147.7	-89	-59	0	0	0	109.2	V99 F2067	V99-Y101 PolarHBondContact O-N 3.08Å; Y101-F2067 HydrophobicContact CD1-CZ 4.46Å; Y101-F2067 HydrophobicContact CE1-CE1 4.01Å; Y101-F2067 HydrophobicContact CE1-CE2 4.45Å; Y101-F2067 AromaticContact CE1-CZ 3.67Å; Y101-F2067 HydrophobicContact CE1-CZ 3.67Å
102	G	30.3	Very low	31.3	Very low	80 Å²	80	139 Å²	139	83%	0.825	76%	0.759	S	S	*	*			trans	-88.5	144.9	-161.6	0	0	0	0	0	116
103	E	29.4	Very low	31.4	Very low	183 Å²	183	139.5 Å²	139.5	86%	0.855	76%	0.762	S	S	*	*			trans	-115.3	89.7	179.2	-65.3	-159.1	133.4	0	0	113	E105	E103-E105 PolarHBondContact O-N 2.82Å
104	S	33	Very low	31.3	Very low	120 Å²	120	137.1 Å²	137.1	84%	0.839	75%	0.754	S	S	*	*			trans	31.4	79.7	146.4	61	0	0	0	0	119.3
105	E	27.2	Very low	31.4	Very low	199 Å²	199	135.7 Å²	135.7	93%	0.93	75%	0.753	S	S	*	*			trans	-70.1	154.6	145.6	-73.2	-150.2	138.3	0	0	111.2	E103	E103-E105 PolarHBondContact O-N 2.82Å
106	G	31.3	Very low	31.3	Very low	72 Å²	72	137.8 Å²	137.8	74%	0.742	76%	0.759	S	S	*	*			trans	94.9	100.5	162.7	0	0	0	0	0	117
107	C	30.5	Very low	31.5	Very low	115 Å²	115	140 Å²	140	78%	0.777	76%	0.764	S	S	*	*			trans	-155.7	86.9	151.3	-102.7	0	0	0	0	113.3
108	W	30.6	Very low	31.5	Very low	211 Å²	211	135 Å²	135	80%	0.799	76%	0.756	S	S	*	*			trans	61.8	78.3	144	-48.6	105.2	0	0	0	119.7
109	G	29.7	Very low	31.6	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-68.1	134.1	138	0	0	0	0	0	109.8
110	L	31.7	Very low	31.5	Very low	145 Å²	145	139.4 Å²	139.4	76%	0.759	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-77.2	127.5	-169.5	-74.2	170	0	0	0	113.3
111	P	29.1	Very low	31.7	Very low	95 Å²	95	142.5 Å²	142.5	62%	0.617	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-75	145	166.5	32.7	-33.6	0	0	0	110.3
112	Y	29.9	Very low	31.7	Very low	209 Å²	209	138 Å²	138	82%	0.82	76%	0.756	S	S	*	*			trans	-134.7	122.3	169.5	-109.8	-77.8	0	0	0	112
113	N	35.6	Very low	31.6	Very low	112 Å²	112	141 Å²	141	60%	0.599	75%	0.753	S	S	*	*			trans	-70.6	135.2	-166.3	-76.4	-8.7	0	0	0	114.5	H115	N113-H115 PolarHBondContact ND2-CE1 3.17Å; N113-H115 PolarHBondContact ND2-NE2 3.23Å; N113-H115 PolarHBondContact O-N 3.28Å
114	D	32.6	Very low	32	Very low	97 Å²	97	138.2 Å²	138.2	52%	0.519	75%	0.75	S	S	.	*			trans	-76.1	99.6	155.1	-93	5	0	0	0	110	R652	D114-R652 IonicContact OD1-CZ 2.64Å; D114-R652 VanDerWaalsContact OD1-CZ 3.28Å; D114-R652 IonicContact OD1-NH1 3.61Å; D114-R652 PolarHBondContact OD1-NH1 2.95Å; D114-R652 IonicContact OD1-NH2 3.16Å; D114-R652 PolarHBondContact OD1-NH2 3.3Å; D114-R652 IonicContact OD2-CZ 3.04Å; D114-R652 IonicContact OD2-NH1 2.67Å; D114-R652 IonicContact OD2-NH2 3.27Å; D114-R652 PolarHBondContact OD2-NH2 2.96Å
115	H	35.7	Very low	31.9	Very low	149 Å²	149	139.4 Å²	139.4	69%	0.69	75%	0.747	S	S	*	*			trans	-127.2	79.7	174.8	-74.3	-5.8	0	0	0	111.3	N113	N113-H115 PolarHBondContact ND2-CE1 3.17Å; N113-H115 PolarHBondContact ND2-NE2 3.23Å; N113-H115 PolarHBondContact O-N 3.28Å
116	N	36.2	Very low	32.1	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	74%	0.742	S	S	*	*			trans	-154.5	53.9	157.3	-137.8	-1.7	0	0	0	114.1
117	Y	30.9	Very low	32.1	Very low	216 Å²	216	143 Å²	143	85%	0.847	75%	0.75	S	S	*	*			trans	-101.6	98.9	155.6	-114.7	-95.4	0	0	0	108.5	S119	Y117-S119 PolarHBondContact O-N 2.81Å
118	A	34.3	Very low	32	Very low	85 Å²	85	148.3 Å²	148.3	70%	0.702	75%	0.754	S	S	*	*			trans	-96.4	69	-178.4	0	0	0	0	0	111.2
119	S	32.2	Very low	32.1	Very low	102 Å²	102	143.6 Å²	143.6	71%	0.713	75%	0.753	S	S	*	*			trans	-85.9	115.3	163.4	49.6	0	0	0	0	109.4	Y117	Y117-S119 PolarHBondContact O-N 2.81Å
120	Y	29.6	Very low	32.1	Very low	218 Å²	218	144.8 Å²	144.8	86%	0.855	75%	0.745	S	S	*	*			trans	-74.5	134	174.2	-101.4	-104.3	0	0	0	110.9
121	E	32.9	Very low	32.2	Very low	175 Å²	175	146.3 Å²	146.3	82%	0.818	75%	0.749	S	S	*	*			trans	-149.4	156	139.6	-93	-53.1	100.3	0	0	108.2
122	P	34.1	Very low	32.6	Very low	93 Å²	93	146.7 Å²	146.7	60%	0.604	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-101.1	156.4	-161.1	37.5	-34.5	0	0	0	116.5
123	N	28.2	Very low	32.9	Very low	143 Å²	143	144.2 Å²	144.2	77%	0.765	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-58.2	145.7	174.1	-77.4	3.3	0	0	0	114.7
124	P	35.8	Very low	33.4	Very low	123 Å²	123	143.8 Å²	143.8	80%	0.799	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-88.1	143.2	133.2	34.2	-29	0	0	0	111.3
125	D	31.9	Very low	33.9	Very low	145 Å²	145	149.6 Å²	149.6	78%	0.775	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-80.6	159.4	-176.8	-83.3	-54.1	0	0	0	114.5
126	H	31.1	Very low	34.6	Very low	175 Å²	175	149.5 Å²	149.5	81%	0.81	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-61.6	149.6	179.5	-58.7	-57.4	0	0	0	114.8
127	N	31.2	Very low	35.5	Very low	172 Å²	172	144.7 Å²	144.7	92%	0.92	75%	0.746	S	S	*	*				-156.8	141.1	118.9	-101.8	-46.7	0	0	0	114.1
128	R	29.5	Very low	36.7	Very low	226 Å²	226	139.8 Å²	139.8	85%	0.853	73%	0.734	S	S	*	*			trans	-83.1	145.8	-174.4	-74.5	171.5	158.3	-167	-6.7	114.1	V130	R128-V130 HydrophobicContact CB-CG2 4.4Å
129	S	30.8	Very low	37.7	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	73%	0.731	S	S	*	*				-165.7	122.8	116.3	-147	0	0	0	0	106.7
130	V	30.8	Very low	38.5	Very low	100 Å²	100	139.9 Å²	139.9	61%	0.606	72%	0.723	S	S	*	*			cis	63.2	98.2	47.6	-170.7	0	0	0	0	112.2	R128	R128-V130 HydrophobicContact CB-CG2 4.4Å
131	E	33.9	Very low	39.5	Very low	177 Å²	177	136.9 Å²	136.9	83%	0.827	71%	0.714	S	S	*	*			trans	-152.9	159	142.2	-91.7	-60.7	91.2	0	0	106.7
132	P	38.1	Very low	40.6	Very low	103 Å²	103	135.1 Å²	135.1	67%	0.669	71%	0.71	S	S	*	*			trans	-118.2	-178.4	-140.1	42.5	-35.2	0	0	0	117.4
133	D	35.7	Very low	41.2	Very low	157 Å²	157	134.5 Å²	134.5	84%	0.84	71%	0.713	S	S	*	*			trans	-68.8	134.6	-179.8	-46.9	-93.8	0	0	0	114.5
134	D	45.8	Very low	41.8	Very low	103 Å²	103	135 Å²	135	55%	0.551	71%	0.714	S	S	*	*			trans	-154.5	13.1	155.5	-139	-7.2	0	0	0	115.2	S137	D134-S137 WeakPolarHBondContact OD1-CB 3.02Å; D134-S137 PolarHBondContact OD1-OG 3.4Å
135	R	44	Very low	42	Very low	219 Å²	219	133.1 Å²	133.1	83%	0.826	71%	0.71	S	S	*	*	H	α-helix	trans	-87.6	-21.4	-174.3	-59.6	-168.2	82.9	159.7	3.8	115.3
136	L	50.2	Low	42.2	Very low	147 Å²	147	133.6 Å²	133.6	77%	0.77	71%	0.705	S	S	*	*	H	α-helix	trans	-86.9	-33	172.1	-82.5	71.2	0	0	0	112.1	L138 L139 A140	L136-L138 PolarHBondContact O-N 3.02Å; L136-L139 PolarHBondContact O-N 3.49Å; L136-A140 PolarHBondContact O-N 3.41Å
137	S	54	Low	42.4	Very low	47 Å²	47	132.1 Å²	132.1	33%	0.329	70%	0.703	S	S	.	*	H	α-helix	trans	-59.4	-28.5	175	167.4	0	0	0	0	113.2	D134 K141	D134-S137 WeakPolarHBondContact OD1-CB 3.02Å; D134-S137 PolarHBondContact OD1-OG 3.4Å; S137-K141 WeakPolarHBondContact O-CD 3.39Å; S137-K141 WeakPolarHBondContact O-CG 3.41Å; S137-K141 PolarHBondContact OG-NZ 2.76Å
138	L	56.7	Low	42.9	Very low	112 Å²	112	130.8 Å²	130.8	59%	0.586	70%	0.696	S	S	*	*	H	α-helix	trans	-83.9	-30.9	179.4	-120.4	160.9	0	0	0	113.7	L136	L136-L138 PolarHBondContact O-N 3.02Å
139	L	56.2	Low	43	Very low	123 Å²	123	128 Å²	128	64%	0.644	70%	0.698	S	S	*	*	H	α-helix	trans	-76.7	-41	176	-76	166.2	0	0	0	111.8	L136 K141 L142	L136-L139 PolarHBondContact O-N 3.49Å; L139-K141 PolarHBondContact O-N 2.98Å; L139-K141 VanDerWaalsContact O-N 3.15Å; L139-L142 PolarHBondContact O-N 2.83Å; L139-L142 VanDerWaalsContact O-N 3.12Å
140	A	48.4	Very low	43.3	Very low	67 Å²	67	127.1 Å²	127.1	55%	0.554	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-22.1	176.4	0	0	0	0	0	113.7	L136	L136-A140 PolarHBondContact O-N 3.41Å
141	K	50.5	Low	43.2	Very low	154 Å²	154	131.4 Å²	131.4	67%	0.67	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-7.1	177.9	-74.9	172.4	-176.4	150.6	0	114.7	S137 L139	S137-K141 WeakPolarHBondContact O-CD 3.39Å; S137-K141 WeakPolarHBondContact O-CG 3.41Å; S137-K141 PolarHBondContact OG-NZ 2.76Å; L139-K141 PolarHBondContact O-N 2.98Å; L139-K141 VanDerWaalsContact O-N 3.15Å
142	L	55.5	Low	43.3	Very low	138 Å²	138	130.1 Å²	130.1	72%	0.723	71%	0.706	S	S	*	*	S	Bend	trans	-99.4	-4.4	176.8	-73.7	168.4	0	0	0	113.4	L139	L139-L142 PolarHBondContact O-N 2.83Å; L139-L142 VanDerWaalsContact O-N 3.12Å
143	A	47.8	Very low	42.8	Very low	80 Å²	80	129.2 Å²	129.2	66%	0.661	70%	0.702	S	S	*	*	S	Bend	trans	-106	-2.9	-175	0	0	0	0	0	114.9
144	L	39.7	Very low	42.4	Very low	153 Å²	153	129.8 Å²	129.8	80%	0.801	70%	0.698	S	S	*	*	S	Bend	trans	-135.4	45	-173	-69.7	175.3	0	0	0	112.7
145	A	40.8	Very low	41.7	Very low	85 Å²	85	131.4 Å²	131.4	70%	0.702	70%	0.702	S	S	*	*			trans	-153.8	135.9	169.4	0	0	0	0	0	110.1
146	K	35.3	Very low	41.1	Very low	155 Å²	155	125.8 Å²	125.8	67%	0.674	69%	0.692	S	S	*	*			cis	-163.7	146.7	-13.9	-174.9	-168.6	159.5	-70.9	0	106.6	D148	K146-D148 IonicContact NZ-OD1 2.89Å; K146-D148 PolarHBondContact NZ-OD1 2.61Å; K146-D148 IonicContact NZ-OD2 2.66Å; K146-D148 PolarHBondContact NZ-OD2 3.24Å
147	D	35.3	Very low	40.2	Very low	144 Å²	144	124.9 Å²	124.9	77%	0.77	69%	0.693	S	S	*	*			trans	-62.7	142.7	168.9	-42.1	-90.8	0	0	0	111.6
148	D	41.1	Very low	39.1	Very low	144 Å²	144	126.8 Å²	126.8	77%	0.77	71%	0.706	S	S	*	*			trans	-168.8	142.5	146.9	-81.2	-39	0	0	0	108.8	K146	K146-D148 IonicContact NZ-OD1 2.89Å; K146-D148 PolarHBondContact NZ-OD1 2.61Å; K146-D148 IonicContact NZ-OD2 2.66Å; K146-D148 PolarHBondContact NZ-OD2 3.24Å
149	D	32.8	Very low	38	Very low	168 Å²	168	132.3 Å²	132.3	90%	0.898	72%	0.719	S	S	*	*			trans	-86.6	148.7	-170.8	-70.7	-88.3	0	0	0	116.4
150	A	36.1	Very low	36.7	Very low	93 Å²	93	131.5 Å²	131.5	77%	0.769	72%	0.719	S	S	*	*			trans	173.2	134.5	140.8	0	0	0	0	0	109.1
151	K	30.1	Very low	35.7	Very low	191 Å²	191	134.3 Å²	134.3	83%	0.83	72%	0.724	S	S	*	*			cis	58.1	79.9	40.4	-68.8	-173.1	179	172.7	0	115.2
152	D	34.5	Very low	34.6	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	73%	0.729	S	S	*	*				-173.4	131	100.7	-88.7	-18.6	0	0	0	109.4
153	S	28.4	Very low	33.2	Very low	84 Å²	84	132.6 Å²	132.6	59%	0.587	73%	0.725	S	S	*	*				85	120.9	68.1	112.6	0	0	0	0	113.2
154	K	28	Very low	32.1	Very low	170 Å²	170	133.8 Å²	133.8	74%	0.739	72%	0.724	S	S	*	*			trans	64.7	164.7	162	-68	150.3	161.5	-100.9	0	116
155	E	29.5	Very low	31.3	Very low	136 Å²	136	133.2 Å²	133.2	64%	0.636	72%	0.721	S	S	*	*			cis	-138.5	129.6	-9.2	-125.3	137.9	-144.7	0	0	106.9
156	T	31	Very low	30.5	Very low	102 Å²	102	136.3 Å²	136.3	63%	0.626	72%	0.721	S	S	*	*				62.5	101.4	97.8	-51.3	0	0	0	0	115.3
157	T	32.8	Very low	30.2	Very low	128 Å²	128	133.9 Å²	133.9	79%	0.785	72%	0.719	S	S	*	*				-164.3	112.4	119.6	11.8	0	0	0	0	106.6
158	S	31.1	Very low	30	Very low	86 Å²	86	133.9 Å²	133.9	60%	0.601	72%	0.719	S	S	*	*				55.2	113.1	63.6	-42.8	0	0	0	0	110.1
159	R	32.1	Very low	29.2	Very low	229 Å²	229	137.8 Å²	137.8	86%	0.864	72%	0.723	S	S	*	*				-178.4	163.3	81	-86.6	172.3	-171	173.1	3.4	107.8
160	T	30.7	Very low	29	Very low	105 Å²	105	135 Å²	135	64%	0.644	71%	0.713	S	S	*	*			cis	-154.3	119.4	-1.1	-116.5	0	0	0	0	105.6
161	L	27.1	Very low	28.4	Very low	127 Å²	127	136.6 Å²	136.6	67%	0.665	71%	0.707	S	S	*	*				67.3	131.6	94.3	-69.7	173.9	0	0	0	114.9
162	Q	27.1	Very low	28.3	Very low	166 Å²	166	134.9 Å²	134.9	78%	0.776	70%	0.702	S	S	*	*			trans	72.8	145.2	139.8	-73.1	166.1	-29.9	0	0	118.2
163	S	25	Very low	27.7	Very low	89 Å²	89	135.9 Å²	135.9	62%	0.622	70%	0.702	S	S	*	*			cis	-169.4	177.2	-4.9	47.8	0	0	0	0	113.3
164	T	25	Very low	27.4	Very low	105 Å²	105	136.1 Å²	136.1	64%	0.644	70%	0.703	S	S	*	*			trans	61.4	122.5	140.1	44.5	0	0	0	0	121.4
165	L	23.8	Very low	27.1	Very low	141 Å²	141	132.6 Å²	132.6	74%	0.738	70%	0.7	S	S	*	*			trans	67.8	167	137.8	-54.9	168.7	0	0	0	114.7
166	Q	24.6	Very low	26.7	Very low	150 Å²	150	131.8 Å²	131.8	70%	0.701	71%	0.705	S	S	*	*			cis	-153.6	170.1	-18.4	-126.5	168.1	-47.3	0	0	109.3
167	T	27.4	Very low	26.4	Very low	104 Å²	104	132.4 Å²	132.4	64%	0.638	71%	0.708	S	S	*	*			trans	22.3	112	153	56.6	0	0	0	0	120.8
168	N	30.7	Very low	26	Very low	145 Å²	145	130.4 Å²	130.4	78%	0.775	70%	0.699	S	S	*	*			trans	60.6	175.3	140.4	-67.4	-8.6	0	0	0	118.9
169	W	24.7	Very low	25.9	Very low	225 Å²	225	131.4 Å²	131.4	85%	0.852	70%	0.702	S	S	*	*			trans	70.5	113.5	-179.7	-57.8	91	0	0	0	111.3
170	V	28.2	Very low	25.6	Very low	111 Å²	111	125.2 Å²	125.2	67%	0.673	69%	0.69	S	S	*	*				51.4	102.6	54.8	-169.4	0	0	0	0	107.5
171	L	24.1	Very low	25.6	Very low	125 Å²	125	128.5 Å²	128.5	65%	0.654	70%	0.695	S	S	*	*				-144	166.8	74.1	-163.2	55.4	0	0	0	112.3
172	E	27.9	Very low	25.5	Very low	155 Å²	155	126.7 Å²	126.7	72%	0.724	69%	0.693	S	S	*	*			trans	-38.4	146.4	142.4	-44.8	162.9	133.7	0	0	109.6
173	E	22.2	Very low	25.6	Very low	171 Å²	171	125 Å²	125	80%	0.799	69%	0.694	S	S	*	*				-142	104.1	127.5	-121.2	161.4	-135.3	0	0	108.6
174	S	22.5	Very low	25.7	Very low	88 Å²	88	124.1 Å²	124.1	62%	0.615	69%	0.688	S	S	*	*				53.6	129.8	119.4	-51.3	0	0	0	0	116.7
175	S	21.3	Very low	25.7	Very low	96 Å²	96	126.6 Å²	126.6	67%	0.671	70%	0.696	S	S	*	*			cis	-150.5	146.6	41.8	-56.6	0	0	0	0	108.3
176	T	21.7	Very low	25.9	Very low	119 Å²	119	125.1 Å²	125.1	73%	0.73	69%	0.693	S	S	*	*				31.8	132.1	79	93	0	0	0	0	112.6
177	V	24.4	Very low	26.1	Very low	115 Å²	115	125.5 Å²	125.5	70%	0.697	69%	0.694	S	S	*	*			cis	-129.6	150.1	29.4	-169.1	0	0	0	0	108
178	S	24.5	Very low	26.2	Very low	86 Å²	86	125.5 Å²	125.5	60%	0.601	70%	0.696	S	S	*	*			trans	-9.1	141.8	130.6	-16.1	0	0	0	0	113.4
179	T	28.5	Very low	25.9	Very low	108 Å²	108	122.9 Å²	122.9	66%	0.663	69%	0.689	S	S	*	*				-162	106.9	90.3	-72.1	0	0	0	0	102.7	K181	T179-K181 HydrophobicContact CG2-CD 4.28Å
180	T	27.4	Very low	25.8	Very low	98 Å²	98	116.7 Å²	116.7	60%	0.601	69%	0.686	S	S	*	*				46.9	153.7	77.7	76.7	0	0	0	0	112.5
181	K	29	Very low	25.5	Very low	174 Å²	174	119 Å²	119	76%	0.757	69%	0.694	S	S	*	*			trans	71.3	107.1	-174.8	-56	156.5	-171.7	174.2	0	109.3	T179	T179-K181 HydrophobicContact CG2-CD 4.28Å
182	S	26.7	Very low	26.2	Very low	89 Å²	89	118.7 Å²	118.7	62%	0.622	70%	0.701	S	S	*	*				56.6	128.5	82	79.6	0	0	0	0	110.6
183	V	28.7	Very low	26.3	Very low	132 Å²	132	116.9 Å²	116.9	80%	0.8	70%	0.703	S	S	*	*				-124.5	106.1	51.7	162.6	0	0	0	0	108.8
184	S	25.8	Very low	26.5	Very low	69 Å²	69	113.4 Å²	113.4	48%	0.483	70%	0.697	S	S	.	*				50.4	144.7	76.7	77.4	0	0	0	0	114
185	L	26.1	Very low	26.8	Very low	158 Å²	158	113.4 Å²	113.4	83%	0.827	69%	0.694	S	S	*	*			trans	66.7	140.6	170.6	-81.9	52.9	0	0	0	114.7
186	V	28	Very low	27.2	Very low	109 Å²	109	115.2 Å²	115.2	66%	0.661	69%	0.686	S	S	*	*			cis	-164	167.6	-15.7	60.9	0	0	0	0	107.5	P188	V186-P188 HydrophobicContact CG1-CG 4.34Å; V186-P188 WeakPolarHBondContact O-CD 2.24Å
187	E	29.4	Very low	27.8	Very low	158 Å²	158	115.4 Å²	115.4	74%	0.738	67%	0.673	S	S	*	*			trans	-57.3	119.6	153.8	-60.2	171.7	101.4	0	0	108.7
188	P	28.6	Very low	28.3	Very low	104 Å²	104	112.9 Å²	112.9	68%	0.675	66%	0.661	S	S	*	*				-115	110.3	116.5	-11.1	29.9	0	0	0	111.3	V186	V186-P188 HydrophobicContact CG1-CG 4.34Å; V186-P188 WeakPolarHBondContact O-CD 2.24Å
189	S	23.6	Very low	28.7	Very low	90 Å²	90	113.1 Å²	113.1	63%	0.629	66%	0.658	S	S	*	*				38.6	101.3	97.2	-50.3	0	0	0	0	117
190	A	22.7	Very low	28.8	Very low	96 Å²	96	113 Å²	113	79%	0.793	66%	0.657	S	S	*	*			trans	71.7	-170.4	136	0	0	0	0	0	118.1
191	L	22.9	Very low	28.7	Very low	158 Å²	158	112.8 Å²	112.8	83%	0.827	66%	0.659	S	S	*	*			trans	68.5	77.8	169.6	-62	159.2	0	0	0	115.5
192	C	38.2	Very low	28.7	Very low	120 Å²	120	111.6 Å²	111.6	81%	0.811	66%	0.661	S	S	*	*				-12.8	147.8	127.2	-58.1	0	0	0	0	114.7
193	P	29.5	Very low	28.7	Very low	117 Å²	117	112.2 Å²	112.2	76%	0.76	67%	0.665	S	S	*	*				-134.2	131.3	106.5	35.6	-27.2	0	0	0	115.8
194	S	26.8	Very low	28.6	Very low	97 Å²	97	109 Å²	109	68%	0.678	66%	0.658	S	S	*	*				76.7	112.4	129.1	-68.2	0	0	0	0	122.4
195	T	29	Very low	28.6	Very low	89 Å²	89	111.4 Å²	111.4	55%	0.546	67%	0.665	S	S	.	*				38.5	133.8	112.2	15.5	0	0	0	0	119.4	R197	T195-R197 HydrophobicContact CG2-CB 4.49Å; T195-R197 HydrophobicContact CG2-CG 3.92Å
196	R	30.8	Very low	28.5	Very low	134 Å²	134	109.2 Å²	109.2	51%	0.506	65%	0.654	S	S	.	*			cis	-144.7	135.3	47	-78.3	-154.9	153	135.6	2.3	114.2	N1892	R196-N1892 WeakPolarHBondContact CD-OD1 2.23Å; R196-N1892 PolarHBondContact NE-OD1 3.4Å; R196-N1892 PolarHBondContact NH1-OD1 3.29Å
197	R	34.2	Very low	28.5	Very low	123 Å²	123	109 Å²	109	46%	0.464	65%	0.653	S	S	.	*				65.6	147.5	69.7	-92	-171.2	-179.6	-159.8	-4.6	111.5	T195 R1893	T195-R197 HydrophobicContact CG2-CB 4.49Å; T195-R197 HydrophobicContact CG2-CG 3.92Å; R197-R1893 VanDerWaalsContact NH1-CA 3.29Å
198	S	33.3	Very low	28.5	Very low	62 Å²	62	106.7 Å²	106.7	43%	0.434	65%	0.652	S	S	.	*			cis	-165.8	-169.7	5.3	-119.4	0	0	0	0	106	V200	S198-V200 WeakPolarHBondContact OG-CG2 3.4Å
199	V	32.6	Very low	28.3	Very low	91 Å²	91	106.1 Å²	106.1	55%	0.552	65%	0.65	S	S	*	*			cis	-141.4	122.4	24.2	-166.5	0	0	0	0	105.2
200	V	30.7	Very low	28.3	Very low	104 Å²	104	108.1 Å²	108.1	63%	0.63	65%	0.654	S	S	*	*				63.5	131.9	70.4	160.9	0	0	0	0	109.7	S198	S198-V200 WeakPolarHBondContact OG-CG2 3.4Å
201	C	26.5	Very low	28.5	Very low	95 Å²	95	106.4 Å²	106.4	64%	0.642	65%	0.645	S	S	*	*			cis	-162.2	-150.7	-6.5	-116.5	0	0	0	0	107.4
202	N	27.7	Very low	28.7	Very low	149 Å²	149	106.8 Å²	106.8	80%	0.797	64%	0.643	S	S	*	*			trans	84.8	148.4	144.3	-72.2	4.2	0	0	0	116.8
203	S	28.3	Very low	28.2	Very low	102 Å²	102	106 Å²	106	71%	0.713	64%	0.638	S	S	*	*			cis	-176.7	149.6	-22.9	49.9	0	0	0	0	108.6
204	G	26.6	Very low	28	Very low	63 Å²	63	106.6 Å²	106.6	65%	0.649	64%	0.635	S	S	*	*			trans	87.5	145.3	164.2	0	0	0	0	0	113.9
205	L	24.8	Very low	28.1	Very low	120 Å²	120	107.5 Å²	107.5	63%	0.628	64%	0.636	S	S	*	*			cis	81.5	131.8	40	-67.2	163.8	0	0	0	113.2
206	N	24.7	Very low	27.9	Very low	112 Å²	112	108.3 Å²	108.3	60%	0.599	64%	0.641	S	S	*	*			trans	75.6	110.1	157	-55.7	1.1	0	0	0	117.9
207	T	28.8	Very low	27.6	Very low	106 Å²	106	106.8 Å²	106.8	65%	0.65	65%	0.647	S	S	*	*				11.4	153.9	110.8	49.6	0	0	0	0	118.8
208	P	29	Very low	27.1	Very low	108 Å²	108	105.1 Å²	105.1	70%	0.701	65%	0.65	S	S	*	*			cis	-107.6	174.8	6.8	17.2	7.3	0	0	0	111.6
209	S	24.4	Very low	26.8	Very low	92 Å²	92	107.2 Å²	107.2	64%	0.643	67%	0.665	S	S	*	*				61.1	142.4	52.6	144.6	0	0	0	0	113.2
210	N	24	Very low	26.4	Very low	133 Å²	133	108.2 Å²	108.2	71%	0.711	66%	0.663	S	S	*	*			trans	57.1	111.4	-173.8	-54.6	-48.3	0	0	0	113.9
211	G	26.4	Very low	26.1	Very low	59 Å²	59	108 Å²	108	61%	0.608	66%	0.662	S	S	*	*				75	120.7	53.6	0	0	0	0	0	108.4
212	Q	27	Very low	26	Very low	167 Å²	167	108.6 Å²	108.6	78%	0.78	67%	0.667	S	S	*	*				-143.4	150.7	66.1	-79.1	131.4	84.2	0	0	110.7	L214	Q212-L214 HydrophobicContact CB-CD1 4.42Å
213	S	26.6	Very low	25.8	Very low	102 Å²	102	106.3 Å²	106.3	71%	0.713	66%	0.663	S	S	*	*			cis	67.4	150.1	48.8	-169.1	0	0	0	0	112.9
214	L	26.2	Very low	26.5	Very low	130 Å²	130	109 Å²	109	68%	0.681	67%	0.668	S	S	*	*			trans	67.7	137.8	-175.6	-52.9	119.2	0	0	0	113.9	Q212	Q212-L214 HydrophobicContact CB-CD1 4.42Å
215	V	29.3	Very low	26.5	Very low	117 Å²	117	111.2 Å²	111.2	71%	0.709	67%	0.671	S	S	*	*			cis	-125.9	116.7	1.3	-178.4	0	0	0	0	106.6
216	T	24.1	Very low	26.6	Very low	106 Å²	106	110 Å²	110	65%	0.65	67%	0.673	S	S	*	*				67	161.9	71	-36.8	0	0	0	0	113.7
217	T	24	Very low	26.7	Very low	102 Å²	102	116.1 Å²	116.1	63%	0.626	69%	0.688	S	S	*	*			trans	73.5	105.9	165.4	58.1	0	0	0	0	118.8
218	T	24.9	Very low	26.5	Very low	87 Å²	87	115.5 Å²	115.5	53%	0.534	68%	0.684	S	S	.	*				48.2	130.5	129.1	62.9	0	0	0	0	118.6
219	S	25.5	Very low	26.5	Very low	106 Å²	106	118.1 Å²	118.1	74%	0.741	69%	0.69	S	S	*	*				-170.8	121.2	68.7	36.7	0	0	0	0	110.8
220	H	25	Very low	26.5	Very low	112 Å²	112	119.9 Å²	119.9	52%	0.519	69%	0.692	S	S	.	*				85.9	129.5	98.1	-88.2	-105.9	0	0	0	115.1	L489	H220-L489 WeakPolarHBondContact CE1-CD1 3.4Å
221	V	25.2	Very low	26.8	Very low	101 Å²	101	120.5 Å²	120.5	61%	0.612	69%	0.693	S	S	*	*				58.4	85.8	130	-174.1	0	0	0	0	116.9
222	S	23.2	Very low	26.7	Very low	107 Å²	107	121.9 Å²	121.9	75%	0.748	69%	0.694	S	S	*	*				73	176.5	115.8	-55.7	0	0	0	0	119.9
223	S	25	Very low	26.7	Very low	101 Å²	101	120.3 Å²	120.3	71%	0.706	70%	0.696	S	S	*	*			trans	77.5	123	156.9	72.7	0	0	0	0	117.6
224	L	41.3	Very low	26.8	Very low	158 Å²	158	120.1 Å²	120.1	83%	0.827	70%	0.701	S	S	*	*			trans	-42.7	138.7	148.5	-67.5	61.5	0	0	0	109
225	P	26.7	Very low	26.9	Very low	109 Å²	109	117.8 Å²	117.8	71%	0.708	71%	0.708	S	S	*	*				-136.7	117.3	109.9	30.6	-17.5	0	0	0	114.2	R227	P225-R227 PolarHBondContact O-N 3.05Å
226	S	26.9	Very low	26.9	Very low	95 Å²	95	115.4 Å²	115.4	66%	0.664	71%	0.707	S	S	*	*				33.9	92.6	115.9	-53.8	0	0	0	0	117.6
227	R	27.2	Very low	27.1	Very low	241 Å²	241	118.2 Å²	118.2	91%	0.909	72%	0.718	S	S	*	*			trans	-137	61.3	154.9	-110.7	166.1	-161.5	-173	5.2	114.5	P225	P225-R227 PolarHBondContact O-N 3.05Å
228	T	24.9	Very low	27.4	Very low	93 Å²	93	117.7 Å²	117.7	57%	0.571	72%	0.724	S	S	*	*				37.4	98.5	112.7	-51.6	0	0	0	0	116.8	L230	T228-L230 HydrophobicContact CG2-CB 3.75Å; T228-L230 HydrophobicContact CG2-CD1 3.77Å; T228-L230 HydrophobicContact CG2-CG 3.73Å
229	I	29.5	Very low	27.6	Very low	163 Å²	163	121.2 Å²	121.2	84%	0.836	74%	0.739	S	S	*	*			trans	-103.4	79.9	139.2	-58.1	-174.7	0	0	0	107.9	I231	I229-I231 PolarHBondContact O-N 2.8Å
230	L	24.5	Very low	28.1	Very low	128 Å²	128	121.5 Å²	121.5	67%	0.67	74%	0.739	S	S	*	*			trans	-69.8	102	158.5	-89.6	167.9	0	0	0	108.2	T228 S232	T228-L230 HydrophobicContact CG2-CB 3.75Å; T228-L230 HydrophobicContact CG2-CD1 3.77Å; T228-L230 HydrophobicContact CG2-CG 3.73Å; L230-S232 WeakPolarHBondContact CD2-OG 2.79Å
231	I	28.9	Very low	28.4	Very low	146 Å²	146	120.7 Å²	120.7	75%	0.749	74%	0.743	S	S	*	*			trans	-123.1	79.1	141.8	-55.9	-174.6	0	0	0	108.1	I229	I229-I231 PolarHBondContact O-N 2.8Å
232	S	25.5	Very low	28.7	Very low	89 Å²	89	123.1 Å²	123.1	62%	0.622	75%	0.752	S	S	*	*			trans	-60.2	141.2	157.7	-45.3	0	0	0	0	109.7	L230	L230-S232 WeakPolarHBondContact CD2-OG 2.79Å
233	T	26.4	Very low	29.2	Very low	134 Å²	134	126.9 Å²	126.9	82%	0.822	76%	0.758	S	S	*	*			trans	-159.8	160.2	138.5	1.2	0	0	0	0	111.3
234	A	28.5	Very low	29.4	Very low	98 Å²	98	128.4 Å²	128.4	81%	0.81	76%	0.757	S	S	*	*			trans	-54.6	148.8	180	0	0	0	0	0	112.5
235	G	28.6	Very low	29	Very low	80 Å²	80	130.3 Å²	130.3	83%	0.825	76%	0.761	S	S	*	*			cis	102.2	152.6	18.9	0	0	0	0	0	111.4
236	G	28.8	Very low	29.1	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	77%	0.767	S	S	*	*			trans	119.4	97.9	170.7	0	0	0	0	0	117.4
237	N	28.1	Very low	29.4	Very low	166 Å²	166	137.2 Å²	137.2	89%	0.888	77%	0.772	S	S	*	*			trans	76	149.3	131.5	-57.1	-21.9	0	0	0	123.3
238	A	31.8	Very low	29.4	Very low	91 Å²	91	130.8 Å²	130.8	75%	0.752	76%	0.764	S	S	*	*			trans	72.9	99.1	153.1	0	0	0	0	0	118
239	N	28.4	Very low	29.5	Very low	160 Å²	160	131.5 Å²	131.5	86%	0.856	77%	0.773	S	S	*	*			cis	42.6	142.2	48.3	-85.4	-20.8	0	0	0	114.4
240	P	34.7	Very low	29.5	Very low	112 Å²	112	128.3 Å²	128.3	73%	0.727	77%	0.765	S	S	*	*			cis	-132.5	-129.4	-5.9	36.4	-11.4	0	0	0	109.3
241	P	33.1	Very low	29.7	Very low	95 Å²	95	130.4 Å²	130.4	62%	0.617	78%	0.776	S	S	*	*			cis	-137.6	154.6	-27.9	31.5	-11	0	0	0	117.5
242	L	29.6	Very low	30	Very low	153 Å²	153	129.8 Å²	129.8	80%	0.801	78%	0.779	S	S	*	*			trans	62.3	148.8	145.6	-62.7	167.7	0	0	0	118.8
243	Q	34.8	Very low	30.4	Very low	186 Å²	186	130.4 Å²	130.4	87%	0.869	78%	0.781	S	S	*	*			cis	-135	178.7	31.8	-73.3	-176.2	-9.9	0	0	114.3
244	I	28.9	Very low	30.6	Very low	133 Å²	133	130.2 Å²	130.2	68%	0.682	77%	0.771	S	S	*	*			trans	-123.8	139.6	-171.2	-62.7	163.5	0	0	0	110.1
245	H	33.6	Very low	30.8	Very low	198 Å²	198	131.5 Å²	131.5	92%	0.917	77%	0.768	S	S	*	*			trans	-126.7	159.2	151	-121.2	-109.9	0	0	0	111.5
246	R	28.4	Very low	31	Very low	222 Å²	222	131.4 Å²	131.4	84%	0.838	75%	0.748	S	S	*	*			trans	-109.5	-174.2	-162.8	-70.2	-177.5	166.1	110.8	-6.7	112.9
247	V	32.5	Very low	31.3	Very low	127 Å²	127	134.1 Å²	134.1	77%	0.77	75%	0.746	S	S	*	*			trans	85.6	95.2	171.7	-167.8	0	0	0	0	111.3
248	S	27	Very low	31.6	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	73%	0.726	S	S	*	*				88.4	149.9	57.6	-65.9	0	0	0	0	113.5
249	S	28	Very low	31.8	Very low	107 Å²	107	130 Å²	130	75%	0.748	70%	0.704	S	S	*	*			trans	87.1	110.4	161.9	-45.4	0	0	0	0	118.8
250	S	29.2	Very low	31.8	Very low	96 Å²	96	125 Å²	125	67%	0.671	69%	0.691	S	S	*	*			trans	59.3	116.7	131.3	61.8	0	0	0	0	122.7
251	L	29	Very low	31.8	Very low	172 Å²	172	127.5 Å²	127.5	90%	0.901	70%	0.697	S	S	*	*			trans	40.3	110.7	134.2	-65.6	111.7	0	0	0	119.5
252	T	34.4	Very low	31.7	Very low	133 Å²	133	128.8 Å²	128.8	82%	0.816	71%	0.705	S	S	*	*			trans	-117.6	138.1	153.6	52.5	0	0	0	0	109
253	P	35.1	Very low	31.7	Very low	103 Å²	103	125 Å²	125	67%	0.669	70%	0.703	S	S	*	*			trans	-87.3	147.8	-138.7	31.4	-37.7	0	0	0	116.4
254	H	29.7	Very low	31.8	Very low	130 Å²	130	123.9 Å²	123.9	60%	0.602	70%	0.702	S	S	*	*			trans	-67.9	133.6	158.1	-75.4	-114.1	0	0	0	109.9	I256 F1832	H254-I256 HydrophobicContact CB-CD1 4.35Å; H254-I256 HydrophobicContact CB-CG1 3.79Å; H254-I256 PolarHBondContact O-N 2.88Å; H254-F1832 AromaticContact CE1-CE1 3.79Å; H254-F1832 AromaticContact CE1-CZ 3.46Å; H254-F1832 VanDerWaalsContact CE1-CZ 3.46Å; H254-F1832 WeakPolarHBondContact CE1-CZ 3.48Å
255	V	34.2	Very low	32.1	Very low	125 Å²	125	125.8 Å²	125.8	76%	0.758	71%	0.708	S	S	*	*			trans	-89.4	81.5	165.9	-177.3	0	0	0	0	108	L257	V255-L257 PolarHBondContact O-N 2.98Å
256	I	31.3	Very low	32.1	Very low	78 Å²	78	123 Å²	123	40%	0.4	70%	0.699	S	S	.	*			trans	-80.5	107.8	174.3	-47.6	175.3	0	0	0	107.8	H254 R258 E1830	H254-I256 HydrophobicContact CB-CD1 4.35Å; H254-I256 HydrophobicContact CB-CG1 3.79Å; H254-I256 PolarHBondContact O-N 2.88Å; I256-R258 HydrophobicContact CB-CG 4.32Å; I256-R258 HydrophobicContact CG2-CG 3.57Å; I256-R258 PolarHBondContact O-N 3.41Å; I256-E1830 VanDerWaalsContact CD1-OE1 3.28Å; I256-E1830 WeakPolarHBondContact CD1-OE1 2.82Å
257	L	35	Very low	32.2	Very low	123 Å²	123	116.7 Å²	116.7	64%	0.644	69%	0.688	S	S	*	*			trans	-75.1	82.3	163.7	-72.7	175	0	0	0	108.4	V255	V255-L257 PolarHBondContact O-N 2.98Å
258	R	35	Very low	32.4	Very low	124 Å²	124	116.9 Å²	116.9	47%	0.468	69%	0.69	S	S	.	*			trans	-67.5	146.8	172.6	-71.1	-165.3	176.1	159.5	6	110.6	I256 S1826	I256-R258 HydrophobicContact CB-CG 4.32Å; I256-R258 HydrophobicContact CG2-CG 3.57Å; I256-R258 PolarHBondContact O-N 3.41Å; R258-S1826 WeakPolarHBondContact CD-O 3.07Å; R258-S1826 PolarHBondContact NH1-O 2.81Å
259	T	35.4	Very low	32.8	Very low	47 Å²	47	117.8 Å²	117.8	29%	0.288	69%	0.691	S	S	.	*			trans	-92.6	168.2	173.7	46.7	0	0	0	0	111.4	F615 S1826	T259-F615 HydrophobicContact CG2-CB 3.88Å; T259-F615 WeakPolarHBondContact CG2-O 2.25Å; T259-F615 WeakPolarHBondContact OG1-CB 3.47Å; T259-S1826 PolarHBondContact O-OG 2.84Å
260	G	29.4	Very low	33	Very low	56 Å²	56	117 Å²	117	58%	0.577	69%	0.691	S	S	*	*			trans	87.8	76.1	174.3	0	0	0	0	0	114.5
261	L	35.5	Very low	33.3	Very low	164 Å²	164	118.3 Å²	118.3	86%	0.859	70%	0.698	S	S	*	*			trans	-166.4	122.5	155.4	-109.8	157.3	0	0	0	108.4
262	P	29.5	Very low	33.5	Very low	121 Å²	121	122 Å²	122	79%	0.786	70%	0.699	S	S	*	*			trans	-78.4	155.6	173.9	32.7	-35	0	0	0	111.5
263	G	30.8	Very low	33.4	Very low	73 Å²	73	124 Å²	124	75%	0.753	70%	0.7	S	S	*	*			trans	69.6	105	161.4	0	0	0	0	0	117.7
264	L	36.7	Very low	33.3	Very low	163 Å²	163	125.4 Å²	125.4	85%	0.853	71%	0.706	S	S	*	*			trans	-168.1	103.1	135.2	-110.5	168	0	0	0	110.7	I266	L264-I266 PolarHBondContact O-N 3.22Å
265	Q	35.4	Very low	33.4	Very low	174 Å²	174	123.2 Å²	123.2	81%	0.813	71%	0.705	S	S	*	*			trans	-74.7	119.2	166.1	-69.3	178.6	-11.9	0	0	108.7	S267	Q265-S267 PolarHBondContact O-N 3.37Å
266	I	33.5	Very low	33.2	Very low	140 Å²	140	123.2 Å²	123.2	72%	0.718	71%	0.706	S	S	*	*			trans	-88.4	84.1	173.1	-58.8	-179.2	0	0	0	108.4	L264 T268	L264-I266 PolarHBondContact O-N 3.22Å; I266-T268 HydrophobicContact CG2-CG2 4.09Å; I266-T268 PolarHBondContact O-N 3.44Å
267	S	31.1	Very low	33.4	Very low	89 Å²	89	126.1 Å²	126.1	62%	0.622	72%	0.722	S	S	*	*			trans	-74.5	80.4	-179.7	-59.2	0	0	0	0	112	Q265 T269	Q265-S267 PolarHBondContact O-N 3.37Å; S267-T269 VanDerWaalsContact C-N 3.31Å; S267-T269 PolarHBondContact O-N 2.81Å; S267-T269 VanDerWaalsContact O-N 3.15Å
268	T	34.8	Very low	33.4	Very low	130 Å²	130	125.2 Å²	125.2	80%	0.798	73%	0.726	S	S	*	*			trans	-86.2	66.4	172.2	47	0	0	0	0	112.8	I266	I266-T268 HydrophobicContact CG2-CG2 4.09Å; I266-T268 PolarHBondContact O-N 3.44Å
269	T	36.8	Very low	33.6	Very low	125 Å²	125	126.4 Å²	126.4	77%	0.767	74%	0.739	S	S	*	*	S	Bend	trans	-135.9	125.2	157.4	45.8	0	0	0	0	107.9	S267	S267-T269 VanDerWaalsContact C-N 3.31Å; S267-T269 PolarHBondContact O-N 2.81Å; S267-T269 VanDerWaalsContact O-N 3.15Å
270	A	32.4	Very low	34.8	Very low	91 Å²	91	127 Å²	127	75%	0.752	74%	0.74	S	S	*	*			trans	-61.4	148.5	-175.7	0	0	0	0	0	112	R272	A270-R272 PolarHBondContact O-N 3.11Å; A270-R272 VanDerWaalsContact O-N 3.11Å
271	P	34	Very low	37	Very low	124 Å²	124	127.6 Å²	127.6	81%	0.805	74%	0.736	S	S	*	*			trans	-65	113.8	-179.2	26.6	-34.5	0	0	0	110.9	Q273	P271-Q273 PolarHBondContact O-N 3.22Å
272	R	33.5	Very low	39.4	Very low	249 Å²	249	120.6 Å²	120.6	94%	0.94	70%	0.699	S	S	*	*			trans	-76.9	106.2	156.2	-87.4	-173	163.8	-151.5	-2.2	107.9	A270	A270-R272 PolarHBondContact O-N 3.11Å; A270-R272 VanDerWaalsContact O-N 3.11Å
273	Q	32.7	Very low	41.9	Very low	176 Å²	176	121.3 Å²	121.3	82%	0.822	69%	0.686	S	S	*	*			trans	-73.2	-179.3	159.3	-69.5	-179.7	-42.4	0	0	110.3	P271	P271-Q273 PolarHBondContact O-N 3.22Å
274	V	33.6	Very low	44.6	Very low	132 Å²	132	118.1 Å²	118.1	80%	0.8	65%	0.653	S	S	*	*			trans	77.9	87	-167.8	-171.2	0	0	0	0	110.5
275	S	30.5	Very low	46.7	Very low	84 Å²	84	114.1 Å²	114.1	59%	0.587	64%	0.635	S	S	*	*				59	126.7	67.2	83.8	0	0	0	0	112.5
276	T	30.8	Very low	49	Very low	125 Å²	125	108.1 Å²	108.1	77%	0.767	61%	0.612	S	S	*	*			cis	-142.5	146.7	23.8	55.2	0	0	0	0	113.2
277	D	36.3	Very low	51.1	Low	138 Å²	138	104.4 Å²	104.4	74%	0.738	61%	0.607	S	S	*	*			cis	-155.9	-66.7	-20.1	-95.9	-32.5	0	0	0	112.8
278	S	34.1	Very low	53.2	Low	105 Å²	105	103 Å²	103	73%	0.734	59%	0.593	S	S	*	*			trans	-131.1	103.5	-156	64.2	0	0	0	0	118.2
279	M	38.8	Very low	55.4	Low	149 Å²	149	101.5 Å²	101.5	73%	0.734	58%	0.584	S	S	*	*	S	Bend	trans	-149.2	142.5	144.1	-83.9	-53.5	166	0	0	111.3	S281	M279-S281 PolarHBondContact O-N 3.39Å
280	D	60.4	Low	57.4	Low	59 Å²	59	97.7 Å²	97.7	32%	0.316	56%	0.559	S	S	.	*			trans	47.3	47.9	149.8	-59.1	-20	0	0	0	121.6	V282 W304	D280-V282 PolarHBondContact O-N 2.92Å; D280-W304 PolarHBondContact OD1-NE1 3.05Å
281	S	76.3	Confident	59.6	Low	69 Å²	69	96.6 Å²	96.6	48%	0.483	54%	0.54	S	S	.	.			trans	-77.6	116.8	162.4	72.3	0	0	0	0	112.1	M279 I303 W304	M279-S281 PolarHBondContact O-N 3.39Å; S281-I303 WeakPolarHBondContact O-CG2 3.35Å; S281-W304 PolarHBondContact O-N 3.05Å; S281-W304 VanDerWaalsContact O-N 3.15Å
282	V	85.4	Confident	61.5	Low	16 Å²	16	95.6 Å²	95.6	10%	0.097	53%	0.528	C	S	.	.	B	Isolated β-bridge	trans	-90.9	139.6	169.8	-174.3	0	0	0	0	110.3	D280 C284 L291 W304	D280-V282 PolarHBondContact O-N 2.92Å; V282-C284 HydrophobicContact CG1-CB 4.42Å; V282-L291 HydrophobicContact CG2-CD2 3.44Å; V282-L291 VanDerWaalsContact CG2-CD2 3.44Å; V282-L291 HydrophobicContact CG2-CG 4.1Å; V282-W304 WeakPolarHBondContact CA-O 3.01Å; V282-W304 WeakPolarHBondContact CG1-O 3.21Å; V282-W304 HydrophobicContact CG2-CB 4.03Å
283	R	83.3	Confident	63.3	Low	136 Å²	136	86.5 Å²	86.5	51%	0.513	51%	0.511	S	S	.	.			trans	-143.3	48.3	176.3	-162	-167.8	-69.9	167.7	-0.7	112.9	I303 W304 H305	R283-I303 HydrophobicContact CB-CG2 3.52Å; R283-W304 PolarHBondContact N-O 3.26Å; R283-H305 VanDerWaalsContact C-CD2 3.47Å; R283-H305 PolarHBondContact O-CD2 2.59Å; R283-H305 VanDerWaalsContact O-CD2 3.23Å
284	C	86.6	Confident	65.6	Low	7 Å²	7	86.6 Å²	86.6	5%	0.047	51%	0.505	C	S	.	.			trans	-64.8	150.4	-170.7	-163	0	0	0	0	113.4	V282 C286 G287 H305 H306 C309	V282-C284 HydrophobicContact CG1-CB 4.42Å; C284-C286 PolarHBondContact O-N 3.28Å; C284-C286 VanDerWaalsContact SG-SG 3.61Å; C284-G287 WeakPolarHBondContact O-CA 2.26Å; C284-G287 PolarHBondContact O-N 3.13Å; C284-H305 HydrophobicContact CB-CB 4.45Å; C284-H306 WeakPolarHBondContact CB-ND1 2.26Å; C284-H306 PolarHBondContact SG-N 3.02Å; C284-H306 PolarHBondContact SG-ND1 3.23Å; C284-C309 WeakPolarHBondContact SG-CB 3.44Å
285	V	80.2	Confident	68.1	Low	79 Å²	79	82.3 Å²	82.3	48%	0.479	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.1	-179	-64.1	0	0	0	0	113.6	G287 C309	V285-G287 PolarHBondContact O-N 3.01Å; V285-C309 HydrophobicContact CG2-CB 3.97Å; V285-C309 WeakPolarHBondContact CG2-O 3.39Å
286	C	84.3	Confident	70.9	Confident	48 Å²	48	79.8 Å²	79.8	32%	0.324	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-10	169.7	63.8	0	0	0	0	113.6	C284 N288 C309	C284-C286 PolarHBondContact O-N 3.28Å; C284-C286 VanDerWaalsContact SG-SG 3.61Å; C286-N288 PolarHBondContact O-N 2.89Å; C286-N288 PolarHBondContact SG-N 2.88Å; C286-N288 VanDerWaalsContact SG-N 3.45Å; C286-C309 HydrophobicContact CB-CB 4.29Å; C286-C309 VanDerWaalsContact CB-SG 3.58Å
287	G	76.6	Confident	73.7	Confident	61 Å²	61	77.4 Å²	77.4	63%	0.629	44%	0.439	S	S	*	.	S	Bend	trans	79.4	-2.7	-176	0	0	0	0	0	114.6	C284 V285	C284-G287 WeakPolarHBondContact O-CA 2.26Å; C284-G287 PolarHBondContact O-N 3.13Å; V285-G287 PolarHBondContact O-N 3.01Å
288	N	75.8	Confident	76.2	Confident	61 Å²	61	70.9 Å²	70.9	33%	0.326	40%	0.404	S	S	.	.			trans	-79.4	135.4	173.9	-162.5	9.8	0	0	0	110.6	C286 N290 H306	C286-N288 PolarHBondContact O-N 2.89Å; C286-N288 PolarHBondContact SG-N 2.88Å; C286-N288 VanDerWaalsContact SG-N 3.45Å; N288-N290 VanDerWaalsContact OD1-CG 3.27Å; N288-N290 PolarHBondContact OD1-N 3.38Å; N288-N290 PolarHBondContact OD1-OD1 2.66Å; N288-N290 VanDerWaalsContact OD1-OD1 3.11Å; N288-H306 WeakPolarHBondContact CB-CE1 3.36Å; N288-H306 PolarHBondContact O-CE1 3.28Å
289	T	81.5	Confident	78.8	Confident	97 Å²	97	70.3 Å²	70.3	60%	0.595	39%	0.393	S	S	*	.			trans	-110	6	178.4	61	0	0	0	0	112.7
290	N	77.8	Confident	81	Confident	46 Å²	46	68.6 Å²	68.6	25%	0.246	38%	0.383	C	S	.	.			trans	-62.4	162.4	170.2	-66.5	14.2	0	0	0	111.3	N288 D292 H306 K676	N288-N290 VanDerWaalsContact OD1-CG 3.27Å; N288-N290 PolarHBondContact OD1-N 3.38Å; N288-N290 PolarHBondContact OD1-OD1 2.66Å; N288-N290 VanDerWaalsContact OD1-OD1 3.11Å; N290-D292 WeakPolarHBondContact CB-OD2 2.26Å; N290-D292 PolarHBondContact ND2-OD2 3.5Å; N290-H306 PolarHBondContact O-CE1 3.07Å; N290-H306 VanDerWaalsContact O-CE1 3.28Å; N290-H306 PolarHBondContact O-NE2 3.3Å; N290-K676 PolarHBondContact OD1-NZ 2.81Å
291	L	79	Confident	82.4	Confident	68 Å²	68	68.1 Å²	68.1	36%	0.356	38%	0.384	S	S	.	.			trans	-96.1	12.7	178.2	-71.9	163.4	0	0	0	113	V282 L295	V282-L291 HydrophobicContact CG2-CD2 3.44Å; V282-L291 VanDerWaalsContact CG2-CD2 3.44Å; V282-L291 HydrophobicContact CG2-CG 4.1Å; L291-L295 HydrophobicContact CB-CD1 4.19Å; L291-L295 HydrophobicContact CD2-CD1 3.61Å; L291-L295 WeakPolarHBondContact O-CD1 2.27Å
292	D	75	Confident	83	Confident	102 Å²	102	74 Å²	74	55%	0.545	40%	0.395	S	S	.	.			trans	-89.2	140.2	-163.8	-33	-27.9	0	0	0	111.8	N290 H306	N290-D292 WeakPolarHBondContact CB-OD2 2.26Å; N290-D292 PolarHBondContact ND2-OD2 3.5Å; D292-H306 PolarHBondContact N-NE2 3.12Å; D292-H306 PolarHBondContact O-CD2 3.11Å; D292-H306 PolarHBondContact O-NE2 2.9Å
293	G	71.3	Confident	83.1	Confident	58 Å²	58	73.8 Å²	73.8	60%	0.598	39%	0.393	S	S	*	.	S	Bend	trans	83.9	-173.8	-173.5	0	0	0	0	0	113.3	L295	G293-L295 PolarHBondContact O-N 3.14Å
294	Y	79.5	Confident	83.5	Confident	178 Å²	178	70.4 Å²	70.4	70%	0.698	38%	0.381	S	S	*	.			trans	-70.3	120.3	180	-79.5	-89.7	0	0	0	111	H306 S307	Y294-H306 CarbonylContact O-C 3.59Å; Y294-H306 WeakPolarHBondContact O-CA 3.17Å; Y294-S307 VanDerWaalsContact CB-OG 3.24Å; Y294-S307 WeakPolarHBondContact CB-OG 3.5Å; Y294-S307 PolarHBondContact O-N 2.91Å; Y294-S307 PolarHBondContact O-OG 3.03Å
295	L	87	Confident	83.5	Confident	42 Å²	42	70.4 Å²	70.4	22%	0.22	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.2	176	-63.7	173.1	0	0	0	111.3	L291 G293 W304 H305 H306	L291-L295 HydrophobicContact CB-CD1 4.19Å; L291-L295 HydrophobicContact CD2-CD1 3.61Å; L291-L295 WeakPolarHBondContact O-CD1 2.27Å; G293-L295 PolarHBondContact O-N 3.14Å; L295-W304 HydrophobicContact CB-CD2 4.45Å; L295-W304 HydrophobicContact CB-CE3 3.66Å; L295-W304 HydrophobicContact CB-CZ3 4.09Å; L295-W304 HydrophobicContact CD1-CE3 4.49Å; L295-H305 CarbonylContact C-O 3.37Å; L295-H305 WeakPolarHBondContact CA-O 3.4Å; L295-H306 VanDerWaalsContact CD2-CD2 3.43Å; L295-H306 WeakPolarHBondContact CD2-CD2 3.39Å
296	V	88.1	Confident	83.9	Confident	32 Å²	32	67.1 Å²	67.1	19%	0.194	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133	169.9	65.1	0	0	0	0	110.2	H305 I310 Y322	V296-H305 PolarHBondContact N-O 3.29Å; V296-H305 PolarHBondContact O-N 3.37Å; V296-I310 HydrophobicContact CG1-CD1 3.34Å; V296-Y322 HydrophobicContact CB-CD1 4.37Å; V296-Y322 HydrophobicContact CG1-CD1 3.94Å; V296-Y322 HydrophobicContact CG1-CE1 3.91Å; V296-Y322 HydrophobicContact CG1-CG 4.38Å; V296-Y322 HydrophobicContact CG2-CD1 3.68Å; V296-Y322 HydrophobicContact CG2-CE1 4.47Å; V296-Y322 HydrophobicContact CG2-CG 3.87Å
297	Q	90.2	Very high	83.9	Confident	75 Å²	75	65.8 Å²	65.8	35%	0.35	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.4	-177.2	-168.1	178.3	46.4	0	0	110.9	N299 R302 W304 Y322	Q297-N299 PolarHBondContact O-N 3.48Å; Q297-R302 WeakPolarHBondContact CG-O 2.28Å; Q297-R302 PolarHBondContact NE2-O 3.37Å; Q297-W304 HydrophobicContact CB-CD2 4.06Å; Q297-W304 HydrophobicContact CB-CE3 3.69Å; Q297-W304 HydrophobicContact CB-CH2 4.25Å; Q297-W304 HydrophobicContact CB-CZ3 3.81Å; Q297-W304 HydrophobicContact CG-CD2 4.33Å; Q297-W304 HydrophobicContact CG-CE3 4.45Å; Q297-Y322 WeakPolarHBondContact O-CD1 3.18Å
298	C	90	Very high	84.2	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.351	C	S	.	.			trans	-68.8	123.2	173.6	175.8	0	0	0	0	111	Q300 R302 I303 Y322 C324 C327	C298-Q300 VanDerWaalsContact C-N 3.28Å; C298-Q300 PolarHBondContact O-N 3.29Å; C298-R302 WeakPolarHBondContact O-CA 3.42Å; C298-R302 PolarHBondContact O-N 3.4Å; C298-I303 PolarHBondContact N-O 2.79Å; C298-Y322 HydrophobicContact CB-CD1 4.37Å; C298-Y322 HydrophobicContact CB-CE1 4.03Å; C298-C324 HydrophobicContact CB-CB 3.95Å; C298-C324 PolarHBondContact SG-N 3.06Å; C298-C324 VanDerWaalsContact SG-SG 3.6Å; C298-C327 VanDerWaalsContact SG-SG 3.64Å
299	N	88.2	Confident	84.5	Confident	93 Å²	93	68.4 Å²	68.4	50%	0.497	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-24	-175.9	-72.8	-85.4	0	0	0	113.8	Q297 P321 Y322	Q297-N299 PolarHBondContact O-N 3.48Å; N299-P321 HydrophobicContact CB-CB 3.9Å; N299-Y322 PolarHBondContact N-O 2.92Å; N299-Y322 PolarHBondContact ND2-N 3.12Å; N299-Y322 PolarHBondContact ND2-O 2.98Å
300	Q	84.5	Confident	84.4	Confident	114 Å²	114	66 Å²	66	53%	0.533	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-39.6	178.9	-69.3	-172	9.1	0	0	113.6	C298 V323 C327	C298-Q300 VanDerWaalsContact C-N 3.28Å; C298-Q300 PolarHBondContact O-N 3.29Å; Q300-V323 HydrophobicContact CG-CG1 4.07Å; Q300-V323 HydrophobicContact CG-CG2 4.16Å; Q300-C327 HydrophobicContact CB-CB 3.84Å; Q300-C327 HydrophobicContact CG-CB 4.44Å
301	C	90.7	Very high	83.8	Confident	48 Å²	48	65.4 Å²	65.4	32%	0.324	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-2.4	-177	66.2	0	0	0	0	115.4	I303 C327	C301-I303 HydrophobicContact CB-CD1 4.25Å; C301-I303 HydrophobicContact CB-CG1 4.19Å; C301-I303 PolarHBondContact O-N 2.78Å; C301-I303 VanDerWaalsContact O-N 3.13Å; C301-I303 VanDerWaalsContact SG-CG1 3.6Å; C301-C327 VanDerWaalsContact CB-SG 3.53Å; C301-C327 PolarHBondContact SG-SG 3.39Å
302	R	88.5	Confident	82.6	Confident	194 Å²	194	67.8 Å²	67.8	73%	0.732	35%	0.354	S	S	*	.			trans	58.5	16.1	-177.6	-60	-174.4	179.8	-177.1	-1.3	115.8	Q297 C298	Q297-R302 WeakPolarHBondContact CG-O 2.28Å; Q297-R302 PolarHBondContact NE2-O 3.37Å; C298-R302 WeakPolarHBondContact O-CA 3.42Å; C298-R302 PolarHBondContact O-N 3.4Å
303	I	88	Confident	81	Confident	10 Å²	10	66.7 Å²	66.7	5%	0.051	36%	0.358	C	S	.	.			trans	-82.4	137.9	176.8	-60.5	-179.7	0	0	0	110.4	S281 R283 C298 C301 H305	S281-I303 WeakPolarHBondContact O-CG2 3.35Å; R283-I303 HydrophobicContact CB-CG2 3.52Å; C298-I303 PolarHBondContact N-O 2.79Å; C301-I303 HydrophobicContact CB-CD1 4.25Å; C301-I303 HydrophobicContact CB-CG1 4.19Å; C301-I303 PolarHBondContact O-N 2.78Å; C301-I303 VanDerWaalsContact O-N 3.13Å; C301-I303 VanDerWaalsContact SG-CG1 3.6Å; I303-H305 WeakPolarHBondContact CG2-NE2 3.41Å; I303-H305 PolarHBondContact O-CE1 2.84Å
304	W	90.6	Very high	79.6	Confident	65 Å²	65	67.1 Å²	67.1	25%	0.246	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	146.5	176.3	-66.5	108.3	0	0	0	112.7	D280 S281 V282 R283 L295 Q297	D280-W304 PolarHBondContact OD1-NE1 3.05Å; S281-W304 PolarHBondContact O-N 3.05Å; S281-W304 VanDerWaalsContact O-N 3.15Å; V282-W304 WeakPolarHBondContact CA-O 3.01Å; V282-W304 WeakPolarHBondContact CG1-O 3.21Å; V282-W304 HydrophobicContact CG2-CB 4.03Å; R283-W304 PolarHBondContact N-O 3.26Å; L295-W304 HydrophobicContact CB-CD2 4.45Å; L295-W304 HydrophobicContact CB-CE3 3.66Å; L295-W304 HydrophobicContact CB-CZ3 4.09Å; L295-W304 HydrophobicContact CD1-CE3 4.49Å; Q297-W304 HydrophobicContact CB-CD2 4.06Å; Q297-W304 HydrophobicContact CB-CE3 3.69Å; Q297-W304 HydrophobicContact CB-CH2 4.25Å; Q297-W304 HydrophobicContact CB-CZ3 3.81Å; Q297-W304 HydrophobicContact CG-CD2 4.33Å; Q297-W304 HydrophobicContact CG-CE3 4.45Å
305	H	87.5	Confident	78.4	Confident	7 Å²	7	68.4 Å²	68.4	3%	0.032	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	148.2	175.5	-50.6	113.1	0	0	0	109.8	R283 C284 L295 V296 I303 S307 I310 Y322 C324	R283-H305 VanDerWaalsContact C-CD2 3.47Å; R283-H305 PolarHBondContact O-CD2 2.59Å; R283-H305 VanDerWaalsContact O-CD2 3.23Å; C284-H305 HydrophobicContact CB-CB 4.45Å; L295-H305 CarbonylContact C-O 3.37Å; L295-H305 WeakPolarHBondContact CA-O 3.4Å; V296-H305 PolarHBondContact N-O 3.29Å; V296-H305 PolarHBondContact O-N 3.37Å; I303-H305 WeakPolarHBondContact CG2-NE2 3.41Å; I303-H305 PolarHBondContact O-CE1 2.84Å; H305-S307 PolarHBondContact O-N 2.94Å; H305-I310 HydrophobicContact CB-CD1 3.57Å; H305-I310 HydrophobicContact CB-CG1 4.27Å; H305-Y322 AromaticContact ND1-CE1 3.64Å; H305-Y322 AromaticContact ND1-CZ 3.94Å; H305-Y322 PolarHBondContact ND1-OH 2.9Å; H305-C324 WeakPolarHBondContact CE1-CB 3.03Å
306	H	87.7	Confident	76.9	Confident	11 Å²	11	71.4 Å²	71.4	5%	0.051	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	124.6	171.5	-47.4	102.8	0	0	0	110.2	C284 N288 N290 D292 Y294 L295 E308 C309 I310	C284-H306 WeakPolarHBondContact CB-ND1 2.26Å; C284-H306 PolarHBondContact SG-N 3.02Å; C284-H306 PolarHBondContact SG-ND1 3.23Å; N288-H306 WeakPolarHBondContact CB-CE1 3.36Å; N288-H306 PolarHBondContact O-CE1 3.28Å; N290-H306 PolarHBondContact O-CE1 3.07Å; N290-H306 VanDerWaalsContact O-CE1 3.28Å; N290-H306 PolarHBondContact O-NE2 3.3Å; D292-H306 PolarHBondContact N-NE2 3.12Å; D292-H306 PolarHBondContact O-CD2 3.11Å; D292-H306 PolarHBondContact O-NE2 2.9Å; Y294-H306 CarbonylContact O-C 3.59Å; Y294-H306 WeakPolarHBondContact O-CA 3.17Å; L295-H306 VanDerWaalsContact CD2-CD2 3.43Å; L295-H306 WeakPolarHBondContact CD2-CD2 3.39Å; H306-E308 VanDerWaalsContact C-N 3.3Å; H306-E308 PolarHBondContact O-N 3.12Å; H306-C309 HydrophobicContact CB-CB 4.18Å; H306-C309 WeakPolarHBondContact O-CB 3.5Å; H306-C309 PolarHBondContact O-N 3.41Å; H306-C309 VanDerWaalsContact O-N 3.12Å; H306-I310 PolarHBondContact O-N 3.32Å
307	S	85	Confident	75.4	Confident	20 Å²	20	77.4 Å²	77.4	14%	0.14	41%	0.412	C	S	.	.	H	α-helix	trans	-62	-38.3	-176.6	62.4	0	0	0	0	112.2	Y294 H305 C309 I310 S311	Y294-S307 VanDerWaalsContact CB-OG 3.24Å; Y294-S307 WeakPolarHBondContact CB-OG 3.5Å; Y294-S307 PolarHBondContact O-N 2.91Å; Y294-S307 PolarHBondContact O-OG 3.03Å; H305-S307 PolarHBondContact O-N 2.94Å; S307-C309 PolarHBondContact O-N 3.18Å; S307-I310 PolarHBondContact O-N 3.05Å; S307-I310 VanDerWaalsContact O-N 3.11Å; S307-S311 VanDerWaalsContact O-CB 3.31Å; S307-S311 WeakPolarHBondContact O-CB 3.43Å; S307-S311 PolarHBondContact O-N 3.16Å; S307-S311 PolarHBondContact O-OG 3.45Å
308	E	81.9	Confident	74.2	Confident	135 Å²	135	76.8 Å²	76.8	63%	0.631	41%	0.411	S	S	*	.	H	α-helix	trans	-58.2	-34.8	175.7	-66.8	165.6	-154.7	0	0	112.4	H306	H306-E308 VanDerWaalsContact C-N 3.3Å; H306-E308 PolarHBondContact O-N 3.12Å
309	C	82.8	Confident	73.1	Confident	41 Å²	41	80.2 Å²	80.2	28%	0.277	43%	0.434	S	S	.	.	H	α-helix	trans	-79.8	-18.8	179.7	-64.9	0	0	0	0	113.1	C284 V285 C286 H306 S307	C284-C309 WeakPolarHBondContact SG-CB 3.44Å; V285-C309 HydrophobicContact CG2-CB 3.97Å; V285-C309 WeakPolarHBondContact CG2-O 3.39Å; C286-C309 HydrophobicContact CB-CB 4.29Å; C286-C309 VanDerWaalsContact CB-SG 3.58Å; H306-C309 HydrophobicContact CB-CB 4.18Å; H306-C309 WeakPolarHBondContact O-CB 3.5Å; H306-C309 PolarHBondContact O-N 3.41Å; H306-C309 VanDerWaalsContact O-N 3.12Å; S307-C309 PolarHBondContact O-N 3.18Å
310	I	78.7	Confident	72.3	Confident	46 Å²	46	82.2 Å²	82.2	24%	0.236	45%	0.45	C	S	.	.	H	α-helix	trans	-88.8	-38.5	174.8	-63.1	154.9	0	0	0	110.6	V296 H305 H306 S307 S312 L318 Y322	V296-I310 HydrophobicContact CG1-CD1 3.34Å; H305-I310 HydrophobicContact CB-CD1 3.57Å; H305-I310 HydrophobicContact CB-CG1 4.27Å; H306-I310 PolarHBondContact O-N 3.32Å; S307-I310 PolarHBondContact O-N 3.05Å; S307-I310 VanDerWaalsContact O-N 3.11Å; I310-S312 VanDerWaalsContact C-N 3.34Å; I310-S312 PolarHBondContact O-N 2.83Å; I310-L318 HydrophobicContact CG2-CD2 4.43Å; I310-Y322 HydrophobicContact CD1-CE1 4.1Å; I310-Y322 HydrophobicContact CD1-CE2 3.96Å; I310-Y322 VanDerWaalsContact CD1-CZ 3.49Å; I310-Y322 WeakPolarHBondContact CD1-OH 3.27Å; I310-Y322 HydrophobicContact CG2-CE2 3.85Å
311	S	65.5	Low	71.8	Confident	35 Å²	35	81 Å²	81	25%	0.245	45%	0.452	C	S	.	.			trans	-90.2	64	-164.5	-47.1	0	0	0	0	111.5	S307 A313	S307-S311 VanDerWaalsContact O-CB 3.31Å; S307-S311 WeakPolarHBondContact O-CB 3.43Å; S307-S311 PolarHBondContact O-N 3.16Å; S307-S311 PolarHBondContact O-OG 3.45Å; S311-A313 PolarHBondContact O-N 2.94Å
312	S	54.8	Low	71.5	Confident	118 Å²	118	79.6 Å²	79.6	83%	0.825	44%	0.44	S	S	*	.	S	Bend	trans	-64.5	-8.8	-174.4	-59	0	0	0	0	115.2	I310	I310-S312 VanDerWaalsContact C-N 3.34Å; I310-S312 PolarHBondContact O-N 2.83Å
313	A	39.8	Very low	71.4	Confident	78 Å²	78	71.5 Å²	71.5	65%	0.645	41%	0.412	S	S	*	.	S	Bend	trans	-153.7	127.1	166.6	0	0	0	0	0	110.7	S311	S311-A313 PolarHBondContact O-N 2.94Å
314	S	42.8	Very low	71.3	Confident	68 Å²	68	71.2 Å²	71.2	48%	0.476	41%	0.411	S	S	.	.			trans	62.9	141.6	176.6	74.3	0	0	0	0	117.4	S316	S314-S316 VanDerWaalsContact C-N 3.26Å; S314-S316 PolarHBondContact O-N 2.79Å; S314-S316 PolarHBondContact OG-OG 2.98Å
315	K	53.3	Low	70.8	Confident	204 Å²	204	74.1 Å²	74.1	89%	0.887	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-71.9	-17	174.1	-92.7	-176.8	174.7	178.1	0	113.6
316	S	56.2	Low	70.6	Confident	106 Å²	106	77 Å²	77	74%	0.741	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-79.1	-16.9	-171.8	40.8	0	0	0	0	114.7	S314	S314-S316 VanDerWaalsContact C-N 3.26Å; S314-S316 PolarHBondContact O-N 2.79Å; S314-S316 PolarHBondContact OG-OG 2.98Å
317	H	57.6	Low	70.6	Confident	158 Å²	158	76.7 Å²	76.7	73%	0.731	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-97.1	13.6	-168.2	-123.4	-57.1	0	0	0	116	S319	H317-S319 VanDerWaalsContact C-N 3.3Å; H317-S319 PolarHBondContact O-N 2.85Å
318	L	64.2	Low	70.3	Confident	62 Å²	62	79.5 Å²	79.5	33%	0.325	45%	0.452	S	S	.	.			trans	-74.1	79.2	175.2	-78.9	172.3	0	0	0	111.3	I310 T320	I310-L318 HydrophobicContact CG2-CD2 4.43Å; L318-T320 PolarHBondContact O-N 2.92Å
319	S	66	Low	69.9	Low	71 Å²	71	77 Å²	77	50%	0.497	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-49.9	120.6	178.5	62.3	0	0	0	0	112.3	H317 P321 Y322	H317-S319 VanDerWaalsContact C-N 3.3Å; H317-S319 PolarHBondContact O-N 2.85Å; S319-P321 CarbonylContact O-C 3.34Å; S319-Y322 WeakPolarHBondContact O-CA 3.21Å; S319-Y322 PolarHBondContact O-N 2.87Å
320	T	72.2	Confident	68.7	Low	136 Å²	136	80.5 Å²	80.5	83%	0.834	46%	0.459	S	S	*	.	S	Bend	trans	-90.1	131.6	169.2	40.2	0	0	0	0	109.8	L318	L318-T320 PolarHBondContact O-N 2.92Å
321	P	74.6	Confident	67.6	Low	88 Å²	88	80.7 Å²	80.7	57%	0.571	46%	0.464	S	S	*	.	S	Bend	cis	-72.6	129.9	-6.2	30.5	-34.3	0	0	0	112.3	N299 S319 V323	N299-P321 HydrophobicContact CB-CB 3.9Å; S319-P321 CarbonylContact O-C 3.34Å; P321-V323 PolarHBondContact O-N 3.24Å
322	Y	83.1	Confident	67	Low	19 Å²	19	83.6 Å²	83.6	8%	0.075	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-63.9	130	178.6	167.4	-105.2	0	0	0	111.8	V296 Q297 C298 N299 H305 I310 S319 C324	V296-Y322 HydrophobicContact CB-CD1 4.37Å; V296-Y322 HydrophobicContact CG1-CD1 3.94Å; V296-Y322 HydrophobicContact CG1-CE1 3.91Å; V296-Y322 HydrophobicContact CG1-CG 4.38Å; V296-Y322 HydrophobicContact CG2-CD1 3.68Å; V296-Y322 HydrophobicContact CG2-CE1 4.47Å; V296-Y322 HydrophobicContact CG2-CG 3.87Å; Q297-Y322 WeakPolarHBondContact O-CD1 3.18Å; C298-Y322 HydrophobicContact CB-CD1 4.37Å; C298-Y322 HydrophobicContact CB-CE1 4.03Å; N299-Y322 PolarHBondContact N-O 2.92Å; N299-Y322 PolarHBondContact ND2-N 3.12Å; N299-Y322 PolarHBondContact ND2-O 2.98Å; H305-Y322 AromaticContact ND1-CE1 3.64Å; H305-Y322 AromaticContact ND1-CZ 3.94Å; H305-Y322 PolarHBondContact ND1-OH 2.9Å; I310-Y322 HydrophobicContact CD1-CE1 4.1Å; I310-Y322 HydrophobicContact CD1-CE2 3.96Å; I310-Y322 VanDerWaalsContact CD1-CZ 3.49Å; I310-Y322 WeakPolarHBondContact CD1-OH 3.27Å; I310-Y322 HydrophobicContact CG2-CE2 3.85Å; S319-Y322 WeakPolarHBondContact O-CA 3.21Å; S319-Y322 PolarHBondContact O-N 2.87Å; Y322-C324 HydrophobicContact CE1-CB 4.17Å; Y322-C324 VanDerWaalsContact OH-CA 3.26Å; Y322-C324 WeakPolarHBondContact OH-CA 3.02Å; Y322-C324 WeakPolarHBondContact OH-CB 3.49Å
323	V	86.1	Confident	66.6	Low	23 Å²	23	79.6 Å²	79.6	14%	0.139	45%	0.446	C	S	.	.			trans	-125	126.8	176.6	-175.1	0	0	0	0	109	Q300 P321 C327 Q328	Q300-V323 HydrophobicContact CG-CG1 4.07Å; Q300-V323 HydrophobicContact CG-CG2 4.16Å; P321-V323 PolarHBondContact O-N 3.24Å; V323-C327 HydrophobicContact CG1-CB 3.35Å; V323-Q328 HydrophobicContact CB-CG 4.09Å; V323-Q328 HydrophobicContact CG1-CG 3.81Å; V323-Q328 PolarHBondContact O-NE2 3.07Å
324	C	87.3	Confident	67	Low	5 Å²	5	81.2 Å²	81.2	3%	0.034	44%	0.443	C	S	.	.			trans	-78.9	163	-178.4	73.9	0	0	0	0	113.6	C298 H305 Y322 I326 C327 Q328	C298-C324 HydrophobicContact CB-CB 3.95Å; C298-C324 PolarHBondContact SG-N 3.06Å; C298-C324 VanDerWaalsContact SG-SG 3.6Å; H305-C324 WeakPolarHBondContact CE1-CB 3.03Å; Y322-C324 HydrophobicContact CE1-CB 4.17Å; Y322-C324 VanDerWaalsContact OH-CA 3.26Å; Y322-C324 WeakPolarHBondContact OH-CA 3.02Å; Y322-C324 WeakPolarHBondContact OH-CB 3.49Å; C324-I326 PolarHBondContact O-N 3.11Å; C324-I326 VanDerWaalsContact O-N 3.11Å; C324-C327 CarbonylContact O-C 3.59Å; C324-C327 WeakPolarHBondContact O-CA 3.43Å; C324-C327 WeakPolarHBondContact O-CB 3.38Å; C324-C327 PolarHBondContact O-N 3.07Å; C324-C327 VanDerWaalsContact SG-SG 3.7Å; C324-Q328 WeakPolarHBondContact O-CG 3.31Å; C324-Q328 PolarHBondContact O-N 2.78Å
325	E	80.7	Confident	67.2	Low	126 Å²	126	80.8 Å²	80.8	59%	0.589	44%	0.444	S	S	*	.	H	α-helix	trans	-49.9	-40.5	-178.3	-60.9	-176.6	166.5	0	0	113.9	C327 T329	E325-C327 VanDerWaalsContact C-N 3.32Å; E325-C327 PolarHBondContact O-N 2.87Å; E325-T329 VanDerWaalsContact O-CB 3.31Å; E325-T329 WeakPolarHBondContact O-CB 3.28Å; E325-T329 VanDerWaalsContact O-CG2 3.31Å; E325-T329 WeakPolarHBondContact O-CG2 3.42Å; E325-T329 PolarHBondContact O-N 3.18Å; E325-T329 PolarHBondContact O-OG1 3.28Å
326	I	83	Confident	67	Low	68 Å²	68	73.9 Å²	73.9	35%	0.349	42%	0.419	S	S	.	.	H	α-helix	trans	-65	-38.4	178.4	-60	175.5	0	0	0	110.9	C324 T329 Q330	C324-I326 PolarHBondContact O-N 3.11Å; C324-I326 VanDerWaalsContact O-N 3.11Å; I326-T329 WeakPolarHBondContact CA-OG1 3.48Å; I326-T329 PolarHBondContact O-OG1 3.32Å; I326-Q330 WeakPolarHBondContact O-CB 3.43Å; I326-Q330 VanDerWaalsContact O-CG 3.24Å; I326-Q330 WeakPolarHBondContact O-CG 3.37Å; I326-Q330 PolarHBondContact O-N 3.31Å
327	C	87.7	Confident	66.3	Low	4 Å²	4	77 Å²	77	3%	0.027	42%	0.421	C	S	.	.	H	α-helix	trans	-79.2	-39.2	179.4	-67.4	0	0	0	0	111.8	C298 Q300 C301 V323 C324 E325 T329 Q330 S331	C298-C327 VanDerWaalsContact SG-SG 3.64Å; Q300-C327 HydrophobicContact CB-CB 3.84Å; Q300-C327 HydrophobicContact CG-CB 4.44Å; C301-C327 VanDerWaalsContact CB-SG 3.53Å; C301-C327 PolarHBondContact SG-SG 3.39Å; V323-C327 HydrophobicContact CG1-CB 3.35Å; C324-C327 CarbonylContact O-C 3.59Å; C324-C327 WeakPolarHBondContact O-CA 3.43Å; C324-C327 WeakPolarHBondContact O-CB 3.38Å; C324-C327 PolarHBondContact O-N 3.07Å; C324-C327 VanDerWaalsContact SG-SG 3.7Å; E325-C327 VanDerWaalsContact C-N 3.32Å; E325-C327 PolarHBondContact O-N 2.87Å; C327-T329 VanDerWaalsContact C-N 3.32Å; C327-T329 PolarHBondContact O-N 2.86Å; C327-Q330 PolarHBondContact O-N 2.81Å; C327-S331 PolarHBondContact O-N 3.4Å; C327-S331 PolarHBondContact O-OG 2.81Å
328	Q	78.2	Confident	65.3	Low	79 Å²	79	78.8 Å²	78.8	37%	0.369	42%	0.422	S	S	.	.	H	α-helix	trans	-62.1	-37.4	171.4	-65.7	-170.9	27.2	0	0	112.3	V323 C324 S331 K332	V323-Q328 HydrophobicContact CB-CG 4.09Å; V323-Q328 HydrophobicContact CG1-CG 3.81Å; V323-Q328 PolarHBondContact O-NE2 3.07Å; C324-Q328 WeakPolarHBondContact O-CG 3.31Å; C324-Q328 PolarHBondContact O-N 2.78Å; Q328-S331 PolarHBondContact O-OG 3.27Å; Q328-S331 VanDerWaalsContact O-OG 3.1Å; Q328-K332 VanDerWaalsContact O-CB 3.29Å; Q328-K332 WeakPolarHBondContact O-CB 3.21Å; Q328-K332 VanDerWaalsContact O-CG 3.29Å; Q328-K332 WeakPolarHBondContact O-CG 3.46Å; Q328-K332 PolarHBondContact O-N 3.26Å; Q328-K332 VanDerWaalsContact O-N 3.08Å
329	T	73.2	Confident	63.8	Low	82 Å²	82	81 Å²	81	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-77.3	-32	175.9	51.3	0	0	0	0	112.3	E325 I326 C327 A333	E325-T329 VanDerWaalsContact O-CB 3.31Å; E325-T329 WeakPolarHBondContact O-CB 3.28Å; E325-T329 VanDerWaalsContact O-CG2 3.31Å; E325-T329 WeakPolarHBondContact O-CG2 3.42Å; E325-T329 PolarHBondContact O-N 3.18Å; E325-T329 PolarHBondContact O-OG1 3.28Å; I326-T329 WeakPolarHBondContact CA-OG1 3.48Å; I326-T329 PolarHBondContact O-OG1 3.32Å; C327-T329 VanDerWaalsContact C-N 3.32Å; C327-T329 PolarHBondContact O-N 2.86Å; T329-A333 WeakPolarHBondContact O-CB 3.13Å; T329-A333 PolarHBondContact O-N 2.9Å
330	Q	57.9	Low	62.2	Low	115 Å²	115	85.6 Å²	85.6	54%	0.537	45%	0.453	S	S	.	.	H	α-helix	trans	-68.8	-44.1	171.7	-78.8	178.8	1	0	0	112.2	I326 C327 A333 I334	I326-Q330 WeakPolarHBondContact O-CB 3.43Å; I326-Q330 VanDerWaalsContact O-CG 3.24Å; I326-Q330 WeakPolarHBondContact O-CG 3.37Å; I326-Q330 PolarHBondContact O-N 3.31Å; C327-Q330 PolarHBondContact O-N 2.81Å; Q330-A333 PolarHBondContact O-N 3.32Å; Q330-I334 VanDerWaalsContact O-CG1 3.31Å; Q330-I334 WeakPolarHBondContact O-CG1 3.07Å; Q330-I334 PolarHBondContact O-N 2.87Å
331	S	56.2	Low	60.3	Low	49 Å²	49	87.2 Å²	87.2	34%	0.343	46%	0.456	S	S	.	.	H	α-helix	trans	-62.8	-44.9	175	63.4	0	0	0	0	111.5	C327 Q328 A333 I334 A335	C327-S331 PolarHBondContact O-N 3.4Å; C327-S331 PolarHBondContact O-OG 2.81Å; Q328-S331 PolarHBondContact O-OG 3.27Å; Q328-S331 VanDerWaalsContact O-OG 3.1Å; S331-A333 PolarHBondContact O-N 3.08Å; S331-I334 PolarHBondContact O-N 2.91Å; S331-A335 VanDerWaalsContact O-CB 3.26Å; S331-A335 WeakPolarHBondContact O-CB 3.37Å; S331-A335 PolarHBondContact O-N 3.44Å
332	K	52.4	Low	58.4	Low	96 Å²	96	89.3 Å²	89.3	42%	0.417	47%	0.467	S	S	.	.	H	α-helix	trans	-67.7	-31.8	175.3	-71.5	174.3	177.2	174.7	0	113.4	Q328 T336 N1818	Q328-K332 VanDerWaalsContact O-CB 3.29Å; Q328-K332 WeakPolarHBondContact O-CB 3.21Å; Q328-K332 VanDerWaalsContact O-CG 3.29Å; Q328-K332 WeakPolarHBondContact O-CG 3.46Å; Q328-K332 PolarHBondContact O-N 3.26Å; Q328-K332 VanDerWaalsContact O-N 3.08Å; K332-T336 PolarHBondContact O-N 3.28Å; K332-T336 PolarHBondContact O-OG1 3.11Å; K332-N1818 VanDerWaalsContact C-ND2 3.3Å; K332-N1818 PolarHBondContact O-ND2 3.13Å
333	A	46.8	Very low	56	Low	34 Å²	34	91.9 Å²	91.9	28%	0.281	49%	0.492	S	S	.	.	H	α-helix	trans	-66.9	-43.8	172.8	0	0	0	0	0	112.2	T329 Q330 S331 T336 Q337 N1818	T329-A333 WeakPolarHBondContact O-CB 3.13Å; T329-A333 PolarHBondContact O-N 2.9Å; Q330-A333 PolarHBondContact O-N 3.32Å; S331-A333 PolarHBondContact O-N 3.08Å; A333-T336 PolarHBondContact O-N 3Å; A333-Q337 WeakPolarHBondContact O-CG 3.45Å; A333-Q337 PolarHBondContact O-N 3.4Å; A333-Q337 VanDerWaalsContact O-N 3.08Å; A333-N1818 WeakPolarHBondContact CA-ND2 3.33Å; A333-N1818 PolarHBondContact N-ND2 2.76Å
334	I	47.9	Very low	53.4	Low	112 Å²	112	100.5 Å²	100.5	57%	0.574	53%	0.528	S	S	*	.	H	α-helix	trans	-63.9	-44.7	174.3	-66.6	164.8	0	0	0	110.1	Q330 S331 T336 Q337	Q330-I334 VanDerWaalsContact O-CG1 3.31Å; Q330-I334 WeakPolarHBondContact O-CG1 3.07Å; Q330-I334 PolarHBondContact O-N 2.87Å; S331-I334 PolarHBondContact O-N 2.91Å; I334-T336 PolarHBondContact O-N 3.37Å; I334-T336 VanDerWaalsContact O-N 3.12Å; I334-Q337 PolarHBondContact O-N 2.92Å
335	A	46.2	Very low	50.8	Low	60 Å²	60	107.3 Å²	107.3	50%	0.496	57%	0.565	S	S	.	*	H	α-helix	trans	-70.2	-0.5	179.4	0	0	0	0	0	115.5	S331 R338	S331-A335 VanDerWaalsContact O-CB 3.26Å; S331-A335 WeakPolarHBondContact O-CB 3.37Å; S331-A335 PolarHBondContact O-N 3.44Å; A335-R338 CarbonylContact C-O 2.96Å
336	T	48.8	Very low	48.4	Very low	58 Å²	58	104.3 Å²	104.3	36%	0.356	56%	0.557	S	S	.	*	H	α-helix	trans	-130.8	0.4	174.6	49.8	0	0	0	0	114.3	K332 A333 I334 R338 N1818	K332-T336 PolarHBondContact O-N 3.28Å; K332-T336 PolarHBondContact O-OG1 3.11Å; A333-T336 PolarHBondContact O-N 3Å; I334-T336 PolarHBondContact O-N 3.37Å; I334-T336 VanDerWaalsContact O-N 3.12Å; T336-R338 VanDerWaalsContact C-N 3.31Å; T336-N1818 HydrophobicContact CG2-CB 3.68Å; T336-N1818 VanDerWaalsContact OG1-CB 3.25Å; T336-N1818 WeakPolarHBondContact OG1-CB 3.39Å; T336-N1818 PolarHBondContact OG1-ND2 3.23Å
337	Q	42.9	Very low	46	Very low	171 Å²	171	104.4 Å²	104.4	80%	0.799	56%	0.561	S	S	*	*	H	α-helix	trans	-88.4	-3.1	160.7	-71.9	-174.8	-14.1	0	0	112.5	A333 I334	A333-Q337 WeakPolarHBondContact O-CG 3.45Å; A333-Q337 PolarHBondContact O-N 3.4Å; A333-Q337 VanDerWaalsContact O-N 3.08Å; I334-Q337 PolarHBondContact O-N 2.92Å
338	R	35.4	Very low	43.2	Very low	197 Å²	197	107 Å²	107	74%	0.743	59%	0.588	S	S	*	*			trans	-133.4	131.8	162.3	-60.7	173.5	180	160.7	-0.7	105.8	A335 T336	A335-R338 CarbonylContact C-O 2.96Å; T336-R338 VanDerWaalsContact C-N 3.31Å
339	P	32.7	Very low	41	Very low	109 Å²	109	107 Å²	107	71%	0.708	60%	0.597	S	S	*	*			cis	-125.3	135.4	23.1	36.7	-21.3	0	0	0	115.9
340	H	32.9	Very low	39.1	Very low	166 Å²	166	108.2 Å²	108.2	77%	0.769	60%	0.604	S	S	*	*	S	Bend	trans	-147.1	37	142.8	-156.1	-66.4	0	0	0	111.8
341	L	33	Very low	37.7	Very low	170 Å²	170	107.1 Å²	107.1	89%	0.89	61%	0.606	S	S	*	*	S	Bend	trans	-137.9	50.4	169.9	-79.5	-179.9	0	0	0	110.8
342	T	33.7	Very low	36.4	Very low	132 Å²	132	108.7 Å²	108.7	81%	0.81	61%	0.613	S	S	*	*	S	Bend	trans	-161.8	56.8	167.3	12.9	0	0	0	0	110
343	A	33.5	Very low	35.4	Very low	73 Å²	73	109.4 Å²	109.4	60%	0.603	63%	0.628	S	S	*	*			trans	-148	40.6	178.7	0	0	0	0	0	112.7
344	F	31.7	Very low	34.5	Very low	204 Å²	204	113.3 Å²	113.3	90%	0.895	64%	0.644	S	S	*	*			trans	-140	75.8	166	-87.6	-66.3	0	0	0	110.9
345	N	31.6	Very low	33.5	Very low	149 Å²	149	113 Å²	113	80%	0.797	64%	0.643	S	S	*	*	S	Bend	trans	-138.8	146.4	138.4	-98	-21.4	0	0	0	106
346	S	31.7	Very low	32.7	Very low	62 Å²	62	117.6 Å²	117.6	43%	0.434	65%	0.647	S	S	.	*	S	Bend	trans	27.4	115.7	158.4	-63.9	0	0	0	0	118.3	N63	N63-S346 PolarHBondContact N-OG 2.78Å; N63-S346 WeakPolarHBondContact O-CB 3.36Å; N63-S346 PolarHBondContact O-OG 2.69Å
347	V	31.7	Very low	31.7	Very low	70 Å²	70	119.5 Å²	119.5	42%	0.424	65%	0.654	S	S	.	*			cis	-164.6	153.7	40	174.7	0	0	0	0	108.2	I62 N63 H64	I62-V347 HydrophobicContact CB-CG1 4.34Å; I62-V347 HydrophobicContact CG1-CB 4.28Å; I62-V347 HydrophobicContact CG1-CG1 3.77Å; I62-V347 HydrophobicContact CG2-CG1 4.12Å; N63-V347 VanDerWaalsContact CA-CG2 3.49Å; H64-V347 HydrophobicContact CB-CG2 4.06Å
348	G	29.3	Very low	31	Very low	59 Å²	59	114.2 Å²	114.2	61%	0.608	64%	0.636	S	S	*	*			trans	142.7	72.9	154	0	0	0	0	0	117.1
349	S	31.3	Very low	30.7	Very low	79 Å²	79	113.5 Å²	113.5	55%	0.552	63%	0.633	S	S	*	*			trans	44.8	129.6	157.6	-160.4	0	0	0	0	120.7
350	T	32.8	Very low	30.4	Very low	107 Å²	107	110.3 Å²	110.3	66%	0.656	62%	0.616	S	S	*	*			trans	54.4	91.4	147.5	49.9	0	0	0	0	117.6
351	T	28.7	Very low	30.3	Very low	93 Å²	93	106.7 Å²	106.7	57%	0.571	61%	0.607	S	S	*	*				59.1	113.7	90.9	64.7	0	0	0	0	115.6	T59	T59-T351 HydrophobicContact CG2-CG2 4.28Å
352	T	29.3	Very low	30	Very low	81 Å²	81	103.3 Å²	103.3	50%	0.497	59%	0.589	S	S	.	*			trans	16.1	118.2	130.2	44.3	0	0	0	0	117.1
353	P	31.4	Very low	29.7	Very low	111 Å²	111	100.1 Å²	100.1	72%	0.721	58%	0.582	S	S	*	*				-133.9	119.1	97.3	31.6	-18.8	0	0	0	112.2
354	N	27.5	Very low	29.4	Very low	117 Å²	117	101.3 Å²	101.3	63%	0.626	58%	0.582	S	S	*	*				89.4	159.5	87.3	-77	-46.3	0	0	0	112.3
355	I	28.4	Very low	29.1	Very low	105 Å²	105	98.2 Å²	98.2	54%	0.538	58%	0.575	S	S	.	*				41.8	134.5	103.8	-42.6	167.1	0	0	0	113.5	I357	I355-I357 HydrophobicContact CG2-CD1 3.75Å; I355-I357 HydrophobicContact CG2-CG1 4.24Å
356	R	29	Very low	28.9	Very low	157 Å²	157	96.7 Å²	96.7	59%	0.592	57%	0.571	S	S	*	*			cis	-96.3	176.5	9.1	-97.6	89.5	-154.2	-177.7	4.8	111.5	D1321 S1322	R356-D1321 HydrophobicContact CB-CB 3.71Å; R356-D1321 WeakPolarHBondContact CB-OD2 3.33Å; R356-D1321 WeakPolarHBondContact O-CB 3.25Å; R356-S1322 WeakPolarHBondContact O-CB 3.49Å; R356-S1322 PolarHBondContact O-OG 2.92Å
357	I	28.3	Very low	28.6	Very low	98 Å²	98	98.4 Å²	98.4	50%	0.503	58%	0.583	S	S	.	*			cis	98	99.3	6.8	-54.1	174.2	0	0	0	117	I355 S1320 D1321	I355-I357 HydrophobicContact CG2-CD1 3.75Å; I355-I357 HydrophobicContact CG2-CG1 4.24Å; I357-S1320 CarbonylContact C-O 3.41Å; I357-S1320 VanDerWaalsContact C-O 3.27Å; I357-D1321 CarbonylContact C-O 3.48Å; I357-D1321 WeakPolarHBondContact CA-O 3.49Å; I357-D1321 PolarHBondContact N-O 2.6Å
358	S	26.9	Very low	28.5	Very low	59 Å²	59	100.9 Å²	100.9	41%	0.413	60%	0.604	S	S	.	*			trans	96	-176.7	156.6	-48.5	0	0	0	0	119.1	S1320 D1321	S358-S1320 CarbonylContact C-O 3.02Å; S358-S1320 WeakPolarHBondContact CA-O 3.48Å; S358-S1320 PolarHBondContact N-O 3.48Å; S358-S1320 CarbonylContact O-C 3.5Å; S358-D1321 PolarHBondContact N-O 3.43Å; S358-D1321 CarbonylContact O-C 3.27Å; S358-D1321 PolarHBondContact O-N 2.85Å
359	R	28.5	Very low	28.6	Very low	183 Å²	183	101.2 Å²	101.2	69%	0.691	61%	0.607	S	S	*	*				68.2	142.9	111.1	-84.8	168	-133.3	-149	0.6	115.3	L1319 S1320	R359-L1319 WeakPolarHBondContact CB-O 3.38Å; R359-L1319 CarbonylContact O-C 3.55Å; R359-L1319 VanDerWaalsContact O-C 3.29Å; R359-S1320 CarbonylContact O-C 3.57Å; R359-S1320 PolarHBondContact O-N 2.91Å; R359-S1320 VanDerWaalsContact O-N 3.09Å
360	A	28.3	Very low	28.4	Very low	42 Å²	42	107.4 Å²	107.4	35%	0.347	62%	0.618	S	S	.	*			cis	-150.1	164.3	-22.3	0	0	0	0	0	109	M1318	A360-M1318 VanDerWaalsContact CB-O 3.28Å; A360-M1318 WeakPolarHBondContact CB-O 3.38Å
361	P	30.4	Very low	28.2	Very low	90 Å²	90	108.7 Å²	108.7	58%	0.584	63%	0.626	S	S	*	*			trans	-97.7	-155.1	-162.1	39.1	-34.5	0	0	0	112.1	A1317	P361-A1317 VanDerWaalsContact O-CA 3.28Å; P361-A1317 WeakPolarHBondContact O-CA 3.39Å; P361-A1317 PolarHBondContact O-N 2.86Å
362	I	26.1	Very low	27.9	Very low	99 Å²	99	110.3 Å²	110.3	51%	0.508	63%	0.625	S	S	.	*			trans	77.1	149.8	164.8	-66.8	157.1	0	0	0	114.5	T364 Q1315	I362-T364 HydrophobicContact CG2-CG2 4.19Å; I362-Q1315 VanDerWaalsContact CD1-O 3.24Å; I362-Q1315 WeakPolarHBondContact CD1-O 3.26Å
363	G	27.4	Very low	27.9	Very low	64 Å²	64	113.7 Å²	113.7	66%	0.66	64%	0.639	S	S	*	*			trans	108.2	46	-162.8	0	0	0	0	0	111.7
364	T	26.8	Very low	27.6	Very low	99 Å²	99	112.7 Å²	112.7	61%	0.607	63%	0.631	S	S	*	*				43.3	135.9	73.3	67.6	0	0	0	0	115.3	I362	I362-T364 HydrophobicContact CG2-CG2 4.19Å
365	N	25.5	Very low	27.5	Very low	138 Å²	138	113.6 Å²	113.6	74%	0.738	64%	0.636	S	S	*	*			trans	77.5	93.6	166.9	-48.7	-33.3	0	0	0	113.9
366	T	26.7	Very low	27.5	Very low	117 Å²	117	113.5 Å²	113.5	72%	0.718	64%	0.64	S	S	*	*				73.8	149.3	67.6	69.5	0	0	0	0	114.7
367	S	25.9	Very low	27.4	Very low	98 Å²	98	115.6 Å²	115.6	69%	0.685	65%	0.654	S	S	*	*			trans	59.9	102.1	148.7	59.3	0	0	0	0	118
368	S	29.1	Very low	27.4	Very low	123 Å²	123	115 Å²	115	86%	0.86	67%	0.672	S	S	*	*				-159.7	161.8	96.7	-80.4	0	0	0	0	111.6
369	G	32.2	Very low	27.5	Very low	66 Å²	66	115.4 Å²	115.4	68%	0.68	69%	0.686	S	S	*	*			trans	70.3	100	-178	0	0	0	0	0	113.7
370	R	27.4	Very low	27.6	Very low	208 Å²	208	113.2 Å²	113.2	79%	0.785	69%	0.693	S	S	*	*			cis	63.3	47.5	4.4	-144.1	-167	-161.5	-174.9	7.4	116.6	F372	R370-F372 HydrophobicContact CG-CD2 4.3Å; R370-F372 HydrophobicContact CG-CE2 3.73Å; R370-F372 HydrophobicContact CG-CZ 4.06Å; R370-F372 WeakPolarHBondContact O-CD2 3.11Å
371	V	28.1	Very low	27.8	Very low	135 Å²	135	117 Å²	117	82%	0.818	71%	0.712	S	S	*	*			trans	-118.2	98.6	150.5	177.5	0	0	0	0	102.4
372	F	22.8	Very low	27.7	Very low	127 Å²	127	121.4 Å²	121.4	56%	0.557	72%	0.724	S	S	*	*				45.8	119	77.3	-58.9	-65.3	0	0	0	109.5	R370	R370-F372 HydrophobicContact CG-CD2 4.3Å; R370-F372 HydrophobicContact CG-CE2 3.73Å; R370-F372 HydrophobicContact CG-CZ 4.06Å; R370-F372 WeakPolarHBondContact O-CD2 3.11Å
373	L	28.4	Very low	27.8	Very low	151 Å²	151	128.6 Å²	128.6	79%	0.791	75%	0.745	S	S	*	*				-150.5	116.5	54.2	-78.3	166.3	0	0	0	108
374	T	26	Very low	27.8	Very low	91 Å²	91	133.1 Å²	133.1	56%	0.558	75%	0.749	S	S	*	*				61.8	128.5	91.9	65	0	0	0	0	115.7
375	N	25.5	Very low	27.8	Very low	135 Å²	135	135 Å²	135	72%	0.722	76%	0.76	S	S	*	*			trans	73.2	110.8	136.3	-68.1	21.6	0	0	0	117.2
376	T	27.7	Very low	28	Very low	103 Å²	103	135.8 Å²	135.8	63%	0.632	76%	0.759	S	S	*	*				62.1	137.1	77.9	67.8	0	0	0	0	114.3
377	F	27	Very low	28.2	Very low	201 Å²	201	135.4 Å²	135.4	88%	0.882	76%	0.756	S	S	*	*			trans	77.7	89.1	179	-56.8	-77.2	0	0	0	116.6
378	G	29.2	Very low	28.4	Very low	85 Å²	85	135 Å²	135	88%	0.876	75%	0.752	S	S	*	*				95.8	115.1	108.1	0	0	0	0	0	118.3
379	G	28.8	Very low	28.4	Very low	69 Å²	69	135.8 Å²	135.8	71%	0.711	75%	0.745	S	S	*	*			trans	126.2	117.9	130.8	0	0	0	0	0	118.4
380	V	30.7	Very low	28.3	Very low	136 Å²	136	138.8 Å²	138.8	82%	0.824	75%	0.753	S	S	*	*			trans	77	129	131.3	-169.5	0	0	0	0	119.3
381	T	31.4	Very low	28.5	Very low	122 Å²	122	132.4 Å²	132.4	75%	0.748	74%	0.744	S	S	*	*			trans	58.3	109.9	160.7	51.4	0	0	0	0	122.6
382	H	29	Very low	28.6	Very low	182 Å²	182	134.3 Å²	134.3	84%	0.843	75%	0.75	S	S	*	*				27.3	120.3	114.7	-98.2	-115.3	0	0	0	119.7
383	R	28.8	Very low	29.2	Very low	250 Å²	250	135.1 Å²	135.1	94%	0.943	76%	0.756	S	S	*	*				-165.1	153.1	99	-109.5	177.3	172.9	167.7	-2.7	113.4
384	Q	27.1	Very low	29.3	Very low	160 Å²	160	131.4 Å²	131.4	75%	0.748	75%	0.754	S	S	*	*			trans	-63.7	158.3	177.8	165.1	-171.7	-4.4	0	0	115
385	V	27.5	Very low	29.6	Very low	139 Å²	139	135.8 Å²	135.8	84%	0.842	77%	0.77	S	S	*	*			trans	-179.4	174.7	136.7	147.1	0	0	0	0	111.3
386	H	28.4	Very low	30	Very low	154 Å²	154	133.8 Å²	133.8	71%	0.713	77%	0.767	S	S	*	*			trans	-87.8	156	-144.9	-84.6	-152.5	0	0	0	120.4
387	V	31.5	Very low	30.2	Very low	108 Å²	108	135.8 Å²	135.8	66%	0.655	77%	0.773	S	S	*	*				6.8	141.4	125.9	-168.8	0	0	0	0	119.7	I389	V387-I389 HydrophobicContact CG1-CG1 4.07Å
388	C	30	Very low	30.3	Very low	90 Å²	90	132.4 Å²	132.4	61%	0.608	77%	0.769	S	S	*	*			trans	-137	148.6	142.7	-80.5	0	0	0	0	110.1
389	I	28.4	Very low	30.4	Very low	140 Å²	140	137 Å²	137	72%	0.718	77%	0.767	S	S	*	*			trans	-118.9	142.3	176.3	-58.4	171.4	0	0	0	107.5	V387 A391	V387-I389 HydrophobicContact CG1-CG1 4.07Å; I389-A391 PolarHBondContact O-N 3.38Å
390	P	31.8	Very low	30.4	Very low	128 Å²	128	139.2 Å²	139.2	83%	0.831	77%	0.771	S	S	*	*			trans	-80.5	94.1	166.3	32.7	-31.1	0	0	0	110.2
391	A	29.8	Very low	30.4	Very low	74 Å²	74	135.6 Å²	135.6	61%	0.612	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-93.4	131.4	154	0	0	0	0	0	107.6	I389	I389-A391 PolarHBondContact O-N 3.38Å
392	N	31.9	Very low	30.4	Very low	175 Å²	175	134.4 Å²	134.4	94%	0.936	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-93.3	116.8	167.2	-112.5	28.9	0	0	0	107.5
393	Q	33.9	Very low	30.3	Very low	144 Å²	144	131 Å²	131	67%	0.673	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-77.7	165.9	-174.9	-65.3	172.8	-7.3	0	0	112.6	E1279	Q393-E1279 VanDerWaalsContact NE2-CD 3.27Å; Q393-E1279 PolarHBondContact NE2-OE1 3.12Å; Q393-E1279 VanDerWaalsContact NE2-OE1 3.11Å; Q393-E1279 PolarHBondContact NE2-OE2 3.22Å
394	G	31.4	Very low	30.4	Very low	73 Å²	73	125.2 Å²	125.2	75%	0.753	72%	0.718	S	S	*	*			trans	-145.7	37	-178.6	0	0	0	0	0	115
395	M	32.3	Very low	30.4	Very low	184 Å²	184	124.6 Å²	124.6	91%	0.906	72%	0.719	S	S	*	*			trans	69.7	156	167.4	-45.7	173.9	70.8	0	0	114.7
396	S	33.3	Very low	30.5	Very low	92 Å²	92	123.4 Å²	123.4	64%	0.643	71%	0.712	S	S	*	*			cis	-156.2	146.9	11.9	61.4	0	0	0	0	115.2
397	N	31.1	Very low	30.6	Very low	145 Å²	145	121.2 Å²	121.2	78%	0.775	71%	0.714	S	S	*	*			trans	82.3	128.6	139.4	-66.4	0.6	0	0	0	125.1
398	V	30.6	Very low	30.6	Very low	130 Å²	130	121.2 Å²	121.2	79%	0.788	72%	0.719	S	S	*	*			trans	76.4	134.5	141.9	167.4	0	0	0	0	119.3
399	Q	31.9	Very low	30.6	Very low	181 Å²	181	123.4 Å²	123.4	85%	0.846	73%	0.729	S	S	*	*			cis	-166.4	171.5	-17.3	-176.1	164.4	-1	0	0	109.6
400	C	27	Very low	30.6	Very low	117 Å²	117	123.9 Å²	123.9	79%	0.791	73%	0.732	S	S	*	*			trans	-132	171	-164.3	-156.7	0	0	0	0	117.1
401	G	31.7	Very low	30.5	Very low	60 Å²	60	122 Å²	122	62%	0.619	72%	0.722	S	S	*	*			trans	124.8	156	166.9	0	0	0	0	0	116.7
402	E	31.1	Very low	30.6	Very low	97 Å²	97	126 Å²	126	45%	0.453	73%	0.728	S	S	.	*			cis	-170.4	156.5	-19	-133	179.4	-175.1	0	0	113.9	S470	E402-S470 WeakPolarHBondContact OE1-CB 3.23Å; E402-S470 PolarHBondContact OE1-OG 3.35Å
403	F	27.5	Very low	30.5	Very low	109 Å²	109	124 Å²	124	48%	0.478	72%	0.717	S	S	.	*			trans	75.1	142.8	149.1	-78.9	-52.7	0	0	0	129.3	N471 M472	F403-N471 HydrophobicContact CZ-CB 4.35Å; F403-M472 HydrophobicContact CD1-CG 4.4Å; F403-M472 HydrophobicContact CE1-CG 3.96Å
404	N	29.8	Very low	30.4	Very low	129 Å²	129	119.9 Å²	119.9	69%	0.69	71%	0.713	S	S	*	*			trans	73.8	154.6	147.1	-64.7	-23	0	0	0	122
405	L	28.6	Very low	30.3	Very low	148 Å²	148	122.1 Å²	122.1	78%	0.775	72%	0.717	S	S	*	*			cis	-166.4	-165.7	-24.9	-102.5	172.9	0	0	0	106.6
406	V	28.7	Very low	30	Very low	113 Å²	113	117.7 Å²	117.7	69%	0.685	71%	0.71	S	S	*	*			cis	-160.2	157	7.2	84.6	0	0	0	0	111.5
407	S	30	Very low	29.8	Very low	109 Å²	109	117.7 Å²	117.7	76%	0.762	72%	0.715	S	S	*	*			trans	53.9	148.8	157.7	-61.2	0	0	0	0	122.1
408	S	31.3	Very low	29.8	Very low	107 Å²	107	115 Å²	115	75%	0.748	71%	0.713	S	S	*	*			cis	-144.1	-145.2	8.4	-144.6	0	0	0	0	110.5
409	V	31.6	Very low	29.6	Very low	136 Å²	136	116.5 Å²	116.5	82%	0.824	72%	0.716	S	S	*	*			cis	-150.5	-179.5	11.1	-137.6	0	0	0	0	112
410	I	28.1	Very low	30.1	Very low	151 Å²	151	113.2 Å²	113.2	77%	0.774	71%	0.71	S	S	*	*			trans	-80.7	148.9	176	-68.5	160.8	0	0	0	110
411	S	29.3	Very low	30.3	Very low	89 Å²	89	113.3 Å²	113.3	62%	0.622	71%	0.709	S	S	*	*			cis	-156.9	-178.7	29.8	-126	0	0	0	0	108.8
412	E	32.3	Very low	30.3	Very low	158 Å²	158	117.6 Å²	117.6	74%	0.738	72%	0.718	S	S	*	*			cis	-178.1	-177.8	-11.3	-122.3	-179.8	107.3	0	0	107
413	N	30	Very low	30.2	Very low	133 Å²	133	124.4 Å²	124.4	71%	0.711	74%	0.741	S	S	*	*			cis	-156.1	172.2	-25.6	-152.8	-30.5	0	0	0	107.7
414	G	30.7	Very low	30.3	Very low	57 Å²	57	122.4 Å²	122.4	59%	0.588	75%	0.751	S	S	*	*			trans	79.1	107	158.5	0	0	0	0	0	116
415	S	29.1	Very low	30.2	Very low	120 Å²	120	121.9 Å²	121.9	84%	0.839	76%	0.757	S	S	*	*				67.8	133.9	59.2	-60	0	0	0	0	114.6
416	A	27.8	Very low	30	Very low	91 Å²	91	120.1 Å²	120.1	75%	0.752	76%	0.756	S	S	*	*			cis	-166.7	174.5	-11.2	0	0	0	0	0	111.6
417	A	28.2	Very low	30.3	Very low	92 Å²	92	118 Å²	118	76%	0.76	76%	0.757	S	S	*	*			trans	71.9	134.1	143.7	0	0	0	0	0	122.5
418	A	30.1	Very low	30.3	Very low	89 Å²	89	123.9 Å²	123.9	74%	0.736	76%	0.763	S	S	*	*			trans	67.2	154.9	136.9	0	0	0	0	0	121.4
419	L	26.6	Very low	30.2	Very low	160 Å²	160	124.1 Å²	124.1	84%	0.838	76%	0.764	S	S	*	*			cis	-159	153.4	-27.3	-103.9	166.7	0	0	0	105.8
420	P	43.5	Very low	30.2	Very low	112 Å²	112	123.4 Å²	123.4	73%	0.727	76%	0.76	S	S	*	*			trans	-82.7	166.1	178.9	35.6	-34.5	0	0	0	112.3
421	P	29.9	Very low	30.3	Very low	120 Å²	120	127 Å²	127	78%	0.779	76%	0.764	S	S	*	*				-145	166.3	115.9	38.6	-25.7	0	0	0	115.9
422	N	31.5	Very low	30.3	Very low	149 Å²	149	127.1 Å²	127.1	80%	0.797	76%	0.764	S	S	*	*			trans	-64.2	160.5	159.5	-69.6	-65.9	0	0	0	111.5
423	Y	28.9	Very low	30.2	Very low	241 Å²	241	124.3 Å²	124.3	95%	0.945	76%	0.763	S	S	*	*			trans	179.1	157	131.9	-98.7	-62.4	0	0	0	112.8
424	G	30.3	Very low	30.6	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	76%	0.761	S	S	*	*			trans	85.7	124.3	173.1	0	0	0	0	0	114.9
425	S	27.3	Very low	30.7	Very low	118 Å²	118	132.6 Å²	132.6	83%	0.825	77%	0.77	S	S	*	*			cis	63.4	138.9	17.2	-136.2	0	0	0	0	113.8
426	C	25.6	Very low	30.8	Very low	111 Å²	111	134.2 Å²	134.2	75%	0.75	76%	0.762	S	S	*	*			cis	-155.3	177.5	4.2	-149.6	0	0	0	0	111.4
427	G	33.6	Very low	31	Very low	68 Å²	68	136 Å²	136	70%	0.701	76%	0.755	S	S	*	*			trans	137.6	71.8	168	0	0	0	0	0	115.9
428	R	31	Very low	31.4	Very low	234 Å²	234	138.2 Å²	138.2	88%	0.883	75%	0.754	S	S	*	*				62.2	97.7	83.7	-69.6	-169.7	169.4	-155.5	-0.5	117.2
429	S	29	Very low	31.4	Very low	112 Å²	112	140.2 Å²	140.2	78%	0.783	75%	0.752	S	S	*	*				-171.6	121.2	126.1	-95.2	0	0	0	0	110.9
430	V	31.2	Very low	31.8	Very low	121 Å²	121	139.3 Å²	139.3	73%	0.733	75%	0.747	S	S	*	*				67	120.7	93.1	165.9	0	0	0	0	111.1
431	R	29.7	Very low	31.2	Very low	227 Å²	227	139.3 Å²	139.3	86%	0.857	75%	0.745	S	S	*	*			cis	-163.1	167.5	4.8	-102.4	170.7	-179.1	166.2	-3.2	106.1
432	S	29.7	Very low	31.5	Very low	90 Å²	90	140.7 Å²	140.7	63%	0.629	75%	0.745	S	S	*	*			cis	-179.4	163.8	-15.3	54.4	0	0	0	0	109.5
433	S	29.6	Very low	31.5	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	74%	0.743	S	S	*	*			trans	71.4	144.5	155.5	-64.1	0	0	0	0	117.7
434	K	38.3	Very low	31.7	Very low	158 Å²	158	131.3 Å²	131.3	69%	0.687	73%	0.733	S	S	*	*			cis	-160.3	141.5	-2.8	-123	172	-177.8	176.6	0	110.1
435	R	33.2	Very low	31.7	Very low	206 Å²	206	131.6 Å²	131.6	78%	0.777	74%	0.735	S	S	*	*			trans	57.6	147.2	137.6	-77.2	177.3	-175.1	-169.1	-1	119.8
436	K	31.9	Very low	31.7	Very low	153 Å²	153	131.2 Å²	131.2	67%	0.665	73%	0.733	S	S	*	*			cis	-158.6	171.6	-17.4	-141.5	-175.2	179.3	-123.1	0	108.5
437	Q	32.3	Very low	31.7	Very low	129 Å²	129	131.1 Å²	131.1	60%	0.603	73%	0.733	S	S	*	*			trans	-20.6	140.4	146.6	-58.7	153	-36.8	0	0	113.2
438	D	36	Very low	31.3	Very low	139 Å²	139	132.9 Å²	132.9	74%	0.743	74%	0.735	S	S	*	*				-158.4	169	78	-81.5	-23.1	0	0	0	110.8
439	L	30.8	Very low	31.3	Very low	131 Å²	131	125.6 Å²	125.6	69%	0.686	73%	0.725	S	S	*	*			cis	-174	161.5	-36.5	-128.9	175.6	0	0	0	105.6
440	L	34.4	Very low	31.1	Very low	141 Å²	141	127.9 Å²	127.9	74%	0.738	73%	0.728	S	S	*	*			trans	72.5	125.1	168.4	-58.1	171.4	0	0	0	115.4
441	T	31.5	Very low	30.9	Very low	111 Å²	111	127 Å²	127	68%	0.681	73%	0.734	S	S	*	*				76.4	121.5	65	-57	0	0	0	0	109.4
442	L	36.7	Very low	30.6	Very low	149 Å²	149	119.2 Å²	119.2	78%	0.78	73%	0.725	S	S	*	*			cis	-119.8	127.1	39	-76	162	0	0	0	112.9
443	T	30.9	Very low	30.4	Very low	122 Å²	122	122.1 Å²	122.1	75%	0.748	73%	0.731	S	S	*	*				51.1	132.9	100.4	66.5	0	0	0	0	115.5
444	G	32.6	Very low	30.2	Very low	72 Å²	72	126.2 Å²	126.2	74%	0.742	74%	0.74	S	S	*	*			cis	156.7	-172.4	6.4	0	0	0	0	0	109.5
445	G	30.2	Very low	29.6	Very low	71 Å²	71	121.4 Å²	121.4	73%	0.732	73%	0.734	S	S	*	*			cis	-99.8	160	-23.1	0	0	0	0	0	110.6
446	S	28.2	Very low	29.1	Very low	110 Å²	110	122 Å²	122	77%	0.769	74%	0.743	S	S	*	*			cis	81.5	149.9	36.4	-56.6	0	0	0	0	114.6
447	S	25.3	Very low	28.8	Very low	109 Å²	109	119.7 Å²	119.7	76%	0.762	75%	0.746	S	S	*	*			trans	70.9	156.8	148.6	24.9	0	0	0	0	119
448	S	25.4	Very low	28.5	Very low	106 Å²	106	118 Å²	118	74%	0.741	75%	0.749	S	S	*	*			cis	-179	174.4	-22.5	52.2	0	0	0	0	110.2
449	A	29.5	Very low	28.6	Very low	81 Å²	81	116.8 Å²	116.8	67%	0.669	75%	0.751	S	S	*	*			trans	69.4	142.9	161.5	0	0	0	0	0	115.5
450	N	26.7	Very low	29.1	Very low	159 Å²	159	116 Å²	116	85%	0.85	75%	0.754	S	S	*	*			cis	82	140.1	33.9	-64.4	-3.5	0	0	0	113.8
451	A	25.6	Very low	29.1	Very low	103 Å²	103	114.5 Å²	114.5	85%	0.851	75%	0.752	S	S	*	*			trans	66.1	155.3	-163	0	0	0	0	0	113.2
452	G	23.3	Very low	28.8	Very low	64 Å²	64	114.8 Å²	114.8	66%	0.66	75%	0.754	S	S	*	*			cis	112.4	104.8	-12.9	0	0	0	0	0	114.6
453	I	26.7	Very low	28.4	Very low	150 Å²	150	114.3 Å²	114.3	77%	0.769	75%	0.751	S	S	*	*			trans	71.4	142.2	176.2	-57.2	171.5	0	0	0	113.3
454	E	25	Very low	28.3	Very low	187 Å²	187	114.7 Å²	114.7	87%	0.874	75%	0.749	S	S	*	*			trans	58.6	138	174.8	-71.6	147.9	-133.5	0	0	117.3
455	G	25.2	Very low	28.4	Very low	56 Å²	56	116.4 Å²	116.4	58%	0.577	74%	0.741	S	S	*	*			cis	158.5	136.9	-8.9	0	0	0	0	0	112.1
456	F	22.6	Very low	28.6	Very low	218 Å²	218	122 Å²	122	96%	0.956	74%	0.741	S	S	*	*			trans	63.7	161.8	165.5	-62.4	-90.8	0	0	0	120
457	S	25.4	Very low	29	Very low	105 Å²	105	123.9 Å²	123.9	73%	0.734	74%	0.743	S	S	*	*			trans	88.3	130.2	144	-155.9	0	0	0	0	122.3
458	S	27.2	Very low	29.5	Very low	94 Å²	94	124.8 Å²	124.8	66%	0.657	74%	0.739	S	S	*	*			trans	60.2	101.8	140.1	56.6	0	0	0	0	120.9
459	S	37.3	Very low	30	Very low	113 Å²	113	126.7 Å²	126.7	79%	0.79	74%	0.74	S	S	*	*				17.7	175.6	84.2	-37.2	0	0	0	0	118.3
460	P	41.9	Very low	30	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	72%	0.724	S	S	*	*			cis	-132.9	-155.7	5.5	44.7	-23.7	0	0	0	111.2
461	P	33.5	Very low	30.2	Very low	109 Å²	109	122 Å²	122	71%	0.708	71%	0.708	S	S	*	*			cis	-140.2	176.4	0.9	37.9	-16.1	0	0	0	119
462	V	25.9	Very low	30.3	Very low	117 Å²	117	123.2 Å²	123.2	71%	0.709	70%	0.697	S	S	*	*			trans	89.5	95	159	-166.9	0	0	0	0	118.5
463	L	28	Very low	30.6	Very low	140 Å²	140	130.7 Å²	130.7	73%	0.733	71%	0.705	S	S	*	*			trans	52.1	147.2	144.9	-75.8	96	0	0	0	120.4
464	D	28.8	Very low	31.1	Very low	129 Å²	129	129 Å²	129	69%	0.69	70%	0.704	S	S	*	*			cis	155.2	145.1	-8.3	-90.5	3.2	0	0	0	103.1
465	D	34.6	Very low	31.4	Very low	108 Å²	108	124.7 Å²	124.7	58%	0.578	70%	0.695	S	S	*	*			cis	-164.6	167.5	-7.9	-144.1	-18.4	0	0	0	111.9
466	Y	35.5	Very low	31.7	Very low	189 Å²	189	132.7 Å²	132.7	74%	0.741	71%	0.709	S	S	*	*			trans	57.7	140.1	161.8	-65.9	-60.1	0	0	0	122
467	D	36.2	Very low	32.1	Very low	149 Å²	149	126.5 Å²	126.5	80%	0.797	70%	0.698	S	S	*	*			cis	-157.8	-171.7	-0.3	-147.8	-22.3	0	0	0	112.8
468	D	35.6	Very low	32.5	Very low	129 Å²	129	128.1 Å²	128.1	69%	0.69	70%	0.704	S	S	*	*			trans	-98.3	175.9	-179.1	-162.5	50.5	0	0	0	115.3
469	L	34.8	Very low	32.7	Very low	145 Å²	145	128.9 Å²	128.9	76%	0.759	70%	0.701	S	S	*	*				176.7	144.5	107.5	-82.9	175.1	0	0	0	109.7
470	S	31.1	Very low	32.6	Very low	48 Å²	48	130.4 Å²	130.4	34%	0.336	70%	0.699	S	S	.	*				71.6	130.4	66.4	-156.8	0	0	0	0	114.7	E402	E402-S470 WeakPolarHBondContact OE1-CB 3.23Å; E402-S470 PolarHBondContact OE1-OG 3.35Å
471	N	30	Very low	32.2	Very low	94 Å²	94	132.5 Å²	132.5	50%	0.503	70%	0.696	S	S	.	*			cis	-161.6	-171	-12.7	-119.9	-69.4	0	0	0	108.7	F403	F403-N471 HydrophobicContact CZ-CB 4.35Å
472	M	27.5	Very low	31.9	Very low	128 Å²	128	131.1 Å²	131.1	63%	0.631	69%	0.689	S	S	*	*			cis	-157.7	-157.7	9.9	-133.7	-54.3	155.4	0	0	111.6	F403	F403-M472 HydrophobicContact CD1-CG 4.4Å; F403-M472 HydrophobicContact CE1-CG 3.96Å
473	R	30.5	Very low	32.1	Very low	221 Å²	221	129.3 Å²	129.3	83%	0.834	68%	0.681	S	S	*	*			trans	-162.5	-168.2	178.2	-133.5	-174.6	163.6	-178.4	0.4	109
474	P	36.4	Very low	32	Very low	114 Å²	114	129.2 Å²	129.2	74%	0.74	68%	0.675	S	S	*	*			cis	-132.1	-138.1	-25.4	41.6	-20.3	0	0	0	114.2
475	S	31.3	Very low	31.9	Very low	98 Å²	98	126.9 Å²	126.9	69%	0.685	66%	0.661	S	S	*	*			trans	-140.2	167	-156.8	61.7	0	0	0	0	118.7
476	Y	31.3	Very low	31.5	Very low	224 Å²	224	128.4 Å²	128.4	88%	0.878	67%	0.665	S	S	*	*			trans	-147.3	162	165.4	-71.8	-94.2	0	0	0	111.2
477	A	32.3	Very low	31.2	Very low	88 Å²	88	122.2 Å²	122.2	73%	0.727	66%	0.658	S	S	*	*			cis	90.5	135.2	9	0	0	0	0	0	116.9
478	T	32.1	Very low	30.9	Very low	139 Å²	139	119.4 Å²	119.4	85%	0.853	65%	0.65	S	S	*	*			cis	-160.5	-178.7	-2.1	-14	0	0	0	0	107.8
479	D	32.2	Very low	30.6	Very low	109 Å²	109	118.3 Å²	118.3	58%	0.583	64%	0.644	S	S	*	*			cis	-155.9	-165.2	8.7	176.7	37.6	0	0	0	108.2	K481	D479-K481 IonicContact OD2-NZ 3.27Å; D479-K481 PolarHBondContact OD2-NZ 3.39Å
480	L	35.4	Very low	30.4	Very low	146 Å²	146	116.8 Å²	116.8	76%	0.764	64%	0.636	S	S	*	*			trans	93.4	138.8	167	-50.5	172.4	0	0	0	116.3
481	K	33	Very low	30.3	Very low	158 Å²	158	119.8 Å²	119.8	69%	0.687	65%	0.652	S	S	*	*			cis	127.1	140.3	-8.9	-83	-178.4	-175.4	118.6	0	112.5	D479	D479-K481 IonicContact OD2-NZ 3.27Å; D479-K481 PolarHBondContact OD2-NZ 3.39Å
482	S	27.6	Very low	30.4	Very low	80 Å²	80	119.6 Å²	119.6	56%	0.559	66%	0.657	S	S	*	*			cis	175	150.4	-22.8	49.3	0	0	0	0	114.3
483	C	29.5	Very low	30.5	Very low	79 Å²	79	121 Å²	121	53%	0.534	66%	0.663	S	S	.	*			trans	90	154.1	149.8	-68.5	0	0	0	0	124.3	D1641	C483-D1641 VanDerWaalsContact CA-OD2 3.24Å; C483-D1641 WeakPolarHBondContact CA-OD2 3.38Å
484	F	26.4	Very low	30.5	Very low	139 Å²	139	113.3 Å²	113.3	61%	0.61	64%	0.64	S	S	*	*			trans	168.3	-164.1	170	-83.3	-132.6	0	0	0	113.3	C1640 D1641 A1642	F484-C1640 CarbonylContact C-O 3.6Å; F484-D1641 PolarHBondContact N-OD2 2.81Å; F484-D1641 VanDerWaalsContact O-CG 3.32Å; F484-D1641 VanDerWaalsContact O-OD2 3.08Å; F484-A1642 PolarHBondContact O-N 3.08Å
485	M	27.7	Very low	30.1	Very low	80 Å²	80	114.9 Å²	114.9	39%	0.394	64%	0.637	S	S	.	*	B	Isolated β-bridge	trans	-142.9	142.4	-176.5	-77.2	-170.1	59.1	0	0	119.2	C1640 A1642	M485-C1640 PolarHBondContact N-O 3.46Å; M485-A1642 CarbonylContact C-O 3.12Å; M485-A1642 WeakPolarHBondContact CA-O 3.24Å; M485-A1642 WeakPolarHBondContact CB-O 3.35Å; M485-A1642 WeakPolarHBondContact CG-O 3.37Å
486	E	25.9	Very low	30	Very low	140 Å²	140	113.2 Å²	113.2	65%	0.654	64%	0.636	S	S	*	*			trans	58.2	157.8	159.5	-79.4	152.7	179.1	0	0	120	A1642	E486-A1642 PolarHBondContact N-O 3.19Å
487	G	28.7	Very low	29.8	Very low	58 Å²	58	107.6 Å²	107.6	60%	0.598	63%	0.629	S	S	*	*			cis	167.3	148.2	-11.7	0	0	0	0	0	115.9
488	S	30.6	Very low	29.5	Very low	90 Å²	90	112.3 Å²	112.3	63%	0.629	64%	0.636	S	S	*	*			trans	71.6	112	156.4	-60.5	0	0	0	0	125.4
489	L	28.9	Very low	29.4	Very low	107 Å²	107	110.9 Å²	110.9	56%	0.56	63%	0.629	S	S	*	*				82.4	136.5	121.9	-71.3	169.9	0	0	0	125.8	H220	H220-L489 WeakPolarHBondContact CE1-CD1 3.4Å
490	N	29.8	Very low	29.1	Very low	113 Å²	113	113.7 Å²	113.7	60%	0.604	64%	0.642	S	S	*	*			trans	73.3	146.4	143.6	-70.5	-12.2	0	0	0	119.5
491	V	29.9	Very low	28.8	Very low	111 Å²	111	112.2 Å²	112.2	67%	0.673	64%	0.641	S	S	*	*			cis	-151.4	157.8	1.7	102.4	0	0	0	0	113
492	C	30.8	Very low	28.4	Very low	90 Å²	90	111.6 Å²	111.6	61%	0.608	65%	0.65	S	S	*	*			trans	-3.9	166.9	143.5	-73.2	0	0	0	0	121.7
493	Q	31.1	Very low	28.3	Very low	158 Å²	158	112.5 Å²	112.5	74%	0.738	66%	0.657	S	S	*	*			cis	-172.1	176.7	10.5	-109.9	158.2	-109.5	0	0	107
494	T	29.9	Very low	28.3	Very low	58 Å²	58	115.4 Å²	115.4	36%	0.356	67%	0.667	S	S	.	*			cis	-167.6	163.7	-1.8	25.4	0	0	0	0	106.2	S966	T494-S966 PolarHBondContact O-N 2.88Å; T494-S966 WeakPolarHBondContact OG1-CB 3.43Å
495	Q	28.7	Very low	28.3	Very low	147 Å²	147	117.1 Å²	117.1	69%	0.687	68%	0.675	S	S	*	*			cis	-169.9	169.4	-6.5	-113.7	169.9	-35.7	0	0	109.4
496	G	27.8	Very low	28.3	Very low	63 Å²	63	118.8 Å²	118.8	65%	0.649	69%	0.689	S	S	*	*			trans	127	130.7	160.8	0	0	0	0	0	114.7
497	S	26.7	Very low	28.3	Very low	107 Å²	107	120.1 Å²	120.1	75%	0.748	70%	0.695	S	S	*	*			cis	86.9	129.3	42.4	70.3	0	0	0	0	113.3
498	H	25.8	Very low	28.3	Very low	186 Å²	186	124.6 Å²	124.6	86%	0.861	70%	0.704	S	S	*	*			cis	-153.5	174	-0.1	-110.2	-58.2	0	0	0	109.8
499	P	31.6	Very low	28.1	Very low	110 Å²	110	130.9 Å²	130.9	71%	0.714	71%	0.714	S	S	*	*			trans	-99.2	169.7	-168.1	39.7	-37.8	0	0	0	115.7
500	I	25.5	Very low	28.1	Very low	167 Å²	167	133.9 Å²	133.9	86%	0.856	73%	0.725	S	S	*	*			trans	-160	153.7	151.1	-109.2	156.1	0	0	0	110.6
501	P	28.3	Very low	28.4	Very low	115 Å²	115	133.3 Å²	133.3	75%	0.747	73%	0.729	S	S	*	*			trans	-115.2	152.5	-165.7	39.9	-30.2	0	0	0	116
502	V	25.6	Very low	28.5	Very low	145 Å²	145	133 Å²	133	88%	0.879	73%	0.732	S	S	*	*			trans	-146.5	149.9	163.2	-164.2	0	0	0	0	110.6
503	S	25.9	Very low	28.5	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	74%	0.741	S	S	*	*			trans	-65.1	177.8	167	-43.3	0	0	0	0	112
504	D	27.7	Very low	28.4	Very low	139 Å²	139	134.2 Å²	134.2	74%	0.743	74%	0.74	S	S	*	*			cis	-163	179.9	16.9	-148.9	-29.7	0	0	0	111.7
505	K	27.3	Very low	28.3	Very low	176 Å²	176	138 Å²	138	77%	0.765	75%	0.753	S	S	*	*			trans	81.4	118.1	154.4	-75.1	173.9	-177.3	176.9	0	121.2
506	V	27.6	Very low	28.3	Very low	115 Å²	115	140.2 Å²	140.2	70%	0.697	76%	0.755	S	S	*	*			trans	98.8	94.2	131.5	173.9	0	0	0	0	120.6
507	Q	26.4	Very low	28.3	Very low	167 Å²	167	143.7 Å²	143.7	78%	0.78	76%	0.758	S	S	*	*			trans	82.2	145	130.1	-70	-175.8	0.8	0	0	124.4
508	I	27.8	Very low	28.5	Very low	153 Å²	153	145.2 Å²	145.2	79%	0.785	76%	0.757	S	S	*	*			trans	90.1	82.1	160.8	-58.2	140.1	0	0	0	119.7
509	R	26.8	Very low	28.6	Very low	221 Å²	221	141.8 Å²	141.8	83%	0.834	75%	0.749	S	S	*	*			trans	43.6	137.4	133	-61.3	-172.4	177.4	-176.4	-0.1	123.4
510	H	30.2	Very low	28.5	Very low	171 Å²	171	143.6 Å²	143.6	79%	0.792	75%	0.752	S	S	*	*			trans	75.2	134.6	161.2	-70.3	-71.6	0	0	0	119.8
511	S	34.5	Very low	28.8	Very low	100 Å²	100	141.1 Å²	141.1	70%	0.699	75%	0.749	S	S	*	*			cis	-174.3	88.1	-44	41	0	0	0	0	110.4
512	S	31.7	Very low	29.2	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	75%	0.747	S	S	*	*			trans	-166.6	151	178	65.9	0	0	0	0	114.6
513	I	31.5	Very low	29.5	Very low	155 Å²	155	140.9 Å²	140.9	80%	0.795	74%	0.742	S	S	*	*			trans	48	130	130.2	-66.4	172.2	0	0	0	118.6
514	V	28.5	Very low	29.7	Very low	118 Å²	118	141.9 Å²	141.9	72%	0.715	74%	0.74	S	S	*	*			cis	-173.7	161.8	-7.4	95	0	0	0	0	111.6
515	H	28.7	Very low	29.6	Very low	138 Å²	138	144.1 Å²	144.1	64%	0.639	74%	0.743	S	S	*	*			trans	76.9	118.2	157.2	-93.8	-161.4	0	0	0	125.2
516	R	28.3	Very low	29.7	Very low	194 Å²	194	141.2 Å²	141.2	73%	0.732	74%	0.74	S	S	*	*				76.1	122.3	118.5	-76.7	-172.4	-176.3	-174.6	-0.9	125.7
517	L	27.4	Very low	29.6	Very low	135 Å²	135	143.4 Å²	143.4	71%	0.707	74%	0.742	S	S	*	*			trans	92.1	104.3	130.5	-66.7	167.3	0	0	0	123.9
518	I	30.9	Very low	29.6	Very low	139 Å²	139	142.9 Å²	142.9	71%	0.713	75%	0.745	S	S	*	*				62.4	138.6	120.2	-62.4	-179.1	0	0	0	122.7
519	T	28.5	Very low	29.6	Very low	114 Å²	114	139.9 Å²	139.9	70%	0.699	74%	0.743	S	S	*	*			trans	64.7	146.1	167.6	43.4	0	0	0	0	118.3
520	D	29.4	Very low	29.6	Very low	148 Å²	148	134.5 Å²	134.5	79%	0.791	74%	0.739	S	S	*	*			cis	-153.2	175.4	1.2	-116.5	-33.6	0	0	0	112.3
521	C	32.1	Very low	29.4	Very low	115 Å²	115	131 Å²	131	78%	0.777	73%	0.73	S	S	*	*			trans	-111.3	172.4	177.1	-49.9	0	0	0	0	112.4
522	P	36.7	Very low	29	Very low	109 Å²	109	133.5 Å²	133.5	71%	0.708	73%	0.731	S	S	*	*				-159.5	160.7	80.5	41.3	-20.9	0	0	0	119.5
523	N	31.3	Very low	28.7	Very low	147 Å²	147	133.3 Å²	133.3	79%	0.786	73%	0.725	S	S	*	*			trans	60.4	150.2	150.2	-62.8	-18.2	0	0	0	120.1
524	N	29.6	Very low	28.5	Very low	120 Å²	120	133.5 Å²	133.5	64%	0.642	73%	0.727	S	S	*	*			cis	-157.7	134.2	27.7	-127.7	-30.4	0	0	0	111.9
525	K	27.5	Very low	28.4	Very low	186 Å²	186	136.2 Å²	136.2	81%	0.809	73%	0.732	S	S	*	*			trans	54.3	149.3	155.1	-53.1	176.4	-176.4	179.3	0	118.4
526	V	27.9	Very low	28.4	Very low	115 Å²	115	135.7 Å²	135.7	70%	0.697	74%	0.739	S	S	*	*			cis	-143.8	139.5	28.9	169.3	0	0	0	0	111.3
527	Q	26.8	Very low	28.3	Very low	162 Å²	162	132 Å²	132	76%	0.757	74%	0.742	S	S	*	*			trans	28.9	131.9	154	-60.6	161.3	-15.4	0	0	123.1
528	N	25.7	Very low	28.3	Very low	155 Å²	155	133.5 Å²	133.5	83%	0.829	75%	0.745	S	S	*	*				41.8	139.1	128.5	-47.7	-4.9	0	0	0	120.3
529	A	28.5	Very low	28.1	Very low	90 Å²	90	133.7 Å²	133.7	74%	0.744	75%	0.752	S	S	*	*			cis	-154.8	146.8	27.5	0	0	0	0	0	115.5
530	S	26.5	Very low	28	Very low	108 Å²	108	133 Å²	133	76%	0.755	75%	0.752	S	S	*	*			trans	24.1	122.3	135.1	-55.2	0	0	0	0	122.9
531	T	25.9	Very low	28.2	Very low	99 Å²	99	131.6 Å²	131.6	61%	0.607	75%	0.751	S	S	*	*				83.7	103.6	122.6	-56.6	0	0	0	0	120.6
532	Q	25.3	Very low	28.2	Very low	151 Å²	151	132.2 Å²	132.2	71%	0.706	75%	0.753	S	S	*	*			trans	64.2	167.5	152.7	-54.1	165.2	12.4	0	0	115.3
533	V	25.8	Very low	27.6	Very low	102 Å²	102	132.7 Å²	132.7	62%	0.618	76%	0.758	S	S	*	*			cis	-131.7	155.5	-2.4	-157.4	0	0	0	0	107.7
534	N	27.4	Very low	27.6	Very low	158 Å²	158	131.8 Å²	131.8	85%	0.845	76%	0.763	S	S	*	*				-179.2	127.7	123.4	-91.9	-13.4	0	0	0	112.4
535	E	26.5	Very low	27.6	Very low	175 Å²	175	130.9 Å²	130.9	82%	0.818	77%	0.772	S	S	*	*			trans	-80.4	-172.2	163.5	-63	-179.7	94.9	0	0	110.6
536	V	28.8	Very low	27.9	Very low	127 Å²	127	127.4 Å²	127.4	77%	0.77	77%	0.769	S	S	*	*			trans	70.5	110.3	-179.9	-166.4	0	0	0	0	111.4
537	C	25.6	Very low	27.9	Very low	118 Å²	118	129.1 Å²	129.1	80%	0.797	77%	0.774	S	S	*	*				-146.2	167.3	62.7	-153.1	0	0	0	0	114.9
538	H	27.3	Very low	28.3	Very low	166 Å²	166	127.2 Å²	127.2	77%	0.769	78%	0.779	S	S	*	*			trans	-79.6	138.7	-172.7	-54.3	-92.5	0	0	0	113.1
539	T	27.6	Very low	28.7	Very low	143 Å²	143	126.5 Å²	126.5	88%	0.877	78%	0.78	S	S	*	*			trans	-159.6	150.9	141.3	-0.1	0	0	0	0	112.2
540	S	26.9	Very low	28.9	Very low	100 Å²	100	130 Å²	130	70%	0.699	79%	0.785	S	S	*	*			trans	-37.1	147.7	-178.2	49.3	0	0	0	0	118.9
541	P	33.1	Very low	29.1	Very low	118 Å²	118	129 Å²	129	77%	0.766	78%	0.779	S	S	*	*			trans	-80.2	165.4	179	35.9	-38.1	0	0	0	113.9
542	P	31.6	Very low	29.6	Very low	127 Å²	127	126.3 Å²	126.3	83%	0.825	76%	0.762	S	S	*	*			trans	-132.8	135	135.2	31.1	-17.2	0	0	0	113.7
543	C	24.2	Very low	30.6	Very low	120 Å²	120	123.6 Å²	123.6	81%	0.811	76%	0.758	S	S	*	*			trans	-76.7	155.9	177.3	-60	0	0	0	0	113.5
544	S	30.3	Very low	31.9	Very low	127 Å²	127	122 Å²	122	89%	0.888	75%	0.752	S	S	*	*			trans	-171.6	65.8	149.2	-84.8	0	0	0	0	113.9
545	A	31.4	Very low	33.6	Very low	101 Å²	101	116.3 Å²	116.3	84%	0.835	72%	0.721	S	S	*	*			trans	-156.6	106.8	170.5	0	0	0	0	0	113.9
546	P	33.7	Very low	36.1	Very low	114 Å²	114	114.4 Å²	114.4	74%	0.74	72%	0.715	S	S	*	*			trans	-108.5	165.5	171.3	37.7	-30.9	0	0	0	114.5
547	D	28.1	Very low	39	Very low	151 Å²	151	111 Å²	111	81%	0.807	69%	0.689	S	S	*	*			trans	64	82	157.4	-58.9	-19.5	0	0	0	120.6
548	S	34.1	Very low	42.1	Very low	122 Å²	122	110.7 Å²	110.7	85%	0.853	68%	0.676	S	S	*	*			trans	-163.7	60.6	147.4	-82.2	0	0	0	0	113.7
549	V	33.9	Very low	45.2	Very low	139 Å²	139	109.2 Å²	109.2	84%	0.842	67%	0.669	S	S	*	*			trans	-89.5	152.1	173.4	-173.3	0	0	0	0	110.6
550	L	32.1	Very low	48.2	Very low	163 Å²	163	102.5 Å²	102.5	85%	0.853	63%	0.628	S	S	*	*			trans	82.1	50.4	-177.8	-52.7	176.2	0	0	0	117.5
551	S	32.4	Very low	51	Low	89 Å²	89	106.2 Å²	106.2	62%	0.622	64%	0.635	S	S	*	*			trans	-71.5	148.8	151.6	-66.4	0	0	0	0	111
552	P	35.9	Very low	53.6	Low	41 Å²	41	102.7 Å²	102.7	27%	0.266	62%	0.615	S	S	.	*			trans	-70.6	154	179.8	-15.6	30.8	0	0	0	112.8	S554 D555 N616	P552-S554 PolarHBondContact O-N 3.24Å; P552-D555 PolarHBondContact O-N 2.86Å; P552-D555 VanDerWaalsContact O-N 3.12Å; P552-N616 VanDerWaalsContact CD-ND2 3.33Å; P552-N616 WeakPolarHBondContact CD-ND2 3.47Å; P552-N616 WeakPolarHBondContact CG-ND2 3.35Å
553	P	45.6	Very low	56.5	Low	94 Å²	94	97.4 Å²	97.4	61%	0.61	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-62.1	-11.8	177	25.9	-35.4	0	0	0	114	D555 I556	P553-D555 PolarHBondContact O-N 2.7Å; P553-I556 PolarHBondContact O-N 3.18Å
554	S	54	Low	59.8	Low	70 Å²	70	96 Å²	96	49%	0.49	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-59.8	-20.6	172	-49	0	0	0	0	114.2	P552 F658 R682	P552-S554 PolarHBondContact O-N 3.24Å; S554-F658 VanDerWaalsContact O-CE2 3.31Å; S554-F658 WeakPolarHBondContact O-CE2 3.34Å; S554-R682 PolarHBondContact O-NH2 2.89Å
555	D	63.1	Low	62.7	Low	38 Å²	38	92.3 Å²	92.3	20%	0.203	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-86.6	-17.9	-177.5	-81.6	-52.5	0	0	0	113.8	P552 P553 R618 R682	P552-D555 PolarHBondContact O-N 2.86Å; P552-D555 VanDerWaalsContact O-N 3.12Å; P553-D555 PolarHBondContact O-N 2.7Å; D555-R618 VanDerWaalsContact CA-NH2 3.28Å; D555-R618 PolarHBondContact O-NH2 3.21Å; D555-R618 IonicContact OD1-CZ 2.91Å; D555-R618 IonicContact OD1-NE 3.49Å; D555-R618 PolarHBondContact OD1-NE 3.34Å; D555-R618 IonicContact OD1-NH2 3.9Å; D555-R618 PolarHBondContact OD1-NH2 2.75Å; D555-R682 PolarHBondContact O-NH2 3.05Å
556	I	78.7	Confident	65.7	Low	135 Å²	135	88.5 Å²	88.5	69%	0.692	50%	0.498	S	S	*	.			trans	-79.7	147	175.9	-56.5	174	0	0	0	109.8	P553 R682	P553-I556 PolarHBondContact O-N 3.18Å; I556-R682 PolarHBondContact O-NH2 2.84Å; I556-R682 VanDerWaalsContact O-NH2 3.16Å
557	Y	89.1	Confident	68.4	Low	56 Å²	56	86.9 Å²	86.9	22%	0.22	49%	0.49	C	S	.	.			trans	-164.6	160.9	172	63.4	-72.1	0	0	0	109.9	K676 G678 F683	Y557-K676 WeakPolarHBondContact CA-O 3.45Å; Y557-K676 WeakPolarHBondContact CB-O 3.33Å; Y557-G678 WeakPolarHBondContact CD2-O 3.16Å; Y557-G678 VanDerWaalsContact CE2-O 3.26Å; Y557-G678 WeakPolarHBondContact CE2-O 3.47Å; Y557-F683 HydrophobicContact CE1-CE2 4.33Å; Y557-F683 AromaticContact CE1-CZ 3.94Å; Y557-F683 HydrophobicContact CE1-CZ 3.94Å
558	E	91.5	Very high	71.5	Confident	111 Å²	111	85.6 Å²	85.6	52%	0.519	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.2	170	-159.4	178.3	139.9	0	0	109.5	A560 K676 Y677 G678	E558-A560 PolarHBondContact O-N 3.17Å; E558-K676 PolarHBondContact N-O 3.46Å; E558-Y677 HydrophobicContact CB-CD1 3.95Å; E558-Y677 HydrophobicContact CB-CE1 4.03Å; E558-Y677 HydrophobicContact CG-CD1 4.27Å; E558-Y677 HydrophobicContact CG-CE1 4.09Å; E558-Y677 CarbonylContact O-C 3.56Å; E558-Y677 WeakPolarHBondContact O-CA 3.47Å; E558-Y677 WeakPolarHBondContact OE1-CE1 3.22Å; E558-Y677 WeakPolarHBondContact OE2-CE1 3.35Å; E558-Y677 VanDerWaalsContact OE2-CZ 3.31Å; E558-Y677 PolarHBondContact OE2-OH 2.94Å; E558-Y677 VanDerWaalsContact OE2-OH 3.05Å; E558-G678 PolarHBondContact O-N 3.15Å
559	E	91.7	Very high	74.2	Confident	134 Å²	134	79.8 Å²	79.8	63%	0.626	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	114.6	-173.9	-176.2	153	-133.5	0	0	111.6	Q561 G678	E559-Q561 PolarHBondContact O-N 2.75Å; E559-G678 WeakPolarHBondContact CA-O 3.34Å
560	A	90	Very high	76.8	Confident	3 Å²	3	75 Å²	75	3%	0.025	41%	0.405	C	S	.	.			trans	-81.1	120.1	-177.2	0	0	0	0	0	111.1	E558 A562 R636 G678	E558-A560 PolarHBondContact O-N 3.17Å; A560-A562 VanDerWaalsContact C-N 3.3Å; A560-A562 PolarHBondContact O-N 3.43Å; A560-R636 HydrophobicContact CB-CB 3.94Å; A560-R636 WeakPolarHBondContact O-CD 3.08Å; A560-R636 PolarHBondContact O-NH1 2.84Å; A560-G678 PolarHBondContact N-O 3.46Å
561	Q	87	Confident	79.5	Confident	178 Å²	178	71.6 Å²	71.6	83%	0.832	38%	0.383	S	S	*	.	S	Bend	trans	-71.7	-24.1	175.5	-61.3	-177.5	7.2	0	0	112.8	E559 R636	E559-Q561 PolarHBondContact O-N 2.75Å; Q561-R636 PolarHBondContact O-NE 3.35Å; Q561-R636 PolarHBondContact O-NH1 3.39Å
562	A	87.9	Confident	82.2	Confident	44 Å²	44	71.1 Å²	71.1	36%	0.364	37%	0.37	S	S	.	.	S	Bend	trans	-146.1	179.1	179.1	0	0	0	0	0	111.7	A560 H564	A560-A562 VanDerWaalsContact C-N 3.3Å; A560-A562 PolarHBondContact O-N 3.43Å; A562-H564 PolarHBondContact O-CD2 2.81Å; A562-H564 PolarHBondContact O-N 3.35Å
563	L	92.4	Very high	84.5	Confident	15 Å²	15	69.2 Å²	69.2	8%	0.079	36%	0.358	C	S	.	.			trans	-80.2	109.5	168.3	-173.7	71.3	0	0	0	109.8	L565 C639 V672 L712 L714	L563-L565 HydrophobicContact CD2-CD2 3.98Å; L563-L565 HydrophobicContact CG-CD2 4.18Å; L563-L565 PolarHBondContact O-N 2.9Å; L563-C639 HydrophobicContact CD1-CB 4.13Å; L563-C639 HydrophobicContact CD2-CB 4.23Å; L563-C639 HydrophobicContact CG-CB 4.02Å; L563-V672 HydrophobicContact CD1-CG1 3.85Å; L563-V672 HydrophobicContact CD1-CG2 4.06Å; L563-L712 HydrophobicContact CD2-CD2 4.42Å; L563-L712 HydrophobicContact CD2-CG 4.18Å; L563-L712 WeakPolarHBondContact CD2-O 3.49Å; L563-L714 HydrophobicContact CD1-CD1 4.37Å; L563-L714 HydrophobicContact CD2-CD1 3.85Å; L563-L714 HydrophobicContact CD2-CG 4Å
564	H	92.3	Very high	86.3	Confident	92 Å²	92	68.1 Å²	68.1	43%	0.426	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	107.6	-177	-77.9	-143.8	0	0	0	110.3	A562 G637 C639	A562-H564 PolarHBondContact O-CD2 2.81Å; A562-H564 PolarHBondContact O-N 3.35Å; H564-G637 PolarHBondContact N-O 3.06Å; H564-C639 PolarHBondContact O-N 3.3Å
565	L	92.4	Very high	87.7	Confident	49 Å²	49	71.3 Å²	71.3	26%	0.257	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.5	-179.7	-55.8	-178.9	0	0	0	110.9	L563 V569 C570 L573 C639 L712	L563-L565 HydrophobicContact CD2-CD2 3.98Å; L563-L565 HydrophobicContact CG-CD2 4.18Å; L563-L565 PolarHBondContact O-N 2.9Å; L565-V569 HydrophobicContact CB-CG1 4.37Å; L565-V569 HydrophobicContact CD2-CG1 4.07Å; L565-C570 WeakPolarHBondContact CB-SG 3.29Å; L565-L573 HydrophobicContact CD1-CD1 3.97Å; L565-C639 HydrophobicContact CD2-CB 3.81Å; L565-L712 HydrophobicContact CD2-CB 4.45Å; L565-L712 HydrophobicContact CD2-CD2 4.41Å
566	S	93.5	Very high	88.4	Confident	20 Å²	20	70.6 Å²	70.6	14%	0.14	36%	0.359	C	S	.	.			trans	-67.8	152.6	171.7	56.3	0	0	0	0	111.9	R568 V569 C570 C639 E644	S566-R568 PolarHBondContact O-N 2.88Å; S566-R568 VanDerWaalsContact O-N 3.12Å; S566-V569 CarbonylContact O-C 3.54Å; S566-V569 WeakPolarHBondContact O-CA 3.32Å; S566-V569 WeakPolarHBondContact O-CB 3.32Å; S566-V569 PolarHBondContact O-N 2.79Å; S566-V569 WeakPolarHBondContact OG-CB 3.47Å; S566-V569 WeakPolarHBondContact OG-CG2 3.32Å; S566-V569 PolarHBondContact OG-N 2.77Å; S566-C570 PolarHBondContact O-N 2.8Å; S566-C570 PolarHBondContact O-SG 2.75Å; S566-C570 VanDerWaalsContact O-SG 3.33Å; S566-C639 VanDerWaalsContact CB-O 3.3Å; S566-C639 WeakPolarHBondContact CB-O 3.35Å; S566-C639 PolarHBondContact N-O 3.44Å; S566-C639 PolarHBondContact OG-O 2.94Å; S566-E644 PolarHBondContact OG-OE2 3.1Å
567	S	91.4	Very high	88.1	Confident	80 Å²	80	65.5 Å²	65.5	56%	0.559	33%	0.332	S	S	*	.	H	α-helix	trans	-58.5	-30.7	-177.7	65.4	0	0	0	0	113.8	K571	S567-K571 VanDerWaalsContact O-CG 3.25Å; S567-K571 WeakPolarHBondContact O-CG 3.5Å; S567-K571 PolarHBondContact O-N 3.25Å; S567-K571 VanDerWaalsContact O-N 3.07Å
568	R	92.2	Very high	87.1	Confident	125 Å²	125	67.1 Å²	67.1	47%	0.472	35%	0.349	S	S	.	.	H	α-helix	trans	-70.1	-37.4	172.5	-71.2	-177.1	170.8	179.6	-4.3	112.5	S566 K572 L641 E644 D647	S566-R568 PolarHBondContact O-N 2.88Å; S566-R568 VanDerWaalsContact O-N 3.12Å; R568-K572 WeakPolarHBondContact O-CB 3.46Å; R568-K572 PolarHBondContact O-N 3.47Å; R568-L641 HydrophobicContact CB-CD1 3.8Å; R568-L641 HydrophobicContact CB-CG 4.2Å; R568-E644 WeakPolarHBondContact CD-OE1 3.3Å; R568-D647 IonicContact NH1-OD2 3.57Å; R568-D647 PolarHBondContact NH1-OD2 2.96Å; R568-D647 VanDerWaalsContact NH1-OD2 3.16Å
569	V	91.2	Very high	85.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-69.3	-47.6	172.8	170.8	0	0	0	0	110.6	L565 S566 K571 K572 L573 L640 L641 L670	L565-V569 HydrophobicContact CB-CG1 4.37Å; L565-V569 HydrophobicContact CD2-CG1 4.07Å; S566-V569 CarbonylContact O-C 3.54Å; S566-V569 WeakPolarHBondContact O-CA 3.32Å; S566-V569 WeakPolarHBondContact O-CB 3.32Å; S566-V569 PolarHBondContact O-N 2.79Å; S566-V569 WeakPolarHBondContact OG-CB 3.47Å; S566-V569 WeakPolarHBondContact OG-CG2 3.32Å; S566-V569 PolarHBondContact OG-N 2.77Å; V569-K571 PolarHBondContact O-N 2.98Å; V569-K572 PolarHBondContact O-N 2.81Å; V569-L573 HydrophobicContact CG1-CD1 3.57Å; V569-L573 HydrophobicContact CG1-CG 4.11Å; V569-L573 WeakPolarHBondContact O-CB 3.32Å; V569-L573 WeakPolarHBondContact O-CG 3.47Å; V569-L573 PolarHBondContact O-N 3.03Å; V569-L640 VanDerWaalsContact CG2-C 3.43Å; V569-L641 HydrophobicContact CG2-CD2 3.82Å; V569-L641 HydrophobicContact CG2-CG 3.9Å; V569-L670 HydrophobicContact CB-CD2 4.5Å; V569-L670 HydrophobicContact CG1-CD2 3.98Å; V569-L670 HydrophobicContact CG2-CD2 3.66Å
570	C	88.6	Confident	84.4	Confident	38 Å²	38	62.9 Å²	62.9	26%	0.257	33%	0.332	S	S	.	.	H	α-helix	trans	-52	-59.6	176.1	-62.4	0	0	0	0	111	L565 S566 K572 L573 S574	L565-C570 WeakPolarHBondContact CB-SG 3.29Å; S566-C570 PolarHBondContact O-N 2.8Å; S566-C570 PolarHBondContact O-SG 2.75Å; S566-C570 VanDerWaalsContact O-SG 3.33Å; C570-K572 VanDerWaalsContact C-N 3.28Å; C570-K572 PolarHBondContact O-N 3.48Å; C570-L573 CarbonylContact O-C 3.59Å; C570-L573 PolarHBondContact O-N 3.44Å; C570-L573 VanDerWaalsContact O-N 3.09Å; C570-S574 PolarHBondContact O-N 2.9Å; C570-S574 PolarHBondContact O-OG 3.38Å
571	K	88	Confident	82.6	Confident	91 Å²	91	66.8 Å²	66.8	40%	0.396	36%	0.356	S	S	.	.	H	α-helix	trans	-55.3	-40.9	-179.4	-68.9	177.5	-163.2	-150	0	113.1	S567 V569 S574 L575 T2075	S567-K571 VanDerWaalsContact O-CG 3.25Å; S567-K571 WeakPolarHBondContact O-CG 3.5Å; S567-K571 PolarHBondContact O-N 3.25Å; S567-K571 VanDerWaalsContact O-N 3.07Å; V569-K571 PolarHBondContact O-N 2.98Å; K571-S574 WeakPolarHBondContact O-CB 3.42Å; K571-S574 PolarHBondContact O-N 2.7Å; K571-L575 WeakPolarHBondContact O-CG 3.45Å; K571-L575 PolarHBondContact O-N 2.74Å; K571-L575 VanDerWaalsContact O-N 3.12Å; K571-T2075 WeakPolarHBondContact CE-O 3.22Å; K571-T2075 PolarHBondContact NZ-O 3.27Å
572	K	88.6	Confident	80.5	Confident	79 Å²	79	61.4 Å²	61.4	34%	0.343	35%	0.348	S	S	.	.	H	α-helix	trans	-76.4	-29.8	-178.7	-169.5	167.3	169.9	-153.3	0	112.7	R568 V569 C570 M576 K667 L668	R568-K572 WeakPolarHBondContact O-CB 3.46Å; R568-K572 PolarHBondContact O-N 3.47Å; V569-K572 PolarHBondContact O-N 2.81Å; C570-K572 VanDerWaalsContact C-N 3.28Å; C570-K572 PolarHBondContact O-N 3.48Å; K572-M576 VanDerWaalsContact O-CG 3.28Å; K572-M576 WeakPolarHBondContact O-CG 3.17Å; K572-M576 PolarHBondContact O-N 3.1Å; K572-K667 PolarHBondContact NZ-O 3.25Å; K572-L668 HydrophobicContact CB-CD1 4.33Å; K572-L668 HydrophobicContact CD-CD1 3.43Å; K572-L668 VanDerWaalsContact CD-CD1 3.43Å; K572-L668 HydrophobicContact CG-CD1 3.83Å
573	L	85.5	Confident	78.3	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-69.6	-42.8	168.3	-74	174.5	0	0	0	111.2	L565 V569 C570 L575 M576 F577 F665 L668 L712	L565-L573 HydrophobicContact CD1-CD1 3.97Å; V569-L573 HydrophobicContact CG1-CD1 3.57Å; V569-L573 HydrophobicContact CG1-CG 4.11Å; V569-L573 WeakPolarHBondContact O-CB 3.32Å; V569-L573 WeakPolarHBondContact O-CG 3.47Å; V569-L573 PolarHBondContact O-N 3.03Å; C570-L573 CarbonylContact O-C 3.59Å; C570-L573 PolarHBondContact O-N 3.44Å; C570-L573 VanDerWaalsContact O-N 3.09Å; L573-L575 VanDerWaalsContact C-N 3.29Å; L573-L575 PolarHBondContact O-N 2.99Å; L573-M576 CarbonylContact O-C 3.49Å; L573-M576 WeakPolarHBondContact O-CA 3.43Å; L573-M576 WeakPolarHBondContact O-CB 3.48Å; L573-M576 PolarHBondContact O-N 2.98Å; L573-F577 VanDerWaalsContact C-CD2 3.49Å; L573-F577 HydrophobicContact CB-CE1 4.25Å; L573-F577 HydrophobicContact CB-CE2 3.72Å; L573-F577 HydrophobicContact CB-CZ 3.49Å; L573-F577 VanDerWaalsContact CB-CZ 3.49Å; L573-F577 HydrophobicContact CD1-CZ 4.47Å; L573-F577 HydrophobicContact CG-CZ 4.38Å; L573-F577 WeakPolarHBondContact O-CD2 3.49Å; L573-F577 WeakPolarHBondContact O-CE2 3.36Å; L573-F577 WeakPolarHBondContact O-CG 3.42Å; L573-F577 PolarHBondContact O-N 3.49Å; L573-F665 HydrophobicContact CD2-CE1 3.8Å; L573-F665 HydrophobicContact CD2-CZ 3.72Å; L573-L668 HydrophobicContact CD2-CD2 3.52Å; L573-L668 HydrophobicContact CG-CD2 3.99Å; L573-L712 HydrophobicContact CD1-CB 4.34Å; L573-L712 HydrophobicContact CD1-CD2 4.09Å
574	S	82.4	Confident	75.4	Confident	71 Å²	71	65 Å²	65	50%	0.497	38%	0.375	S	S	.	.	H	α-helix	trans	-51.8	-45.5	173.3	-57.8	0	0	0	0	112.4	C570 K571 M576 F577 P578	C570-S574 PolarHBondContact O-N 2.9Å; C570-S574 PolarHBondContact O-OG 3.38Å; K571-S574 WeakPolarHBondContact O-CB 3.42Å; K571-S574 PolarHBondContact O-N 2.7Å; S574-M576 PolarHBondContact O-N 3.39Å; S574-F577 VanDerWaalsContact CA-CD2 3.48Å; S574-P578 WeakPolarHBondContact O-CD 3.33Å
575	L	83.2	Confident	72.7	Confident	137 Å²	137	66.2 Å²	66.2	72%	0.717	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.8	175.6	-67.5	169.9	0	0	0	114.3	K571 L573	K571-L575 WeakPolarHBondContact O-CG 3.45Å; K571-L575 PolarHBondContact O-N 2.74Å; K571-L575 VanDerWaalsContact O-N 3.12Å; L573-L575 VanDerWaalsContact C-N 3.29Å; L573-L575 PolarHBondContact O-N 2.99Å
576	M	79.2	Confident	69.8	Low	23 Å²	23	70.1 Å²	70.1	11%	0.113	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-20.5	177.6	-72.1	176.4	61.9	0	0	113.6	K572 L573 S574 L579 F580 F665 P666 L668	K572-M576 VanDerWaalsContact O-CG 3.28Å; K572-M576 WeakPolarHBondContact O-CG 3.17Å; K572-M576 PolarHBondContact O-N 3.1Å; L573-M576 CarbonylContact O-C 3.49Å; L573-M576 WeakPolarHBondContact O-CA 3.43Å; L573-M576 WeakPolarHBondContact O-CB 3.48Å; L573-M576 PolarHBondContact O-N 2.98Å; S574-M576 PolarHBondContact O-N 3.39Å; M576-L579 WeakPolarHBondContact O-CA 3.25Å; M576-L579 VanDerWaalsContact O-CB 3.28Å; M576-L579 WeakPolarHBondContact O-CB 3.33Å; M576-L579 PolarHBondContact O-N 2.92Å; M576-F580 HydrophobicContact CB-CD2 4.26Å; M576-F580 HydrophobicContact CB-CE2 3.83Å; M576-F580 HydrophobicContact CE-CE2 3.93Å; M576-F580 HydrophobicContact CE-CZ 3.84Å; M576-F580 WeakPolarHBondContact O-CD2 3.39Å; M576-F580 PolarHBondContact O-N 3.47Å; M576-F665 HydrophobicContact CE-CD1 4.35Å; M576-F665 HydrophobicContact CE-CE1 3.83Å; M576-P666 VanDerWaalsContact CE-O 3.26Å; M576-P666 WeakPolarHBondContact CE-O 3.16Å; M576-L668 HydrophobicContact SD-CB 4.45Å; M576-L668 HydrophobicContact SD-CD2 4.38Å
577	F	72.9	Confident	67	Low	29 Å²	29	71.3 Å²	71.3	13%	0.127	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.9	-178.4	-62.6	-53.1	0	0	0	115.7	L573 S574 L579 F580 T581 I698 P710	L573-F577 VanDerWaalsContact C-CD2 3.49Å; L573-F577 HydrophobicContact CB-CE1 4.25Å; L573-F577 HydrophobicContact CB-CE2 3.72Å; L573-F577 HydrophobicContact CB-CZ 3.49Å; L573-F577 VanDerWaalsContact CB-CZ 3.49Å; L573-F577 HydrophobicContact CD1-CZ 4.47Å; L573-F577 HydrophobicContact CG-CZ 4.38Å; L573-F577 WeakPolarHBondContact O-CD2 3.49Å; L573-F577 WeakPolarHBondContact O-CE2 3.36Å; L573-F577 WeakPolarHBondContact O-CG 3.42Å; L573-F577 PolarHBondContact O-N 3.49Å; S574-F577 VanDerWaalsContact CA-CD2 3.48Å; F577-L579 PolarHBondContact O-N 2.79Å; F577-L579 VanDerWaalsContact O-N 3.15Å; F577-F580 AromaticContact CD1-CD2 3.97Å; F577-F580 HydrophobicContact CD1-CD2 3.97Å; F577-F580 WeakPolarHBondContact O-CA 3.19Å; F577-F580 PolarHBondContact O-N 2.8Å; F577-T581 PolarHBondContact O-N 3.37Å; F577-T581 PolarHBondContact O-OG1 3.29Å; F577-I698 HydrophobicContact CE1-CD1 4.47Å; F577-I698 HydrophobicContact CE1-CG2 4.11Å; F577-P710 HydrophobicContact CD1-CB 3.83Å; F577-P710 HydrophobicContact CD1-CG 3.75Å; F577-P710 HydrophobicContact CD2-CB 4.29Å; F577-P710 HydrophobicContact CD2-CG 3.3Å; F577-P710 HydrophobicContact CE1-CB 3.5Å; F577-P710 VanDerWaalsContact CE1-CB 3.5Å; F577-P710 HydrophobicContact CE1-CG 3.53Å; F577-P710 HydrophobicContact CE2-CB 4.04Å; F577-P710 HydrophobicContact CE2-CG 3.1Å; F577-P710 HydrophobicContact CG-CB 4.24Å; F577-P710 HydrophobicContact CG-CG 3.66Å; F577-P710 HydrophobicContact CZ-CB 3.59Å; F577-P710 HydrophobicContact CZ-CG 3.19Å
578	P	67.4	Low	64	Low	89 Å²	89	70.5 Å²	70.5	58%	0.578	43%	0.434	S	S	*	.	H	α-helix	trans	-59.2	-23.9	170.4	-25.9	36	0	0	0	113.8	S574	S574-P578 WeakPolarHBondContact O-CD 3.33Å
579	L	63.9	Low	61.3	Low	116 Å²	116	73 Å²	73	61%	0.607	46%	0.456	S	S	*	.	H	α-helix	trans	-87.9	-5.1	174.5	-51.2	176.4	0	0	0	113.1	M576 F577 I583	M576-L579 WeakPolarHBondContact O-CA 3.25Å; M576-L579 VanDerWaalsContact O-CB 3.28Å; M576-L579 WeakPolarHBondContact O-CB 3.33Å; M576-L579 PolarHBondContact O-N 2.92Å; F577-L579 PolarHBondContact O-N 2.79Å; F577-L579 VanDerWaalsContact O-N 3.15Å; L579-I583 VanDerWaalsContact O-CD1 3.23Å; L579-I583 WeakPolarHBondContact O-CD1 3.23Å; L579-I583 WeakPolarHBondContact O-CG1 3.47Å
580	F	61.4	Low	59	Low	41 Å²	41	77.4 Å²	77.4	18%	0.18	48%	0.479	C	S	.	.	H	α-helix	trans	-106.2	-42.6	174.7	-69.5	-58.8	0	0	0	111.6	M576 F577 G582 I583 F665 P666 I698	M576-F580 HydrophobicContact CB-CD2 4.26Å; M576-F580 HydrophobicContact CB-CE2 3.83Å; M576-F580 HydrophobicContact CE-CE2 3.93Å; M576-F580 HydrophobicContact CE-CZ 3.84Å; M576-F580 WeakPolarHBondContact O-CD2 3.39Å; M576-F580 PolarHBondContact O-N 3.47Å; F577-F580 AromaticContact CD1-CD2 3.97Å; F577-F580 HydrophobicContact CD1-CD2 3.97Å; F577-F580 WeakPolarHBondContact O-CA 3.19Å; F577-F580 PolarHBondContact O-N 2.8Å; F580-G582 VanDerWaalsContact C-N 3.27Å; F580-G582 PolarHBondContact O-N 2.59Å; F580-I583 PolarHBondContact O-N 2.9Å; F580-I583 VanDerWaalsContact O-N 3.14Å; F580-F665 AromaticContact CE2-CE1 3.92Å; F580-F665 HydrophobicContact CE2-CE1 3.92Å; F580-F665 AromaticContact CE2-CZ 3.79Å; F580-F665 HydrophobicContact CE2-CZ 3.79Å; F580-F665 AromaticContact CZ-CE1 3.57Å; F580-F665 HydrophobicContact CZ-CE1 3.57Å; F580-F665 AromaticContact CZ-CZ 3.55Å; F580-F665 HydrophobicContact CZ-CZ 3.55Å; F580-P666 HydrophobicContact CE1-CG 4.21Å; F580-P666 HydrophobicContact CZ-CG 4.13Å; F580-I698 HydrophobicContact CB-CD1 4.48Å; F580-I698 HydrophobicContact CD1-CD1 4.1Å; F580-I698 HydrophobicContact CD2-CD1 3.74Å; F580-I698 HydrophobicContact CE1-CD1 4.22Å; F580-I698 HydrophobicContact CE2-CD1 3.86Å; F580-I698 HydrophobicContact CG-CD1 3.87Å; F580-I698 HydrophobicContact CZ-CD1 4.1Å
581	T	53.8	Low	57.3	Low	85 Å²	85	80.1 Å²	80.1	52%	0.521	49%	0.491	S	S	.	.	H	α-helix	trans	-65.3	-31.7	176.1	54.3	0	0	0	0	112.2	F577 I583 F700	F577-T581 PolarHBondContact O-N 3.37Å; F577-T581 PolarHBondContact O-OG1 3.29Å; T581-I583 PolarHBondContact O-N 3.48Å; T581-F700 HydrophobicContact CG2-CE1 3.8Å; T581-F700 HydrophobicContact CG2-CZ 3.7Å
582	G	41.8	Very low	55.5	Low	65 Å²	65	76.8 Å²	76.8	67%	0.67	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-0.7	173.1	0	0	0	0	0	115.7	F580	F580-G582 VanDerWaalsContact C-N 3.27Å; F580-G582 PolarHBondContact O-N 2.59Å
583	I	41.4	Very low	54	Low	75 Å²	75	73.7 Å²	73.7	39%	0.385	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	32.1	176	-27.2	177.4	0	0	0	111.8	L579 F580 T581 A585 C587	L579-I583 VanDerWaalsContact O-CD1 3.23Å; L579-I583 WeakPolarHBondContact O-CD1 3.23Å; L579-I583 WeakPolarHBondContact O-CG1 3.47Å; F580-I583 PolarHBondContact O-N 2.9Å; F580-I583 VanDerWaalsContact O-N 3.14Å; T581-I583 PolarHBondContact O-N 3.48Å; I583-A585 PolarHBondContact O-N 3.31Å; I583-C587 HydrophobicContact CB-CB 4.24Å; I583-C587 HydrophobicContact CG2-CB 3.61Å
584	G	32.2	Very low	52.6	Low	60 Å²	60	81 Å²	81	62%	0.619	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	133.5	165.2	0	0	0	0	0	111.1	D586	G584-D586 VanDerWaalsContact C-N 3.34Å; G584-D586 PolarHBondContact O-N 2.95Å
585	A	35	Very low	51.5	Low	117 Å²	117	81.2 Å²	81.2	97%	0.967	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	-21.8	177.2	0	0	0	0	0	119.7	I583	I583-A585 PolarHBondContact O-N 3.31Å
586	D	33	Very low	50	Low	131 Å²	131	83.9 Å²	83.9	70%	0.701	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	20.1	-170.4	-151.6	27.4	0	0	0	115.9	G584 G588	G584-D586 VanDerWaalsContact C-N 3.34Å; G584-D586 PolarHBondContact O-N 2.95Å; D586-G588 VanDerWaalsContact C-N 3.31Å; D586-G588 PolarHBondContact O-N 2.82Å; D586-G588 VanDerWaalsContact O-N 3.09Å
587	C	34.5	Very low	49.2	Very low	44 Å²	44	88.6 Å²	88.6	30%	0.297	53%	0.528	S	S	.	.			trans	-86.9	62.8	178.2	-143.4	0	0	0	0	113.4	I583 I590	I583-C587 HydrophobicContact CB-CB 4.24Å; I583-C587 HydrophobicContact CG2-CB 3.61Å; C587-I590 HydrophobicContact CB-CD1 4.07Å; C587-I590 HydrophobicContact CB-CG1 4.2Å; C587-I590 WeakPolarHBondContact SG-CD1 3.4Å
588	G	28.6	Very low	49.2	Very low	64 Å²	64	88.5 Å²	88.5	66%	0.66	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	148.7	165.1	0	0	0	0	0	112.2	D586 I590	D586-G588 VanDerWaalsContact C-N 3.31Å; D586-G588 PolarHBondContact O-N 2.82Å; D586-G588 VanDerWaalsContact O-N 3.09Å; G588-I590 PolarHBondContact O-N 3.38Å
589	D	35.3	Very low	49.4	Very low	177 Å²	177	86.5 Å²	86.5	95%	0.947	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	20.1	175.2	-63.4	-20.2	0	0	0	118.2
590	I	42.3	Very low	49.6	Very low	92 Å²	92	86.9 Å²	86.9	47%	0.472	53%	0.527	S	S	.	.			trans	-92.5	139.8	154.1	57.7	165.9	0	0	0	111.1	C587 G588 G592	C587-I590 HydrophobicContact CB-CD1 4.07Å; C587-I590 HydrophobicContact CB-CG1 4.2Å; C587-I590 WeakPolarHBondContact SG-CD1 3.4Å; G588-I590 PolarHBondContact O-N 3.38Å; I590-G592 PolarHBondContact O-N 3.04Å
591	D	51.9	Low	50	Low	95 Å²	95	88.3 Å²	88.3	51%	0.508	54%	0.537	S	S	.	.			trans	-70.5	26	179.1	-86.5	-54.9	0	0	0	114.6	R695	D591-R695 IonicContact OD1-CZ 3.27Å; D591-R695 IonicContact OD1-NH1 2.71Å; D591-R695 PolarHBondContact OD1-NH1 3.11Å; D591-R695 IonicContact OD1-NH2 2.78Å; D591-R695 PolarHBondContact OD1-NH2 2.87Å
592	G	50.7	Low	51.3	Low	21 Å²	21	84.8 Å²	84.8	22%	0.216	52%	0.515	C	S	.	.	B	Isolated β-bridge	trans	-67.3	145	173.7	0	0	0	0	0	111.6	I590 H696	I590-G592 PolarHBondContact O-N 3.04Å; G592-H696 WeakPolarHBondContact CA-O 3.47Å
593	I	57.8	Low	52.7	Low	15 Å²	15	85 Å²	85	8%	0.077	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-84.6	131.8	160	-51.3	179.3	0	0	0	106.4	E597 I598 R695 H696 C697 I715 V717	I593-E597 HydrophobicContact CG2-CB 3.68Å; I593-E597 WeakPolarHBondContact CG2-OE2 3.18Å; I593-I598 HydrophobicContact CB-CD1 4.38Å; I593-I598 HydrophobicContact CB-CG1 4.32Å; I593-I598 HydrophobicContact CG2-CD1 4.2Å; I593-I598 HydrophobicContact CG2-CG1 3.65Å; I593-R695 HydrophobicContact CD1-CB 3.95Å; I593-R695 HydrophobicContact CG1-CB 3.65Å; I593-R695 HydrophobicContact CG1-CG 4.32Å; I593-H696 PolarHBondContact N-O 3.41Å; I593-C697 WeakPolarHBondContact O-CB 3.32Å; I593-I715 HydrophobicContact CD1-CB 3.75Å; I593-I715 HydrophobicContact CD1-CD1 4.15Å; I593-I715 HydrophobicContact CD1-CG2 3.69Å; I593-V717 HydrophobicContact CD1-CG2 3.48Å; I593-V717 VanDerWaalsContact CD1-CG2 3.48Å; I593-V717 HydrophobicContact CG1-CG2 4.4Å
594	F	55.2	Low	54.1	Low	154 Å²	154	90 Å²	90	68%	0.675	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-63.7	139.8	171.5	-74.6	-81.3	0	0	0	109.2	E596 E597	F594-E596 PolarHBondContact O-N 3.08Å; F594-E597 HydrophobicContact CB-CG 4.26Å; F594-E597 PolarHBondContact N-OE2 3.04Å; F594-E597 PolarHBondContact O-N 2.79Å
595	N	59.7	Low	56.3	Low	76 Å²	76	90.3 Å²	90.3	41%	0.406	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-58.6	-24	-173.6	-73.8	-39.3	0	0	0	113.5	C697 I698	N595-C697 WeakPolarHBondContact OD1-CB 3.28Å; N595-C697 PolarHBondContact OD1-SG 2.76Å; N595-C697 VanDerWaalsContact OD1-SG 3.37Å; N595-I698 PolarHBondContact ND2-O 3.47Å
596	E	52.5	Low	58.5	Low	193 Å²	193	91.7 Å²	91.7	90%	0.902	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-78.9	-20.9	176.2	-56.2	-164	156.3	0	0	114.5	F594 I598	F594-E596 PolarHBondContact O-N 3.08Å; E596-I598 PolarHBondContact O-N 2.94Å
597	E	61	Low	61.3	Low	121 Å²	121	87.8 Å²	87.8	57%	0.565	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-76	-4.2	175	-66.8	-178.8	145	0	0	112.6	I593 F594 P599	I593-E597 HydrophobicContact CG2-CB 3.68Å; I593-E597 WeakPolarHBondContact CG2-OE2 3.18Å; F594-E597 HydrophobicContact CB-CG 4.26Å; F594-E597 PolarHBondContact N-OE2 3.04Å; F594-E597 PolarHBondContact O-N 2.79Å; E597-P599 WeakPolarHBondContact O-CD 3.16Å
598	I	73.1	Confident	64.2	Low	28 Å²	28	86.9 Å²	86.9	14%	0.144	45%	0.45	C	S	.	.	S	Bend	trans	-101.7	110.4	-175.4	-54.1	164.9	0	0	0	109.1	I593 E596 S600 C697 I715	I593-I598 HydrophobicContact CB-CD1 4.38Å; I593-I598 HydrophobicContact CB-CG1 4.32Å; I593-I598 HydrophobicContact CG2-CD1 4.2Å; I593-I598 HydrophobicContact CG2-CG1 3.65Å; E596-I598 PolarHBondContact O-N 2.94Å; I598-S600 PolarHBondContact O-N 2.85Å; I598-C697 HydrophobicContact CD1-CB 3.87Å; I598-C697 WeakPolarHBondContact CD1-SG 3.47Å; I598-I715 HydrophobicContact CB-CD1 4.46Å; I598-I715 HydrophobicContact CD1-CD1 3.47Å; I598-I715 VanDerWaalsContact CD1-CD1 3.47Å; I598-I715 HydrophobicContact CG1-CD1 3.76Å; I598-I715 HydrophobicContact CG2-CD1 3.82Å
599	P	71.8	Confident	67.3	Low	47 Å²	47	89.3 Å²	89.3	31%	0.305	44%	0.444	S	S	.	.			trans	-61.5	124.9	175.6	-22.5	34.2	0	0	0	110.5	E597 N601 L602 L605 P631	E597-P599 WeakPolarHBondContact O-CD 3.16Å; P599-N601 PolarHBondContact O-N 3.35Å; P599-L602 VanDerWaalsContact O-CB 3.31Å; P599-L602 WeakPolarHBondContact O-CB 3.04Å; P599-L602 PolarHBondContact O-N 3.17Å; P599-L605 HydrophobicContact CB-CD1 3.99Å; P599-L605 HydrophobicContact CG-CD1 3.93Å; P599-P631 HydrophobicContact CG-CG 4.39Å
600	S	68	Low	70	Confident	123 Å²	123	82.3 Å²	82.3	86%	0.86	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.6	172.3	54.3	0	0	0	0	112.9	I598	I598-S600 PolarHBondContact O-N 2.85Å
601	N	71	Confident	72.4	Confident	71 Å²	71	80 Å²	80	38%	0.38	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	18.4	174.9	-69.8	-57.1	0	0	0	114.2	P599 E603 R604 L605	P599-N601 PolarHBondContact O-N 3.35Å; N601-E603 VanDerWaalsContact C-N 3.27Å; N601-E603 PolarHBondContact O-N 3.13Å; N601-E603 VanDerWaalsContact O-N 3.07Å; N601-R604 HydrophobicContact CB-CB 4.34Å; N601-R604 WeakPolarHBondContact O-CA 3.46Å; N601-R604 WeakPolarHBondContact O-CB 3.07Å; N601-R604 PolarHBondContact O-N 2.94Å; N601-R604 WeakPolarHBondContact OD1-CD 3.28Å; N601-R604 PolarHBondContact OD1-NH1 2.81Å; N601-L605 PolarHBondContact O-N 2.9Å
602	L	81.5	Confident	74.1	Confident	12 Å²	12	79.3 Å²	79.3	6%	0.063	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-46.8	-44.2	-170.4	-179.2	59.5	0	0	0	114.3	P599 R604 L605 P631 I715	P599-L602 VanDerWaalsContact O-CB 3.31Å; P599-L602 WeakPolarHBondContact O-CB 3.04Å; P599-L602 PolarHBondContact O-N 3.17Å; L602-R604 VanDerWaalsContact C-N 3.33Å; L602-R604 PolarHBondContact O-N 3.41Å; L602-L605 HydrophobicContact CD1-CD1 4.36Å; L602-L605 PolarHBondContact O-N 2.79Å; L602-P631 HydrophobicContact CD1-CB 3.96Å; L602-P631 HydrophobicContact CD1-CG 4.29Å; L602-I715 HydrophobicContact CD2-CG2 4.36Å
603	E	69.9	Low	75.4	Confident	69 Å²	69	82 Å²	82	32%	0.322	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-71.6	-26.5	-179.5	-59.5	-172.8	115.8	0	0	112.9	N601 L605 R636	N601-E603 VanDerWaalsContact C-N 3.27Å; N601-E603 PolarHBondContact O-N 3.13Å; N601-E603 VanDerWaalsContact O-N 3.07Å; E603-L605 VanDerWaalsContact C-N 3.32Å; E603-R636 VanDerWaalsContact CD-NH1 3.28Å; E603-R636 IonicContact OE1-CZ 3.68Å; E603-R636 VanDerWaalsContact OE1-CZ 3.31Å; E603-R636 IonicContact OE1-NH1 2.8Å; E603-R636 PolarHBondContact OE1-NH1 2.85Å; E603-R636 IonicContact OE1-NH2 2.69Å; E603-R636 PolarHBondContact OE1-NH2 2.79Å; E603-R636 IonicContact OE2-CZ 3.36Å; E603-R636 VanDerWaalsContact OE2-CZ 3.23Å; E603-R636 IonicContact OE2-NH1 3.24Å; E603-R636 PolarHBondContact OE2-NH1 3.48Å; E603-R636 IonicContact OE2-NH2 3.06Å; E603-R636 PolarHBondContact OE2-NH2 3.28Å
604	R	70.6	Confident	76.1	Confident	181 Å²	181	84.6 Å²	84.6	68%	0.683	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-81.9	-4.6	176	-60.1	173.6	174.6	156.9	-6	113.7	N601 L602 F606	N601-R604 HydrophobicContact CB-CB 4.34Å; N601-R604 WeakPolarHBondContact O-CA 3.46Å; N601-R604 WeakPolarHBondContact O-CB 3.07Å; N601-R604 PolarHBondContact O-N 2.94Å; N601-R604 WeakPolarHBondContact OD1-CD 3.28Å; N601-R604 PolarHBondContact OD1-NH1 2.81Å; L602-R604 VanDerWaalsContact C-N 3.33Å; L602-R604 PolarHBondContact O-N 3.41Å; R604-F606 VanDerWaalsContact C-N 3.25Å; R604-F606 WeakPolarHBondContact O-CD2 3.21Å; R604-F606 WeakPolarHBondContact O-CE2 3.43Å; R604-F606 PolarHBondContact O-N 2.78Å
605	L	79.7	Confident	75.8	Confident	65 Å²	65	82.4 Å²	82.4	34%	0.34	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-77.5	-9.5	178.3	-63.8	179.5	0	0	0	113.2	P599 N601 L602 E603 R607	P599-L605 HydrophobicContact CB-CD1 3.99Å; P599-L605 HydrophobicContact CG-CD1 3.93Å; N601-L605 PolarHBondContact O-N 2.9Å; L602-L605 HydrophobicContact CD1-CD1 4.36Å; L602-L605 PolarHBondContact O-N 2.79Å; E603-L605 VanDerWaalsContact C-N 3.32Å; L605-R607 HydrophobicContact CB-CG 3.99Å; L605-R607 PolarHBondContact O-N 3.33Å
606	F	80.9	Confident	75.9	Confident	147 Å²	147	82.5 Å²	82.5	65%	0.645	41%	0.411	S	S	*	.			trans	45.9	32.4	174.6	-62.8	-69.1	0	0	0	115.3	R604 Y608 N623	R604-F606 VanDerWaalsContact C-N 3.25Å; R604-F606 WeakPolarHBondContact O-CD2 3.21Å; R604-F606 WeakPolarHBondContact O-CE2 3.43Å; R604-F606 PolarHBondContact O-N 2.78Å; F606-Y608 PolarHBondContact O-N 3.26Å; F606-N623 PolarHBondContact O-ND2 3.46Å
607	R	91.2	Very high	77.1	Confident	48 Å²	48	77.8 Å²	77.8	18%	0.181	39%	0.385	C	S	.	.			trans	-65	-12.2	-176.7	-64.5	-166.3	151.2	130.5	7.1	114.4	L605 A622 N623 E624 I626 T630 P631	L605-R607 HydrophobicContact CB-CG 3.99Å; L605-R607 PolarHBondContact O-N 3.33Å; R607-A622 WeakPolarHBondContact O-CA 3.34Å; R607-N623 PolarHBondContact O-N 3.39Å; R607-E624 WeakPolarHBondContact CD-OE1 3.5Å; R607-E624 WeakPolarHBondContact CG-OE1 3.43Å; R607-E624 IonicContact CZ-OE1 2.71Å; R607-E624 IonicContact NE-OE1 3.41Å; R607-E624 PolarHBondContact NE-OE1 3.34Å; R607-E624 IonicContact NH2-OE1 3.59Å; R607-I626 HydrophobicContact CB-CD1 4.18Å; R607-T630 VanDerWaalsContact CZ-CG2 3.46Å; R607-P631 PolarHBondContact NH1-O 3.2Å
608	Y	94.8	Very high	78.5	Confident	26 Å²	26	75 Å²	75	10%	0.102	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	161.2	-172.3	62.6	-87.2	0	0	0	111.5	F606 L620 I621 N623 I632 I633 E680	F606-Y608 PolarHBondContact O-N 3.26Å; Y608-L620 HydrophobicContact CD2-CD2 3.5Å; Y608-L620 HydrophobicContact CD2-CG 3.95Å; Y608-L620 HydrophobicContact CE2-CD2 4.16Å; Y608-L620 HydrophobicContact CG-CD2 3.83Å; Y608-L620 HydrophobicContact CG-CG 4.48Å; Y608-I621 CarbonylContact C-O 3.48Å; Y608-I621 WeakPolarHBondContact CA-O 3.46Å; Y608-N623 PolarHBondContact O-ND2 2.68Å; Y608-I632 HydrophobicContact CD1-CG2 4.01Å; Y608-I633 HydrophobicContact CD1-CB 4.44Å; Y608-I633 HydrophobicContact CE1-CB 3.9Å; Y608-I633 HydrophobicContact CE1-CD1 3.92Å; Y608-I633 HydrophobicContact CE1-CG1 3.92Å; Y608-I633 HydrophobicContact CE2-CD1 3.84Å; Y608-I633 WeakPolarHBondContact OH-CD1 3.4Å; Y608-E680 HydrophobicContact CE2-CB 4.23Å; Y608-E680 WeakPolarHBondContact CE2-OE2 3.47Å
609	Q	93.6	Very high	79.5	Confident	115 Å²	115	73.6 Å²	73.6	54%	0.537	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	141.1	169.7	179.8	173.6	62	0	0	109.8	V611 I621 N623	Q609-V611 HydrophobicContact CG-CG2 4.19Å; Q609-I621 PolarHBondContact N-O 3.41Å; Q609-I621 PolarHBondContact O-N 2.71Å; Q609-N623 WeakPolarHBondContact CB-OD1 3.29Å
610	V	93.4	Very high	80.6	Confident	29 Å²	29	71.4 Å²	71.4	18%	0.176	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	123	171.6	173.5	0	0	0	0	110.8	R618 L620 E680 F683	V610-R618 HydrophobicContact CG1-CB 3.91Å; V610-R618 HydrophobicContact CG1-CG 4.08Å; V610-L620 HydrophobicContact CG2-CD1 3.66Å; V610-L620 HydrophobicContact CG2-CG 4.17Å; V610-E680 HydrophobicContact CG2-CB 3.91Å; V610-E680 HydrophobicContact CG2-CG 4.1Å; V610-E680 VanDerWaalsContact CG2-OE1 3.23Å; V610-E680 WeakPolarHBondContact CG2-OE1 3.49Å; V610-E680 VanDerWaalsContact CG2-OE2 3.3Å; V610-E680 WeakPolarHBondContact CG2-OE2 3.02Å; V610-F683 HydrophobicContact CG1-CD2 4.03Å; V610-F683 HydrophobicContact CG1-CG 4.49Å; V610-F683 HydrophobicContact CG2-CD2 3.8Å; V610-F683 HydrophobicContact CG2-CE2 4.45Å
611	V	91.7	Very high	81.9	Confident	45 Å²	45	66.9 Å²	66.9	27%	0.273	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.3	-176.7	179.8	0	0	0	0	110.7	Q609 R618 G619 I621	Q609-V611 HydrophobicContact CG-CG2 4.19Å; V611-R618 CarbonylContact O-C 3.55Å; V611-R618 WeakPolarHBondContact O-CA 3.19Å; V611-G619 PolarHBondContact N-O 2.99Å; V611-G619 PolarHBondContact O-N 3.32Å; V611-I621 HydrophobicContact CB-CD1 3.77Å; V611-I621 HydrophobicContact CB-CG1 4.16Å; V611-I621 HydrophobicContact CG1-CD1 3.93Å; V611-I621 HydrophobicContact CG2-CB 4.25Å; V611-I621 HydrophobicContact CG2-CD1 3.91Å; V611-I621 HydrophobicContact CG2-CG1 4.19Å
612	S	88.8	Confident	83.1	Confident	80 Å²	80	63.6 Å²	63.6	56%	0.559	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	116.7	174.1	-68.6	0	0	0	0	111.2
613	F	77.6	Confident	83.7	Confident	78 Å²	78	65.5 Å²	65.5	34%	0.342	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-46.9	-177.8	-73.1	-95.5	0	0	0	113.3	R617 I621 R685 E727	F613-R617 PolarHBondContact N-O 3.05Å; F613-I621 HydrophobicContact CE1-CD1 4.09Å; F613-I621 HydrophobicContact CE2-CD1 4.3Å; F613-I621 HydrophobicContact CE2-CG1 4.2Å; F613-I621 HydrophobicContact CZ-CD1 3.64Å; F613-I621 HydrophobicContact CZ-CG1 3.66Å; F613-R685 VanDerWaalsContact CB-NH1 3.3Å; F613-R685 VanDerWaalsContact CD2-NH1 3.34Å; F613-R685 VanDerWaalsContact CG-NH1 3.33Å; F613-E727 HydrophobicContact CE1-CB 4.45Å; F613-E727 HydrophobicContact CE1-CG 4.46Å; F613-E727 HydrophobicContact CE2-CG 4.21Å; F613-E727 HydrophobicContact CZ-CB 3.93Å; F613-E727 HydrophobicContact CZ-CG 3.65Å
614	D	73.1	Confident	84.9	Confident	68 Å²	68	66 Å²	66	36%	0.364	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	165	166.6	-61.5	-57.1	0	0	0	107.2	N616 R617	D614-N616 PolarHBondContact O-N 2.75Å; D614-N616 VanDerWaalsContact O-N 3.13Å; D614-R617 HydrophobicContact CB-CB 4.03Å; D614-R617 HydrophobicContact CB-CG 4.23Å; D614-R617 PolarHBondContact O-N 3.01Å; D614-R617 WeakPolarHBondContact OD2-CD 3.45Å
615	F	49	Very low	86.1	Confident	108 Å²	108	62.5 Å²	62.5	47%	0.474	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.4	123.1	161.5	-63.4	-92.2	0	0	0	109.4	T259 R617 S1828	T259-F615 HydrophobicContact CG2-CB 3.88Å; T259-F615 WeakPolarHBondContact CG2-O 2.25Å; T259-F615 WeakPolarHBondContact OG1-CB 3.47Å; F615-R617 VanDerWaalsContact C-N 3.33Å; F615-R617 PolarHBondContact O-N 3.04Å; F615-S1828 VanDerWaalsContact CD2-OG 3.3Å; F615-S1828 WeakPolarHBondContact CD2-OG 3.35Å; F615-S1828 WeakPolarHBondContact CE2-OG 3.39Å
616	N	60.4	Low	86.9	Confident	78 Å²	78	59.4 Å²	59.4	42%	0.417	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	33.2	-179.8	-45.4	16.8	0	0	0	114.1	P552 D614	P552-N616 VanDerWaalsContact CD-ND2 3.33Å; P552-N616 WeakPolarHBondContact CD-ND2 3.47Å; P552-N616 WeakPolarHBondContact CG-ND2 3.35Å; D614-N616 PolarHBondContact O-N 2.75Å; D614-N616 VanDerWaalsContact O-N 3.13Å
617	R	79	Confident	87.6	Confident	94 Å²	94	56 Å²	56	36%	0.355	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	85.4	171.6	-68.3	-172.2	163.6	-95.6	-16.4	112.9	F613 D614 F615	F613-R617 PolarHBondContact N-O 3.05Å; D614-R617 HydrophobicContact CB-CB 4.03Å; D614-R617 HydrophobicContact CB-CG 4.23Å; D614-R617 PolarHBondContact O-N 3.01Å; D614-R617 WeakPolarHBondContact OD2-CD 3.45Å; F615-R617 VanDerWaalsContact C-N 3.33Å; F615-R617 PolarHBondContact O-N 3.04Å
618	R	90.2	Very high	87.8	Confident	62 Å²	62	56.8 Å²	56.8	23%	0.234	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	158.6	166.9	-65.8	-164.9	-80.8	170.1	-5.4	112.3	D555 V610 V611 F683	D555-R618 VanDerWaalsContact CA-NH2 3.28Å; D555-R618 PolarHBondContact O-NH2 3.21Å; D555-R618 IonicContact OD1-CZ 2.91Å; D555-R618 IonicContact OD1-NE 3.49Å; D555-R618 PolarHBondContact OD1-NE 3.34Å; D555-R618 IonicContact OD1-NH2 3.9Å; D555-R618 PolarHBondContact OD1-NH2 2.75Å; V610-R618 HydrophobicContact CG1-CB 3.91Å; V610-R618 HydrophobicContact CG1-CG 4.08Å; V611-R618 CarbonylContact O-C 3.55Å; V611-R618 WeakPolarHBondContact O-CA 3.19Å; R618-F683 HydrophobicContact CB-CB 4.28Å; R618-F683 HydrophobicContact CB-CD1 3.93Å; R618-F683 HydrophobicContact CB-CG 4.07Å; R618-F683 VanDerWaalsContact CZ-CE1 3.46Å; R618-F683 VanDerWaalsContact NH1-CZ 3.34Å
619	G	93	Very high	87.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	162.3	172.9	0	0	0	0	0	110.4	V611 F683	V611-G619 PolarHBondContact N-O 2.99Å; V611-G619 PolarHBondContact O-N 3.32Å; G619-F683 WeakPolarHBondContact CA-O 3.29Å
620	L	95.2	Very high	87.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	139.5	-177.5	-87	67.3	0	0	0	111.3	Y608 V610 E680 F683 I684 E727 I728	Y608-L620 HydrophobicContact CD2-CD2 3.5Å; Y608-L620 HydrophobicContact CD2-CG 3.95Å; Y608-L620 HydrophobicContact CE2-CD2 4.16Å; Y608-L620 HydrophobicContact CG-CD2 3.83Å; Y608-L620 HydrophobicContact CG-CG 4.48Å; V610-L620 HydrophobicContact CG2-CD1 3.66Å; V610-L620 HydrophobicContact CG2-CG 4.17Å; L620-E680 VanDerWaalsContact CD1-O 3.3Å; L620-E680 WeakPolarHBondContact CD1-O 3.35Å; L620-F683 HydrophobicContact CD1-CB 3.84Å; L620-I684 HydrophobicContact CB-CG1 4.28Å; L620-I684 HydrophobicContact CD1-CG1 4.05Å; L620-I684 HydrophobicContact CD2-CD1 4.18Å; L620-I684 HydrophobicContact CD2-CG1 3.89Å; L620-I684 HydrophobicContact CG-CG1 4.3Å; L620-E727 WeakPolarHBondContact O-CA 3.42Å; L620-E727 WeakPolarHBondContact O-CG 3.31Å; L620-I728 HydrophobicContact CB-CB 4.12Å; L620-I728 HydrophobicContact CB-CD1 4.21Å; L620-I728 PolarHBondContact O-N 2.98Å
621	I	95.4	Very high	87.8	Confident	28 Å²	28	60.9 Å²	60.9	14%	0.144	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.2	173.4	-67.8	-171.3	0	0	0	108.7	Y608 Q609 V611 F613 S725 S726	Y608-I621 CarbonylContact C-O 3.48Å; Y608-I621 WeakPolarHBondContact CA-O 3.46Å; Q609-I621 PolarHBondContact N-O 3.41Å; Q609-I621 PolarHBondContact O-N 2.71Å; V611-I621 HydrophobicContact CB-CD1 3.77Å; V611-I621 HydrophobicContact CB-CG1 4.16Å; V611-I621 HydrophobicContact CG1-CD1 3.93Å; V611-I621 HydrophobicContact CG2-CB 4.25Å; V611-I621 HydrophobicContact CG2-CD1 3.91Å; V611-I621 HydrophobicContact CG2-CG1 4.19Å; F613-I621 HydrophobicContact CE1-CD1 4.09Å; F613-I621 HydrophobicContact CE2-CD1 4.3Å; F613-I621 HydrophobicContact CE2-CG1 4.2Å; F613-I621 HydrophobicContact CZ-CD1 3.64Å; F613-I621 HydrophobicContact CZ-CG1 3.66Å; I621-S725 VanDerWaalsContact CG2-CA 3.48Å; I621-S726 WeakPolarHBondContact CA-O 3.2Å
622	A	96.6	Very high	87.9	Confident	2 Å²	2	58.8 Å²	58.8	2%	0.017	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	132	177.9	0	0	0	0	0	112.3	R607 I626 I722 S725 S726 I728	R607-A622 WeakPolarHBondContact O-CA 3.34Å; A622-I626 HydrophobicContact CB-CD1 3.83Å; A622-I626 HydrophobicContact CB-CG1 4.21Å; A622-I722 HydrophobicContact CB-CG2 3.81Å; A622-S725 PolarHBondContact O-N 2.77Å; A622-S726 PolarHBondContact N-O 3.21Å; A622-I728 HydrophobicContact CB-CD1 4.23Å; A622-I728 HydrophobicContact CB-CG1 4.3Å
623	N	94.9	Very high	88.2	Confident	53 Å²	53	55 Å²	55	28%	0.283	27%	0.266	S	S	.	.	S	Bend	trans	-85.8	-19.1	178.1	-70.4	-14.9	0	0	0	112.9	F606 R607 Y608 Q609 K724	F606-N623 PolarHBondContact O-ND2 3.46Å; R607-N623 PolarHBondContact O-N 3.39Å; Y608-N623 PolarHBondContact O-ND2 2.68Å; Q609-N623 WeakPolarHBondContact CB-OD1 3.29Å; N623-K724 WeakPolarHBondContact O-CD 3.49Å; N623-K724 WeakPolarHBondContact O-CE 3.26Å; N623-K724 WeakPolarHBondContact O-CG 3.44Å; N623-K724 PolarHBondContact O-NZ 3.35Å
624	E	94.3	Very high	89	Confident	79 Å²	79	52 Å²	52	37%	0.369	25%	0.253	S	S	.	.	S	Bend	trans	-134.9	173.6	177.6	62.6	-178.1	-158	0	0	110	R607 I626 K724	R607-E624 WeakPolarHBondContact CD-OE1 3.5Å; R607-E624 WeakPolarHBondContact CG-OE1 3.43Å; R607-E624 IonicContact CZ-OE1 2.71Å; R607-E624 IonicContact NE-OE1 3.41Å; R607-E624 PolarHBondContact NE-OE1 3.34Å; R607-E624 IonicContact NH2-OE1 3.59Å; E624-I626 HydrophobicContact CG-CG1 4.12Å; E624-I626 PolarHBondContact O-N 2.94Å; E624-K724 WeakPolarHBondContact O-CA 3.5Å; E624-K724 PolarHBondContact O-N 3.43Å
625	D	96.2	Very high	90.1	Very high	107 Å²	107	48.8 Å²	48.8	57%	0.572	24%	0.235	S	C	*	.			trans	-79.3	105.6	170.5	-64.4	-50.2	0	0	0	108.8	I722 P723 K724	D625-I722 CarbonylContact C-O 3.48Å; D625-I722 WeakPolarHBondContact CA-O 3.46Å; D625-P723 WeakPolarHBondContact OD1-CA 3.47Å; D625-K724 PolarHBondContact OD1-N 2.81Å
626	I	96.3	Very high	92.3	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-89.1	116.6	-174.9	-50.1	175	0	0	0	109.6	R607 A622 E624 T630 I632 A718 V721 I722 I728	R607-I626 HydrophobicContact CB-CD1 4.18Å; A622-I626 HydrophobicContact CB-CD1 3.83Å; A622-I626 HydrophobicContact CB-CG1 4.21Å; E624-I626 HydrophobicContact CG-CG1 4.12Å; E624-I626 PolarHBondContact O-N 2.94Å; I626-T630 HydrophobicContact CG2-CG2 3.89Å; I626-I632 HydrophobicContact CD1-CD1 4.16Å; I626-I632 HydrophobicContact CD1-CG1 4.27Å; I626-I632 HydrophobicContact CD1-CG2 4.37Å; I626-I632 HydrophobicContact CG2-CD1 4.5Å; I626-I632 HydrophobicContact CG2-CG1 4.26Å; I626-A718 HydrophobicContact CG2-CB 3.84Å; I626-V721 CarbonylContact O-C 3.25Å; I626-V721 WeakPolarHBondContact O-CA 3.32Å; I626-I722 HydrophobicContact CB-CB 4.17Å; I626-I722 PolarHBondContact N-O 3.39Å; I626-I722 PolarHBondContact O-N 2.97Å; I626-I728 HydrophobicContact CD1-CD1 4.26Å
627	C	95.9	Very high	93.9	Very high	76 Å²	76	41.1 Å²	41.1	51%	0.514	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-66.9	154.3	177.4	-71.5	0	0	0	0	113.1	T630 A718	C627-T630 WeakPolarHBondContact O-CB 3.35Å; C627-T630 PolarHBondContact O-N 3.01Å; C627-T630 PolarHBondContact O-OG1 3.49Å; C627-A718 WeakPolarHBondContact O-CB 3.3Å
628	P	95.1	Very high	94.7	Very high	63 Å²	63	39.2 Å²	39.2	41%	0.409	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	152.5	172.8	-16.5	28	0	0	0	111.9	T630 A718 V721	P628-T630 PolarHBondContact O-N 2.79Å; P628-A718 CarbonylContact C-O 3.47Å; P628-A718 WeakPolarHBondContact CA-O 3.4Å; P628-V721 HydrophobicContact CG-CG2 4.14Å
629	R	92.9	Very high	95	Very high	215 Å²	215	36.3 Å²	36.3	81%	0.811	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	-2.2	-175.1	-58.5	-175.5	177.5	-168.4	-2.1	115.9	V717 A718	R629-V717 VanDerWaalsContact C-CG1 3.44Å; R629-V717 WeakPolarHBondContact O-CG1 3.16Å; R629-A718 PolarHBondContact N-O 2.95Å
630	T	93.6	Very high	95.1	Very high	27 Å²	27	37.3 Å²	37.3	17%	0.166	19%	0.189	C	C	.	.			trans	-71.5	129.4	176.4	-52.8	0	0	0	0	111	R607 I626 C627 P628 A718	R607-T630 VanDerWaalsContact CZ-CG2 3.46Å; I626-T630 HydrophobicContact CG2-CG2 3.89Å; C627-T630 WeakPolarHBondContact O-CB 3.35Å; C627-T630 PolarHBondContact O-N 3.01Å; C627-T630 PolarHBondContact O-OG1 3.49Å; P628-T630 PolarHBondContact O-N 2.79Å; T630-A718 PolarHBondContact O-N 2.84Å
631	P	94.2	Very high	95.1	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	140.5	172.8	29.5	-33.8	0	0	0	111.3	P599 L602 R607 I715	P599-P631 HydrophobicContact CG-CG 4.39Å; L602-P631 HydrophobicContact CD1-CB 3.96Å; L602-P631 HydrophobicContact CD1-CG 4.29Å; R607-P631 PolarHBondContact NH1-O 3.2Å; P631-I715 HydrophobicContact CB-CG2 3.9Å
632	I	94.8	Very high	94.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-53.9	-172.3	-52.9	-178.1	0	0	0	111.5	Y608 I626 V716 A718 I722 I728	Y608-I632 HydrophobicContact CD1-CG2 4.01Å; I626-I632 HydrophobicContact CD1-CD1 4.16Å; I626-I632 HydrophobicContact CD1-CG1 4.27Å; I626-I632 HydrophobicContact CD1-CG2 4.37Å; I626-I632 HydrophobicContact CG2-CD1 4.5Å; I626-I632 HydrophobicContact CG2-CG1 4.26Å; I632-V716 WeakPolarHBondContact CB-O 3.27Å; I632-V716 HydrophobicContact CD1-CG1 4.36Å; I632-V716 PolarHBondContact N-O 3.06Å; I632-A718 HydrophobicContact CD1-CB 4.22Å; I632-I722 HydrophobicContact CD1-CD1 3.8Å; I632-I728 HydrophobicContact CD1-CG2 4.12Å; I632-I728 HydrophobicContact CG2-CD1 4.02Å
633	I	94.8	Very high	94.8	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	152.8	-177.5	-161	-176.9	0	0	0	109.7	Y608 E680 A681 I684 V716	Y608-I633 HydrophobicContact CD1-CB 4.44Å; Y608-I633 HydrophobicContact CE1-CB 3.9Å; Y608-I633 HydrophobicContact CE1-CD1 3.92Å; Y608-I633 HydrophobicContact CE1-CG1 3.92Å; Y608-I633 HydrophobicContact CE2-CD1 3.84Å; Y608-I633 WeakPolarHBondContact OH-CD1 3.4Å; I633-E680 HydrophobicContact CD1-CB 4.31Å; I633-A681 HydrophobicContact CD1-CB 4.06Å; I633-A681 HydrophobicContact CG2-CB 3.81Å; I633-I684 HydrophobicContact CG2-CD1 4.39Å; I633-V716 HydrophobicContact CG2-CB 3.99Å; I633-V716 HydrophobicContact CG2-CG2 3.89Å; I633-V716 PolarHBondContact O-N 2.68Å
634	E	94.2	Very high	94.7	Very high	15 Å²	15	40.4 Å²	40.4	7%	0.07	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	145.5	164.9	-169	176.7	-165.6	0	0	110.5	R636 N679 A681 R713 L714	E634-R636 HydrophobicContact CB-CG 4.45Å; E634-R636 HydrophobicContact CG-CG 3.99Å; E634-R636 IonicContact OE2-CZ 3.7Å; E634-R636 VanDerWaalsContact OE2-CZ 3.25Å; E634-R636 IonicContact OE2-NE 3.16Å; E634-R636 PolarHBondContact OE2-NE 3.08Å; E634-R636 IonicContact OE2-NH2 2.65Å; E634-R636 PolarHBondContact OE2-NH2 2.92Å; E634-N679 PolarHBondContact O-ND2 3.33Å; E634-N679 PolarHBondContact O-OD1 2.73Å; E634-A681 WeakPolarHBondContact O-CB 3.42Å; E634-R713 WeakPolarHBondContact OE1-CB 3.31Å; E634-L714 CarbonylContact C-O 3.58Å; E634-L714 WeakPolarHBondContact CA-O 3.26Å; E634-L714 WeakPolarHBondContact CG-O 3.29Å
635	Y	95.6	Very high	94.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.			trans	-100.9	97.9	175.9	-162.1	-74.2	0	0	0	110.1	L660 V672 A674 A681 L714 V716	Y635-L660 HydrophobicContact CD1-CB 4.24Å; Y635-L660 HydrophobicContact CD1-CD2 3.64Å; Y635-L660 HydrophobicContact CD2-CD2 4.11Å; Y635-L660 HydrophobicContact CE1-CB 3.61Å; Y635-L660 HydrophobicContact CE1-CD2 3.9Å; Y635-L660 HydrophobicContact CE1-CG 4.38Å; Y635-L660 HydrophobicContact CE2-CD2 4.35Å; Y635-L660 HydrophobicContact CG-CD2 3.78Å; Y635-V672 HydrophobicContact CD1-CB 4.3Å; Y635-V672 HydrophobicContact CD1-CG1 4.1Å; Y635-V672 HydrophobicContact CE1-CB 4.25Å; Y635-V672 HydrophobicContact CE1-CG1 4.17Å; Y635-A674 HydrophobicContact CE1-CB 4.29Å; Y635-A681 HydrophobicContact CD2-CB 3.51Å; Y635-A681 HydrophobicContact CE2-CB 4.05Å; Y635-A681 VanDerWaalsContact CE2-O 3.26Å; Y635-A681 WeakPolarHBondContact CE2-O 3.19Å; Y635-A681 HydrophobicContact CG-CB 4.02Å; Y635-L714 PolarHBondContact N-O 2.84Å; Y635-V716 HydrophobicContact CD2-CG2 4.39Å
636	R	95.2	Very high	94.5	Very high	26 Å²	26	34.6 Å²	34.6	10%	0.098	18%	0.181	C	C	.	.			trans	-100.2	157.5	-175	-62.2	-176.3	-176.6	143.1	10.2	113.3	A560 Q561 E603 E634 G678 N679	A560-R636 HydrophobicContact CB-CB 3.94Å; A560-R636 WeakPolarHBondContact O-CD 3.08Å; A560-R636 PolarHBondContact O-NH1 2.84Å; Q561-R636 PolarHBondContact O-NE 3.35Å; Q561-R636 PolarHBondContact O-NH1 3.39Å; E603-R636 VanDerWaalsContact CD-NH1 3.28Å; E603-R636 IonicContact OE1-CZ 3.68Å; E603-R636 VanDerWaalsContact OE1-CZ 3.31Å; E603-R636 IonicContact OE1-NH1 2.8Å; E603-R636 PolarHBondContact OE1-NH1 2.85Å; E603-R636 IonicContact OE1-NH2 2.69Å; E603-R636 PolarHBondContact OE1-NH2 2.79Å; E603-R636 IonicContact OE2-CZ 3.36Å; E603-R636 VanDerWaalsContact OE2-CZ 3.23Å; E603-R636 IonicContact OE2-NH1 3.24Å; E603-R636 PolarHBondContact OE2-NH1 3.48Å; E603-R636 IonicContact OE2-NH2 3.06Å; E603-R636 PolarHBondContact OE2-NH2 3.28Å; E634-R636 HydrophobicContact CB-CG 4.45Å; E634-R636 HydrophobicContact CG-CG 3.99Å; E634-R636 IonicContact OE2-CZ 3.7Å; E634-R636 VanDerWaalsContact OE2-CZ 3.25Å; E634-R636 IonicContact OE2-NE 3.16Å; E634-R636 PolarHBondContact OE2-NE 3.08Å; E634-R636 IonicContact OE2-NH2 2.65Å; E634-R636 PolarHBondContact OE2-NH2 2.92Å; R636-G678 WeakPolarHBondContact O-CA 3.31Å; R636-N679 HydrophobicContact CB-CB 4.39Å; R636-N679 PolarHBondContact N-OD1 3.28Å
637	G	95.5	Very high	94.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.4	-166.4	-179.4	0	0	0	0	0	111.9	H564 C639 Y677	H564-G637 PolarHBondContact N-O 3.06Å; G637-C639 PolarHBondContact O-N 3.26Å; G637-Y677 VanDerWaalsContact CA-O 3.25Å; G637-Y677 WeakPolarHBondContact CA-O 3.31Å
638	N	95.4	Very high	94.1	Very high	54 Å²	54	42 Å²	42	29%	0.289	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.6	-176.4	-70.1	0.8	0	0	0	111.3	V672 D673	N638-V672 CarbonylContact O-C 3.55Å; N638-V672 WeakPolarHBondContact O-CA 3.32Å; N638-D673 PolarHBondContact N-O 2.79Å; N638-D673 VanDerWaalsContact N-O 3.12Å; N638-D673 PolarHBondContact O-N 3.05Å
639	C	95.3	Very high	93.9	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	111.9	-177.7	-167.6	0	0	0	0	111.7	L563 H564 L565 S566 G637	L563-C639 HydrophobicContact CD1-CB 4.13Å; L563-C639 HydrophobicContact CD2-CB 4.23Å; L563-C639 HydrophobicContact CG-CB 4.02Å; H564-C639 PolarHBondContact O-N 3.3Å; L565-C639 HydrophobicContact CD2-CB 3.81Å; S566-C639 VanDerWaalsContact CB-O 3.3Å; S566-C639 WeakPolarHBondContact CB-O 3.35Å; S566-C639 PolarHBondContact N-O 3.44Å; S566-C639 PolarHBondContact OG-O 2.94Å; G637-C639 PolarHBondContact O-N 3.26Å
640	L	95.2	Very high	93.7	Very high	22 Å²	22	35.3 Å²	35.3	12%	0.115	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	158.9	-176.7	-61.2	162.9	0	0	0	110.4	V569 E644 Y645 L670 C671 D673	V569-L640 VanDerWaalsContact CG2-C 3.43Å; L640-E644 HydrophobicContact CB-CG 4.41Å; L640-E644 HydrophobicContact CD2-CG 3.96Å; L640-Y645 HydrophobicContact CD1-CD2 4.19Å; L640-L670 CarbonylContact O-C 3.53Å; L640-L670 WeakPolarHBondContact O-CA 3.29Å; L640-C671 PolarHBondContact N-O 3.03Å; L640-C671 PolarHBondContact O-N 3.02Å; L640-D673 HydrophobicContact CD1-CB 4.39Å
641	L	94.9	Very high	93.4	Very high	22 Å²	22	35.4 Å²	35.4	12%	0.115	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	146.8	162.4	-64.7	179.1	0	0	0	109.6	R568 V569 S643 E644 Y645 L668 L670	R568-L641 HydrophobicContact CB-CD1 3.8Å; R568-L641 HydrophobicContact CB-CG 4.2Å; V569-L641 HydrophobicContact CG2-CD2 3.82Å; V569-L641 HydrophobicContact CG2-CG 3.9Å; L641-S643 PolarHBondContact O-N 3.2Å; L641-E644 HydrophobicContact CB-CB 3.95Å; L641-E644 PolarHBondContact N-OE2 3.11Å; L641-E644 WeakPolarHBondContact O-CB 3.21Å; L641-E644 PolarHBondContact O-N 3.18Å; L641-E644 VanDerWaalsContact O-N 3.1Å; L641-Y645 PolarHBondContact O-N 2.81Å; L641-L668 HydrophobicContact CD2-CD1 3.48Å; L641-L668 VanDerWaalsContact CD2-CD1 3.48Å; L641-L668 HydrophobicContact CD2-CG 4.41Å; L641-L670 HydrophobicContact CD2-CD2 4.32Å
642	L	93.2	Very high	93.2	Very high	31 Å²	31	38.2 Å²	38.2	16%	0.162	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-30.2	175.2	-177.8	59.2	0	0	0	112.5	N646 F661 P669	L642-N646 WeakPolarHBondContact O-CB 3.47Å; L642-N646 PolarHBondContact O-N 3Å; L642-N646 VanDerWaalsContact O-N 3.09Å; L642-N646 PolarHBondContact O-ND2 3.03Å; L642-F661 HydrophobicContact CD1-CD1 3.75Å; L642-F661 HydrophobicContact CD1-CE1 4.15Å; L642-P669 HydrophobicContact CB-CB 3.83Å; L642-P669 HydrophobicContact CB-CG 4.15Å; L642-P669 WeakPolarHBondContact CB-O 3.24Å; L642-P669 HydrophobicContact CD2-CB 3.83Å; L642-P669 HydrophobicContact CD2-CG 4.48Å; L642-P669 HydrophobicContact CG-CB 4.49Å; L642-P669 PolarHBondContact N-O 3.38Å
643	S	92.7	Very high	92.9	Very high	67 Å²	67	43.5 Å²	43.5	47%	0.469	21%	0.213	S	C	.	.	H	α-helix	trans	-65.2	-49.4	172	51.5	0	0	0	0	111.9	L641 Y645 N646 D647	L641-S643 PolarHBondContact O-N 3.2Å; S643-Y645 VanDerWaalsContact C-N 3.35Å; S643-Y645 PolarHBondContact O-N 2.88Å; S643-N646 CarbonylContact O-C 3.33Å; S643-N646 WeakPolarHBondContact O-CA 3.22Å; S643-N646 WeakPolarHBondContact O-CB 3.45Å; S643-N646 PolarHBondContact O-N 2.85Å; S643-D647 PolarHBondContact O-N 2.85Å
644	E	94.3	Very high	92.4	Very high	27 Å²	27	49.2 Å²	49.2	13%	0.126	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-39.4	179.5	175.9	178.9	-142.3	0	0	112.3	S566 R568 L640 L641 D647 M648	S566-E644 PolarHBondContact OG-OE2 3.1Å; R568-E644 WeakPolarHBondContact CD-OE1 3.3Å; L640-E644 HydrophobicContact CB-CG 4.41Å; L640-E644 HydrophobicContact CD2-CG 3.96Å; L641-E644 HydrophobicContact CB-CB 3.95Å; L641-E644 PolarHBondContact N-OE2 3.11Å; L641-E644 WeakPolarHBondContact O-CB 3.21Å; L641-E644 PolarHBondContact O-N 3.18Å; L641-E644 VanDerWaalsContact O-N 3.1Å; E644-D647 WeakPolarHBondContact O-CB 3.48Å; E644-D647 PolarHBondContact O-N 3.3Å; E644-M648 WeakPolarHBondContact O-CG 3.28Å; E644-M648 PolarHBondContact O-N 3.45Å
645	Y	93.7	Very high	92	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-40.6	170.6	179.9	-88.5	0	0	0	112.4	L640 L641 S643 M648 Y649 N656 V659 F661 C671	L640-Y645 HydrophobicContact CD1-CD2 4.19Å; L641-Y645 PolarHBondContact O-N 2.81Å; S643-Y645 VanDerWaalsContact C-N 3.35Å; S643-Y645 PolarHBondContact O-N 2.88Å; Y645-M648 PolarHBondContact O-N 2.83Å; Y645-Y649 HydrophobicContact CD2-CD2 4.02Å; Y645-Y649 AromaticContact CE2-CD2 3.75Å; Y645-Y649 HydrophobicContact CE2-CD2 3.75Å; Y645-Y649 HydrophobicContact CE2-CG 4.36Å; Y645-Y649 PolarHBondContact O-N 3.16Å; Y645-N656 WeakPolarHBondContact OH-CB 3.25Å; Y645-N656 PolarHBondContact OH-ND2 3.48Å; Y645-V659 HydrophobicContact CD2-CG1 4.41Å; Y645-V659 HydrophobicContact CE2-CG1 3.68Å; Y645-V659 HydrophobicContact CE2-CG2 4.12Å; Y645-F661 AromaticContact CD1-CE1 3.88Å; Y645-F661 HydrophobicContact CD1-CE1 3.88Å; Y645-F661 HydrophobicContact CD1-CZ 4.48Å; Y645-F661 AromaticContact CE1-CE1 3.58Å; Y645-F661 HydrophobicContact CE1-CE1 3.58Å; Y645-F661 AromaticContact CE1-CZ 3.73Å; Y645-F661 HydrophobicContact CE1-CZ 3.73Å; Y645-C671 HydrophobicContact CD2-CB 4.4Å; Y645-C671 WeakPolarHBondContact CD2-SG 2.93Å; Y645-C671 HydrophobicContact CG-CB 4.11Å
646	N	92	Very high	91.6	Very high	64 Å²	64	55.3 Å²	55.3	34%	0.342	27%	0.265	S	S	.	.	H	α-helix	trans	-70.8	-28.2	178	-72.1	-26.6	0	0	0	113	L642 S643 M648	L642-N646 WeakPolarHBondContact O-CB 3.47Å; L642-N646 PolarHBondContact O-N 3Å; L642-N646 VanDerWaalsContact O-N 3.09Å; L642-N646 PolarHBondContact O-ND2 3.03Å; S643-N646 CarbonylContact O-C 3.33Å; S643-N646 WeakPolarHBondContact O-CA 3.22Å; S643-N646 WeakPolarHBondContact O-CB 3.45Å; S643-N646 PolarHBondContact O-N 2.85Å; N646-M648 PolarHBondContact O-N 3.23Å
647	D	92.3	Very high	91.1	Very high	119 Å²	119	56 Å²	56	64%	0.636	27%	0.274	S	S	*	.	H	α-helix	trans	-59.4	-35.4	170.9	-63.3	-26.9	0	0	0	110.3	R568 S643 E644	R568-D647 IonicContact NH1-OD2 3.57Å; R568-D647 PolarHBondContact NH1-OD2 2.96Å; R568-D647 VanDerWaalsContact NH1-OD2 3.16Å; S643-D647 PolarHBondContact O-N 2.85Å; E644-D647 WeakPolarHBondContact O-CB 3.48Å; E644-D647 PolarHBondContact O-N 3.3Å
648	M	90.5	Very high	91	Very high	115 Å²	115	57.7 Å²	57.7	57%	0.567	28%	0.281	S	S	*	.	H	α-helix	trans	-91.9	-39	-179.6	-58.9	174.9	78.4	0	0	114.1	E644 Y645 N646	E644-M648 WeakPolarHBondContact O-CG 3.28Å; E644-M648 PolarHBondContact O-N 3.45Å; Y645-M648 PolarHBondContact O-N 2.83Å; N646-M648 PolarHBondContact O-N 3.23Å
649	Y	91.2	Very high	90.9	Very high	83 Å²	83	55.3 Å²	55.3	33%	0.325	27%	0.268	S	S	.	.			trans	-143.1	120.6	-165.8	-56.6	-74.2	0	0	0	114.1	Y645 Y651 R675	Y645-Y649 HydrophobicContact CD2-CD2 4.02Å; Y645-Y649 AromaticContact CE2-CD2 3.75Å; Y645-Y649 HydrophobicContact CE2-CD2 3.75Å; Y645-Y649 HydrophobicContact CE2-CG 4.36Å; Y645-Y649 PolarHBondContact O-N 3.16Å; Y649-Y651 PolarHBondContact O-N 3.47Å; Y649-R675 VanDerWaalsContact CZ-NH2 3.25Å
650	D	88.4	Confident	90.9	Very high	53 Å²	53	55.6 Å²	55.6	28%	0.283	27%	0.27	S	S	.	.			trans	-84.7	99.9	170.6	-175.4	-21.9	0	0	0	111.9	R652 K653 H654	D650-R652 PolarHBondContact O-N 3.02Å; D650-R652 WeakPolarHBondContact OD1-CA 3.24Å; D650-R652 VanDerWaalsContact OD1-CB 3.23Å; D650-R652 WeakPolarHBondContact OD1-CB 3.39Å; D650-R652 PolarHBondContact OD1-N 2.68Å; D650-K653 HydrophobicContact CB-CB 4.3Å; D650-K653 HydrophobicContact CB-CD 4.09Å; D650-K653 HydrophobicContact CB-CG 4.22Å; D650-K653 PolarHBondContact O-N 3.37Å; D650-K653 VanDerWaalsContact O-N 3.17Å; D650-K653 PolarHBondContact OD1-N 3.45Å; D650-K653 WeakPolarHBondContact OD2-CD 3.09Å; D650-K653 VanDerWaalsContact OD2-CE 3.23Å; D650-K653 WeakPolarHBondContact OD2-CE 3.46Å; D650-K653 WeakPolarHBondContact OD2-CG 3.43Å; D650-K653 IonicContact OD2-NZ 3.26Å; D650-K653 PolarHBondContact OD2-NZ 3.11Å; D650-H654 PolarHBondContact O-N 3.15Å; D650-H654 VanDerWaalsContact O-N 3.14Å
651	Y	88.1	Confident	90.9	Very high	29 Å²	29	55.2 Å²	55.2	11%	0.114	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.1	177.6	74.7	-92.5	0	0	0	114.7	Y649 F661 F734 Y741	Y649-Y651 PolarHBondContact O-N 3.47Å; Y651-F661 HydrophobicContact CD1-CE1 4.32Å; Y651-F661 HydrophobicContact CG-CE1 4.36Å; Y651-F661 HydrophobicContact CG-CZ 4.17Å; Y651-F734 HydrophobicContact CD2-CB 4.24Å; Y651-F734 HydrophobicContact CE2-CB 4.32Å; Y651-Y741 VanDerWaalsContact O-CE1 3.31Å; Y651-Y741 WeakPolarHBondContact O-CE1 3.32Å; Y651-Y741 PolarHBondContact O-OH 3.31Å
652	R	90	Very high	90.9	Very high	74 Å²	74	54.6 Å²	54.6	28%	0.279	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-27.6	176	-57.3	175.9	173.3	143.8	0.6	111.6	D114 D650 A738 R740	D114-R652 IonicContact OD1-CZ 2.64Å; D114-R652 VanDerWaalsContact OD1-CZ 3.28Å; D114-R652 IonicContact OD1-NH1 3.61Å; D114-R652 PolarHBondContact OD1-NH1 2.95Å; D114-R652 IonicContact OD1-NH2 3.16Å; D114-R652 PolarHBondContact OD1-NH2 3.3Å; D114-R652 IonicContact OD2-CZ 3.04Å; D114-R652 IonicContact OD2-NH1 2.67Å; D114-R652 IonicContact OD2-NH2 3.27Å; D114-R652 PolarHBondContact OD2-NH2 2.96Å; D650-R652 PolarHBondContact O-N 3.02Å; D650-R652 WeakPolarHBondContact OD1-CA 3.24Å; D650-R652 VanDerWaalsContact OD1-CB 3.23Å; D650-R652 WeakPolarHBondContact OD1-CB 3.39Å; D650-R652 PolarHBondContact OD1-N 2.68Å; R652-A738 HydrophobicContact CG-CB 4.15Å; R652-R740 PolarHBondContact O-N 3.23Å
653	K	88.4	Confident	90.8	Very high	111 Å²	111	58 Å²	58	48%	0.483	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-43.8	175.7	-67.4	179.6	-172.9	110.7	0	112.1	D650	D650-K653 HydrophobicContact CB-CB 4.3Å; D650-K653 HydrophobicContact CB-CD 4.09Å; D650-K653 HydrophobicContact CB-CG 4.22Å; D650-K653 PolarHBondContact O-N 3.37Å; D650-K653 VanDerWaalsContact O-N 3.17Å; D650-K653 PolarHBondContact OD1-N 3.45Å; D650-K653 WeakPolarHBondContact OD2-CD 3.09Å; D650-K653 VanDerWaalsContact OD2-CE 3.23Å; D650-K653 WeakPolarHBondContact OD2-CE 3.46Å; D650-K653 WeakPolarHBondContact OD2-CG 3.43Å; D650-K653 IonicContact OD2-NZ 3.26Å; D650-K653 PolarHBondContact OD2-NZ 3.11Å
654	H	84.5	Confident	90.5	Very high	121 Å²	121	58.6 Å²	58.6	56%	0.56	28%	0.281	S	S	*	.	S	Bend	trans	-127	134.8	-170.5	-56.6	115.1	0	0	0	112.6	D650 N656	D650-H654 PolarHBondContact O-N 3.15Å; D650-H654 VanDerWaalsContact O-N 3.14Å; H654-N656 PolarHBondContact O-N 3.21Å
655	Y	84.8	Confident	90	Very high	112 Å²	112	57.5 Å²	57.5	44%	0.439	28%	0.276	S	S	.	.			trans	-77.8	104.5	171.4	-176.8	-119.1	0	0	0	109.8	P657 Y741	Y655-P657 HydrophobicContact CE1-CB 3.93Å; Y655-P657 WeakPolarHBondContact O-CD 3.48Å; Y655-Y741 VanDerWaalsContact CB-CE2 3.48Å; Y655-Y741 HydrophobicContact CD2-CD2 4.49Å; Y655-Y741 AromaticContact CD2-CE2 3.61Å; Y655-Y741 HydrophobicContact CD2-CE2 3.61Å; Y655-Y741 HydrophobicContact CG-CD2 4.4Å; Y655-Y741 AromaticContact CG-CE2 3.9Å; Y655-Y741 HydrophobicContact CG-CE2 3.9Å
656	N	86.9	Confident	89.4	Confident	31 Å²	31	60.1 Å²	60.1	17%	0.166	29%	0.293	C	S	.	.			trans	-90.9	102.9	168.8	-68.7	-24.8	0	0	0	108.3	Y645 H654 V659 R675	Y645-N656 WeakPolarHBondContact OH-CB 3.25Å; Y645-N656 PolarHBondContact OH-ND2 3.48Å; H654-N656 PolarHBondContact O-N 3.21Å; N656-V659 HydrophobicContact CB-CG2 3.86Å; N656-R675 VanDerWaalsContact CG-NH1 3.27Å; N656-R675 PolarHBondContact ND2-NH1 3.08Å; N656-R675 PolarHBondContact OD1-NH1 3.45Å
657	P	85.3	Confident	88.9	Confident	42 Å²	42	66 Å²	66	27%	0.273	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	162.6	170.3	30.7	-36	0	0	0	110	Y655 V659 R675	Y655-P657 HydrophobicContact CE1-CB 3.93Å; Y655-P657 WeakPolarHBondContact O-CD 3.48Å; P657-V659 PolarHBondContact O-N 2.82Å; P657-R675 WeakPolarHBondContact O-CG 3.36Å
658	F	93.3	Very high	88.8	Confident	35 Å²	35	60.4 Å²	60.4	15%	0.154	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	18	176.3	-40.5	-47.3	0	0	0	115	S554 A674 R675 R682 F683	S554-F658 VanDerWaalsContact O-CE2 3.31Å; S554-F658 WeakPolarHBondContact O-CE2 3.34Å; F658-A674 HydrophobicContact CB-CB 4.39Å; F658-A674 WeakPolarHBondContact O-CA 3.45Å; F658-A674 VanDerWaalsContact O-CB 3.27Å; F658-A674 WeakPolarHBondContact O-CB 3.09Å; F658-A674 PolarHBondContact O-N 3.03Å; F658-R675 HydrophobicContact CB-CG 4.11Å; F658-R675 HydrophobicContact CD2-CG 4.46Å; F658-R682 HydrophobicContact CB-CB 4.13Å; F658-R682 HydrophobicContact CD1-CB 4.14Å; F658-R682 HydrophobicContact CD1-CG 3.96Å; F658-R682 WeakPolarHBondContact CD1-O 3.1Å; F658-R682 HydrophobicContact CG-CB 4.38Å; F658-R682 HydrophobicContact CG-CG 4.3Å; F658-F683 HydrophobicContact CD1-CD1 4.43Å; F658-F683 AromaticContact CE1-CD1 3.71Å; F658-F683 HydrophobicContact CE1-CD1 3.71Å; F658-F683 AromaticContact CE1-CE1 3.99Å; F658-F683 HydrophobicContact CE1-CE1 3.99Å; F658-F683 HydrophobicContact CZ-CD1 4.27Å; F658-F683 HydrophobicContact CZ-CE1 4.16Å
659	V	94.4	Very high	88.9	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.4	174.1	-178.7	0	0	0	0	110.3	Y645 N656 P657 F661 C671 V672 R675 R686	Y645-V659 HydrophobicContact CD2-CG1 4.41Å; Y645-V659 HydrophobicContact CE2-CG1 3.68Å; Y645-V659 HydrophobicContact CE2-CG2 4.12Å; N656-V659 HydrophobicContact CB-CG2 3.86Å; P657-V659 PolarHBondContact O-N 2.82Å; V659-F661 HydrophobicContact CB-CE2 4.44Å; V659-F661 HydrophobicContact CG1-CE1 4.29Å; V659-F661 HydrophobicContact CG1-CE2 3.99Å; V659-F661 HydrophobicContact CG1-CZ 3.85Å; V659-C671 WeakPolarHBondContact CG1-SG 3.39Å; V659-V672 CarbonylContact C-O 3.29Å; V659-V672 WeakPolarHBondContact CA-O 3.17Å; V659-R675 HydrophobicContact CG2-CG 4.25Å; V659-R686 PolarHBondContact O-NH2 2.7Å
660	L	95.7	Very high	89	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.1	180	175.8	70.7	0	0	0	111.3	Y635 Y662 C671 V672 V694 L730 D733	Y635-L660 HydrophobicContact CD1-CB 4.24Å; Y635-L660 HydrophobicContact CD1-CD2 3.64Å; Y635-L660 HydrophobicContact CD2-CD2 4.11Å; Y635-L660 HydrophobicContact CE1-CB 3.61Å; Y635-L660 HydrophobicContact CE1-CD2 3.9Å; Y635-L660 HydrophobicContact CE1-CG 4.38Å; Y635-L660 HydrophobicContact CE2-CD2 4.35Å; Y635-L660 HydrophobicContact CG-CD2 3.78Å; L660-Y662 PolarHBondContact O-N 3.32Å; L660-C671 CarbonylContact O-C 3.34Å; L660-C671 WeakPolarHBondContact O-CA 3.42Å; L660-V672 HydrophobicContact CB-CB 4.31Å; L660-V672 PolarHBondContact N-O 2.86Å; L660-V672 PolarHBondContact O-N 2.81Å; L660-V694 HydrophobicContact CD1-CG2 4.36Å; L660-V694 HydrophobicContact CD2-CG1 4.42Å; L660-V694 HydrophobicContact CD2-CG2 4.19Å; L660-L730 HydrophobicContact CD1-CD1 4.42Å; L660-D733 WeakPolarHBondContact CA-OD2 3.41Å
661	F	94.7	Very high	89.3	Confident	13 Å²	13	51.2 Å²	51.2	6%	0.057	25%	0.247	C	C	.	.			trans	-94.4	83.1	-178.3	-63.1	-85.2	0	0	0	112.1	L642 Y645 Y651 V659 K663 D733 F734	L642-F661 HydrophobicContact CD1-CD1 3.75Å; L642-F661 HydrophobicContact CD1-CE1 4.15Å; Y645-F661 AromaticContact CD1-CE1 3.88Å; Y645-F661 HydrophobicContact CD1-CE1 3.88Å; Y645-F661 HydrophobicContact CD1-CZ 4.48Å; Y645-F661 AromaticContact CE1-CE1 3.58Å; Y645-F661 HydrophobicContact CE1-CE1 3.58Å; Y645-F661 AromaticContact CE1-CZ 3.73Å; Y645-F661 HydrophobicContact CE1-CZ 3.73Å; Y651-F661 HydrophobicContact CD1-CE1 4.32Å; Y651-F661 HydrophobicContact CG-CE1 4.36Å; Y651-F661 HydrophobicContact CG-CZ 4.17Å; V659-F661 HydrophobicContact CB-CE2 4.44Å; V659-F661 HydrophobicContact CG1-CE1 4.29Å; V659-F661 HydrophobicContact CG1-CE2 3.99Å; V659-F661 HydrophobicContact CG1-CZ 3.85Å; F661-K663 PolarHBondContact O-N 3.25Å; F661-D733 HydrophobicContact CB-CB 4.1Å; F661-D733 PolarHBondContact N-OD2 3.13Å; F661-F734 HydrophobicContact CD2-CB 3.97Å; F661-F734 AromaticContact CD2-CD1 3.93Å; F661-F734 HydrophobicContact CD2-CD1 3.93Å; F661-F734 HydrophobicContact CD2-CG 4.37Å; F661-F734 HydrophobicContact CE2-CB 4.27Å; F661-F734 HydrophobicContact CE2-CD1 4.06Å; F661-F734 HydrophobicContact CE2-CG 4.44Å; F661-F734 HydrophobicContact CG-CB 4.46Å
662	Y	94.3	Very high	89.7	Confident	10 Å²	10	49.8 Å²	49.8	4%	0.039	24%	0.242	C	C	.	.			trans	-81.8	109.1	-174.2	-164.8	-113.1	0	0	0	113.2	L660 F665 L670 V694 H696 L714	L660-Y662 PolarHBondContact O-N 3.32Å; Y662-F665 HydrophobicContact CD1-CB 4.14Å; Y662-F665 HydrophobicContact CE1-CB 3.94Å; Y662-L670 PolarHBondContact N-O 2.69Å; Y662-L670 PolarHBondContact O-N 3.03Å; Y662-V694 HydrophobicContact CD2-CB 4.24Å; Y662-V694 HydrophobicContact CD2-CG1 4.06Å; Y662-V694 HydrophobicContact CE2-CB 3.96Å; Y662-V694 HydrophobicContact CE2-CG1 3.83Å; Y662-V694 WeakPolarHBondContact CE2-O 3.25Å; Y662-V694 PolarHBondContact OH-O 2.93Å; Y662-H696 HydrophobicContact CE1-CB 4.19Å; Y662-H696 AromaticContact CE1-ND1 3.88Å; Y662-H696 AromaticContact CZ-ND1 3.85Å; Y662-H696 PolarHBondContact OH-N 3.25Å; Y662-H696 PolarHBondContact OH-ND1 2.96Å; Y662-L714 HydrophobicContact CD1-CD2 3.76Å; Y662-L714 HydrophobicContact CE1-CD2 3.69Å; Y662-L714 HydrophobicContact CE2-CD2 4.49Å; Y662-L714 HydrophobicContact CG-CD2 4.18Å
663	K	90.6	Very high	89.9	Confident	101 Å²	101	47.3 Å²	47.3	44%	0.439	23%	0.234	S	C	.	.			trans	-107.8	-9.5	-174.9	-68.6	165.7	-177.5	160	0	114.8	F661 F665 D733	F661-K663 PolarHBondContact O-N 3.25Å; K663-F665 VanDerWaalsContact C-N 3.31Å; K663-F665 PolarHBondContact O-N 3.2Å; K663-D733 PolarHBondContact NZ-O 2.92Å
664	S	86.3	Confident	90.3	Very high	81 Å²	81	42 Å²	42	57%	0.566	21%	0.211	S	C	*	.			trans	-81.4	-7.3	-174	-47.3	0	0	0	0	114
665	F	85.2	Confident	90.7	Very high	3 Å²	3	38.9 Å²	38.9	1%	0.013	19%	0.194	C	C	.	.	S	Bend	trans	-75.1	129.9	174.5	-157.5	-82.5	0	0	0	110.3	L573 M576 F580 Y662 K663 K667 L668 L670 H696 I698 L712	L573-F665 HydrophobicContact CD2-CE1 3.8Å; L573-F665 HydrophobicContact CD2-CZ 3.72Å; M576-F665 HydrophobicContact CE-CD1 4.35Å; M576-F665 HydrophobicContact CE-CE1 3.83Å; F580-F665 AromaticContact CE2-CE1 3.92Å; F580-F665 HydrophobicContact CE2-CE1 3.92Å; F580-F665 AromaticContact CE2-CZ 3.79Å; F580-F665 HydrophobicContact CE2-CZ 3.79Å; F580-F665 AromaticContact CZ-CE1 3.57Å; F580-F665 HydrophobicContact CZ-CE1 3.57Å; F580-F665 AromaticContact CZ-CZ 3.55Å; F580-F665 HydrophobicContact CZ-CZ 3.55Å; Y662-F665 HydrophobicContact CD1-CB 4.14Å; Y662-F665 HydrophobicContact CE1-CB 3.94Å; K663-F665 VanDerWaalsContact C-N 3.31Å; K663-F665 PolarHBondContact O-N 3.2Å; F665-K667 PolarHBondContact O-N 2.99Å; F665-L668 HydrophobicContact CD1-CB 3.72Å; F665-L668 HydrophobicContact CD1-CD2 3.92Å; F665-L668 HydrophobicContact CD1-CG 4.38Å; F665-L668 HydrophobicContact CE1-CB 4.39Å; F665-L668 HydrophobicContact CE1-CD2 3.94Å; F665-L668 PolarHBondContact O-N 3.04Å; F665-L670 HydrophobicContact CB-CD1 4.48Å; F665-H696 HydrophobicContact CD2-CB 4.31Å; F665-H696 AromaticContact CD2-CD2 3.61Å; F665-H696 AromaticContact CD2-CG 3.78Å; F665-H696 AromaticContact CD2-NE2 3.82Å; F665-H696 AromaticContact CE2-CD2 3.58Å; F665-H696 AromaticContact CE2-NE2 3.96Å; F665-I698 HydrophobicContact CE2-CD1 4.33Å; F665-I698 HydrophobicContact CZ-CD1 4.07Å; F665-L712 HydrophobicContact CD2-CD1 4.08Å; F665-L712 HydrophobicContact CE2-CD1 3.61Å; F665-L712 HydrophobicContact CE2-CD2 4.48Å
666	P	81	Confident	91	Very high	55 Å²	55	39.3 Å²	39.3	36%	0.357	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	123.6	-171.4	21.8	-33.8	0	0	0	112.3	M576 F580 L668	M576-P666 VanDerWaalsContact CE-O 3.26Å; M576-P666 WeakPolarHBondContact CE-O 3.16Å; F580-P666 HydrophobicContact CE1-CG 4.21Å; F580-P666 HydrophobicContact CZ-CG 4.13Å; P666-L668 PolarHBondContact O-N 2.97Å
667	K	81.7	Confident	91.2	Very high	188 Å²	188	41.3 Å²	41.3	82%	0.817	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	12.8	176.3	-53	171.3	-175.1	168.4	0	115.4	K572 F665	K572-K667 PolarHBondContact NZ-O 3.25Å; F665-K667 PolarHBondContact O-N 2.99Å
668	L	88.8	Confident	91.6	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.191	C	C	.	.			trans	-137.9	85.4	-175.2	-168.9	66.4	0	0	0	110.9	K572 L573 M576 L641 F665 P666 L670	K572-L668 HydrophobicContact CB-CD1 4.33Å; K572-L668 HydrophobicContact CD-CD1 3.43Å; K572-L668 VanDerWaalsContact CD-CD1 3.43Å; K572-L668 HydrophobicContact CG-CD1 3.83Å; L573-L668 HydrophobicContact CD2-CD2 3.52Å; L573-L668 HydrophobicContact CG-CD2 3.99Å; M576-L668 HydrophobicContact SD-CB 4.45Å; M576-L668 HydrophobicContact SD-CD2 4.38Å; L641-L668 HydrophobicContact CD2-CD1 3.48Å; L641-L668 VanDerWaalsContact CD2-CD1 3.48Å; L641-L668 HydrophobicContact CD2-CG 4.41Å; F665-L668 HydrophobicContact CD1-CB 3.72Å; F665-L668 HydrophobicContact CD1-CD2 3.92Å; F665-L668 HydrophobicContact CD1-CG 4.38Å; F665-L668 HydrophobicContact CE1-CB 4.39Å; F665-L668 HydrophobicContact CE1-CD2 3.94Å; F665-L668 PolarHBondContact O-N 3.04Å; P666-L668 PolarHBondContact O-N 2.97Å; L668-L670 HydrophobicContact CD2-CD1 4.34Å; L668-L670 HydrophobicContact CD2-CD2 3.99Å; L668-L670 HydrophobicContact CD2-CG 4.29Å; L668-L670 HydrophobicContact CG-CD2 3.83Å; L668-L670 HydrophobicContact CG-CG 4.05Å; L668-L670 PolarHBondContact O-N 3.32Å
669	P	92.4	Very high	91.6	Very high	58 Å²	58	37.7 Å²	37.7	38%	0.377	18%	0.184	S	C	.	.			trans	-69.8	118.2	172	29.5	-33.4	0	0	0	109.6	L642	L642-P669 HydrophobicContact CB-CB 3.83Å; L642-P669 HydrophobicContact CB-CG 4.15Å; L642-P669 WeakPolarHBondContact CB-O 3.24Å; L642-P669 HydrophobicContact CD2-CB 3.83Å; L642-P669 HydrophobicContact CD2-CG 4.48Å; L642-P669 HydrophobicContact CG-CB 4.49Å; L642-P669 PolarHBondContact N-O 3.38Å
670	L	94.4	Very high	91.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	162.3	-177.4	-67	173.8	0	0	0	111.2	V569 L640 L641 Y662 F665 L668 L712	V569-L670 HydrophobicContact CB-CD2 4.5Å; V569-L670 HydrophobicContact CG1-CD2 3.98Å; V569-L670 HydrophobicContact CG2-CD2 3.66Å; L640-L670 CarbonylContact O-C 3.53Å; L640-L670 WeakPolarHBondContact O-CA 3.29Å; L641-L670 HydrophobicContact CD2-CD2 4.32Å; Y662-L670 PolarHBondContact N-O 2.69Å; Y662-L670 PolarHBondContact O-N 3.03Å; F665-L670 HydrophobicContact CB-CD1 4.48Å; L668-L670 HydrophobicContact CD2-CD1 4.34Å; L668-L670 HydrophobicContact CD2-CD2 3.99Å; L668-L670 HydrophobicContact CD2-CG 4.29Å; L668-L670 HydrophobicContact CG-CD2 3.83Å; L668-L670 HydrophobicContact CG-CG 4.05Å; L668-L670 PolarHBondContact O-N 3.32Å; L670-L712 HydrophobicContact CD1-CD2 3.67Å
671	C	94.2	Very high	91.6	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	117.8	175.9	-167	0	0	0	0	109.5	L640 Y645 V659 L660	L640-C671 PolarHBondContact N-O 3.03Å; L640-C671 PolarHBondContact O-N 3.02Å; Y645-C671 HydrophobicContact CD2-CB 4.4Å; Y645-C671 WeakPolarHBondContact CD2-SG 2.93Å; Y645-C671 HydrophobicContact CG-CB 4.11Å; V659-C671 WeakPolarHBondContact CG1-SG 3.39Å; L660-C671 CarbonylContact O-C 3.34Å; L660-C671 WeakPolarHBondContact O-CA 3.42Å
672	V	96.2	Very high	91.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.3	174.8	-170.4	0	0	0	0	109	L563 Y635 N638 V659 L660 L714	L563-V672 HydrophobicContact CD1-CG1 3.85Å; L563-V672 HydrophobicContact CD1-CG2 4.06Å; Y635-V672 HydrophobicContact CD1-CB 4.3Å; Y635-V672 HydrophobicContact CD1-CG1 4.1Å; Y635-V672 HydrophobicContact CE1-CB 4.25Å; Y635-V672 HydrophobicContact CE1-CG1 4.17Å; N638-V672 CarbonylContact O-C 3.55Å; N638-V672 WeakPolarHBondContact O-CA 3.32Å; V659-V672 CarbonylContact C-O 3.29Å; V659-V672 WeakPolarHBondContact CA-O 3.17Å; L660-V672 HydrophobicContact CB-CB 4.31Å; L660-V672 PolarHBondContact N-O 2.86Å; L660-V672 PolarHBondContact O-N 2.81Å; V672-L714 HydrophobicContact CG2-CD1 3.5Å
673	D	95.4	Very high	91.6	Very high	21 Å²	21	39.4 Å²	39.4	11%	0.112	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	98.7	175.7	-172.9	-0.1	0	0	0	110.4	N638 L640 R675	N638-D673 PolarHBondContact N-O 2.79Å; N638-D673 VanDerWaalsContact N-O 3.12Å; N638-D673 PolarHBondContact O-N 3.05Å; L640-D673 HydrophobicContact CD1-CB 4.39Å; D673-R675 VanDerWaalsContact C-N 3.33Å; D673-R675 WeakPolarHBondContact OD1-CB 3.44Å; D673-R675 WeakPolarHBondContact OD1-CG 3.24Å; D673-R675 IonicContact OD1-CZ 2.85Å; D673-R675 PolarHBondContact OD1-N 2.73Å; D673-R675 VanDerWaalsContact OD1-N 3.11Å; D673-R675 IonicContact OD1-NE 3.98Å; D673-R675 PolarHBondContact OD1-NE 2.83Å; D673-R675 IonicContact OD1-NH2 2.72Å; D673-R675 IonicContact OD2-CZ 3.21Å; D673-R675 IonicContact OD2-NE 3.27Å; D673-R675 PolarHBondContact OD2-NE 3.28Å; D673-R675 IonicContact OD2-NH2 2.68Å; D673-R675 PolarHBondContact OD2-NH2 2.96Å
674	A	95.9	Very high	91.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	23.7	177.6	0	0	0	0	0	113.2	Y635 F658 Y677 R682	Y635-A674 HydrophobicContact CE1-CB 4.29Å; F658-A674 HydrophobicContact CB-CB 4.39Å; F658-A674 WeakPolarHBondContact O-CA 3.45Å; F658-A674 VanDerWaalsContact O-CB 3.27Å; F658-A674 WeakPolarHBondContact O-CB 3.09Å; F658-A674 PolarHBondContact O-N 3.03Å; A674-Y677 VanDerWaalsContact CA-O 3.25Å; A674-Y677 WeakPolarHBondContact CA-O 3.43Å; A674-R682 HydrophobicContact CB-CB 3.75Å; A674-R682 WeakPolarHBondContact O-CD 3.47Å; A674-R682 PolarHBondContact O-NH1 3.15Å
675	R	92.5	Very high	92.1	Very high	56 Å²	56	33.2 Å²	33.2	21%	0.211	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-46.5	179.9	-69.9	178	-67.8	176.1	-2.1	113.2	Y649 N656 P657 F658 V659 D673 R682	Y649-R675 VanDerWaalsContact CZ-NH2 3.25Å; N656-R675 VanDerWaalsContact CG-NH1 3.27Å; N656-R675 PolarHBondContact ND2-NH1 3.08Å; N656-R675 PolarHBondContact OD1-NH1 3.45Å; P657-R675 WeakPolarHBondContact O-CG 3.36Å; F658-R675 HydrophobicContact CB-CG 4.11Å; F658-R675 HydrophobicContact CD2-CG 4.46Å; V659-R675 HydrophobicContact CG2-CG 4.25Å; D673-R675 VanDerWaalsContact C-N 3.33Å; D673-R675 WeakPolarHBondContact OD1-CB 3.44Å; D673-R675 WeakPolarHBondContact OD1-CG 3.24Å; D673-R675 IonicContact OD1-CZ 2.85Å; D673-R675 PolarHBondContact OD1-N 2.73Å; D673-R675 VanDerWaalsContact OD1-N 3.11Å; D673-R675 IonicContact OD1-NE 3.98Å; D673-R675 PolarHBondContact OD1-NE 2.83Å; D673-R675 IonicContact OD1-NH2 2.72Å; D673-R675 IonicContact OD2-CZ 3.21Å; D673-R675 IonicContact OD2-NE 3.27Å; D673-R675 PolarHBondContact OD2-NE 3.28Å; D673-R675 IonicContact OD2-NH2 2.68Å; D673-R675 PolarHBondContact OD2-NH2 2.96Å; R675-R682 PolarHBondContact O-NH1 3.11Å
676	K	91.3	Very high	92.5	Very high	120 Å²	120	34.1 Å²	34.1	52%	0.522	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-56.2	178	-75.2	-164.8	171.6	-161.4	0	112.1	N290 Y557 E558	N290-K676 PolarHBondContact OD1-NZ 2.81Å; Y557-K676 WeakPolarHBondContact CA-O 3.45Å; Y557-K676 WeakPolarHBondContact CB-O 3.33Å; E558-K676 PolarHBondContact N-O 3.46Å
677	Y	91.2	Very high	93.2	Very high	73 Å²	73	31.7 Å²	31.7	29%	0.286	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.3	-179.1	-64.2	-96.1	0	0	0	109	E558 G637 A674	E558-Y677 HydrophobicContact CB-CD1 3.95Å; E558-Y677 HydrophobicContact CB-CE1 4.03Å; E558-Y677 HydrophobicContact CG-CD1 4.27Å; E558-Y677 HydrophobicContact CG-CE1 4.09Å; E558-Y677 CarbonylContact O-C 3.56Å; E558-Y677 WeakPolarHBondContact O-CA 3.47Å; E558-Y677 WeakPolarHBondContact OE1-CE1 3.22Å; E558-Y677 WeakPolarHBondContact OE2-CE1 3.35Å; E558-Y677 VanDerWaalsContact OE2-CZ 3.31Å; E558-Y677 PolarHBondContact OE2-OH 2.94Å; E558-Y677 VanDerWaalsContact OE2-OH 3.05Å; G637-Y677 VanDerWaalsContact CA-O 3.25Å; G637-Y677 WeakPolarHBondContact CA-O 3.31Å; A674-Y677 VanDerWaalsContact CA-O 3.25Å; A674-Y677 WeakPolarHBondContact CA-O 3.43Å
678	G	93.9	Very high	93.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172	-164.5	177	0	0	0	0	0	114.5	Y557 E558 E559 A560 R636	Y557-G678 WeakPolarHBondContact CD2-O 3.16Å; Y557-G678 VanDerWaalsContact CE2-O 3.26Å; Y557-G678 WeakPolarHBondContact CE2-O 3.47Å; E558-G678 PolarHBondContact O-N 3.15Å; E559-G678 WeakPolarHBondContact CA-O 3.34Å; A560-G678 PolarHBondContact N-O 3.46Å; R636-G678 WeakPolarHBondContact O-CA 3.31Å
679	N	94.1	Very high	94.1	Very high	2 Å²	2	27 Å²	27	1%	0.011	13%	0.13	C	C	.	.			trans	-136.7	-176.1	175.4	72.4	-13.8	0	0	0	111.9	E634 R636 A681 R682	E634-N679 PolarHBondContact O-ND2 3.33Å; E634-N679 PolarHBondContact O-OD1 2.73Å; R636-N679 HydrophobicContact CB-CB 4.39Å; R636-N679 PolarHBondContact N-OD1 3.28Å; N679-A681 PolarHBondContact O-N 2.99Å; N679-A681 WeakPolarHBondContact OD1-CB 3.38Å; N679-A681 PolarHBondContact OD1-N 3.04Å; N679-R682 WeakPolarHBondContact O-CB 3.44Å; N679-R682 VanDerWaalsContact O-CG 3.25Å; N679-R682 WeakPolarHBondContact O-CG 3.09Å; N679-R682 PolarHBondContact O-N 2.92Å; N679-R682 VanDerWaalsContact O-N 3.08Å
680	E	94.2	Very high	94.2	Very high	58 Å²	58	26 Å²	26	27%	0.271	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-57.4	-25.8	-174.9	-64.9	-143.9	122.5	0	0	114.1	Y608 V610 L620 I633 R682 F683	Y608-E680 HydrophobicContact CE2-CB 4.23Å; Y608-E680 WeakPolarHBondContact CE2-OE2 3.47Å; V610-E680 HydrophobicContact CG2-CB 3.91Å; V610-E680 HydrophobicContact CG2-CG 4.1Å; V610-E680 VanDerWaalsContact CG2-OE1 3.23Å; V610-E680 WeakPolarHBondContact CG2-OE1 3.49Å; V610-E680 VanDerWaalsContact CG2-OE2 3.3Å; V610-E680 WeakPolarHBondContact CG2-OE2 3.02Å; L620-E680 VanDerWaalsContact CD1-O 3.3Å; L620-E680 WeakPolarHBondContact CD1-O 3.35Å; I633-E680 HydrophobicContact CD1-CB 4.31Å; E680-R682 PolarHBondContact O-N 2.77Å; E680-F683 HydrophobicContact CB-CD2 4.42Å; E680-F683 WeakPolarHBondContact O-CD2 3.36Å; E680-F683 PolarHBondContact O-N 3.34Å
681	A	95.2	Very high	94.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-52.4	-26.8	175.9	0	0	0	0	0	112.9	I633 E634 Y635 N679 F683 I684	I633-A681 HydrophobicContact CD1-CB 4.06Å; I633-A681 HydrophobicContact CG2-CB 3.81Å; E634-A681 WeakPolarHBondContact O-CB 3.42Å; Y635-A681 HydrophobicContact CD2-CB 3.51Å; Y635-A681 HydrophobicContact CE2-CB 4.05Å; Y635-A681 VanDerWaalsContact CE2-O 3.26Å; Y635-A681 WeakPolarHBondContact CE2-O 3.19Å; Y635-A681 HydrophobicContact CG-CB 4.02Å; N679-A681 PolarHBondContact O-N 2.99Å; N679-A681 WeakPolarHBondContact OD1-CB 3.38Å; N679-A681 PolarHBondContact OD1-N 3.04Å; A681-F683 PolarHBondContact O-N 2.73Å; A681-F683 VanDerWaalsContact O-N 3.13Å; A681-I684 HydrophobicContact CB-CD1 4.21Å; A681-I684 WeakPolarHBondContact O-CB 3.15Å; A681-I684 WeakPolarHBondContact O-CD1 3.37Å; A681-I684 VanDerWaalsContact O-CG1 3.24Å; A681-I684 WeakPolarHBondContact O-CG1 3.14Å; A681-I684 PolarHBondContact O-N 2.05Å
682	R	94.3	Very high	94.5	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.008	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-54.9	-31.8	178.4	81	-170.2	-157.7	129.5	-0.8	113.3	S554 D555 I556 F658 A674 R675 N679 E680 I684	S554-R682 PolarHBondContact O-NH2 2.89Å; D555-R682 PolarHBondContact O-NH2 3.05Å; I556-R682 PolarHBondContact O-NH2 2.84Å; I556-R682 VanDerWaalsContact O-NH2 3.16Å; F658-R682 HydrophobicContact CB-CB 4.13Å; F658-R682 HydrophobicContact CD1-CB 4.14Å; F658-R682 HydrophobicContact CD1-CG 3.96Å; F658-R682 WeakPolarHBondContact CD1-O 3.1Å; F658-R682 HydrophobicContact CG-CB 4.38Å; F658-R682 HydrophobicContact CG-CG 4.3Å; A674-R682 HydrophobicContact CB-CB 3.75Å; A674-R682 WeakPolarHBondContact O-CD 3.47Å; A674-R682 PolarHBondContact O-NH1 3.15Å; R675-R682 PolarHBondContact O-NH1 3.11Å; N679-R682 WeakPolarHBondContact O-CB 3.44Å; N679-R682 VanDerWaalsContact O-CG 3.25Å; N679-R682 WeakPolarHBondContact O-CG 3.09Å; N679-R682 PolarHBondContact O-N 2.92Å; N679-R682 VanDerWaalsContact O-N 3.08Å; E680-R682 PolarHBondContact O-N 2.77Å; R682-I684 VanDerWaalsContact C-N 3.29Å; R682-I684 PolarHBondContact O-N 3.33Å
683	F	94.4	Very high	94.5	Very high	8 Å²	8	29 Å²	29	4%	0.035	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-76.7	-8.6	-178.4	-52	-61.1	0	0	0	114.3	Y557 V610 R618 G619 L620 F658 E680 A681 R685	Y557-F683 HydrophobicContact CE1-CE2 4.33Å; Y557-F683 AromaticContact CE1-CZ 3.94Å; Y557-F683 HydrophobicContact CE1-CZ 3.94Å; V610-F683 HydrophobicContact CG1-CD2 4.03Å; V610-F683 HydrophobicContact CG1-CG 4.49Å; V610-F683 HydrophobicContact CG2-CD2 3.8Å; V610-F683 HydrophobicContact CG2-CE2 4.45Å; R618-F683 HydrophobicContact CB-CB 4.28Å; R618-F683 HydrophobicContact CB-CD1 3.93Å; R618-F683 HydrophobicContact CB-CG 4.07Å; R618-F683 VanDerWaalsContact CZ-CE1 3.46Å; R618-F683 VanDerWaalsContact NH1-CZ 3.34Å; G619-F683 WeakPolarHBondContact CA-O 3.29Å; L620-F683 HydrophobicContact CD1-CB 3.84Å; F658-F683 HydrophobicContact CD1-CD1 4.43Å; F658-F683 AromaticContact CE1-CD1 3.71Å; F658-F683 HydrophobicContact CE1-CD1 3.71Å; F658-F683 AromaticContact CE1-CE1 3.99Å; F658-F683 HydrophobicContact CE1-CE1 3.99Å; F658-F683 HydrophobicContact CZ-CD1 4.27Å; F658-F683 HydrophobicContact CZ-CE1 4.16Å; E680-F683 HydrophobicContact CB-CD2 4.42Å; E680-F683 WeakPolarHBondContact O-CD2 3.36Å; E680-F683 PolarHBondContact O-N 3.34Å; A681-F683 PolarHBondContact O-N 2.73Å; A681-F683 VanDerWaalsContact O-N 3.13Å; F683-R685 WeakPolarHBondContact O-CG 3.25Å; F683-R685 PolarHBondContact O-N 2.84Å
684	I	95.4	Very high	94.5	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-60.8	123	-179.7	-62.1	166.1	0	0	0	110.9	L620 I633 A681 R682 R686 V716 L730	L620-I684 HydrophobicContact CB-CG1 4.28Å; L620-I684 HydrophobicContact CD1-CG1 4.05Å; L620-I684 HydrophobicContact CD2-CD1 4.18Å; L620-I684 HydrophobicContact CD2-CG1 3.89Å; L620-I684 HydrophobicContact CG-CG1 4.3Å; I633-I684 HydrophobicContact CG2-CD1 4.39Å; A681-I684 HydrophobicContact CB-CD1 4.21Å; A681-I684 WeakPolarHBondContact O-CB 3.15Å; A681-I684 WeakPolarHBondContact O-CD1 3.37Å; A681-I684 VanDerWaalsContact O-CG1 3.24Å; A681-I684 WeakPolarHBondContact O-CG1 3.14Å; A681-I684 PolarHBondContact O-N 2.05Å; R682-I684 VanDerWaalsContact C-N 3.29Å; R682-I684 PolarHBondContact O-N 3.33Å; I684-R686 PolarHBondContact O-NH1 2.81Å; I684-V716 HydrophobicContact CD1-CG1 4.09Å; I684-V716 HydrophobicContact CD1-CG2 3.89Å; I684-L730 HydrophobicContact CB-CD1 4.3Å; I684-L730 HydrophobicContact CG2-CB 4.16Å; I684-L730 HydrophobicContact CG2-CD1 3.84Å; I684-L730 HydrophobicContact CG2-CG 3.65Å
685	R	93.4	Very high	94.4	Very high	52 Å²	52	31.4 Å²	31.4	20%	0.196	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	151.9	-175.2	-49	-163.3	-60.1	-155.4	-2.5	111.1	F613 F683 E727 T729 L730 A746	F613-R685 VanDerWaalsContact CB-NH1 3.3Å; F613-R685 VanDerWaalsContact CD2-NH1 3.34Å; F613-R685 VanDerWaalsContact CG-NH1 3.33Å; F683-R685 WeakPolarHBondContact O-CG 3.25Å; F683-R685 PolarHBondContact O-N 2.84Å; R685-E727 WeakPolarHBondContact CB-OE1 3.5Å; R685-E727 IonicContact CZ-OE1 3.86Å; R685-E727 VanDerWaalsContact CZ-OE1 3.27Å; R685-E727 IonicContact CZ-OE2 2.68Å; R685-E727 IonicContact NE-OE1 3.62Å; R685-E727 PolarHBondContact NE-OE1 3Å; R685-E727 IonicContact NE-OE2 2.71Å; R685-E727 IonicContact NH2-OE1 3.52Å; R685-E727 PolarHBondContact NH2-OE1 3.36Å; R685-E727 VanDerWaalsContact NH2-OE1 3.16Å; R685-E727 IonicContact NH2-OE2 3.29Å; R685-E727 PolarHBondContact NH2-OE2 3.35Å; R685-T729 VanDerWaalsContact O-CA 3.31Å; R685-T729 WeakPolarHBondContact O-CA 3.43Å; R685-T729 WeakPolarHBondContact O-CB 3.38Å; R685-L730 PolarHBondContact O-N 3.04Å; R685-L730 VanDerWaalsContact O-N 3.08Å; R685-A746 HydrophobicContact CB-CB 4Å
686	R	93.6	Very high	94.3	Very high	21 Å²	21	29.2 Å²	29.2	8%	0.079	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.3	-178.7	-72.9	66.8	166.4	163.4	-2.2	111	V659 I684 L730 P731 F732 D733 A746	V659-R686 PolarHBondContact O-NH2 2.7Å; I684-R686 PolarHBondContact O-NH1 2.81Å; R686-L730 CarbonylContact C-O 3.55Å; R686-L730 WeakPolarHBondContact CA-O 3.31Å; R686-P731 WeakPolarHBondContact CG-O 3.39Å; R686-F732 HydrophobicContact CB-CD1 3.73Å; R686-F732 HydrophobicContact CB-CD2 3.99Å; R686-F732 HydrophobicContact CB-CE1 3.38Å; R686-F732 HydrophobicContact CB-CE2 3.69Å; R686-F732 HydrophobicContact CB-CG 4.03Å; R686-F732 HydrophobicContact CB-CZ 3.37Å; R686-F732 HydrophobicContact CG-CD1 4.29Å; R686-F732 HydrophobicContact CG-CE1 4.28Å; R686-F732 WeakPolarHBondContact O-CE2 3.23Å; R686-F732 WeakPolarHBondContact O-CZ 3.39Å; R686-D733 IonicContact NE-OD1 3.28Å; R686-D733 PolarHBondContact NE-OD1 2.71Å; R686-D733 IonicContact NE-OD2 3.58Å; R686-D733 IonicContact NH2-OD1 3.76Å; R686-D733 IonicContact NH2-OD2 2.69Å; R686-D733 PolarHBondContact NH2-OD2 3.11Å; R686-A746 WeakPolarHBondContact O-CB 3.48Å; R686-A746 PolarHBondContact O-N 2.7Å
687	S	94.4	Very high	94.1	Very high	5 Å²	5	23.7 Å²	23.7	4%	0.035	12%	0.116	C	C	.	.			trans	-129.9	148.2	-168.7	-178.8	0	0	0	0	113.3	T689 T729 L730 F732 C747	S687-T689 PolarHBondContact O-N 2.91Å; S687-T689 VanDerWaalsContact OG-C 3.3Å; S687-T689 PolarHBondContact OG-N 2.6Å; S687-T689 VanDerWaalsContact OG-N 3.13Å; S687-T689 PolarHBondContact OG-O 3.32Å; S687-T729 VanDerWaalsContact CB-OG1 3.29Å; S687-T729 WeakPolarHBondContact CB-OG1 3Å; S687-L730 PolarHBondContact N-O 2.81Å; S687-F732 WeakPolarHBondContact O-CD2 3.23Å; S687-C747 WeakPolarHBondContact OG-CB 3.41Å
688	C	94.5	Very high	93.9	Very high	32 Å²	32	21.4 Å²	21.4	22%	0.216	11%	0.108	C	C	.	.	S	Bend	trans	-75.9	-14	172.1	77.9	0	0	0	0	112.8	C745 C747 P753 I754	C688-C745 VanDerWaalsContact CB-SG 3.59Å; C688-C745 PolarHBondContact N-SG 3.34Å; C688-C747 HydrophobicContact CB-CB 4.2Å; C688-C747 WeakPolarHBondContact CB-SG 3.41Å; C688-C747 WeakPolarHBondContact SG-CB 3.34Å; C688-C747 CovalentContact SG-SG 2.05Å; C688-C747 PolarHBondContact SG-SG 3.12Å; C688-P753 HydrophobicContact CB-CG 4.19Å; C688-I754 HydrophobicContact CB-CD1 4.27Å; C688-I754 HydrophobicContact CB-CG1 4.5Å
689	T	94.5	Very high	93.2	Very high	59 Å²	59	22 Å²	22	36%	0.362	11%	0.112	S	C	.	.	S	Bend	trans	-140.8	65.9	179.8	51	0	0	0	0	107.5	S687 R720 C747 L749	S687-T689 PolarHBondContact O-N 2.91Å; S687-T689 VanDerWaalsContact OG-C 3.3Å; S687-T689 PolarHBondContact OG-N 2.6Å; S687-T689 VanDerWaalsContact OG-N 3.13Å; S687-T689 PolarHBondContact OG-O 3.32Å; T689-R720 PolarHBondContact O-NH2 2.92Å; T689-C747 VanDerWaalsContact OG1-CB 3.25Å; T689-C747 WeakPolarHBondContact OG1-CB 3.29Å; T689-L749 HydrophobicContact CG2-CD1 4.07Å
690	P	96.3	Very high	92.4	Very high	36 Å²	36	26.3 Å²	26.3	23%	0.234	13%	0.131	C	C	.	.			trans	-62.2	158	-173.8	30.8	-38.4	0	0	0	111.8	R720 L730 P731	P690-R720 PolarHBondContact O-NH1 3.33Å; P690-R720 PolarHBondContact O-NH2 3.3Å; P690-L730 VanDerWaalsContact CB-C 3.49Å; P690-P731 HydrophobicContact CB-CB 4.41Å; P690-P731 HydrophobicContact CG-CB 4.1Å
691	N	96.3	Very high	91.3	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.027	13%	0.133	C	C	.	.	S	Bend	trans	-127.1	-2.4	177.1	56.8	-19.4	0	0	0	113.4	S719 R720 I722 E727 T729	N691-S719 PolarHBondContact O-N 3.29Å; N691-S719 PolarHBondContact O-OG 3.3Å; N691-R720 HydrophobicContact CB-CG 4Å; N691-I722 HydrophobicContact CB-CD1 4.32Å; N691-I722 HydrophobicContact CB-CG1 4.06Å; N691-I722 WeakPolarHBondContact ND2-CG2 3.45Å; N691-E727 PolarHBondContact ND2-O 3.07Å; N691-E727 PolarHBondContact OD1-O 2.95Å; N691-T729 PolarHBondContact N-O 3.28Å; N691-T729 VanDerWaalsContact N-O 3.1Å; N691-T729 WeakPolarHBondContact OD1-CA 3.3Å; N691-T729 PolarHBondContact OD1-N 2.91Å; N691-T729 PolarHBondContact OD1-O 2.86Å; N691-T729 PolarHBondContact OD1-OG1 2.89Å
692	S	97.2	Very high	89.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	160.6	167.4	56.8	0	0	0	0	110.6	V717 S719 T729 P731	S692-V717 CarbonylContact C-O 3.58Å; S692-V717 WeakPolarHBondContact CA-O 3.14Å; S692-V717 VanDerWaalsContact CB-O 3.27Å; S692-V717 WeakPolarHBondContact CB-O 3.29Å; S692-S719 PolarHBondContact N-OG 3.5Å; S692-T729 PolarHBondContact N-O 3.38Å; S692-T729 VanDerWaalsContact OG-C 3.26Å; S692-T729 PolarHBondContact OG-O 2.77Å; S692-P731 VanDerWaalsContact O-CD 3.29Å; S692-P731 WeakPolarHBondContact O-CD 3.19Å
693	E	95.9	Very high	88.6	Confident	59 Å²	59	35.2 Å²	35.2	28%	0.276	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	167.9	175.1	61.9	-171.9	-144.5	0	0	110.1	R695 V716 V717 S719	E693-R695 IonicContact OE1-CZ 3.89Å; E693-R695 VanDerWaalsContact OE1-CZ 3.24Å; E693-R695 IonicContact OE1-NE 2.67Å; E693-R695 PolarHBondContact OE1-NE 2.84Å; E693-R695 IonicContact OE1-NH2 3.17Å; E693-R695 PolarHBondContact OE1-NH2 3.27Å; E693-V716 WeakPolarHBondContact O-CA 3.22Å; E693-V717 HydrophobicContact CG-CB 4.44Å; E693-V717 PolarHBondContact N-O 3.16Å; E693-V717 PolarHBondContact O-N 2.81Å; E693-S719 WeakPolarHBondContact OE2-CB 3.16Å
694	V	95.8	Very high	87	Confident	21 Å²	21	43.9 Å²	43.9	13%	0.127	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.6	173.5	-175.4	0	0	0	0	109	L660 Y662 L714 I715 L730	L660-V694 HydrophobicContact CD1-CG2 4.36Å; L660-V694 HydrophobicContact CD2-CG1 4.42Å; L660-V694 HydrophobicContact CD2-CG2 4.19Å; Y662-V694 HydrophobicContact CD2-CB 4.24Å; Y662-V694 HydrophobicContact CD2-CG1 4.06Å; Y662-V694 HydrophobicContact CE2-CB 3.96Å; Y662-V694 HydrophobicContact CE2-CG1 3.83Å; Y662-V694 WeakPolarHBondContact CE2-O 3.25Å; Y662-V694 PolarHBondContact OH-O 2.93Å; V694-L714 HydrophobicContact CG1-CB 4.13Å; V694-L714 HydrophobicContact CG1-CD2 4.47Å; V694-I715 WeakPolarHBondContact CA-O 3.4Å; V694-L730 HydrophobicContact CG2-CD1 4Å; V694-L730 HydrophobicContact CG2-CD2 3.66Å
695	R	93.8	Very high	85.5	Confident	49 Å²	49	51.2 Å²	51.2	19%	0.185	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	166.1	169.6	-66.6	-178.3	173.8	-101.3	-24.3	109.6	D591 I593 E693 I715 V717	D591-R695 IonicContact OD1-CZ 3.27Å; D591-R695 IonicContact OD1-NH1 2.71Å; D591-R695 PolarHBondContact OD1-NH1 3.11Å; D591-R695 IonicContact OD1-NH2 2.78Å; D591-R695 PolarHBondContact OD1-NH2 2.87Å; I593-R695 HydrophobicContact CD1-CB 3.95Å; I593-R695 HydrophobicContact CG1-CB 3.65Å; I593-R695 HydrophobicContact CG1-CG 4.32Å; E693-R695 IonicContact OE1-CZ 3.89Å; E693-R695 VanDerWaalsContact OE1-CZ 3.24Å; E693-R695 IonicContact OE1-NE 2.67Å; E693-R695 PolarHBondContact OE1-NE 2.84Å; E693-R695 IonicContact OE1-NH2 3.17Å; E693-R695 PolarHBondContact OE1-NH2 3.27Å; R695-I715 PolarHBondContact N-O 2.99Å; R695-I715 PolarHBondContact O-N 2.7Å; R695-V717 HydrophobicContact CB-CG2 4.47Å; R695-V717 HydrophobicContact CG-CG2 4.41Å
696	H	91.7	Very high	84.1	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.051	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	156.3	173	61.1	-85.8	0	0	0	110.5	G592 I593 Y662 F665 L712 R713 L714	G592-H696 WeakPolarHBondContact CA-O 3.47Å; I593-H696 PolarHBondContact N-O 3.41Å; Y662-H696 HydrophobicContact CE1-CB 4.19Å; Y662-H696 AromaticContact CE1-ND1 3.88Å; Y662-H696 AromaticContact CZ-ND1 3.85Å; Y662-H696 PolarHBondContact OH-N 3.25Å; Y662-H696 PolarHBondContact OH-ND1 2.96Å; F665-H696 HydrophobicContact CD2-CB 4.31Å; F665-H696 AromaticContact CD2-CD2 3.61Å; F665-H696 AromaticContact CD2-CG 3.78Å; F665-H696 AromaticContact CD2-NE2 3.82Å; F665-H696 AromaticContact CE2-CD2 3.58Å; F665-H696 AromaticContact CE2-NE2 3.96Å; H696-L712 HydrophobicContact CB-CD1 4.01Å; H696-R713 VanDerWaalsContact CA-O 3.31Å; H696-R713 WeakPolarHBondContact CA-O 3.11Å; H696-L714 HydrophobicContact CB-CD2 3.85Å
697	C	87.3	Confident	82.8	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.027	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	163	158.1	77.1	0	0	0	0	109.5	I593 N595 I598 R713	I593-C697 WeakPolarHBondContact O-CB 3.32Å; N595-C697 WeakPolarHBondContact OD1-CB 3.28Å; N595-C697 PolarHBondContact OD1-SG 2.76Å; N595-C697 VanDerWaalsContact OD1-SG 3.37Å; I598-C697 HydrophobicContact CD1-CB 3.87Å; I598-C697 WeakPolarHBondContact CD1-SG 3.47Å; C697-R713 PolarHBondContact N-O 3.16Å; C697-R713 PolarHBondContact O-N 3.37Å
698	I	85.9	Confident	81.6	Confident	24 Å²	24	57 Å²	57	12%	0.123	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	105.5	172.5	-57.3	175	0	0	0	105.8	F577 F580 N595 F665 F700 P710	F577-I698 HydrophobicContact CE1-CD1 4.47Å; F577-I698 HydrophobicContact CE1-CG2 4.11Å; F580-I698 HydrophobicContact CB-CD1 4.48Å; F580-I698 HydrophobicContact CD1-CD1 4.1Å; F580-I698 HydrophobicContact CD2-CD1 3.74Å; F580-I698 HydrophobicContact CE1-CD1 4.22Å; F580-I698 HydrophobicContact CE2-CD1 3.86Å; F580-I698 HydrophobicContact CG-CD1 3.87Å; F580-I698 HydrophobicContact CZ-CD1 4.1Å; N595-I698 PolarHBondContact ND2-O 3.47Å; F665-I698 HydrophobicContact CE2-CD1 4.33Å; F665-I698 HydrophobicContact CZ-CD1 4.07Å; I698-F700 HydrophobicContact CG2-CE2 4.25Å; I698-F700 HydrophobicContact CG2-CZ 4.24Å; I698-P710 HydrophobicContact CG2-CB 3.82Å
699	S	79.9	Confident	80.5	Confident	12 Å²	12	57.4 Å²	57.4	8%	0.084	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.3	174.8	62.8	0	0	0	0	108.9	H711 R713	S699-H711 PolarHBondContact N-O 2.79Å; S699-H711 PolarHBondContact O-N 2.64Å; S699-H711 PolarHBondContact OG-O 3.17Å; S699-R713 PolarHBondContact OG-NE 2.67Å; S699-R713 PolarHBondContact OG-NH2 2.69Å; S699-R713 VanDerWaalsContact OG-NH2 3.11Å
700	F	77.2	Confident	79.7	Confident	94 Å²	94	55.7 Å²	55.7	41%	0.412	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	137.1	168.3	-56.4	-95.7	0	0	0	108.7	T581 I698 P708 V709 P710	T581-F700 HydrophobicContact CG2-CE1 3.8Å; T581-F700 HydrophobicContact CG2-CZ 3.7Å; I698-F700 HydrophobicContact CG2-CE2 4.25Å; I698-F700 HydrophobicContact CG2-CZ 4.24Å; F700-P708 HydrophobicContact CB-CB 4.5Å; F700-P708 HydrophobicContact CD1-CB 4.47Å; F700-V709 WeakPolarHBondContact CA-O 3.2Å; F700-P710 HydrophobicContact CD1-CB 3.73Å; F700-P710 HydrophobicContact CE1-CB 3.69Å; F700-P710 HydrophobicContact CE1-CG 4.39Å; F700-P710 HydrophobicContact CZ-CB 4.43Å
701	S	70.4	Confident	79	Confident	44 Å²	44	57.4 Å²	57.4	31%	0.308	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.8	164	39	0	0	0	0	109.3	D703 P708 V709 H711	S701-D703 PolarHBondContact O-N 2.99Å; S701-D703 VanDerWaalsContact O-N 3.12Å; S701-P708 CarbonylContact O-C 3.56Å; S701-P708 WeakPolarHBondContact O-CA 3.11Å; S701-V709 PolarHBondContact N-O 2.76Å; S701-V709 PolarHBondContact O-N 2.92Å; S701-H711 PolarHBondContact OG-CD2 3.17Å; S701-H711 PolarHBondContact OG-NE2 3.3Å; S701-H711 VanDerWaalsContact OG-NE2 3.16Å
702	D	65	Low	78.7	Confident	129 Å²	129	57.4 Å²	57.4	69%	0.69	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	90.7	-178.8	-57.4	-55.1	0	0	0	109.9	Q704 P708	D702-Q704 PolarHBondContact O-N 3.43Å; D702-P708 WeakPolarHBondContact OD1-CB 3.41Å
703	D	67.5	Low	78.4	Confident	73 Å²	73	62 Å²	62	39%	0.39	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	118.5	171.6	-76.9	-20.2	0	0	0	108.3	S701 H705 N706 G707 V709	S701-D703 PolarHBondContact O-N 2.99Å; S701-D703 VanDerWaalsContact O-N 3.12Å; D703-H705 PolarHBondContact O-N 3.25Å; D703-N706 HydrophobicContact CB-CB 4.36Å; D703-N706 PolarHBondContact O-N 3.14Å; D703-G707 PolarHBondContact N-O 3.13Å; D703-G707 PolarHBondContact O-N 2.82Å; D703-V709 HydrophobicContact CB-CG2 4.07Å; D703-V709 VanDerWaalsContact OD2-CG2 3.3Å; D703-V709 WeakPolarHBondContact OD2-CG2 3.49Å
704	Q	61.7	Low	78.4	Confident	190 Å²	190	59.2 Å²	59.2	89%	0.888	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-13.1	-166.9	-62.6	-176.6	11.4	0	0	115.1	D702	D702-Q704 PolarHBondContact O-N 3.43Å
705	H	63.1	Low	78.3	Confident	155 Å²	155	58.3 Å²	58.3	72%	0.718	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-26.4	177	-58.6	-71.3	0	0	0	113.9	D703	D703-H705 PolarHBondContact O-N 3.25Å
706	N	63.4	Low	78.4	Confident	88 Å²	88	56 Å²	56	47%	0.471	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-3.5	-171.9	-68.9	20.2	0	0	0	113.7	D703 V709 D2079	D703-N706 HydrophobicContact CB-CB 4.36Å; D703-N706 PolarHBondContact O-N 3.14Å; N706-V709 HydrophobicContact CB-CG2 4.26Å; N706-D2079 VanDerWaalsContact ND2-CG 3.25Å; N706-D2079 PolarHBondContact ND2-OD2 2.76Å; N706-D2079 VanDerWaalsContact ND2-OD2 3.16Å
707	G	67.6	Low	78.6	Confident	29 Å²	29	55.6 Å²	55.6	30%	0.299	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	82.6	-161.4	-178.6	0	0	0	0	0	113.5	D703 V709	D703-G707 PolarHBondContact N-O 3.13Å; D703-G707 PolarHBondContact O-N 2.82Å; G707-V709 PolarHBondContact O-N 3.25Å
708	P	69.8	Low	79	Confident	82 Å²	82	55.5 Å²	55.5	53%	0.532	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	96.2	-177.1	27.5	-34.3	0	0	0	111.1	F700 S701 D702 P710	F700-P708 HydrophobicContact CB-CB 4.5Å; F700-P708 HydrophobicContact CD1-CB 4.47Å; S701-P708 CarbonylContact O-C 3.56Å; S701-P708 WeakPolarHBondContact O-CA 3.11Å; D702-P708 WeakPolarHBondContact OD1-CB 3.41Å; P708-P710 VanDerWaalsContact O-CD 3.28Å; P708-P710 WeakPolarHBondContact O-CD 3.25Å
709	V	70	Confident	79.5	Confident	42 Å²	42	56.8 Å²	56.8	26%	0.255	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	120	176.9	178.9	0	0	0	0	109.7	F700 S701 D703 N706 G707 H711	F700-V709 WeakPolarHBondContact CA-O 3.2Å; S701-V709 PolarHBondContact N-O 2.76Å; S701-V709 PolarHBondContact O-N 2.92Å; D703-V709 HydrophobicContact CB-CG2 4.07Å; D703-V709 VanDerWaalsContact OD2-CG2 3.3Å; D703-V709 WeakPolarHBondContact OD2-CG2 3.49Å; N706-V709 HydrophobicContact CB-CG2 4.26Å; G707-V709 PolarHBondContact O-N 3.25Å; V709-H711 PolarHBondContact O-CD2 2.96Å; V709-H711 VanDerWaalsContact O-CD2 3.25Å; V709-H711 PolarHBondContact O-N 3.26Å
710	P	77.2	Confident	80.2	Confident	22 Å²	22	61.8 Å²	61.8	14%	0.143	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	108.7	-179.9	29.7	-34.6	0	0	0	113.3	F577 I698 F700 P708	F577-P710 HydrophobicContact CD1-CB 3.83Å; F577-P710 HydrophobicContact CD1-CG 3.75Å; F577-P710 HydrophobicContact CD2-CB 4.29Å; F577-P710 HydrophobicContact CD2-CG 3.3Å; F577-P710 HydrophobicContact CE1-CB 3.5Å; F577-P710 VanDerWaalsContact CE1-CB 3.5Å; F577-P710 HydrophobicContact CE1-CG 3.53Å; F577-P710 HydrophobicContact CE2-CB 4.04Å; F577-P710 HydrophobicContact CE2-CG 3.1Å; F577-P710 HydrophobicContact CG-CB 4.24Å; F577-P710 HydrophobicContact CG-CG 3.66Å; F577-P710 HydrophobicContact CZ-CB 3.59Å; F577-P710 HydrophobicContact CZ-CG 3.19Å; I698-P710 HydrophobicContact CG2-CB 3.82Å; F700-P710 HydrophobicContact CD1-CB 3.73Å; F700-P710 HydrophobicContact CE1-CB 3.69Å; F700-P710 HydrophobicContact CE1-CG 4.39Å; F700-P710 HydrophobicContact CZ-CB 4.43Å; P708-P710 VanDerWaalsContact O-CD 3.28Å; P708-P710 WeakPolarHBondContact O-CD 3.25Å
711	H	82.6	Confident	81.2	Confident	72 Å²	72	61 Å²	61	33%	0.333	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	117.2	174.3	-62.5	-92.9	0	0	0	111.4	S699 S701 V709	S699-H711 PolarHBondContact N-O 2.79Å; S699-H711 PolarHBondContact O-N 2.64Å; S699-H711 PolarHBondContact OG-O 3.17Å; S701-H711 PolarHBondContact OG-CD2 3.17Å; S701-H711 PolarHBondContact OG-NE2 3.3Å; S701-H711 VanDerWaalsContact OG-NE2 3.16Å; V709-H711 PolarHBondContact O-CD2 2.96Å; V709-H711 VanDerWaalsContact O-CD2 3.25Å; V709-H711 PolarHBondContact O-N 3.26Å
712	L	90.3	Very high	82.4	Confident	5 Å²	5	59 Å²	59	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	121.8	166.8	172.9	61.6	0	0	0	109.7	L563 L565 L573 F665 L670 H696	L563-L712 HydrophobicContact CD2-CD2 4.42Å; L563-L712 HydrophobicContact CD2-CG 4.18Å; L563-L712 WeakPolarHBondContact CD2-O 3.49Å; L565-L712 HydrophobicContact CD2-CB 4.45Å; L565-L712 HydrophobicContact CD2-CD2 4.41Å; L573-L712 HydrophobicContact CD1-CB 4.34Å; L573-L712 HydrophobicContact CD1-CD2 4.09Å; F665-L712 HydrophobicContact CD2-CD1 4.08Å; F665-L712 HydrophobicContact CE2-CD1 3.61Å; F665-L712 HydrophobicContact CE2-CD2 4.48Å; L670-L712 HydrophobicContact CD1-CD2 3.67Å; H696-L712 HydrophobicContact CB-CD1 4.01Å
713	R	91.4	Very high	83.9	Confident	98 Å²	98	55.9 Å²	55.9	37%	0.37	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	148.2	170.3	-48.7	-172.7	-164.4	-145.1	0.2	110.4	E634 H696 C697 S699 I715	E634-R713 WeakPolarHBondContact OE1-CB 3.31Å; H696-R713 VanDerWaalsContact CA-O 3.31Å; H696-R713 WeakPolarHBondContact CA-O 3.11Å; C697-R713 PolarHBondContact N-O 3.16Å; C697-R713 PolarHBondContact O-N 3.37Å; S699-R713 PolarHBondContact OG-NE 2.67Å; S699-R713 PolarHBondContact OG-NH2 2.69Å; S699-R713 VanDerWaalsContact OG-NH2 3.11Å; R713-I715 HydrophobicContact CB-CG1 4.48Å
714	L	94.3	Very high	85.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116.4	178.1	-66.5	173.1	0	0	0	108.7	L563 E634 Y635 Y662 V672 V694 H696	L563-L714 HydrophobicContact CD1-CD1 4.37Å; L563-L714 HydrophobicContact CD2-CD1 3.85Å; L563-L714 HydrophobicContact CD2-CG 4Å; E634-L714 CarbonylContact C-O 3.58Å; E634-L714 WeakPolarHBondContact CA-O 3.26Å; E634-L714 WeakPolarHBondContact CG-O 3.29Å; Y635-L714 PolarHBondContact N-O 2.84Å; Y662-L714 HydrophobicContact CD1-CD2 3.76Å; Y662-L714 HydrophobicContact CE1-CD2 3.69Å; Y662-L714 HydrophobicContact CE2-CD2 4.49Å; Y662-L714 HydrophobicContact CG-CD2 4.18Å; V672-L714 HydrophobicContact CG2-CD1 3.5Å; V694-L714 HydrophobicContact CG1-CB 4.13Å; V694-L714 HydrophobicContact CG1-CD2 4.47Å; H696-L714 HydrophobicContact CB-CD2 3.85Å
715	I	94.5	Very high	86.8	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.3	-165.8	-62.6	173.7	0	0	0	109.9	I593 I598 L602 P631 V694 R695 R713 V717	I593-I715 HydrophobicContact CD1-CB 3.75Å; I593-I715 HydrophobicContact CD1-CD1 4.15Å; I593-I715 HydrophobicContact CD1-CG2 3.69Å; I598-I715 HydrophobicContact CB-CD1 4.46Å; I598-I715 HydrophobicContact CD1-CD1 3.47Å; I598-I715 VanDerWaalsContact CD1-CD1 3.47Å; I598-I715 HydrophobicContact CG1-CD1 3.76Å; I598-I715 HydrophobicContact CG2-CD1 3.82Å; L602-I715 HydrophobicContact CD2-CG2 4.36Å; P631-I715 HydrophobicContact CB-CG2 3.9Å; V694-I715 WeakPolarHBondContact CA-O 3.4Å; R695-I715 PolarHBondContact N-O 2.99Å; R695-I715 PolarHBondContact O-N 2.7Å; R713-I715 HydrophobicContact CB-CG1 4.48Å; I715-V717 HydrophobicContact CG2-CG2 4.06Å
716	V	95.8	Very high	88.3	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.1	174.4	-175.7	0	0	0	0	108.8	I632 I633 Y635 I684 E693 L730	I632-V716 WeakPolarHBondContact CB-O 3.27Å; I632-V716 HydrophobicContact CD1-CG1 4.36Å; I632-V716 PolarHBondContact N-O 3.06Å; I633-V716 HydrophobicContact CG2-CB 3.99Å; I633-V716 HydrophobicContact CG2-CG2 3.89Å; I633-V716 PolarHBondContact O-N 2.68Å; Y635-V716 HydrophobicContact CD2-CG2 4.39Å; I684-V716 HydrophobicContact CD1-CG1 4.09Å; I684-V716 HydrophobicContact CD1-CG2 3.89Å; E693-V716 WeakPolarHBondContact O-CA 3.22Å; V716-L730 HydrophobicContact CG1-CD2 4.41Å
717	V	95.5	Very high	89.8	Confident	3 Å²	3	46 Å²	46	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.6	-175.5	178.5	0	0	0	0	109.7	I593 R629 S692 E693 R695 I715 S719	I593-V717 HydrophobicContact CD1-CG2 3.48Å; I593-V717 VanDerWaalsContact CD1-CG2 3.48Å; I593-V717 HydrophobicContact CG1-CG2 4.4Å; R629-V717 VanDerWaalsContact C-CG1 3.44Å; R629-V717 WeakPolarHBondContact O-CG1 3.16Å; S692-V717 CarbonylContact C-O 3.58Å; S692-V717 WeakPolarHBondContact CA-O 3.14Å; S692-V717 VanDerWaalsContact CB-O 3.27Å; S692-V717 WeakPolarHBondContact CB-O 3.29Å; E693-V717 HydrophobicContact CG-CB 4.44Å; E693-V717 PolarHBondContact N-O 3.16Å; E693-V717 PolarHBondContact O-N 2.81Å; R695-V717 HydrophobicContact CB-CG2 4.47Å; R695-V717 HydrophobicContact CG-CG2 4.41Å; I715-V717 HydrophobicContact CG2-CG2 4.06Å; V717-S719 PolarHBondContact O-N 3.13Å
718	A	96.9	Very high	91.2	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.008	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	120.8	173.7	0	0	0	0	0	111.2	I626 C627 P628 R629 T630 I632 I722	I626-A718 HydrophobicContact CG2-CB 3.84Å; C627-A718 WeakPolarHBondContact O-CB 3.3Å; P628-A718 CarbonylContact C-O 3.47Å; P628-A718 WeakPolarHBondContact CA-O 3.4Å; R629-A718 PolarHBondContact N-O 2.95Å; T630-A718 PolarHBondContact O-N 2.84Å; I632-A718 HydrophobicContact CD1-CB 4.22Å; A718-I722 HydrophobicContact CB-CD1 3.98Å; A718-I722 HydrophobicContact CB-CG1 4.13Å
719	S	95.6	Very high	92.5	Very high	51 Å²	51	41 Å²	41	36%	0.357	22%	0.218	S	C	.	.	S	Bend	trans	-89.4	-11.8	178.4	59.6	0	0	0	0	113.5	N691 S692 E693 V717	N691-S719 PolarHBondContact O-N 3.29Å; N691-S719 PolarHBondContact O-OG 3.3Å; S692-S719 PolarHBondContact N-OG 3.5Å; E693-S719 WeakPolarHBondContact OE2-CB 3.16Å; V717-S719 PolarHBondContact O-N 3.13Å
720	R	95.3	Very high	93.8	Very high	117 Å²	117	39.2 Å²	39.2	44%	0.442	21%	0.207	S	C	.	.	S	Bend	trans	-150.3	174.8	165.7	60.9	167.5	179.3	-94.4	-7.7	108.9	T689 P690 N691 I722	T689-R720 PolarHBondContact O-NH2 2.92Å; P690-R720 PolarHBondContact O-NH1 3.33Å; P690-R720 PolarHBondContact O-NH2 3.3Å; N691-R720 HydrophobicContact CB-CG 4Å; R720-I722 PolarHBondContact O-N 2.88Å
721	V	96.6	Very high	94.6	Very high	79 Å²	79	41 Å²	41	48%	0.479	22%	0.219	S	C	.	.			trans	-52.2	126.5	170.3	-178.3	0	0	0	0	109.5	I626 P628	I626-V721 CarbonylContact O-C 3.25Å; I626-V721 WeakPolarHBondContact O-CA 3.32Å; P628-V721 HydrophobicContact CG-CG2 4.14Å
722	I	97.1	Very high	95.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-107.3	104.7	171.3	-50	-175.7	0	0	0	107.3	A622 D625 I626 I632 N691 A718 R720 I728	A622-I722 HydrophobicContact CB-CG2 3.81Å; D625-I722 CarbonylContact C-O 3.48Å; D625-I722 WeakPolarHBondContact CA-O 3.46Å; I626-I722 HydrophobicContact CB-CB 4.17Å; I626-I722 PolarHBondContact N-O 3.39Å; I626-I722 PolarHBondContact O-N 2.97Å; I632-I722 HydrophobicContact CD1-CD1 3.8Å; N691-I722 HydrophobicContact CB-CD1 4.32Å; N691-I722 HydrophobicContact CB-CG1 4.06Å; N691-I722 WeakPolarHBondContact ND2-CG2 3.45Å; A718-I722 HydrophobicContact CB-CD1 3.98Å; A718-I722 HydrophobicContact CB-CG1 4.13Å; R720-I722 PolarHBondContact O-N 2.88Å; I722-I728 HydrophobicContact CD1-CG1 4.21Å; I722-I728 HydrophobicContact CD1-CG2 4.45Å; I722-I728 HydrophobicContact CG2-CG1 4.29Å
723	P	96.5	Very high	95.3	Very high	65 Å²	65	40.2 Å²	40.2	42%	0.422	22%	0.216	S	C	.	.			trans	-63.1	149.7	177.9	-24.3	34.8	0	0	0	112.5	D625 S726	D625-P723 WeakPolarHBondContact OD1-CA 3.47Å; P723-S726 WeakPolarHBondContact O-CA 3.19Å; P723-S726 WeakPolarHBondContact O-CB 3.33Å; P723-S726 PolarHBondContact O-N 2.94Å
724	K	95.8	Very high	95.2	Very high	128 Å²	128	36.2 Å²	36.2	56%	0.557	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	139.4	169.7	-177.5	172.4	-174.8	119.2	0	110.6	N623 E624 D625 S726	N623-K724 WeakPolarHBondContact O-CD 3.49Å; N623-K724 WeakPolarHBondContact O-CE 3.26Å; N623-K724 WeakPolarHBondContact O-CG 3.44Å; N623-K724 PolarHBondContact O-NZ 3.35Å; E624-K724 WeakPolarHBondContact O-CA 3.5Å; E624-K724 PolarHBondContact O-N 3.43Å; D625-K724 PolarHBondContact OD1-N 2.81Å; K724-S726 PolarHBondContact O-N 3.33Å
725	S	93.8	Very high	95	Very high	100 Å²	100	39.3 Å²	39.3	70%	0.699	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	2.9	-171.6	75.7	0	0	0	0	116.6	I621 A622	I621-S725 VanDerWaalsContact CG2-CA 3.48Å; A622-S725 PolarHBondContact O-N 2.77Å
726	S	94.7	Very high	94.8	Very high	45 Å²	45	42 Å²	42	32%	0.315	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-79.4	149.5	169.6	-164.5	0	0	0	0	111.8	I621 A622 P723 K724	I621-S726 WeakPolarHBondContact CA-O 3.2Å; A622-S726 PolarHBondContact N-O 3.21Å; P723-S726 WeakPolarHBondContact O-CA 3.19Å; P723-S726 WeakPolarHBondContact O-CB 3.33Å; P723-S726 PolarHBondContact O-N 2.94Å; K724-S726 PolarHBondContact O-N 3.33Å
727	E	95.4	Very high	94.6	Very high	24 Å²	24	44.6 Å²	44.6	11%	0.112	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-72.6	134.7	174.9	-171.6	-173.6	165.1	0	0	111	F613 L620 R685 N691 T729	F613-E727 HydrophobicContact CE1-CB 4.45Å; F613-E727 HydrophobicContact CE1-CG 4.46Å; F613-E727 HydrophobicContact CE2-CG 4.21Å; F613-E727 HydrophobicContact CZ-CB 3.93Å; F613-E727 HydrophobicContact CZ-CG 3.65Å; L620-E727 WeakPolarHBondContact O-CA 3.42Å; L620-E727 WeakPolarHBondContact O-CG 3.31Å; R685-E727 WeakPolarHBondContact CB-OE1 3.5Å; R685-E727 IonicContact CZ-OE1 3.86Å; R685-E727 VanDerWaalsContact CZ-OE1 3.27Å; R685-E727 IonicContact CZ-OE2 2.68Å; R685-E727 IonicContact NE-OE1 3.62Å; R685-E727 PolarHBondContact NE-OE1 3Å; R685-E727 IonicContact NE-OE2 2.71Å; R685-E727 IonicContact NH2-OE1 3.52Å; R685-E727 PolarHBondContact NH2-OE1 3.36Å; R685-E727 VanDerWaalsContact NH2-OE1 3.16Å; R685-E727 IonicContact NH2-OE2 3.29Å; R685-E727 PolarHBondContact NH2-OE2 3.35Å; N691-E727 PolarHBondContact ND2-O 3.07Å; N691-E727 PolarHBondContact OD1-O 2.95Å; E727-T729 HydrophobicContact CB-CG2 4.14Å; E727-T729 HydrophobicContact CG-CG2 3.61Å; E727-T729 WeakPolarHBondContact OE1-CG2 3.3Å
728	I	96.8	Very high	94.4	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-84.7	122.9	171.9	-61.4	164.4	0	0	0	107.8	L620 A622 I626 I632 I722	L620-I728 HydrophobicContact CB-CB 4.12Å; L620-I728 HydrophobicContact CB-CD1 4.21Å; L620-I728 PolarHBondContact O-N 2.98Å; A622-I728 HydrophobicContact CB-CD1 4.23Å; A622-I728 HydrophobicContact CB-CG1 4.3Å; I626-I728 HydrophobicContact CD1-CD1 4.26Å; I632-I728 HydrophobicContact CD1-CG2 4.12Å; I632-I728 HydrophobicContact CG2-CD1 4.02Å; I722-I728 HydrophobicContact CD1-CG1 4.21Å; I722-I728 HydrophobicContact CD1-CG2 4.45Å; I722-I728 HydrophobicContact CG2-CG1 4.29Å
729	T	96.9	Very high	94	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.043	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.4	-171.1	66.9	0	0	0	0	113.7	R685 S687 N691 S692 E727 A746	R685-T729 VanDerWaalsContact O-CA 3.31Å; R685-T729 WeakPolarHBondContact O-CA 3.43Å; R685-T729 WeakPolarHBondContact O-CB 3.38Å; S687-T729 VanDerWaalsContact CB-OG1 3.29Å; S687-T729 WeakPolarHBondContact CB-OG1 3Å; N691-T729 PolarHBondContact N-O 3.28Å; N691-T729 VanDerWaalsContact N-O 3.1Å; N691-T729 WeakPolarHBondContact OD1-CA 3.3Å; N691-T729 PolarHBondContact OD1-N 2.91Å; N691-T729 PolarHBondContact OD1-O 2.86Å; N691-T729 PolarHBondContact OD1-OG1 2.89Å; S692-T729 PolarHBondContact N-O 3.38Å; S692-T729 VanDerWaalsContact OG-C 3.26Å; S692-T729 PolarHBondContact OG-O 2.77Å; E727-T729 HydrophobicContact CB-CG2 4.14Å; E727-T729 HydrophobicContact CG-CG2 3.61Å; E727-T729 WeakPolarHBondContact OE1-CG2 3.3Å; T729-A746 HydrophobicContact CG2-CB 3.78Å
730	L	96.5	Very high	93.6	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	159.4	179.7	-76.5	171.6	0	0	0	112.2	L660 I684 R685 R686 S687 P690 V694 V716	L660-L730 HydrophobicContact CD1-CD1 4.42Å; I684-L730 HydrophobicContact CB-CD1 4.3Å; I684-L730 HydrophobicContact CG2-CB 4.16Å; I684-L730 HydrophobicContact CG2-CD1 3.84Å; I684-L730 HydrophobicContact CG2-CG 3.65Å; R685-L730 PolarHBondContact O-N 3.04Å; R685-L730 VanDerWaalsContact O-N 3.08Å; R686-L730 CarbonylContact C-O 3.55Å; R686-L730 WeakPolarHBondContact CA-O 3.31Å; S687-L730 PolarHBondContact N-O 2.81Å; P690-L730 VanDerWaalsContact CB-C 3.49Å; V694-L730 HydrophobicContact CG2-CD1 4Å; V694-L730 HydrophobicContact CG2-CD2 3.66Å; V716-L730 HydrophobicContact CG1-CD2 4.41Å
731	P	95.3	Very high	93.3	Very high	59 Å²	59	50.2 Å²	50.2	38%	0.383	27%	0.265	S	S	.	.			trans	-61.2	168.3	167.7	26.8	-36.2	0	0	0	112.1	R686 P690 S692 D733	R686-P731 WeakPolarHBondContact CG-O 3.39Å; P690-P731 HydrophobicContact CB-CB 4.41Å; P690-P731 HydrophobicContact CG-CB 4.1Å; S692-P731 VanDerWaalsContact O-CD 3.29Å; S692-P731 WeakPolarHBondContact O-CD 3.19Å; P731-D733 PolarHBondContact O-N 3.03Å
732	F	93.7	Very high	92.9	Very high	41 Å²	41	51.3 Å²	51.3	18%	0.18	27%	0.267	C	S	.	.			trans	-77.9	111.3	169.1	-81.9	-86.9	0	0	0	110.7	R686 S687 F734 Y736 V743 C745 I754	R686-F732 HydrophobicContact CB-CD1 3.73Å; R686-F732 HydrophobicContact CB-CD2 3.99Å; R686-F732 HydrophobicContact CB-CE1 3.38Å; R686-F732 HydrophobicContact CB-CE2 3.69Å; R686-F732 HydrophobicContact CB-CG 4.03Å; R686-F732 HydrophobicContact CB-CZ 3.37Å; R686-F732 HydrophobicContact CG-CD1 4.29Å; R686-F732 HydrophobicContact CG-CE1 4.28Å; R686-F732 WeakPolarHBondContact O-CE2 3.23Å; R686-F732 WeakPolarHBondContact O-CZ 3.39Å; S687-F732 WeakPolarHBondContact O-CD2 3.23Å; F732-F734 HydrophobicContact CD1-CE1 4.44Å; F732-F734 HydrophobicContact CD1-CZ 4.19Å; F732-F734 HydrophobicContact CE1-CZ 4.36Å; F732-Y736 HydrophobicContact CB-CD1 4.23Å; F732-Y736 HydrophobicContact CD1-CD1 4.45Å; F732-Y736 HydrophobicContact CG-CD1 4.23Å; F732-V743 HydrophobicContact CD1-CG1 4.2Å; F732-V743 HydrophobicContact CE1-CG1 3.38Å; F732-V743 HydrophobicContact CZ-CG1 4.1Å; F732-C745 HydrophobicContact CE2-CB 4.22Å; F732-C745 HydrophobicContact CZ-CB 4.07Å; F732-I754 HydrophobicContact CD1-CD1 4.44Å; F732-I754 HydrophobicContact CD2-CD1 3.26Å; F732-I754 HydrophobicContact CE1-CD1 4.32Å; F732-I754 HydrophobicContact CE2-CD1 3.08Å; F732-I754 HydrophobicContact CG-CD1 3.97Å; F732-I754 HydrophobicContact CZ-CD1 3.67Å
733	D	92.6	Very high	92.5	Very high	21 Å²	21	51.5 Å²	51.5	11%	0.112	27%	0.268	C	S	.	.			trans	-80.5	-25.6	-176.2	50.6	-34.3	0	0	0	113	L660 F661 K663 R686 P731	L660-D733 WeakPolarHBondContact CA-OD2 3.41Å; F661-D733 HydrophobicContact CB-CB 4.1Å; F661-D733 PolarHBondContact N-OD2 3.13Å; K663-D733 PolarHBondContact NZ-O 2.92Å; R686-D733 IonicContact NE-OD1 3.28Å; R686-D733 PolarHBondContact NE-OD1 2.71Å; R686-D733 IonicContact NE-OD2 3.58Å; R686-D733 IonicContact NH2-OD1 3.76Å; R686-D733 IonicContact NH2-OD2 2.69Å; R686-D733 PolarHBondContact NH2-OD2 3.11Å; P731-D733 PolarHBondContact O-N 3.03Å
734	F	90	Very high	92.1	Very high	14 Å²	14	53 Å²	53	6%	0.061	27%	0.268	C	S	.	.	S	Bend	trans	-113.7	156.6	172.1	61.7	-87.2	0	0	0	111.9	Y651 F661 F732 Y736 C739 V743	Y651-F734 HydrophobicContact CD2-CB 4.24Å; Y651-F734 HydrophobicContact CE2-CB 4.32Å; F661-F734 HydrophobicContact CD2-CB 3.97Å; F661-F734 AromaticContact CD2-CD1 3.93Å; F661-F734 HydrophobicContact CD2-CD1 3.93Å; F661-F734 HydrophobicContact CD2-CG 4.37Å; F661-F734 HydrophobicContact CE2-CB 4.27Å; F661-F734 HydrophobicContact CE2-CD1 4.06Å; F661-F734 HydrophobicContact CE2-CG 4.44Å; F661-F734 HydrophobicContact CG-CB 4.46Å; F732-F734 HydrophobicContact CD1-CE1 4.44Å; F732-F734 HydrophobicContact CD1-CZ 4.19Å; F732-F734 HydrophobicContact CE1-CZ 4.36Å; F734-Y736 PolarHBondContact O-N 3.3Å; F734-C739 VanDerWaalsContact CE2-SG 3.59Å; F734-V743 HydrophobicContact CE2-CG1 4.21Å; F734-V743 HydrophobicContact CE2-CG2 3.83Å; F734-V743 HydrophobicContact CZ-CG1 3.95Å; F734-V743 HydrophobicContact CZ-CG2 4.26Å
735	D	89.6	Confident	92	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.342	25%	0.25	S	C	.	.			trans	-73	100.5	174.9	175.4	20.3	0	0	0	110.6	T737 A738	D735-T737 VanDerWaalsContact CG-OG1 3.29Å; D735-T737 PolarHBondContact O-N 3.44Å; D735-T737 VanDerWaalsContact O-N 3.16Å; D735-T737 WeakPolarHBondContact OD1-CA 3.31Å; D735-T737 VanDerWaalsContact OD1-CB 3.3Å; D735-T737 WeakPolarHBondContact OD1-CB 3.5Å; D735-T737 PolarHBondContact OD1-N 3.23Å; D735-T737 PolarHBondContact OD1-OG1 3.11Å; D735-T737 PolarHBondContact OD2-OG1 3.42Å; D735-T737 VanDerWaalsContact OD2-OG1 3.11Å; D735-A738 HydrophobicContact CB-CB 4.31Å; D735-A738 PolarHBondContact O-N 2.96Å; D735-A738 VanDerWaalsContact O-N 3.15Å; D735-A738 WeakPolarHBondContact OD2-CB 3.5Å; D735-A738 PolarHBondContact OD2-N 2.88Å
736	Y	90.8	Very high	91.9	Very high	58 Å²	58	43.9 Å²	43.9	23%	0.227	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.9	175.7	64.7	-94.5	0	0	0	113.5	F732 F734 I754 W757 F758	F732-Y736 HydrophobicContact CB-CD1 4.23Å; F732-Y736 HydrophobicContact CD1-CD1 4.45Å; F732-Y736 HydrophobicContact CG-CD1 4.23Å; F734-Y736 PolarHBondContact O-N 3.3Å; Y736-I754 HydrophobicContact CD1-CD1 4.08Å; Y736-I754 HydrophobicContact CD1-CG1 4.25Å; Y736-I754 HydrophobicContact CD2-CB 4.38Å; Y736-I754 HydrophobicContact CD2-CG1 4.22Å; Y736-I754 HydrophobicContact CD2-CG2 3.82Å; Y736-I754 HydrophobicContact CE1-CD1 4.01Å; Y736-I754 HydrophobicContact CE1-CG1 3.9Å; Y736-I754 HydrophobicContact CE2-CB 4.23Å; Y736-I754 HydrophobicContact CE2-CG1 3.86Å; Y736-I754 HydrophobicContact CE2-CG2 4.18Å; Y736-I754 HydrophobicContact CG-CD1 4.47Å; Y736-I754 HydrophobicContact CG-CG1 4.4Å; Y736-I754 HydrophobicContact CG-CG2 4.12Å; Y736-W757 HydrophobicContact CE2-CB 4.32Å; Y736-W757 HydrophobicContact CE2-CG 4.39Å; Y736-F758 HydrophobicContact CD2-CE2 4.35Å; Y736-F758 WeakPolarHBondContact O-CZ 3.43Å
737	T	91.4	Very high	91.7	Very high	56 Å²	56	42.6 Å²	42.6	34%	0.344	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-18.1	176	78.6	0	0	0	0	113.3	D735 W757	D735-T737 VanDerWaalsContact CG-OG1 3.29Å; D735-T737 PolarHBondContact O-N 3.44Å; D735-T737 VanDerWaalsContact O-N 3.16Å; D735-T737 WeakPolarHBondContact OD1-CA 3.31Å; D735-T737 VanDerWaalsContact OD1-CB 3.3Å; D735-T737 WeakPolarHBondContact OD1-CB 3.5Å; D735-T737 PolarHBondContact OD1-N 3.23Å; D735-T737 PolarHBondContact OD1-OG1 3.11Å; D735-T737 PolarHBondContact OD2-OG1 3.42Å; D735-T737 VanDerWaalsContact OD2-OG1 3.11Å; T737-W757 VanDerWaalsContact CA-CZ2 3.43Å; T737-W757 HydrophobicContact CG2-CD2 4.11Å; T737-W757 HydrophobicContact CG2-CG 4.23Å; T737-W757 HydrophobicContact CG2-CZ2 4.27Å; T737-W757 WeakPolarHBondContact O-CH2 3.31Å; T737-W757 WeakPolarHBondContact O-CZ2 3.36Å
738	A	90.7	Very high	90.8	Very high	31 Å²	31	47.8 Å²	47.8	26%	0.256	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-16.6	168.7	0	0	0	0	0	113.2	R652 D735	R652-A738 HydrophobicContact CG-CB 4.15Å; D735-A738 HydrophobicContact CB-CB 4.31Å; D735-A738 PolarHBondContact O-N 2.96Å; D735-A738 VanDerWaalsContact O-N 3.15Å; D735-A738 WeakPolarHBondContact OD2-CB 3.5Å; D735-A738 PolarHBondContact OD2-N 2.88Å
739	C	89.4	Confident	90.3	Very high	7 Å²	7	52.4 Å²	52.4	5%	0.047	27%	0.269	C	S	.	.			trans	-71.6	131.9	-177.2	-65.6	0	0	0	0	112.7	F734 Y741 V743	F734-C739 VanDerWaalsContact CE2-SG 3.59Å; C739-Y741 VanDerWaalsContact C-N 3.31Å; C739-Y741 HydrophobicContact CB-CD1 4.38Å; C739-Y741 HydrophobicContact CB-CD2 4.44Å; C739-Y741 HydrophobicContact CB-CE1 4.04Å; C739-Y741 HydrophobicContact CB-CE2 4.09Å; C739-Y741 PolarHBondContact SG-OH 3.41Å; C739-Y741 VanDerWaalsContact SG-OH 3.37Å; C739-V743 HydrophobicContact CB-CG2 3.96Å
740	R	87	Confident	89.6	Confident	212 Å²	212	61 Å²	61	80%	0.8	31%	0.306	S	S	*	.	S	Bend	trans	-82.8	-6.7	175.4	-63.1	-176.6	177.7	-167.9	-0.8	113.9	R652	R652-R740 PolarHBondContact O-N 3.23Å
741	Y	89	Confident	89.2	Confident	40 Å²	40	62.3 Å²	62.3	16%	0.157	32%	0.32	C	S	.	.	S	Bend	trans	-117.1	156.9	-177.7	57.5	-98.1	0	0	0	111.3	Y651 Y655 C739 V743 F758	Y651-Y741 VanDerWaalsContact O-CE1 3.31Å; Y651-Y741 WeakPolarHBondContact O-CE1 3.32Å; Y651-Y741 PolarHBondContact O-OH 3.31Å; Y655-Y741 VanDerWaalsContact CB-CE2 3.48Å; Y655-Y741 HydrophobicContact CD2-CD2 4.49Å; Y655-Y741 AromaticContact CD2-CE2 3.61Å; Y655-Y741 HydrophobicContact CD2-CE2 3.61Å; Y655-Y741 HydrophobicContact CG-CD2 4.4Å; Y655-Y741 AromaticContact CG-CE2 3.9Å; Y655-Y741 HydrophobicContact CG-CE2 3.9Å; C739-Y741 VanDerWaalsContact C-N 3.31Å; C739-Y741 HydrophobicContact CB-CD1 4.38Å; C739-Y741 HydrophobicContact CB-CD2 4.44Å; C739-Y741 HydrophobicContact CB-CE1 4.04Å; C739-Y741 HydrophobicContact CB-CE2 4.09Å; C739-Y741 PolarHBondContact SG-OH 3.41Å; C739-Y741 VanDerWaalsContact SG-OH 3.37Å; Y741-V743 HydrophobicContact CD2-CG2 4.12Å; Y741-V743 HydrophobicContact CE2-CG2 3.63Å; Y741-V743 PolarHBondContact O-N 3.27Å; Y741-V743 VanDerWaalsContact O-N 3.15Å; Y741-F758 WeakPolarHBondContact O-CE1 3.25Å; Y741-F758 VanDerWaalsContact O-CZ 3.31Å; Y741-F758 WeakPolarHBondContact O-CZ 3.4Å
742	L	88.8	Confident	89.1	Confident	101 Å²	101	59.6 Å²	59.6	53%	0.529	30%	0.303	S	S	.	.			trans	-67.4	110.2	178.9	174.6	60.8	0	0	0	112	F758	L742-F758 HydrophobicContact CD1-CB 3.58Å; L742-F758 HydrophobicContact CD1-CD1 3.86Å; L742-F758 HydrophobicContact CD1-CD2 3.87Å; L742-F758 HydrophobicContact CD1-CG 3.46Å; L742-F758 VanDerWaalsContact CD1-CG 3.46Å
743	V	88	Confident	89	Confident	4 Å²	4	61 Å²	61	2%	0.024	32%	0.315	C	S	.	.			trans	-82.4	120.3	169.2	-176.1	0	0	0	0	109	F732 F734 C739 Y741 F758	F732-V743 HydrophobicContact CD1-CG1 4.2Å; F732-V743 HydrophobicContact CE1-CG1 3.38Å; F732-V743 HydrophobicContact CZ-CG1 4.1Å; F734-V743 HydrophobicContact CE2-CG1 4.21Å; F734-V743 HydrophobicContact CE2-CG2 3.83Å; F734-V743 HydrophobicContact CZ-CG1 3.95Å; F734-V743 HydrophobicContact CZ-CG2 4.26Å; C739-V743 HydrophobicContact CB-CG2 3.96Å; Y741-V743 HydrophobicContact CD2-CG2 4.12Å; Y741-V743 HydrophobicContact CE2-CG2 3.63Å; Y741-V743 PolarHBondContact O-N 3.27Å; Y741-V743 VanDerWaalsContact O-N 3.15Å; V743-F758 HydrophobicContact CB-CE2 3.63Å; V743-F758 HydrophobicContact CB-CZ 3.8Å; V743-F758 HydrophobicContact CG2-CE2 4.03Å; V743-F758 HydrophobicContact CG2-CZ 3.69Å
744	K	88.7	Confident	89	Confident	98 Å²	98	60.1 Å²	60.1	43%	0.426	31%	0.311	S	S	.	.			trans	-82.7	147.2	171.6	-78.4	-173.2	173	-169.8	0	110.4
745	C	92.9	Very high	89	Confident	25 Å²	25	62.3 Å²	62.3	17%	0.169	33%	0.325	C	S	.	.			trans	-125.3	134.6	-176.3	175	0	0	0	0	110.9	C688 F732 C747 C752 I754	C688-C745 VanDerWaalsContact CB-SG 3.59Å; C688-C745 PolarHBondContact N-SG 3.34Å; F732-C745 HydrophobicContact CE2-CB 4.22Å; F732-C745 HydrophobicContact CZ-CB 4.07Å; C745-C747 PolarHBondContact O-N 2.96Å; C745-C747 PolarHBondContact SG-SG 3.2Å; C745-C752 VanDerWaalsContact SG-SG 3.68Å; C745-I754 HydrophobicContact CB-CB 4.25Å; C745-I754 HydrophobicContact CB-CD1 4.18Å; C745-I754 HydrophobicContact CB-CG2 4.38Å
746	A	92.4	Very high	89.1	Confident	11 Å²	11	66.2 Å²	66.2	9%	0.091	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.8	-172.8	0	0	0	0	0	114.9	R685 R686 T729 V748	R685-A746 HydrophobicContact CB-CB 4Å; R686-A746 WeakPolarHBondContact O-CB 3.48Å; R686-A746 PolarHBondContact O-N 2.7Å; T729-A746 HydrophobicContact CG2-CB 3.78Å; A746-V748 VanDerWaalsContact O-CG2 3.29Å; A746-V748 WeakPolarHBondContact O-CG2 3.13Å; A746-V748 PolarHBondContact O-N 3.26Å
747	C	89.2	Confident	89.1	Confident	18 Å²	18	65.9 Å²	65.9	12%	0.122	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-5.9	-165.6	61.9	0	0	0	0	117.2	S687 C688 T689 C745 L749	S687-C747 WeakPolarHBondContact OG-CB 3.41Å; C688-C747 HydrophobicContact CB-CB 4.2Å; C688-C747 WeakPolarHBondContact CB-SG 3.41Å; C688-C747 WeakPolarHBondContact SG-CB 3.34Å; C688-C747 CovalentContact SG-SG 2.05Å; C688-C747 PolarHBondContact SG-SG 3.12Å; T689-C747 VanDerWaalsContact OG1-CB 3.25Å; T689-C747 WeakPolarHBondContact OG1-CB 3.29Å; C745-C747 PolarHBondContact O-N 2.96Å; C745-C747 PolarHBondContact SG-SG 3.2Å; C747-L749 HydrophobicContact CB-CG 4.42Å; C747-L749 WeakPolarHBondContact O-CG 3.38Å; C747-L749 PolarHBondContact O-N 2.72Å
748	V	77	Confident	89	Confident	133 Å²	133	63.8 Å²	63.8	81%	0.806	32%	0.32	S	S	*	.			trans	59.4	-17.9	-179.6	-166	0	0	0	0	116	A746 K750	A746-V748 VanDerWaalsContact O-CG2 3.29Å; A746-V748 WeakPolarHBondContact O-CG2 3.13Å; A746-V748 PolarHBondContact O-N 3.26Å; V748-K750 PolarHBondContact O-N 2.84Å
749	L	87.4	Confident	88.9	Confident	97 Å²	97	67.4 Å²	67.4	51%	0.508	33%	0.332	S	S	.	.			trans	-57.4	126.7	-173.6	-60.7	-176.4	0	0	0	113	T689 C747 G751 C752	T689-L749 HydrophobicContact CG2-CD1 4.07Å; C747-L749 HydrophobicContact CB-CG 4.42Å; C747-L749 WeakPolarHBondContact O-CG 3.38Å; C747-L749 PolarHBondContact O-N 2.72Å; L749-G751 PolarHBondContact O-N 2.85Å; L749-C752 VanDerWaalsContact O-CB 3.25Å; L749-C752 WeakPolarHBondContact O-CB 3.15Å; L749-C752 PolarHBondContact O-N 2.8Å
750	K	82.2	Confident	88.8	Confident	187 Å²	187	74.9 Å²	74.9	81%	0.813	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-19.3	171.1	-63.9	171.7	-175.4	164.6	0	113.3	V748	V748-K750 PolarHBondContact O-N 2.84Å
751	G	86.8	Confident	88.7	Confident	31 Å²	31	68.9 Å²	68.9	32%	0.32	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	2.1	176.2	0	0	0	0	0	115.9	L749 R756	L749-G751 PolarHBondContact O-N 2.85Å; G751-R756 WeakPolarHBondContact O-CD 3.39Å; G751-R756 VanDerWaalsContact O-CZ 3.26Å; G751-R756 PolarHBondContact O-NE 3.27Å; G751-R756 PolarHBondContact O-NH1 3.39Å; G751-R756 VanDerWaalsContact O-NH1 3.08Å
752	C	93.5	Very high	88.2	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.02	36%	0.357	C	S	.	.			trans	-48.6	124	-170.9	178.9	0	0	0	0	113.1	C745 L749 I754 T755 R756	C745-C752 VanDerWaalsContact SG-SG 3.68Å; L749-C752 VanDerWaalsContact O-CB 3.25Å; L749-C752 WeakPolarHBondContact O-CB 3.15Å; L749-C752 PolarHBondContact O-N 2.8Å; C752-I754 VanDerWaalsContact C-N 3.29Å; C752-I754 PolarHBondContact O-N 3.35Å; C752-T755 PolarHBondContact O-N 2.95Å; C752-R756 WeakPolarHBondContact O-CB 3.18Å; C752-R756 VanDerWaalsContact O-CG 3.29Å; C752-R756 WeakPolarHBondContact O-CG 3.17Å; C752-R756 PolarHBondContact O-N 2.85Å
753	P	92.6	Very high	87.5	Confident	69 Å²	69	73.4 Å²	73.4	45%	0.448	36%	0.364	S	S	.	.	H	α-helix	trans	-64.2	-33.8	-177.6	24.9	-33.4	0	0	0	112.6	C688 R756 W757	C688-P753 HydrophobicContact CB-CG 4.19Å; P753-R756 WeakPolarHBondContact O-CB 3.23Å; P753-R756 PolarHBondContact O-N 2.74Å; P753-W757 WeakPolarHBondContact O-CB 3.13Å; P753-W757 PolarHBondContact O-N 3.27Å
754	I	92	Very high	86.4	Confident	3 Å²	3	78.8 Å²	78.8	2%	0.015	39%	0.392	C	S	.	.	H	α-helix	trans	-68.5	-51.5	-179.5	-53.5	-177.5	0	0	0	110	C688 F732 Y736 C745 C752 R756 W757 F758	C688-I754 HydrophobicContact CB-CD1 4.27Å; C688-I754 HydrophobicContact CB-CG1 4.5Å; F732-I754 HydrophobicContact CD1-CD1 4.44Å; F732-I754 HydrophobicContact CD2-CD1 3.26Å; F732-I754 HydrophobicContact CE1-CD1 4.32Å; F732-I754 HydrophobicContact CE2-CD1 3.08Å; F732-I754 HydrophobicContact CG-CD1 3.97Å; F732-I754 HydrophobicContact CZ-CD1 3.67Å; Y736-I754 HydrophobicContact CD1-CD1 4.08Å; Y736-I754 HydrophobicContact CD1-CG1 4.25Å; Y736-I754 HydrophobicContact CD2-CB 4.38Å; Y736-I754 HydrophobicContact CD2-CG1 4.22Å; Y736-I754 HydrophobicContact CD2-CG2 3.82Å; Y736-I754 HydrophobicContact CE1-CD1 4.01Å; Y736-I754 HydrophobicContact CE1-CG1 3.9Å; Y736-I754 HydrophobicContact CE2-CB 4.23Å; Y736-I754 HydrophobicContact CE2-CG1 3.86Å; Y736-I754 HydrophobicContact CE2-CG2 4.18Å; Y736-I754 HydrophobicContact CG-CD1 4.47Å; Y736-I754 HydrophobicContact CG-CG1 4.4Å; Y736-I754 HydrophobicContact CG-CG2 4.12Å; C745-I754 HydrophobicContact CB-CB 4.25Å; C745-I754 HydrophobicContact CB-CD1 4.18Å; C745-I754 HydrophobicContact CB-CG2 4.38Å; C752-I754 VanDerWaalsContact C-N 3.29Å; C752-I754 PolarHBondContact O-N 3.35Å; I754-R756 VanDerWaalsContact C-N 3.27Å; I754-R756 PolarHBondContact O-N 3.22Å; I754-W757 WeakPolarHBondContact O-CB 3.47Å; I754-W757 PolarHBondContact O-N 3.24Å; I754-F758 HydrophobicContact CG2-CD2 4.01Å; I754-F758 HydrophobicContact CG2-CE2 3.89Å; I754-F758 WeakPolarHBondContact O-CD2 3.36Å; I754-F758 PolarHBondContact O-N 2.94Å
755	T	90.4	Very high	84.9	Confident	60 Å²	60	77.8 Å²	77.8	37%	0.368	40%	0.397	S	S	.	.	H	α-helix	trans	-58	-40.2	174.2	-52.7	0	0	0	0	111.5	C752 Q759	C752-T755 PolarHBondContact O-N 2.95Å; T755-Q759 WeakPolarHBondContact O-CB 3.18Å; T755-Q759 WeakPolarHBondContact O-CG 3.42Å; T755-Q759 PolarHBondContact O-N 3.07Å
756	R	91.3	Very high	82.6	Confident	146 Å²	146	80.4 Å²	80.4	55%	0.551	41%	0.409	S	S	*	.	H	α-helix	trans	-64.4	-38.3	174	-75.5	170.1	167.2	178.3	-8	112.8	G751 C752 P753 I754 Q759 R760	G751-R756 WeakPolarHBondContact O-CD 3.39Å; G751-R756 VanDerWaalsContact O-CZ 3.26Å; G751-R756 PolarHBondContact O-NE 3.27Å; G751-R756 PolarHBondContact O-NH1 3.39Å; G751-R756 VanDerWaalsContact O-NH1 3.08Å; C752-R756 WeakPolarHBondContact O-CB 3.18Å; C752-R756 VanDerWaalsContact O-CG 3.29Å; C752-R756 WeakPolarHBondContact O-CG 3.17Å; C752-R756 PolarHBondContact O-N 2.85Å; P753-R756 WeakPolarHBondContact O-CB 3.23Å; P753-R756 PolarHBondContact O-N 2.74Å; I754-R756 VanDerWaalsContact C-N 3.27Å; I754-R756 PolarHBondContact O-N 3.22Å; R756-Q759 PolarHBondContact O-N 2.88Å; R756-R760 WeakPolarHBondContact O-CB 3.44Å; R756-R760 PolarHBondContact O-N 2.94Å
757	W	91.1	Very high	80.1	Confident	52 Å²	52	84.9 Å²	84.9	20%	0.197	44%	0.437	C	S	.	.	H	α-helix	trans	-63.3	-51.4	176.3	-172.7	92.6	0	0	0	110.9	Y736 T737 P753 I754 Q759 R760 M761	Y736-W757 HydrophobicContact CE2-CB 4.32Å; Y736-W757 HydrophobicContact CE2-CG 4.39Å; T737-W757 VanDerWaalsContact CA-CZ2 3.43Å; T737-W757 HydrophobicContact CG2-CD2 4.11Å; T737-W757 HydrophobicContact CG2-CG 4.23Å; T737-W757 HydrophobicContact CG2-CZ2 4.27Å; T737-W757 WeakPolarHBondContact O-CH2 3.31Å; T737-W757 WeakPolarHBondContact O-CZ2 3.36Å; P753-W757 WeakPolarHBondContact O-CB 3.13Å; P753-W757 PolarHBondContact O-N 3.27Å; I754-W757 WeakPolarHBondContact O-CB 3.47Å; I754-W757 PolarHBondContact O-N 3.24Å; W757-Q759 VanDerWaalsContact C-N 3.34Å; W757-Q759 PolarHBondContact O-N 2.94Å; W757-R760 WeakPolarHBondContact O-CB 3.38Å; W757-R760 PolarHBondContact O-N 3.26Å; W757-R760 VanDerWaalsContact O-N 3.1Å; W757-M761 HydrophobicContact CD2-CG 3.91Å; W757-M761 HydrophobicContact CE3-CG 3.9Å; W757-M761 HydrophobicContact CH2-CE 3.8Å; W757-M761 HydrophobicContact CH2-CG 3.64Å; W757-M761 HydrophobicContact CH2-SD 4.23Å; W757-M761 HydrophobicContact CZ2-CE 3.85Å; W757-M761 HydrophobicContact CZ2-CG 3.63Å; W757-M761 HydrophobicContact CZ2-SD 3.87Å; W757-M761 HydrophobicContact CZ3-CG 3.78Å; W757-M761 WeakPolarHBondContact O-CG 3.46Å; W757-M761 PolarHBondContact O-N 2.84Å
758	F	89.1	Confident	77.9	Confident	12 Å²	12	91.9 Å²	91.9	5%	0.053	47%	0.473	C	S	.	.	H	α-helix	trans	-64.1	-35	176.3	-77.2	-74.7	0	0	0	113.2	Y736 Y741 L742 V743 I754 R760 M761 N762	Y736-F758 HydrophobicContact CD2-CE2 4.35Å; Y736-F758 WeakPolarHBondContact O-CZ 3.43Å; Y741-F758 WeakPolarHBondContact O-CE1 3.25Å; Y741-F758 VanDerWaalsContact O-CZ 3.31Å; Y741-F758 WeakPolarHBondContact O-CZ 3.4Å; L742-F758 HydrophobicContact CD1-CB 3.58Å; L742-F758 HydrophobicContact CD1-CD1 3.86Å; L742-F758 HydrophobicContact CD1-CD2 3.87Å; L742-F758 HydrophobicContact CD1-CG 3.46Å; L742-F758 VanDerWaalsContact CD1-CG 3.46Å; V743-F758 HydrophobicContact CB-CE2 3.63Å; V743-F758 HydrophobicContact CB-CZ 3.8Å; V743-F758 HydrophobicContact CG2-CE2 4.03Å; V743-F758 HydrophobicContact CG2-CZ 3.69Å; I754-F758 HydrophobicContact CG2-CD2 4.01Å; I754-F758 HydrophobicContact CG2-CE2 3.89Å; I754-F758 WeakPolarHBondContact O-CD2 3.36Å; I754-F758 PolarHBondContact O-N 2.94Å; F758-R760 VanDerWaalsContact C-N 3.34Å; F758-M761 PolarHBondContact O-N 3.05Å; F758-N762 WeakPolarHBondContact O-CB 3.48Å; F758-N762 PolarHBondContact O-N 2.93Å; F758-N762 PolarHBondContact O-ND2 2.76Å
759	Q	87.9	Confident	76.3	Confident	107 Å²	107	96 Å²	96	50%	0.5	47%	0.474	S	S	.	.	H	α-helix	trans	-62.4	-40.6	172	-77.8	171.1	-2.6	0	0	112	T755 R756 W757 Q763	T755-Q759 WeakPolarHBondContact O-CB 3.18Å; T755-Q759 WeakPolarHBondContact O-CG 3.42Å; T755-Q759 PolarHBondContact O-N 3.07Å; R756-Q759 PolarHBondContact O-N 2.88Å; W757-Q759 VanDerWaalsContact C-N 3.34Å; W757-Q759 PolarHBondContact O-N 2.94Å; Q759-Q763 WeakPolarHBondContact O-CG 3.5Å; Q759-Q763 PolarHBondContact O-N 3.16Å; Q759-Q763 PolarHBondContact O-NE2 3.1Å
760	R	88.6	Confident	73.9	Confident	164 Å²	164	96.7 Å²	96.7	62%	0.619	49%	0.487	S	S	*	.	H	α-helix	trans	-67.8	-44.5	176.4	-172.4	-178.4	-66.5	163.8	-1.2	111.7	R756 W757 F758 N762 Q763 L764	R756-R760 WeakPolarHBondContact O-CB 3.44Å; R756-R760 PolarHBondContact O-N 2.94Å; W757-R760 WeakPolarHBondContact O-CB 3.38Å; W757-R760 PolarHBondContact O-N 3.26Å; W757-R760 VanDerWaalsContact O-N 3.1Å; F758-R760 VanDerWaalsContact C-N 3.34Å; R760-N762 VanDerWaalsContact C-N 3.33Å; R760-N762 PolarHBondContact O-N 3.33Å; R760-Q763 WeakPolarHBondContact O-CB 3.36Å; R760-Q763 PolarHBondContact O-N 2.92Å; R760-Q763 VanDerWaalsContact O-N 3.11Å; R760-L764 HydrophobicContact CG-CD1 4.29Å; R760-L764 WeakPolarHBondContact O-CG 3.48Å; R760-L764 PolarHBondContact O-N 2.79Å
761	M	83.1	Confident	71.9	Confident	85 Å²	85	93 Å²	93	42%	0.419	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-39.9	176.9	-69.1	-64.9	-81.5	0	0	112.1	W757 F758 Q763 L764 S765	W757-M761 HydrophobicContact CD2-CG 3.91Å; W757-M761 HydrophobicContact CE3-CG 3.9Å; W757-M761 HydrophobicContact CH2-CE 3.8Å; W757-M761 HydrophobicContact CH2-CG 3.64Å; W757-M761 HydrophobicContact CH2-SD 4.23Å; W757-M761 HydrophobicContact CZ2-CE 3.85Å; W757-M761 HydrophobicContact CZ2-CG 3.63Å; W757-M761 HydrophobicContact CZ2-SD 3.87Å; W757-M761 HydrophobicContact CZ3-CG 3.78Å; W757-M761 WeakPolarHBondContact O-CG 3.46Å; W757-M761 PolarHBondContact O-N 2.84Å; F758-M761 PolarHBondContact O-N 3.05Å; M761-Q763 VanDerWaalsContact C-N 3.27Å; M761-Q763 PolarHBondContact O-N 2.97Å; M761-L764 PolarHBondContact O-N 3.45Å; M761-L764 HydrophobicContact SD-CD1 4.45Å; M761-S765 PolarHBondContact O-N 2.82Å; M761-S765 PolarHBondContact O-OG 3.45Å
762	N	79.4	Confident	69.6	Low	93 Å²	93	97 Å²	97	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-69.3	-19.8	175.2	-79.5	-66.8	0	0	0	114.3	F758 R760 S765 N766	F758-N762 WeakPolarHBondContact O-CB 3.48Å; F758-N762 PolarHBondContact O-N 2.93Å; F758-N762 PolarHBondContact O-ND2 2.76Å; R760-N762 VanDerWaalsContact C-N 3.33Å; R760-N762 PolarHBondContact O-N 3.33Å; N762-S765 WeakPolarHBondContact CA-OG 3.43Å; N762-S765 PolarHBondContact O-OG 3.08Å; N762-N766 PolarHBondContact O-ND2 3.42Å
763	Q	75	Confident	66.8	Low	143 Å²	143	108.3 Å²	108.3	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-80.1	-43.3	170.1	-70.2	166.5	32.5	0	0	110.8	Q759 R760 M761 S765 N766	Q759-Q763 WeakPolarHBondContact O-CG 3.5Å; Q759-Q763 PolarHBondContact O-N 3.16Å; Q759-Q763 PolarHBondContact O-NE2 3.1Å; R760-Q763 WeakPolarHBondContact O-CB 3.36Å; R760-Q763 PolarHBondContact O-N 2.92Å; R760-Q763 VanDerWaalsContact O-N 3.11Å; M761-Q763 VanDerWaalsContact C-N 3.27Å; M761-Q763 PolarHBondContact O-N 2.97Å; Q763-S765 VanDerWaalsContact C-N 3.32Å; Q763-S765 PolarHBondContact O-N 2.74Å; Q763-N766 PolarHBondContact O-N 2.74Å; Q763-N766 VanDerWaalsContact O-N 3.13Å
764	L	63.1	Low	64.1	Low	118 Å²	118	113.8 Å²	113.8	62%	0.618	56%	0.564	S	S	*	*	H	α-helix	trans	-65.4	-32.3	177	-67.8	170.6	0	0	0	112.8	R760 M761 N766 P767	R760-L764 HydrophobicContact CG-CD1 4.29Å; R760-L764 WeakPolarHBondContact O-CG 3.48Å; R760-L764 PolarHBondContact O-N 2.79Å; M761-L764 PolarHBondContact O-N 3.45Å; M761-L764 HydrophobicContact SD-CD1 4.45Å; L764-N766 PolarHBondContact O-N 2.69Å; L764-P767 WeakPolarHBondContact O-CD 3.36Å
765	S	57.7	Low	61.3	Low	76 Å²	76	119 Å²	119	53%	0.531	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	2.5	173.8	67.3	0	0	0	0	114.7	M761 N762 Q763 P767	M761-S765 PolarHBondContact O-N 2.82Å; M761-S765 PolarHBondContact O-OG 3.45Å; N762-S765 WeakPolarHBondContact CA-OG 3.43Å; N762-S765 PolarHBondContact O-OG 3.08Å; Q763-S765 VanDerWaalsContact C-N 3.32Å; Q763-S765 PolarHBondContact O-N 2.74Å; S765-P767 VanDerWaalsContact C-CD 3.43Å
766	N	45.8	Very low	58.6	Low	80 Å²	80	123.8 Å²	123.8	43%	0.428	62%	0.623	S	S	.	*			trans	-120.3	58.8	173.8	-78.3	-86.6	0	0	0	114	N762 Q763 L764 L768	N762-N766 PolarHBondContact O-ND2 3.42Å; Q763-N766 PolarHBondContact O-N 2.74Å; Q763-N766 VanDerWaalsContact O-N 3.13Å; L764-N766 PolarHBondContact O-N 2.69Å; N766-L768 PolarHBondContact O-N 2.56Å
767	P	40	Very low	55.9	Low	105 Å²	105	123 Å²	123	68%	0.682	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-17.9	-178.1	-19.6	31.9	0	0	0	115.2	L764 S765	L764-P767 WeakPolarHBondContact O-CD 3.36Å; S765-P767 VanDerWaalsContact C-CD 3.43Å
768	L	42.2	Very low	53	Low	165 Å²	165	126.9 Å²	126.9	86%	0.864	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	13.9	-169.8	-72.1	93.1	0	0	0	115.4	N766	N766-L768 PolarHBondContact O-N 2.56Å
769	R	42.6	Very low	50.3	Low	220 Å²	220	131.6 Å²	131.6	83%	0.83	70%	0.698	S	S	*	*	S	Bend	trans	-130.5	-0.5	-172.2	-75.9	-168.7	174.7	-130.7	0.1	118
770	S	37.9	Very low	47.4	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	72%	0.715	S	S	*	*	S	Bend	trans	-116.6	-5.6	-173.3	48.7	0	0	0	0	116
771	S	39.5	Very low	44.6	Very low	109 Å²	109	139.1 Å²	139.1	76%	0.762	73%	0.727	S	S	*	*	S	Bend	trans	-108	107	172.2	-162.9	0	0	0	0	112.2
772	T	39.5	Very low	41.9	Very low	116 Å²	116	141.7 Å²	141.7	71%	0.712	74%	0.742	S	S	*	*			trans	35	118.9	140.2	-40.6	0	0	0	0	119.5	H774	T772-H774 PolarHBondContact O-N 2.78Å
773	R	33.8	Very low	39.7	Very low	241 Å²	241	143.3 Å²	143.3	91%	0.909	76%	0.758	S	S	*	*			trans	-62.7	108.9	157.1	-64.5	171.9	176.7	168.8	-3.6	109.8
774	H	35.8	Very low	37.5	Very low	184 Å²	184	144.1 Å²	144.1	85%	0.852	76%	0.761	S	S	*	*			trans	-165.5	147	146.5	-115.3	-83	0	0	0	111.8	T772	T772-H774 PolarHBondContact O-N 2.78Å
775	S	34.8	Very low	35.8	Very low	113 Å²	113	142.9 Å²	142.9	79%	0.79	76%	0.762	S	S	*	*			trans	57.9	119.2	176.6	-145.7	0	0	0	0	118.8
776	L	31.9	Very low	34.8	Very low	159 Å²	159	145.3 Å²	145.3	83%	0.832	78%	0.776	S	S	*	*			trans	-84.1	-172.9	158.9	-68.3	164.5	0	0	0	109.7
777	V	35.1	Very low	33.9	Very low	131 Å²	131	149.4 Å²	149.4	79%	0.794	79%	0.792	S	S	*	*			trans	73.8	88.8	167.7	-165.5	0	0	0	0	115.7
778	C	30.2	Very low	33.4	Very low	133 Å²	133	148.3 Å²	148.3	90%	0.899	79%	0.788	S	S	*	*			trans	-142	96.7	134	-166.2	0	0	0	0	109
779	T	31.9	Very low	32.8	Very low	110 Å²	110	150.8 Å²	150.8	68%	0.675	79%	0.787	S	S	*	*			trans	-96.5	139.8	177.8	51.1	0	0	0	0	110.8
780	R	28	Very low	32.2	Very low	229 Å²	229	143.9 Å²	143.9	86%	0.864	79%	0.785	S	S	*	*	S	Bend	trans	69.7	139.2	166.6	-58.3	173.3	170.4	-180	-5.2	116.6
781	K	28.5	Very low	31.9	Very low	201 Å²	201	144.2 Å²	144.2	87%	0.874	78%	0.782	S	S	*	*	S	Bend	trans	68.3	159.3	164.6	-62.3	-177.4	179.2	-175.8	0	117.1
782	L	28	Very low	31.4	Very low	138 Å²	138	143.5 Å²	143.5	72%	0.723	77%	0.769	S	S	*	*			trans	-65.3	131.3	178.5	-66.4	151.1	0	0	0	110.7	H784	L782-H784 PolarHBondContact O-N 2.71Å
783	P	33.1	Very low	31	Very low	127 Å²	127	140.5 Å²	140.5	83%	0.825	76%	0.761	S	S	*	*			trans	-70.3	105.6	146.5	29.9	-28.5	0	0	0	107.3
784	H	27.3	Very low	30.9	Very low	160 Å²	160	131.3 Å²	131.3	74%	0.741	73%	0.729	S	S	*	*			trans	-61.7	155	164.7	-83.1	-1.2	0	0	0	110.5	L782	L782-H784 PolarHBondContact O-N 2.71Å
785	S	28.9	Very low	30.5	Very low	92 Å²	92	128.1 Å²	128.1	64%	0.643	73%	0.727	S	S	*	*			trans	-20.9	131.6	175	-176.7	0	0	0	0	116.9	H787	S785-H787 PolarHBondContact O-N 3.3Å
786	P	36.8	Very low	30.5	Very low	128 Å²	128	132.9 Å²	132.9	83%	0.831	73%	0.728	S	S	*	*			trans	-69.3	77.3	159.4	31.3	-33.5	0	0	0	111.2
787	H	27.4	Very low	30.5	Very low	165 Å²	165	128.9 Å²	128.9	76%	0.764	73%	0.725	S	S	*	*			trans	41.8	122	144.2	-79.6	-97.7	0	0	0	121.8	S785	S785-H787 PolarHBondContact O-N 3.3Å
788	S	27.6	Very low	30.2	Very low	83 Å²	83	131 Å²	131	58%	0.58	73%	0.731	S	S	*	*			trans	74.4	150.6	137	-137	0	0	0	0	117.4
789	Y	30.9	Very low	30.1	Very low	216 Å²	216	129.6 Å²	129.6	85%	0.847	72%	0.722	S	S	*	*			cis	-142.6	129.6	21.4	-74.5	-98.1	0	0	0	114.8
790	G	29.3	Very low	29.9	Very low	76 Å²	76	131.4 Å²	131.4	78%	0.784	73%	0.727	S	S	*	*			trans	59.9	178.4	139.4	0	0	0	0	0	121.1
791	V	32.1	Very low	30	Very low	118 Å²	118	127 Å²	127	72%	0.715	72%	0.72	S	S	*	*			cis	-152.4	130.4	5	171.1	0	0	0	0	111
792	N	29.5	Very low	30.2	Very low	94 Å²	94	125.1 Å²	125.1	50%	0.503	71%	0.714	S	S	.	*			trans	54.8	133.3	162.2	-57.8	-10.8	0	0	0	119.8
793	G	29.7	Very low	30.2	Very low	53 Å²	53	123.4 Å²	123.4	55%	0.546	71%	0.714	S	S	.	*			cis	164.1	-156.5	2	0	0	0	0	0	107.4	I1106	G793-I1106 PolarHBondContact O-N 3.46Å
794	H	33.1	Very low	30.1	Very low	48 Å²	48	122.2 Å²	122.2	22%	0.222	71%	0.709	C	S	.	*			cis	-156.7	-177.9	21	-55.7	-25.4	0	0	0	108.6	S1104 Q1105 I1106	H794-S1104 VanDerWaalsContact CE1-CB 3.42Å; H794-S1104 WeakPolarHBondContact CE1-CB 3.44Å; H794-S1104 PolarHBondContact CE1-OG 3.32Å; H794-S1104 PolarHBondContact NE2-O 3.25Å; H794-S1104 PolarHBondContact NE2-OG 3.12Å; H794-Q1105 VanDerWaalsContact CB-CA 3.49Å; H794-Q1105 HydrophobicContact CB-CB 3.3Å; H794-Q1105 HydrophobicContact CB-CG 4.33Å; H794-Q1105 WeakPolarHBondContact CD2-CA 3.36Å; H794-Q1105 WeakPolarHBondContact CD2-CB 3.44Å; H794-Q1105 PolarHBondContact CD2-N 3.3Å; H794-Q1105 PolarHBondContact CD2-O 3.45Å; H794-Q1105 WeakPolarHBondContact CE1-CA 3.5Å; H794-Q1105 WeakPolarHBondContact CE1-CB 3.29Å; H794-Q1105 WeakPolarHBondContact CE1-CG 3.31Å; H794-Q1105 PolarHBondContact CE1-N 3.15Å; H794-Q1105 VanDerWaalsContact CG-CG 3.47Å; H794-Q1105 WeakPolarHBondContact ND1-CA 3.31Å; H794-Q1105 WeakPolarHBondContact ND1-CB 3.49Å; H794-Q1105 WeakPolarHBondContact ND1-CG 3.14Å; H794-Q1105 PolarHBondContact ND1-N 2.91Å; H794-Q1105 WeakPolarHBondContact NE2-CA 2.96Å; H794-Q1105 WeakPolarHBondContact NE2-CB 3.23Å; H794-Q1105 WeakPolarHBondContact NE2-CG 3.44Å; H794-Q1105 PolarHBondContact NE2-N 2.83Å; H794-I1106 HydrophobicContact CB-CB 4.42Å; H794-I1106 HydrophobicContact CB-CD1 3.99Å; H794-I1106 HydrophobicContact CB-CG1 3.97Å; H794-I1106 VanDerWaalsContact CB-N 3.27Å; H794-I1106 PolarHBondContact CD2-N 2.71Å; H794-I1106 VanDerWaalsContact N-N 3.1Å
795	S	26.8	Very low	30.2	Very low	117 Å²	117	123 Å²	123	82%	0.818	71%	0.713	S	S	*	*			trans	-123.7	140.3	147.6	-50.8	0	0	0	0	110.5
796	R	34.2	Very low	30.2	Very low	213 Å²	213	122.9 Å²	122.9	80%	0.804	71%	0.712	S	S	*	*			trans	-98.3	159.9	149.3	-81.3	164.3	-160.3	167.5	7.2	105.5	I1106	R796-I1106 HydrophobicContact CB-CD1 3.84Å; R796-I1106 HydrophobicContact CG-CD1 3.43Å; R796-I1106 VanDerWaalsContact CG-CD1 3.43Å
797	G	31.6	Very low	30	Very low	75 Å²	75	123.9 Å²	123.9	77%	0.773	71%	0.705	S	S	*	*			cis	-156.7	-169.8	1.5	0	0	0	0	0	110.9
798	L	30.2	Very low	30.2	Very low	175 Å²	175	124.6 Å²	124.6	92%	0.916	70%	0.702	S	S	*	*			trans	-88.1	134.8	-175.6	-74.8	162	0	0	0	112.4
799	S	27	Very low	30.6	Very low	103 Å²	103	126.8 Å²	126.8	72%	0.72	71%	0.708	S	S	*	*			trans	70.9	142.9	138.5	-150.9	0	0	0	0	121.4
800	L	28.9	Very low	30.8	Very low	148 Å²	148	123.1 Å²	123.1	78%	0.775	70%	0.703	S	S	*	*			trans	85.3	121.1	147.4	-125.7	77.3	0	0	0	121
801	L	29.9	Very low	31.2	Very low	137 Å²	137	129 Å²	129	72%	0.717	71%	0.706	S	S	*	*			trans	79.1	129.5	148	-112.9	65.8	0	0	0	121.9
802	Q	32	Very low	31.4	Very low	161 Å²	161	130.5 Å²	130.5	75%	0.752	71%	0.711	S	S	*	*			trans	67.6	96.3	147.2	-79.2	165	-43.1	0	0	122.7
803	S	29.1	Very low	32.1	Very low	103 Å²	103	131 Å²	131	72%	0.72	72%	0.719	S	S	*	*				59.1	123.7	110.2	-49.8	0	0	0	0	123.1
804	S	29.7	Very low	32.2	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	72%	0.723	S	S	*	*			trans	62.3	148.5	135.5	59.5	0	0	0	0	120.1
805	Q	30.5	Very low	32.3	Very low	176 Å²	176	137.1 Å²	137.1	82%	0.822	75%	0.748	S	S	*	*			cis	-163.1	155.5	0.6	-127.2	168.3	-16.1	0	0	111.2
806	S	28.2	Very low	32.5	Very low	89 Å²	89	138.5 Å²	138.5	62%	0.622	74%	0.742	S	S	*	*			trans	45.9	134.1	146.4	63.7	0	0	0	0	125.1
807	H	32.3	Very low	32.3	Very low	150 Å²	150	135.6 Å²	135.6	69%	0.694	74%	0.737	S	S	*	*			trans	64.1	158.9	142.5	-71.6	-55.3	0	0	0	119.9
808	Y	31	Very low	32.2	Very low	180 Å²	180	136.8 Å²	136.8	71%	0.706	73%	0.733	S	S	*	*			cis	-154.9	170	-9.2	-120.1	-45.2	0	0	0	109.8
809	D	35.9	Very low	32.1	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	73%	0.729	S	S	*	*			trans	51.2	110	149.5	-55.2	-22.6	0	0	0	124.1
810	D	36.3	Very low	32.4	Very low	139 Å²	139	137.1 Å²	137.1	74%	0.743	73%	0.732	S	S	*	*				37.5	116.6	111.3	-166.4	23.9	0	0	0	121.4
811	K	37.7	Very low	32.7	Very low	198 Å²	198	136.3 Å²	136.3	86%	0.861	74%	0.737	S	S	*	*				-179.4	142.8	129.1	-100.3	155.1	-170.1	167.2	0	116.8
812	D	36.6	Very low	33.1	Very low	150 Å²	150	135.2 Å²	135.2	80%	0.802	74%	0.738	S	S	*	*			trans	-79.8	175.4	160	-113.1	-24.2	0	0	0	111.2
813	P	44.2	Very low	33.1	Very low	105 Å²	105	136.8 Å²	136.8	68%	0.682	74%	0.743	S	S	*	*			cis	-136.8	-144.1	-21.7	39.1	-18.4	0	0	0	111.3
814	S	30.8	Very low	33.1	Very low	90 Å²	90	137.5 Å²	137.5	63%	0.629	75%	0.748	S	S	*	*			trans	101.5	130.2	145.3	-97.9	0	0	0	0	122
815	D	35.9	Very low	33.4	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	75%	0.746	S	S	*	*			trans	80.2	122.2	133.2	-59.6	-27.5	0	0	0	125
816	E	30.6	Very low	33.5	Very low	147 Å²	147	134.3 Å²	134.3	69%	0.687	74%	0.74	S	S	*	*				73.1	108.2	129.5	-62.6	-97.4	91.9	0	0	121.8
817	Q	30.9	Very low	33.5	Very low	151 Å²	151	136.8 Å²	136.8	71%	0.706	75%	0.746	S	S	*	*				63.9	143.8	127.4	-56.3	-169	37.2	0	0	123.4
818	S	28.4	Very low	33.6	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	74%	0.744	S	S	*	*			trans	107.1	109.2	134.2	81.5	0	0	0	0	121
819	V	28	Very low	33.6	Very low	135 Å²	135	132.4 Å²	132.4	82%	0.818	74%	0.744	S	S	*	*				75.2	167.8	121.1	173.8	0	0	0	0	118.8
820	L	34.4	Very low	33.3	Very low	151 Å²	151	132.4 Å²	132.4	79%	0.791	74%	0.743	S	S	*	*			trans	75.4	83.7	173.9	-75.3	140.1	0	0	0	119.6
821	C	34.7	Very low	33	Very low	130 Å²	130	135.5 Å²	135.5	88%	0.878	75%	0.745	S	S	*	*			trans	-90.1	131.4	143.7	-70.6	0	0	0	0	110.8
822	P	38.6	Very low	32.6	Very low	115 Å²	115	131.9 Å²	131.9	75%	0.747	74%	0.735	S	S	*	*			trans	-114.7	104.7	163.4	32.2	-20.3	0	0	0	113.8
823	K	31.1	Very low	32.3	Very low	193 Å²	193	131.4 Å²	131.4	84%	0.839	73%	0.731	S	S	*	*			trans	-0.8	143.8	147.2	-58.8	166.4	-177.9	170.5	0	120.4
824	S	30.2	Very low	31.7	Very low	118 Å²	118	131.7 Å²	131.7	83%	0.825	73%	0.733	S	S	*	*			trans	75.5	168.3	136.9	80.9	0	0	0	0	118.3
825	S	34.8	Very low	31.6	Very low	97 Å²	97	132.1 Å²	132.1	68%	0.678	73%	0.732	S	S	*	*			cis	-156.8	-170.5	16.2	63.4	0	0	0	0	114.5
826	V	32	Very low	31.2	Very low	115 Å²	115	131.6 Å²	131.6	70%	0.697	73%	0.729	S	S	*	*			trans	81.6	89.1	149.9	166.1	0	0	0	0	119.2
827	N	28.5	Very low	31.2	Very low	140 Å²	140	135 Å²	135	75%	0.749	74%	0.736	S	S	*	*				94.7	156.4	108.4	-90.3	-20.7	0	0	0	125.8
828	T	34.4	Very low	31	Very low	107 Å²	107	133.2 Å²	133.2	66%	0.656	74%	0.735	S	S	*	*			trans	78.4	90.5	147.4	39.6	0	0	0	0	121.2
829	N	31	Very low	31	Very low	132 Å²	132	131.5 Å²	131.5	71%	0.706	73%	0.733	S	S	*	*				88.4	132.4	105	-81.4	4.1	0	0	0	122.9
830	L	29.3	Very low	30.9	Very low	129 Å²	129	133.9 Å²	133.9	68%	0.675	73%	0.727	S	S	*	*			trans	68.9	140.4	139.6	-63.2	167.5	0	0	0	118.4
831	R	30	Very low	30.6	Very low	204 Å²	204	135.6 Å²	135.6	77%	0.77	73%	0.725	S	S	*	*			cis	-165.4	174.6	-21.4	-143.6	-176	-147.7	165.5	3.5	108.5
832	N	30.7	Very low	30.9	Very low	121 Å²	121	136.5 Å²	136.5	65%	0.647	72%	0.72	S	S	*	*			trans	72.2	104.7	162.4	-55	-12.4	0	0	0	114.9
833	L	29.7	Very low	30.4	Very low	141 Å²	141	136.9 Å²	136.9	74%	0.738	72%	0.723	S	S	*	*				85.2	148.8	67.3	-79.4	164.3	0	0	0	112.3	V835	L833-V835 HydrophobicContact CD2-CG2 4.28Å
834	P	30.9	Very low	30.9	Very low	110 Å²	110	132.3 Å²	132.3	71%	0.714	72%	0.715	S	S	*	*			cis	-113.2	153.3	-16.5	23.4	-1.1	0	0	0	110.7
835	V	30	Very low	31.2	Very low	99 Å²	99	131.7 Å²	131.7	60%	0.6	71%	0.708	S	S	*	*				57.3	108.3	63.6	-178.7	0	0	0	0	109.4	L833	L833-V835 HydrophobicContact CD2-CG2 4.28Å
836	N	27.3	Very low	30.7	Very low	129 Å²	129	133.9 Å²	133.9	69%	0.69	71%	0.711	S	S	*	*			cis	-137.3	159.7	49.4	-82.5	-62	0	0	0	110.5
837	R	30.1	Very low	30.3	Very low	219 Å²	219	132.5 Å²	132.5	83%	0.826	71%	0.706	S	S	*	*				57.5	148	51.9	-58.8	177.4	166.1	-173.4	-5.2	111.1
838	T	27.1	Very low	30	Very low	112 Å²	112	131.4 Å²	131.4	69%	0.687	70%	0.7	S	S	*	*			cis	-115.5	-179	2.3	46.1	0	0	0	0	109.2
839	G	28	Very low	29.5	Very low	64 Å²	64	131.7 Å²	131.7	66%	0.66	69%	0.694	S	S	*	*				55.9	139.4	55.5	0	0	0	0	0	110.5
840	R	26.4	Very low	29.2	Very low	186 Å²	186	133.6 Å²	133.6	70%	0.702	69%	0.691	S	S	*	*			cis	-169.5	151.2	44.5	-82	-176.4	-171.4	-118.9	5.9	109.6
841	Y	28.3	Very low	29	Very low	186 Å²	186	133.1 Å²	133.1	73%	0.729	69%	0.694	S	S	*	*			trans	62.1	123.3	141.3	-63.9	-145.4	0	0	0	115.9
842	L	41.3	Very low	28.7	Very low	150 Å²	150	129.2 Å²	129.2	79%	0.785	70%	0.698	S	S	*	*				42.4	128.8	89.1	-74.2	175.5	0	0	0	113.5
843	P	28.3	Very low	28.5	Very low	123 Å²	123	126.7 Å²	126.7	80%	0.799	70%	0.7	S	S	*	*				-148.9	174	62.6	46.1	-29.6	0	0	0	117.7
844	S	40.7	Very low	28.4	Very low	97 Å²	97	125 Å²	125	68%	0.678	70%	0.701	S	S	*	*			trans	-87.4	-152.9	151.7	-41.7	0	0	0	0	108.2
845	P	36.8	Very low	28.2	Very low	104 Å²	104	126.8 Å²	126.8	68%	0.675	70%	0.699	S	S	*	*			cis	-123.2	-139.3	-25.5	26.2	-0.3	0	0	0	109
846	I	24.7	Very low	28.1	Very low	144 Å²	144	129 Å²	129	74%	0.738	70%	0.703	S	S	*	*			trans	71.4	108.3	159.8	-60.3	162.9	0	0	0	113.8
847	S	23.2	Very low	28.2	Very low	86 Å²	86	130.2 Å²	130.2	60%	0.601	71%	0.708	S	S	*	*			cis	95	136.8	40.2	78.9	0	0	0	0	115.1
848	N	22.7	Very low	28.1	Very low	116 Å²	116	123.2 Å²	123.2	62%	0.62	70%	0.704	S	S	*	*			trans	77.6	116.4	164.4	-64.5	34.9	0	0	0	121.3
849	E	23.5	Very low	28.4	Very low	114 Å²	114	122.5 Å²	122.5	53%	0.533	70%	0.703	S	S	.	*			trans	76.5	135	132.2	-68.4	-161.6	-167.5	0	0	124.3
850	R	24.2	Very low	28.5	Very low	172 Å²	172	124 Å²	124	65%	0.649	70%	0.696	S	S	*	*			trans	38	134.9	133.9	-49.6	176.9	175.2	130.4	-3.8	117.9
851	T	24.8	Very low	28.8	Very low	119 Å²	119	124.5 Å²	124.5	73%	0.73	70%	0.698	S	S	*	*				-176.7	141.9	50.5	-41.8	0	0	0	0	111.2
852	S	24.3	Very low	28.9	Very low	122 Å²	122	120.2 Å²	120.2	85%	0.853	69%	0.691	S	S	*	*			trans	57.8	163.2	156.9	67.2	0	0	0	0	120.2
853	G	26.4	Very low	28.4	Very low	67 Å²	67	117.2 Å²	117.2	69%	0.691	68%	0.679	S	S	*	*			trans	-177.2	-58.1	174.7	0	0	0	0	0	117.9
854	S	27.5	Very low	28.4	Very low	107 Å²	107	121.7 Å²	121.7	75%	0.748	68%	0.68	S	S	*	*			trans	70.3	166.3	170.9	80.1	0	0	0	0	120.9
855	H	27.8	Very low	27.8	Very low	146 Å²	146	120.3 Å²	120.3	68%	0.676	68%	0.682	S	S	*	*			trans	71.1	91.2	154.8	-69.8	-59.1	0	0	0	123.9
856	Q	27.9	Very low	27.6	Very low	147 Å²	147	124 Å²	124	69%	0.687	68%	0.683	S	S	*	*				90.3	143.2	104.6	-90.4	-178.1	13.3	0	0	124.7
857	I	27.5	Very low	27.8	Very low	154 Å²	154	123.5 Å²	123.5	79%	0.79	68%	0.681	S	S	*	*			trans	72.1	145.5	146.4	-68.2	163.7	0	0	0	118.6
858	G	29.6	Very low	28	Very low	72 Å²	72	124.9 Å²	124.9	74%	0.742	68%	0.682	S	S	*	*			trans	171	19.6	167.2	0	0	0	0	0	122.2
859	S	31.7	Very low	28.4	Very low	97 Å²	97	127.7 Å²	127.7	68%	0.678	69%	0.689	S	S	*	*			trans	-29.4	129.2	179.9	-52.7	0	0	0	0	121.5
860	N	30.2	Very low	28.7	Very low	96 Å²	96	128.2 Å²	128.2	51%	0.513	71%	0.705	S	S	.	*				67.7	152.8	125.5	-54	-9.8	0	0	0	124.6
861	R	33.6	Very low	29	Very low	195 Å²	195	123.7 Å²	123.7	74%	0.736	71%	0.712	S	S	*	*				112.8	141.9	125.7	-105.5	-178.8	-170.8	177.2	5.1	122.4
862	T	29.3	Very low	29.1	Very low	97 Å²	97	125.5 Å²	125.5	60%	0.595	72%	0.716	S	S	*	*			trans	92.9	84.7	139.8	39.7	0	0	0	0	124.1
863	T	30.8	Very low	29.2	Very low	86 Å²	86	124.4 Å²	124.4	53%	0.528	71%	0.708	S	S	.	*				63.4	136	110.6	57.6	0	0	0	0	125.2
864	R	29.4	Very low	29.2	Very low	217 Å²	217	126.9 Å²	126.9	82%	0.819	71%	0.713	S	S	*	*				79.8	122.7	128.7	-176.5	-169.1	-156.8	-173.3	7.7	120.9
865	G	28.8	Very low	29.3	Very low	69 Å²	69	125.2 Å²	125.2	71%	0.711	71%	0.713	S	S	*	*			trans	176.5	90.6	157.5	0	0	0	0	0	120.9
866	Y	31.1	Very low	29.5	Very low	182 Å²	182	123.6 Å²	123.6	71%	0.714	71%	0.714	S	S	*	*			trans	43.9	108.4	136.5	-75.2	-96.6	0	0	0	123.7
867	L	29.4	Very low	29.5	Very low	132 Å²	132	126.3 Å²	126.3	69%	0.691	72%	0.717	S	S	*	*				62.3	151.4	110.6	-94.1	163.7	0	0	0	124.4
868	N	27.5	Very low	29.7	Very low	115 Å²	115	127.1 Å²	127.1	62%	0.615	72%	0.715	S	S	*	*			trans	86.5	96.9	151.1	-74.6	-36.9	0	0	0	122.5
869	K	31.3	Very low	29.8	Very low	175 Å²	175	128.6 Å²	128.6	76%	0.761	72%	0.72	S	S	*	*				50.1	130.2	108.5	-66.9	-180	-177.4	173.6	0	121
870	S	29.8	Very low	29.7	Very low	125 Å²	125	130.8 Å²	130.8	87%	0.874	72%	0.723	S	S	*	*			trans	71.7	145.6	142.3	72.5	0	0	0	0	118.8
871	G	30.2	Very low	29.7	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	73%	0.728	S	S	*	*			trans	-177.1	60.4	-170.4	0	0	0	0	0	115.1	S873	G871-S873 PolarHBondContact O-N 3.4Å
872	I	26.7	Very low	29.5	Very low	157 Å²	157	131 Å²	131	81%	0.805	72%	0.722	S	S	*	*			trans	-39.9	116.3	176.5	-68.6	161.7	0	0	0	115.5
873	S	27.6	Very low	29.5	Very low	99 Å²	99	136 Å²	136	69%	0.692	73%	0.73	S	S	*	*			trans	51.4	158.8	134	91.2	0	0	0	0	124.3	G871	G871-S873 PolarHBondContact O-N 3.4Å
874	C	26.2	Very low	29.4	Very low	118 Å²	118	135.3 Å²	135.3	80%	0.797	74%	0.74	S	S	*	*			trans	72.4	103.9	145.7	-159	0	0	0	0	118.5
875	G	28.7	Very low	29.5	Very low	73 Å²	73	136.3 Å²	136.3	75%	0.753	74%	0.744	S	S	*	*			trans	-149.6	64.4	-177.6	0	0	0	0	0	115.1
876	V	31.2	Very low	29.5	Very low	112 Å²	112	136.4 Å²	136.4	68%	0.679	74%	0.744	S	S	*	*				38.1	127.7	129	174.6	0	0	0	0	118.8
877	R	29.5	Very low	29.5	Very low	203 Å²	203	139.6 Å²	139.6	77%	0.766	76%	0.755	S	S	*	*			cis	-172	167.2	-2.1	-114.7	177.4	-162.1	159.6	0.2	110.1
878	K	32.1	Very low	29.6	Very low	171 Å²	171	136.6 Å²	136.6	74%	0.743	76%	0.756	S	S	*	*			trans	62.9	88.2	145.4	-71.7	176.2	174.7	-176.7	0	120.9
879	A	30.1	Very low	29.8	Very low	103 Å²	103	142 Å²	142	85%	0.851	77%	0.768	S	S	*	*				64.6	-159.1	103.1	0	0	0	0	0	120.4
880	I	30.8	Very low	29.6	Very low	143 Å²	143	139.6 Å²	139.6	73%	0.733	76%	0.763	S	S	*	*			trans	78.6	73.5	180	-48.7	-174.8	0	0	0	115.7
881	H	29.7	Very low	29.4	Very low	133 Å²	133	142.9 Å²	142.9	62%	0.616	76%	0.756	S	S	*	*				108.7	103	113.4	-84.2	-168.6	0	0	0	122
882	R	30	Very low	29.2	Very low	162 Å²	162	144.1 Å²	144.1	61%	0.611	75%	0.752	S	S	*	*				67.1	122.6	107.4	-73.7	-177.6	-174.6	-175	6.7	120.2
883	R	27.9	Very low	29.3	Very low	202 Å²	202	141.1 Å²	141.1	76%	0.762	75%	0.745	S	S	*	*				66.7	101.1	126.3	-59.3	171.3	-176.3	179.5	-1.7	118.7
884	G	29.2	Very low	29.3	Very low	72 Å²	72	141 Å²	141	74%	0.742	74%	0.744	S	S	*	*			trans	-158.7	103.3	145.1	0	0	0	0	0	107.1
885	R	31.4	Very low	29.6	Very low	239 Å²	239	140.5 Å²	140.5	90%	0.902	74%	0.742	S	S	*	*				54.8	126.9	62.1	-67.5	-171.1	167.3	-161.1	0	112.6
886	G	29.2	Very low	29.6	Very low	70 Å²	70	144.8 Å²	144.8	72%	0.722	75%	0.747	S	S	*	*			trans	127.1	59.9	-175.1	0	0	0	0	0	110.2
887	R	31.2	Very low	29.5	Very low	249 Å²	249	142.4 Å²	142.4	94%	0.94	75%	0.745	S	S	*	*				53.8	92.2	69.8	-74.6	-171.5	168	-161.7	-2.5	112.9
888	G	32	Very low	29.5	Very low	69 Å²	69	139.1 Å²	139.1	71%	0.711	75%	0.747	S	S	*	*			trans	159	102.7	157.3	0	0	0	0	0	110.2
889	R	31.3	Very low	29.2	Very low	229 Å²	229	141.7 Å²	141.7	86%	0.864	75%	0.753	S	S	*	*			cis	57.9	140.3	13.4	-149.3	-174.3	-154	-139.7	6.4	114
890	L	27	Very low	29.1	Very low	124 Å²	124	140.9 Å²	140.9	65%	0.649	74%	0.741	S	S	*	*			trans	70.6	140.1	-171.4	-42.5	-178.8	0	0	0	111.1
891	R	25.5	Very low	29.3	Very low	195 Å²	195	141.9 Å²	141.9	74%	0.736	74%	0.739	S	S	*	*			cis	-143.4	154	-14.6	-109.1	160.6	-178.2	160.4	-0.1	104.7
892	S	26.5	Very low	29.2	Very low	103 Å²	103	145.8 Å²	145.8	72%	0.72	75%	0.749	S	S	*	*				49.8	140.2	74	-29.2	0	0	0	0	111.8
893	S	27.3	Very low	29.2	Very low	95 Å²	95	144.7 Å²	144.7	66%	0.664	75%	0.751	S	S	*	*			cis	-157.5	-171.6	26	-41.4	0	0	0	0	110.1
894	S	28	Very low	29.4	Very low	96 Å²	96	140 Å²	140	67%	0.671	75%	0.745	S	S	*	*			trans	49.7	118.1	147.7	54.5	0	0	0	0	118.2
895	S	32.2	Very low	29.4	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	74%	0.738	S	S	*	*				-134.4	135	57.7	-61.7	0	0	0	0	111.2
896	L	29.1	Very low	29.3	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	73%	0.729	S	S	*	*				52.3	107.9	83.8	-53.2	176.1	0	0	0	111.3
897	G	30	Very low	29.4	Very low	62 Å²	62	143.9 Å²	143.9	64%	0.639	73%	0.731	S	S	*	*			cis	-161.4	-169.8	6.4	0	0	0	0	0	115
898	V	29.2	Very low	29.3	Very low	133 Å²	133	136.2 Å²	136.2	81%	0.806	72%	0.715	S	S	*	*				74.3	118.7	90.6	168.5	0	0	0	0	111.2
899	R	26.4	Very low	29.3	Very low	226 Å²	226	138.3 Å²	138.3	85%	0.853	72%	0.719	S	S	*	*			cis	-170.9	166.8	-7.3	-121.9	171.9	178	178.7	-1.9	106.8
900	S	26.7	Very low	29.2	Very low	86 Å²	86	137 Å²	137	60%	0.601	71%	0.714	S	S	*	*			trans	37.2	123.6	143.7	-161	0	0	0	0	118.9
901	K	35.1	Very low	29.4	Very low	163 Å²	163	137.5 Å²	137.5	71%	0.709	72%	0.716	S	S	*	*			cis	-130.6	148.8	42.8	-61.5	177.8	-179.7	-175.9	0	111.1
902	R	27.4	Very low	29.6	Very low	215 Å²	215	133.4 Å²	133.4	81%	0.811	71%	0.712	S	S	*	*			cis	63	158.2	47	-81	-169.2	168.9	-166.7	-0.9	113.3
903	E	30.1	Very low	29.6	Very low	139 Å²	139	137.4 Å²	137.4	65%	0.65	71%	0.713	S	S	*	*			trans	70.7	119.8	176.3	-66.5	141.5	-132.5	0	0	113.2
904	T	31.5	Very low	29.6	Very low	105 Å²	105	138.1 Å²	138.1	64%	0.644	71%	0.709	S	S	*	*			cis	-161.6	138.8	0.2	11.7	0	0	0	0	111.2
905	E	29.9	Very low	29.5	Very low	128 Å²	128	143.1 Å²	143.1	60%	0.598	71%	0.713	S	S	*	*			trans	66.6	164.5	134.6	-65.2	-176	164.5	0	0	118.5
906	R	30.1	Very low	29.3	Very low	190 Å²	190	145.9 Å²	145.9	72%	0.717	71%	0.711	S	S	*	*			cis	-159.4	153.9	-15.8	-104	160.2	-176.7	161.3	-0.1	103.1
907	L	31.7	Very low	29.1	Very low	143 Å²	143	141.8 Å²	141.8	75%	0.749	70%	0.696	S	S	*	*			cis	-155.4	162.7	-1.5	-131.4	160.9	0	0	0	109.3
908	S	28.4	Very low	28.9	Very low	89 Å²	89	145.4 Å²	145.4	62%	0.622	70%	0.701	S	S	*	*			trans	-44.7	141.8	162.2	-43.4	0	0	0	0	113.9
909	S	32.1	Very low	28.7	Very low	112 Å²	112	143.2 Å²	143.2	78%	0.783	69%	0.692	S	S	*	*				-157.1	140.5	119.2	-86.5	0	0	0	0	111
910	R	29.8	Very low	28.7	Very low	202 Å²	202	140.9 Å²	140.9	76%	0.762	69%	0.688	S	S	*	*			cis	-177.6	166.9	-20	-129.4	173.1	166.2	-173.1	-4.9	105.4
911	I	29.9	Very low	28.6	Very low	134 Å²	134	141.6 Å²	141.6	69%	0.687	69%	0.693	S	S	*	*			trans	35.3	123	134.4	-69.5	168.4	0	0	0	116.6
912	V	30.2	Very low	28.2	Very low	109 Å²	109	140.6 Å²	140.6	66%	0.661	69%	0.694	S	S	*	*			cis	-160.1	139.8	37.1	84.1	0	0	0	0	113
913	Y	27.1	Very low	28.1	Very low	187 Å²	187	135.4 Å²	135.4	73%	0.733	69%	0.687	S	S	*	*			trans	57.6	115.4	136.9	-78.2	-146.9	0	0	0	119.2
914	L	26.7	Very low	28.1	Very low	111 Å²	111	135 Å²	135	58%	0.581	69%	0.694	S	S	*	*				83.3	138.4	78.1	-111.3	71.6	0	0	0	112.8
915	R	26.9	Very low	28.1	Very low	201 Å²	201	133.3 Å²	133.3	76%	0.758	69%	0.691	S	S	*	*			trans	68.8	156.6	153.9	-63.7	174.4	178.7	167.9	3.2	114.7
916	K	27.1	Very low	28.1	Very low	165 Å²	165	138.2 Å²	138.2	72%	0.717	70%	0.704	S	S	*	*			cis	-145.9	135	-15.6	-115.1	173.7	-179.9	-174	0	105.5
917	S	25.8	Very low	28.4	Very low	77 Å²	77	137.4 Å²	137.4	54%	0.538	71%	0.706	S	S	.	*				49.4	140.1	95	92.8	0	0	0	0	115.6
918	N	25.4	Very low	28.4	Very low	138 Å²	138	142 Å²	142	74%	0.738	71%	0.713	S	S	*	*			trans	69.6	94	147.3	-57.9	-1.7	0	0	0	117.7
919	S	25.3	Very low	28.5	Very low	88 Å²	88	149 Å²	149	62%	0.615	73%	0.726	S	S	*	*				72.8	155.1	112.1	79.4	0	0	0	0	119.8
920	K	24.9	Very low	28.3	Very low	177 Å²	177	148 Å²	148	77%	0.77	72%	0.718	S	S	*	*			trans	71.5	123.3	168.3	-56.4	161.9	-172.8	-179.4	0	111.2
921	S	24.3	Very low	28.9	Very low	100 Å²	100	147.2 Å²	147.2	70%	0.699	72%	0.724	S	S	*	*				64.9	143.8	55	-167.6	0	0	0	0	111.6
922	L	26.9	Very low	29	Very low	142 Å²	142	151.3 Å²	151.3	74%	0.743	73%	0.73	S	S	*	*			trans	69.5	140.4	-178	-50	118.9	0	0	0	113
923	T	27	Very low	29.3	Very low	106 Å²	106	152.2 Å²	152.2	65%	0.65	73%	0.731	S	S	*	*			cis	-163.5	166.6	-7.3	9	0	0	0	0	110.4
924	T	28.8	Very low	29.3	Very low	130 Å²	130	151.6 Å²	151.6	80%	0.798	73%	0.733	S	S	*	*			trans	67.3	142.6	147.7	46.7	0	0	0	0	118.9
925	A	31.4	Very low	29.3	Very low	71 Å²	71	156.2 Å²	156.2	59%	0.587	74%	0.744	S	S	*	*			cis	-159.6	146.2	0.3	0	0	0	0	0	114
926	R	30.6	Very low	29.2	Very low	230 Å²	230	151.1 Å²	151.1	87%	0.868	74%	0.739	S	S	*	*			trans	68.6	138.9	145.8	-70.1	166.2	179.6	-176.3	-1.7	116.3
927	K	36.7	Very low	29.1	Very low	174 Å²	174	151.5 Å²	151.5	76%	0.757	74%	0.743	S	S	*	*			cis	-135.2	136.4	-0.6	-100.6	154.9	179.6	-179.3	0	106.9
928	R	30.3	Very low	29.1	Very low	238 Å²	238	153 Å²	153	90%	0.898	75%	0.754	S	S	*	*				55.6	135.3	96.1	-62.7	-175.5	176.1	-178.3	-2.9	112.9
929	R	30.7	Very low	29.1	Very low	237 Å²	237	149.8 Å²	149.8	89%	0.894	75%	0.753	S	S	*	*			cis	-143.5	175.9	37.6	-146.4	174.4	177.7	160.6	-2.9	114.3
930	S	28.3	Very low	29.1	Very low	90 Å²	90	154.6 Å²	154.6	63%	0.629	77%	0.766	S	S	*	*			trans	-56.5	167	175.7	54.6	0	0	0	0	114.3
931	Q	43.7	Very low	29.4	Very low	187 Å²	187	154.8 Å²	154.8	87%	0.874	77%	0.769	S	S	*	*			cis	-127.1	178	26.5	-71.7	174.9	-18.3	0	0	114.8
932	R	31.1	Very low	29.7	Very low	219 Å²	219	155.2 Å²	155.2	83%	0.826	77%	0.77	S	S	*	*			trans	-155.9	154.4	-161.1	-123.6	-164	-177.9	167.5	0.6	112.7
933	N	37.3	Very low	29.6	Very low	128 Å²	128	154.3 Å²	154.3	68%	0.684	77%	0.769	S	S	*	*			trans	50.4	99.9	152.8	-62.5	17.7	0	0	0	118.5
934	F	26	Very low	29.5	Very low	175 Å²	175	153.8 Å²	153.8	77%	0.768	77%	0.77	S	S	*	*			trans	-153.1	137.7	155	-100.5	-75.4	0	0	0	110.6
935	Y	27.4	Very low	29.3	Very low	207 Å²	207	152.5 Å²	152.5	81%	0.812	77%	0.767	S	S	*	*			trans	60.2	158.5	174	-48.8	-66.2	0	0	0	116.7
936	S	25	Very low	29	Very low	94 Å²	94	154.1 Å²	154.1	66%	0.657	77%	0.773	S	S	*	*			cis	-150.9	143.2	-33.6	-92.9	0	0	0	0	106.3
937	H	24.8	Very low	28.8	Very low	173 Å²	173	148 Å²	148	80%	0.801	77%	0.766	S	S	*	*				62.6	89.9	59.3	-83.9	-77.5	0	0	0	115.7
938	S	24.8	Very low	28.4	Very low	110 Å²	110	147 Å²	147	77%	0.769	77%	0.769	S	S	*	*			trans	47.4	108	130.6	59.6	0	0	0	0	121.1
939	G	25.4	Very low	28.2	Very low	69 Å²	69	139.8 Å²	139.8	71%	0.711	76%	0.755	S	S	*	*				107.9	155.6	116.6	0	0	0	0	0	118.8
940	Q	26.3	Very low	28.2	Very low	190 Å²	190	135.7 Å²	135.7	89%	0.888	75%	0.749	S	S	*	*			trans	70.4	135	170.7	-39.6	-178.2	18.3	0	0	112
941	H	31.7	Very low	28.1	Very low	181 Å²	181	136.9 Å²	136.9	84%	0.838	75%	0.752	S	S	*	*				41.1	134.5	66.4	-77.7	-72.5	0	0	0	112.9
942	P	29.5	Very low	27.3	Very low	109 Å²	109	134.6 Å²	134.6	71%	0.708	75%	0.746	S	S	*	*			cis	-138.9	175	18.6	46.1	-29.1	0	0	0	115.7
943	V	24.8	Very low	27.2	Very low	122 Å²	122	129.7 Å²	129.7	74%	0.739	74%	0.74	S	S	*	*				40.8	133.7	128	179.9	0	0	0	0	121.6
944	S	24.3	Very low	26.9	Very low	96 Å²	96	129.9 Å²	129.9	67%	0.671	74%	0.737	S	S	*	*			trans	72.2	141.9	148.8	68.5	0	0	0	0	122
945	S	25.2	Very low	27.1	Very low	103 Å²	103	128.6 Å²	128.6	72%	0.72	73%	0.731	S	S	*	*			trans	51.9	141.1	136.3	60.6	0	0	0	0	120.4
946	S	24.7	Very low	27.4	Very low	104 Å²	104	126.1 Å²	126.1	73%	0.727	73%	0.725	S	S	*	*			cis	-165.6	179.8	0.3	37.3	0	0	0	0	109.5
947	S	27.5	Very low	27.7	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	73%	0.727	S	S	*	*			trans	-22.8	140.3	160.8	53.4	0	0	0	0	116.4
948	D	27.8	Very low	28.1	Very low	154 Å²	154	127.6 Å²	127.6	82%	0.824	72%	0.717	S	S	*	*				-150.7	168.1	111.1	-130.1	-47.4	0	0	0	114.2
949	S	26	Very low	28.3	Very low	85 Å²	85	128.7 Å²	128.7	59%	0.594	71%	0.714	S	S	*	*			trans	-80.3	165.7	-168.1	52.8	0	0	0	0	115.4
950	I	29.8	Very low	28.5	Very low	152 Å²	152	132.2 Å²	132.2	78%	0.779	71%	0.711	S	S	*	*				165	93.6	124.4	-80.3	154.8	0	0	0	111.3
951	V	26.5	Very low	28.6	Very low	115 Å²	115	127.8 Å²	127.8	70%	0.697	69%	0.694	S	S	*	*				26.4	119.8	124.4	-175.3	0	0	0	0	119.1
952	N	28.4	Very low	28.6	Very low	139 Å²	139	127.7 Å²	127.7	74%	0.743	69%	0.691	S	S	*	*				177.2	137.6	116.7	-98	-48.9	0	0	0	115.9
953	V	28.8	Very low	28.7	Very low	115 Å²	115	127.1 Å²	127.1	70%	0.697	69%	0.69	S	S	*	*			trans	62.9	130.3	134.7	174.2	0	0	0	0	120
954	E	29.2	Very low	29	Very low	133 Å²	133	124.7 Å²	124.7	62%	0.621	69%	0.689	S	S	*	*			cis	-166.1	163.2	-11.2	-116.2	-164.9	141.8	0	0	113.4
955	K	31.4	Very low	29.5	Very low	147 Å²	147	128.5 Å²	128.5	64%	0.639	69%	0.694	S	S	*	*			trans	68.1	94.1	143.7	-75.1	171.1	177.9	136	0	122.7
956	K	33.4	Very low	29.9	Very low	156 Å²	156	126.4 Å²	126.4	68%	0.678	68%	0.679	S	S	*	*				78.4	125.2	99.6	-85.7	-175	144.4	-178.1	0	122
957	R	31.7	Very low	30.2	Very low	185 Å²	185	126.3 Å²	126.3	70%	0.698	68%	0.678	S	S	*	*				86.1	149.3	129	-70.9	-171.8	-53	162.6	-0.4	119.2
958	D	32.7	Very low	30.3	Very low	113 Å²	113	126 Å²	126	60%	0.604	68%	0.675	S	S	*	*			cis	-156.7	151.1	3.5	-105.6	-22	0	0	0	112.5
959	L	29.5	Very low	30.5	Very low	132 Å²	132	121.2 Å²	121.2	69%	0.691	65%	0.653	S	S	*	*			trans	49.5	153.1	142.6	-83.1	83.7	0	0	0	122.9
960	H	29.5	Very low	30.7	Very low	143 Å²	143	126.8 Å²	126.8	66%	0.662	66%	0.663	S	S	*	*			cis	-171.2	158.6	-15.7	-124.5	-159.4	0	0	0	112.7
961	N	28.8	Very low	30.6	Very low	98 Å²	98	126.3 Å²	126.3	52%	0.524	66%	0.658	S	S	.	*			trans	63.1	150.3	145.5	-64.5	5.8	0	0	0	121.8
962	F	30.7	Very low	30.7	Very low	179 Å²	179	128.2 Å²	128.2	79%	0.785	66%	0.662	S	S	*	*			cis	-172	173.3	-10.2	-102.4	-6.3	0	0	0	109.6
963	S	31.1	Very low	30.9	Very low	97 Å²	97	130.3 Å²	130.3	68%	0.678	67%	0.667	S	S	*	*			cis	-178.9	69.6	-33.3	-177.7	0	0	0	0	115
964	G	32.9	Very low	31	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	67%	0.674	S	S	*	*			trans	102.9	-175.1	158	0	0	0	0	0	117.9
965	K	34.2	Very low	31	Very low	177 Å²	177	131.7 Å²	131.7	77%	0.77	68%	0.683	S	S	*	*			cis	-144.2	155	0.9	-57.4	172.8	-176.8	175.1	0	109.5
966	S	33.8	Very low	30.8	Very low	58 Å²	58	129.9 Å²	129.9	41%	0.406	68%	0.68	S	S	.	*			cis	101.1	92.6	2.2	85.4	0	0	0	0	119.4	T494	T494-S966 PolarHBondContact O-N 2.88Å; T494-S966 WeakPolarHBondContact OG1-CB 3.43Å
967	S	30.9	Very low	30.7	Very low	102 Å²	102	131.4 Å²	131.4	71%	0.713	68%	0.682	S	S	*	*			trans	-155	141.9	148.6	55.7	0	0	0	0	110.9
968	C	29.8	Very low	30.5	Very low	97 Å²	97	128.5 Å²	128.5	66%	0.655	68%	0.679	S	S	*	*			cis	-158.4	158.3	-6.2	-105.3	0	0	0	0	107.8
969	S	31.3	Very low	30.3	Very low	52 Å²	52	130.6 Å²	130.6	36%	0.364	69%	0.685	S	S	.	*			cis	69.5	125.1	16.5	75	0	0	0	0	116.9	E971	S969-E971 WeakPolarHBondContact CA-OE2 3.49Å; S969-E971 WeakPolarHBondContact CB-OE2 3.18Å
970	Y	29.5	Very low	30.2	Very low	202 Å²	202	129.4 Å²	129.4	79%	0.792	69%	0.688	S	S	*	*			cis	-139.6	162.3	19.2	-55.8	-92	0	0	0	110.3
971	E	28.5	Very low	30.3	Very low	143 Å²	143	127.7 Å²	127.7	67%	0.668	69%	0.688	S	S	*	*			cis	96.4	116.4	13.1	-58.7	166.3	99.6	0	0	117.4	S969	S969-E971 WeakPolarHBondContact CA-OE2 3.49Å; S969-E971 WeakPolarHBondContact CB-OE2 3.18Å
972	I	29.7	Very low	30.5	Very low	155 Å²	155	128.9 Å²	128.9	80%	0.795	70%	0.7	S	S	*	*			trans	84.4	172.3	147.7	-70.3	171.6	0	0	0	119.9
973	E	32	Very low	30.2	Very low	182 Å²	182	125.3 Å²	125.3	85%	0.85	69%	0.693	S	S	*	*			trans	-72.5	-179.3	-157.4	-59.1	161.8	96.6	0	0	118.6
974	C	30.3	Very low	30.1	Very low	123 Å²	123	129.3 Å²	129.3	83%	0.831	70%	0.698	S	S	*	*			trans	-80	165.1	173.2	-78.5	0	0	0	0	115.6
975	L	28.6	Very low	29.8	Very low	154 Å²	154	130.3 Å²	130.3	81%	0.806	70%	0.699	S	S	*	*			trans	89.7	118	158.4	-78.6	167.6	0	0	0	121.5
976	D	28.7	Very low	29.3	Very low	110 Å²	110	126.1 Å²	126.1	59%	0.588	69%	0.692	S	S	*	*			trans	71	97	137.6	-85.9	8.1	0	0	0	122.3
977	R	30	Very low	29	Very low	188 Å²	188	129.5 Å²	129.5	71%	0.709	71%	0.706	S	S	*	*				116.8	120.3	96.8	-90	177.2	-166.7	-100.8	-10.5	120.2
978	L	28.3	Very low	29.3	Very low	124 Å²	124	129.2 Å²	129.2	65%	0.649	70%	0.704	S	S	*	*			trans	72.8	149.4	137.8	-54	169.8	0	0	0	116.5
979	Q	28.5	Very low	29.4	Very low	156 Å²	156	128.9 Å²	128.9	73%	0.729	70%	0.701	S	S	*	*			cis	-161.7	-175.9	-2.1	-130.3	168.2	-2.7	0	0	113.1
980	S	26.7	Very low	29.1	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	72%	0.716	S	S	*	*			trans	86.3	102.1	164.9	69.6	0	0	0	0	116.5
981	V	33	Very low	28.8	Very low	107 Å²	107	131.4 Å²	131.4	65%	0.648	71%	0.711	S	S	*	*			cis	83.2	112.3	47.3	178.5	0	0	0	0	111.7	V983	V981-V983 HydrophobicContact CG1-CB 4.26Å; V981-V983 HydrophobicContact CG1-CG2 3.57Å
982	P	32	Very low	28.7	Very low	122 Å²	122	128.3 Å²	128.3	79%	0.792	71%	0.706	S	S	*	*				-99.1	151.7	85	-19.3	35.7	0	0	0	114.3
983	V	25.6	Very low	28.4	Very low	105 Å²	105	129.5 Å²	129.5	64%	0.636	71%	0.705	S	S	*	*			cis	66.9	108.9	41.5	166.7	0	0	0	0	110.2	V981	V981-V983 HydrophobicContact CG1-CB 4.26Å; V981-V983 HydrophobicContact CG1-CG2 3.57Å
984	K	27.9	Very low	28.1	Very low	181 Å²	181	127.1 Å²	127.1	79%	0.787	70%	0.699	S	S	*	*			cis	-129	166.3	12.1	-83.5	132.8	176.1	176.8	0	109.8
985	A	26.2	Very low	27.9	Very low	90 Å²	90	130.5 Å²	130.5	74%	0.744	69%	0.694	S	S	*	*				51.5	143	60.1	0	0	0	0	0	113
986	S	24.9	Very low	27.8	Very low	89 Å²	89	127.9 Å²	127.9	62%	0.622	68%	0.681	S	S	*	*			cis	-159	176.8	-6.9	47.7	0	0	0	0	108.2
987	D	27.9	Very low	27.7	Very low	129 Å²	129	128.8 Å²	128.8	69%	0.69	69%	0.686	S	S	*	*			trans	71.6	139.8	166	-52.9	-63.3	0	0	0	114.3
988	S	35.2	Very low	27.6	Very low	96 Å²	96	126.7 Å²	126.7	67%	0.671	68%	0.684	S	S	*	*			cis	65.4	157.1	35.9	107.7	0	0	0	0	112.7
989	P	31.9	Very low	27.6	Very low	90 Å²	90	128.1 Å²	128.1	58%	0.584	69%	0.687	S	S	*	*			cis	-130.7	-164	-6.2	40.9	-24.3	0	0	0	112.1
990	Q	24.9	Very low	27.6	Very low	146 Å²	146	125.7 Å²	125.7	68%	0.682	68%	0.683	S	S	*	*			trans	68	173.2	154.3	-70.9	168.3	33.1	0	0	115
991	K	24.8	Very low	27.7	Very low	161 Å²	161	126.9 Å²	126.9	70%	0.7	68%	0.679	S	S	*	*			cis	-151.7	136.7	-1	-137.6	156.4	-172.5	152.5	0	111.8
992	S	25.3	Very low	27.5	Very low	79 Å²	79	127.6 Å²	127.6	55%	0.552	68%	0.68	S	S	*	*			trans	56.1	160.5	139.2	56.2	0	0	0	0	123.9
993	F	24.1	Very low	27.4	Very low	179 Å²	179	127.5 Å²	127.5	79%	0.785	67%	0.672	S	S	*	*			trans	77.7	145.1	164.9	-55.9	-70.8	0	0	0	118.6
994	N	25.1	Very low	27.7	Very low	133 Å²	133	128.3 Å²	128.3	71%	0.711	68%	0.678	S	S	*	*			cis	-164.1	165.7	-39.1	-137.7	3.6	0	0	0	112.4
995	R	26.7	Very low	27.9	Very low	194 Å²	194	126.4 Å²	126.4	73%	0.732	68%	0.676	S	S	*	*			trans	72.3	119.9	154.4	-67.1	-171.1	83.6	153.9	9	121.2
996	D	26.9	Very low	28.1	Very low	99 Å²	99	129.9 Å²	129.9	53%	0.529	68%	0.681	S	S	.	*				77.1	103.8	122	-54.4	4.8	0	0	0	121
997	N	25.4	Very low	28.7	Very low	128 Å²	128	128.8 Å²	128.8	68%	0.684	68%	0.683	S	S	*	*				94.7	119.7	125	-63.7	-4.3	0	0	0	121.7
998	Q	28.1	Very low	28.9	Very low	144 Å²	144	128.2 Å²	128.2	67%	0.673	69%	0.688	S	S	*	*				56.4	140	121.8	-49.2	-38.9	89.5	0	0	118.9
999	E	28.4	Very low	28.8	Very low	154 Å²	154	132.3 Å²	132.3	72%	0.72	69%	0.694	S	S	*	*			cis	-171.9	179.5	10.5	-126.4	168.1	-120.8	0	0	109.6
1000	V	29	Very low	28.8	Very low	105 Å²	105	132.8 Å²	132.8	64%	0.636	70%	0.699	S	S	*	*			cis	-160.5	164.1	0.9	69.2	0	0	0	0	110.9
1001	I	28.2	Very low	29.1	Very low	134 Å²	134	132.1 Å²	132.1	69%	0.687	70%	0.7	S	S	*	*			trans	68.5	97.3	154.2	-73.3	161.9	0	0	0	121.3
1002	D	28.3	Very low	29.2	Very low	122 Å²	122	131.3 Å²	131.3	65%	0.652	70%	0.703	S	S	*	*				82.8	111.9	113.9	-68.9	24.2	0	0	0	126.6
1003	N	30.3	Very low	29.5	Very low	119 Å²	119	135.6 Å²	135.6	64%	0.636	72%	0.715	S	S	*	*				99.6	95.2	114.1	-64.8	-13.5	0	0	0	124.6
1004	T	31.5	Very low	29.8	Very low	122 Å²	122	134.3 Å²	134.3	75%	0.748	72%	0.715	S	S	*	*				68.4	148.3	120.6	57.7	0	0	0	0	123.8
1005	D	32.6	Very low	30.4	Very low	141 Å²	141	135.9 Å²	135.9	75%	0.754	72%	0.723	S	S	*	*			cis	-173.5	172.8	-27.1	-153.3	-10.8	0	0	0	111.9
1006	I	30.9	Very low	30.4	Very low	164 Å²	164	129.7 Å²	129.7	84%	0.841	72%	0.719	S	S	*	*			trans	83.7	143	158.8	-59.7	154.9	0	0	0	119.3
1007	G	36.2	Very low	31	Very low	65 Å²	65	133.9 Å²	133.9	67%	0.67	74%	0.735	S	S	*	*			trans	172.8	-140.1	175	0	0	0	0	0	114.2
1008	C	33.3	Very low	31.2	Very low	117 Å²	117	134.9 Å²	134.9	79%	0.791	74%	0.741	S	S	*	*			trans	92.5	147.6	153.5	-133.5	0	0	0	0	122.5
1009	K	32.6	Very low	31.5	Very low	183 Å²	183	134.6 Å²	134.6	80%	0.796	74%	0.743	S	S	*	*			trans	81.3	150.2	153.8	-72.8	156.6	-171.4	172.8	0	119.9
1010	S	31.7	Very low	31.6	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	75%	0.749	S	S	*	*			cis	177.9	159.4	-7	52.1	0	0	0	0	110.1
1011	N	31.3	Very low	31.7	Very low	133 Å²	133	133.9 Å²	133.9	71%	0.711	75%	0.753	S	S	*	*			cis	-170.5	171.2	-10.7	-114.8	75.6	0	0	0	111.1
1012	N	27.5	Very low	31.8	Very low	143 Å²	143	135 Å²	135	77%	0.765	76%	0.76	S	S	*	*			trans	80.9	125.8	146.9	-84.1	43.6	0	0	0	124.6
1013	E	32.2	Very low	32.1	Very low	169 Å²	169	135.4 Å²	135.4	79%	0.79	77%	0.767	S	S	*	*			trans	-68.8	-175.9	151	-64.7	155.7	100.1	0	0	111.1
1014	L	29.9	Very low	32.5	Very low	153 Å²	153	138 Å²	138	80%	0.801	78%	0.775	S	S	*	*			cis	-163.6	177.6	37.2	-155.3	127.2	0	0	0	113.4
1015	L	37.1	Very low	32.5	Very low	166 Å²	166	136.4 Å²	136.4	87%	0.869	77%	0.767	S	S	*	*			trans	-84.2	175.5	-174.8	-73.3	161.1	0	0	0	115.2
1016	G	27.4	Very low	32.2	Very low	63 Å²	63	135.7 Å²	135.7	65%	0.649	76%	0.759	S	S	*	*			trans	131.8	97.4	-178.1	0	0	0	0	0	109
1017	E	39.6	Very low	32	Very low	188 Å²	188	136.3 Å²	136.3	88%	0.879	75%	0.753	S	S	*	*				61.6	113.9	57.2	-55.5	-164.6	143.9	0	0	113.3
1018	D	29.2	Very low	31.4	Very low	148 Å²	148	138.5 Å²	138.5	79%	0.791	75%	0.749	S	S	*	*			trans	-173.2	133.7	156	-109.2	-19.9	0	0	0	113.4
1019	L	33.7	Very low	31.2	Very low	139 Å²	139	138.3 Å²	138.3	73%	0.728	74%	0.744	S	S	*	*			trans	63.9	94.4	143	-55.3	172.9	0	0	0	122.5
1020	D	31.1	Very low	30.8	Very low	156 Å²	156	136.9 Å²	136.9	83%	0.834	74%	0.74	S	S	*	*				40.9	155.9	107	-78.8	-59.6	0	0	0	125.9
1021	A	30.5	Very low	30.7	Very low	87 Å²	87	136.4 Å²	136.4	72%	0.719	74%	0.735	S	S	*	*			trans	75.6	117.5	152.3	0	0	0	0	0	121.1
1022	D	31.5	Very low	30.4	Very low	157 Å²	157	136.6 Å²	136.6	84%	0.84	73%	0.731	S	S	*	*			trans	28.3	110.2	136.9	-64.1	-19	0	0	0	119.8
1023	T	33.6	Very low	30.4	Very low	132 Å²	132	136.8 Å²	136.8	81%	0.81	73%	0.725	S	S	*	*				-170.3	98.1	119.6	-75	0	0	0	0	109.7
1024	E	38.9	Very low	30	Very low	172 Å²	172	135.2 Å²	135.2	80%	0.804	72%	0.721	S	S	*	*			trans	-54	142.6	145.8	-91.3	-104.5	-176.2	0	0	108
1025	P	31.2	Very low	29.7	Very low	89 Å²	89	133.7 Å²	133.7	58%	0.578	72%	0.718	S	S	*	*				-155.2	-169.7	56	45.4	-25	0	0	0	116.8
1026	E	26.5	Very low	29.3	Very low	126 Å²	126	130.6 Å²	130.6	59%	0.589	70%	0.703	S	S	*	*				26.1	114.2	126.1	-166.5	-177.9	-121.1	0	0	116.9
1027	Y	26.6	Very low	29.4	Very low	178 Å²	178	136.7 Å²	136.7	70%	0.698	71%	0.706	S	S	*	*				-163.1	132.3	95.1	-91.3	-78.7	0	0	0	106.4
1028	D	23.5	Very low	28.8	Very low	110 Å²	110	130.6 Å²	130.6	59%	0.588	69%	0.685	S	S	*	*				48.2	127.8	88.1	-146.4	28.9	0	0	0	111.2
1029	V	29.6	Very low	28.8	Very low	113 Å²	113	128.8 Å²	128.8	69%	0.685	68%	0.678	S	S	*	*			cis	-145.7	133.9	40.8	-163.8	0	0	0	0	104.9
1030	Q	23.7	Very low	28.6	Very low	154 Å²	154	124.3 Å²	124.3	72%	0.72	67%	0.666	S	S	*	*				44.1	159.1	79.9	-85.2	-161.4	93.1	0	0	114.9
1031	P	30.2	Very low	28.6	Very low	89 Å²	89	125 Å²	125	58%	0.578	66%	0.657	S	S	*	*			cis	-122.7	-124.3	-39.5	27.3	-6.2	0	0	0	108.2
1032	E	25.7	Very low	28.4	Very low	137 Å²	137	128.9 Å²	128.9	64%	0.64	66%	0.657	S	S	*	*			trans	27.4	141.7	138	-62.2	-169	177	0	0	121.5
1033	K	26.2	Very low	28.3	Very low	147 Å²	147	130.5 Å²	130.5	64%	0.639	65%	0.653	S	S	*	*			cis	-176.3	178.5	3.3	-113.4	170.7	-163.6	151.4	0	107.4
1034	L	24.9	Very low	28	Very low	135 Å²	135	129.2 Å²	129.2	71%	0.707	65%	0.645	S	S	*	*			trans	6.1	128.1	145.5	-78.3	79.8	0	0	0	119.1
1035	T	23.8	Very low	27.6	Very low	121 Å²	121	129.4 Å²	129.4	74%	0.742	65%	0.646	S	S	*	*			trans	73	162.1	134.1	71.2	0	0	0	0	118.1
1036	D	27.1	Very low	27.6	Very low	102 Å²	102	129.7 Å²	129.7	55%	0.545	65%	0.647	S	S	.	*			cis	-145	-178.1	-1.4	-148	-7.1	0	0	0	112.7
1037	R	29.9	Very low	27.4	Very low	190 Å²	190	130.2 Å²	130.2	72%	0.717	66%	0.655	S	S	*	*			trans	-5.9	137.1	135.7	-63.9	161.4	-167.5	123.1	-10.1	113.4
1038	S	28.5	Very low	27.3	Very low	61 Å²	61	126.4 Å²	126.4	43%	0.427	65%	0.654	S	S	.	*				-165.3	136.8	73.3	37.3	0	0	0	0	110.3	N1572	S1038-N1572 PolarHBondContact O-ND2 3.12Å; S1038-N1572 PolarHBondContact OG-ND2 3.04Å
1039	V	27.4	Very low	27.5	Very low	109 Å²	109	131.1 Å²	131.1	66%	0.661	66%	0.663	S	S	*	*				54.4	115	65.3	-176.7	0	0	0	0	109.5
1040	G	29.6	Very low	27.3	Very low	45 Å²	45	132.8 Å²	132.8	46%	0.464	66%	0.664	S	S	.	*			cis	-179.5	-144.4	9	0	0	0	0	0	107.3
1041	R	31	Very low	27.4	Very low	172 Å²	172	131 Å²	131	65%	0.649	66%	0.659	S	S	*	*			cis	-129.9	168.2	1.8	-76	-177.5	167.6	-168.9	-2.7	108.6	R1576	R1041-R1576 PolarHBondContact O-NH1 3.01Å
1042	K	28	Very low	27.3	Very low	167 Å²	167	136 Å²	136	73%	0.726	67%	0.667	S	S	*	*				28.7	117.1	86	-30.2	-175.1	177.3	-172.6	0	111.3
1043	Y	28.8	Very low	27.5	Very low	192 Å²	192	136.1 Å²	136.1	75%	0.753	67%	0.671	S	S	*	*				-123.1	144.6	62.2	-82	-91.1	0	0	0	111.3
1044	V	26.3	Very low	27.5	Very low	105 Å²	105	135 Å²	135	64%	0.636	67%	0.672	S	S	*	*				57.5	107.3	78.5	-177.8	0	0	0	0	109.1
1045	Q	32.3	Very low	27.7	Very low	176 Å²	176	132.1 Å²	132.1	82%	0.822	66%	0.663	S	S	*	*				58.9	145.2	89.7	-108.2	-171.9	8.3	0	0	112.6
1046	P	29.8	Very low	28	Very low	94 Å²	94	135.9 Å²	135.9	61%	0.61	67%	0.669	S	S	*	*			cis	-138.7	-163.8	13.8	41.7	-21.4	0	0	0	114.4
1047	N	23.4	Very low	28.2	Very low	138 Å²	138	133.7 Å²	133.7	74%	0.738	67%	0.671	S	S	*	*			trans	53.2	105.8	143.9	-64.7	-7.5	0	0	0	121
1048	S	24.1	Very low	28.2	Very low	98 Å²	98	130.7 Å²	130.7	69%	0.685	67%	0.674	S	S	*	*				77.9	163.6	113.5	80.7	0	0	0	0	119.8
1049	R	26.5	Very low	28.4	Very low	208 Å²	208	134.8 Å²	134.8	79%	0.785	68%	0.684	S	S	*	*			trans	66.2	99.1	165	-62.2	-170	173.6	158.9	-0.4	113.2
1050	Q	26	Very low	28.5	Very low	149 Å²	149	135.8 Å²	135.8	70%	0.696	68%	0.681	S	S	*	*				89.5	152.9	85.3	-87.5	174.2	-91.1	0	0	109.5
1051	D	26.6	Very low	28.5	Very low	117 Å²	117	137.6 Å²	137.6	63%	0.626	69%	0.686	S	S	*	*			trans	67.8	139.9	161.6	-69	-4.5	0	0	0	116.8
1052	R	27.4	Very low	28.6	Very low	193 Å²	193	138.2 Å²	138.2	73%	0.728	69%	0.69	S	S	*	*			cis	-175.2	150.1	-16.5	-124.3	171.4	179.6	179.9	-4.9	107.2
1053	L	29.2	Very low	28.7	Very low	139 Å²	139	136.1 Å²	136.1	73%	0.728	69%	0.692	S	S	*	*			trans	63.4	173.1	155.5	-55.3	165.3	0	0	0	113
1054	N	26.9	Very low	28.9	Very low	124 Å²	124	131 Å²	131	66%	0.663	68%	0.684	S	S	*	*			cis	-149	124.7	-25.5	-116.6	-2.3	0	0	0	105.5
1055	S	29.5	Very low	29.1	Very low	74 Å²	74	132.7 Å²	132.7	52%	0.517	69%	0.689	S	S	.	*				89.6	145.8	77.8	81.2	0	0	0	0	113.8
1056	K	30.8	Very low	29	Very low	201 Å²	201	130.8 Å²	130.8	87%	0.874	69%	0.685	S	S	*	*			trans	76.3	136.2	169	-52.7	165.3	-173.3	-178.6	0	114
1057	G	31.5	Very low	29.3	Very low	56 Å²	56	130.6 Å²	130.6	58%	0.577	69%	0.686	S	S	*	*			cis	-156.1	151.8	-0.4	0	0	0	0	0	112.2
1058	T	29.2	Very low	29.9	Very low	127 Å²	127	129.4 Å²	129.4	78%	0.779	69%	0.686	S	S	*	*				75.4	131.4	89.7	59.4	0	0	0	0	112.5
1059	K	31.7	Very low	30.3	Very low	147 Å²	147	134.5 Å²	134.5	64%	0.639	69%	0.69	S	S	*	*			cis	-167.4	154.2	16	-126.3	162.5	156.9	-99	0	110.3
1060	E	30.7	Very low	30.5	Very low	130 Å²	130	131.4 Å²	131.4	61%	0.607	68%	0.684	S	S	*	*			trans	61.9	153.9	147.8	-79.3	139.9	-166.1	0	0	118.9
1061	S	29.8	Very low	30.7	Very low	82 Å²	82	128.6 Å²	128.6	57%	0.573	68%	0.681	S	S	*	*			cis	179.1	171.6	-17.4	57.7	0	0	0	0	107.8
1062	Y	31.8	Very low	31	Very low	186 Å²	186	130 Å²	130	73%	0.729	69%	0.688	S	S	*	*			cis	-158.7	159.1	15.6	-101.5	-56	0	0	0	109.8
1063	T	31.1	Very low	31.3	Very low	123 Å²	123	127.9 Å²	127.9	76%	0.755	69%	0.691	S	S	*	*			trans	54.4	145.8	144.7	55.6	0	0	0	0	122.6
1064	S	32.2	Very low	31.3	Very low	84 Å²	84	128 Å²	128	59%	0.587	69%	0.692	S	S	*	*			cis	-176.6	143.8	-9.8	51.3	0	0	0	0	113.9
1065	N	29.8	Very low	31.5	Very low	140 Å²	140	132.1 Å²	132.1	75%	0.749	70%	0.7	S	S	*	*				57.2	146.4	128.3	-57.9	-5	0	0	0	121
1066	N	31.9	Very low	31.5	Very low	136 Å²	136	133.6 Å²	133.6	73%	0.727	71%	0.705	S	S	*	*			cis	-151.5	160.7	0.1	-93.1	-29.1	0	0	0	108
1067	S	35.7	Very low	31.4	Very low	91 Å²	91	133 Å²	133	64%	0.636	70%	0.703	S	S	*	*				57.6	152.4	59.9	-100.7	0	0	0	0	115.2
1068	P	36.4	Very low	31.3	Very low	113 Å²	113	134 Å²	134	73%	0.734	71%	0.705	S	S	*	*			cis	-127.4	168.9	15.7	28.3	-3.8	0	0	0	115.2
1069	R	31.5	Very low	31.3	Very low	204 Å²	204	136 Å²	136	77%	0.77	71%	0.706	S	S	*	*				59.4	157.8	78.6	-35	-178.8	179.2	-164.8	2	116.1
1070	Q	31	Very low	31.1	Very low	144 Å²	144	135.9 Å²	135.9	67%	0.673	71%	0.709	S	S	*	*			cis	-167.1	174.9	16.7	-150.9	164.1	-90.6	0	0	112.6
1071	S	30.7	Very low	31.1	Very low	90 Å²	90	136.1 Å²	136.1	63%	0.629	71%	0.71	S	S	*	*			trans	66.5	159.3	153.7	35.3	0	0	0	0	119.7
1072	D	33.1	Very low	31.1	Very low	145 Å²	145	139.3 Å²	139.3	78%	0.775	72%	0.716	S	S	*	*			cis	-165.9	172.4	-16.8	-98.5	-18.9	0	0	0	112.3
1073	L	32.3	Very low	31	Very low	149 Å²	149	133.9 Å²	133.9	78%	0.78	71%	0.705	S	S	*	*			trans	75	121.6	148.9	-108.7	70.2	0	0	0	126
1074	D	28.8	Very low	31.3	Very low	141 Å²	141	136.2 Å²	136.2	75%	0.754	71%	0.708	S	S	*	*			trans	3.3	133	137.7	-48.3	-29.8	0	0	0	124.3
1075	Y	32.7	Very low	31.1	Very low	212 Å²	212	138 Å²	138	83%	0.831	71%	0.709	S	S	*	*				-177.1	115.1	122.8	-143	-108	0	0	0	110.1
1076	V	28.3	Very low	31.3	Very low	104 Å²	104	137.1 Å²	137.1	63%	0.63	71%	0.714	S	S	*	*				69.5	89.1	74.6	-178	0	0	0	0	116.8
1077	K	30.1	Very low	31.2	Very low	188 Å²	188	137 Å²	137	82%	0.817	71%	0.707	S	S	*	*				178.5	132.8	128.8	-103.1	-179	176.1	-178	0	110.3
1078	A	29.2	Very low	30.9	Very low	77 Å²	77	142.8 Å²	142.8	64%	0.636	72%	0.715	S	S	*	*				65.7	130.9	92.4	0	0	0	0	0	113.7
1079	E	28	Very low	30.4	Very low	169 Å²	169	146 Å²	146	79%	0.79	72%	0.717	S	S	*	*			cis	-156.5	166.7	5	-120	157.8	165.8	0	0	112.6
1080	M	28.8	Very low	30.2	Very low	145 Å²	145	140.9 Å²	140.9	71%	0.714	71%	0.713	S	S	*	*			trans	10.8	138.5	148.7	-62.4	168.4	80.1	0	0	118.8
1081	H	30.2	Very low	30.1	Very low	135 Å²	135	139.3 Å²	139.3	63%	0.625	71%	0.713	S	S	*	*			cis	-165.1	167.8	25.2	-121.8	-148	0	0	0	108.1
1082	E	28.8	Very low	29.9	Very low	150 Å²	150	141.8 Å²	141.8	70%	0.701	72%	0.719	S	S	*	*			cis	-153.2	-172.6	-2.9	-145.8	174.7	161.8	0	0	111.6
1083	S	30.5	Very low	29.7	Very low	71 Å²	71	139.6 Å²	139.6	50%	0.497	72%	0.715	S	S	.	*			trans	-60.1	161	-178.8	46.8	0	0	0	0	115.2
1084	H	36.6	Very low	29.4	Very low	173 Å²	173	137.6 Å²	137.6	80%	0.801	71%	0.714	S	S	*	*			cis	-137.3	124.7	36.1	-83.3	-93.2	0	0	0	116.3
1085	I	29.2	Very low	29.2	Very low	122 Å²	122	135.2 Å²	135.2	63%	0.626	71%	0.708	S	S	*	*			trans	-114.8	124.4	165.2	-52.6	174.1	0	0	0	108.8	K1087	I1085-K1087 HydrophobicContact CB-CD 4.11Å; I1085-K1087 HydrophobicContact CB-CG 4.5Å; I1085-K1087 HydrophobicContact CG2-CB 3.88Å; I1085-K1087 HydrophobicContact CG2-CD 3.74Å; I1085-K1087 HydrophobicContact CG2-CG 3.66Å
1086	S	34.2	Very low	28.9	Very low	121 Å²	121	132.7 Å²	132.7	85%	0.846	71%	0.708	S	S	*	*			trans	-123.1	93.1	161.8	-62	0	0	0	0	107.1
1087	K	28.7	Very low	28.9	Very low	134 Å²	134	133.2 Å²	133.2	58%	0.583	71%	0.711	S	S	*	*			cis	67.7	85.2	35.8	-105.8	173.8	-171	166.9	0	114.7	I1085	I1085-K1087 HydrophobicContact CB-CD 4.11Å; I1085-K1087 HydrophobicContact CB-CG 4.5Å; I1085-K1087 HydrophobicContact CG2-CB 3.88Å; I1085-K1087 HydrophobicContact CG2-CD 3.74Å; I1085-K1087 HydrophobicContact CG2-CG 3.66Å
1088	R	28.8	Very low	28.8	Very low	211 Å²	211	130 Å²	130	80%	0.796	70%	0.703	S	S	*	*				85.2	158.6	125.2	-71.5	177.8	176.8	-173.9	-3.2	120.6
1089	K	27.6	Very low	28.8	Very low	181 Å²	181	134.4 Å²	134.4	79%	0.787	70%	0.703	S	S	*	*			trans	80.9	117.9	166.4	-67.3	159.1	179.9	-175.2	0	114.5
1090	S	27.5	Very low	29	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	70%	0.703	S	S	*	*			cis	72.9	163.1	28.8	98.2	0	0	0	0	114.8
1091	V	28.1	Very low	29.1	Very low	110 Å²	110	137.3 Å²	137.3	67%	0.667	70%	0.703	S	S	*	*			trans	72.4	101.1	-161.2	-163.5	0	0	0	0	109.1
1092	D	27.2	Very low	29.1	Very low	142 Å²	142	141 Å²	141	76%	0.759	71%	0.712	S	S	*	*				66.9	171.7	56.1	-55.2	-68.9	0	0	0	112.8
1093	S	27.8	Very low	29.3	Very low	100 Å²	100	143 Å²	143	70%	0.699	71%	0.713	S	S	*	*			trans	59.6	75.5	172.4	-59.8	0	0	0	0	113.9
1094	S	26.4	Very low	29.1	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	71%	0.71	S	S	*	*				65.5	165	63.8	102.4	0	0	0	0	114.1
1095	S	24.9	Very low	28.8	Very low	91 Å²	91	139.8 Å²	139.8	64%	0.636	70%	0.697	S	S	*	*			trans	77.7	121.7	165.1	87.3	0	0	0	0	117.7
1096	L	26.7	Very low	29	Very low	159 Å²	159	136.9 Å²	136.9	83%	0.832	68%	0.682	S	S	*	*				79.1	153.3	123.2	-75.3	174.4	0	0	0	121.9
1097	V	27.7	Very low	28.6	Very low	115 Å²	115	134.6 Å²	134.6	70%	0.697	67%	0.666	S	S	*	*			trans	73.3	70.2	150.7	173	0	0	0	0	117.2
1098	D	28	Very low	28.7	Very low	120 Å²	120	133.4 Å²	133.4	64%	0.642	67%	0.67	S	S	*	*				72.4	173.2	104.8	-161.6	11.6	0	0	0	118.1
1099	R	29.8	Very low	28.7	Very low	169 Å²	169	130.4 Å²	130.4	64%	0.638	67%	0.67	S	S	*	*			trans	66.9	111.4	155.1	-77	152.2	-156.7	-150.4	2.5	119.7
1100	R	31.2	Very low	28.8	Very low	208 Å²	208	128.4 Å²	128.4	79%	0.785	67%	0.667	S	S	*	*				78	103.6	126.8	-64.7	170.3	-175.3	-165.2	0.5	114.8
1101	K	31.7	Very low	28.9	Very low	168 Å²	168	129.5 Å²	129.5	73%	0.73	67%	0.666	S	S	*	*				81.3	113.8	82.5	-87.2	-176.5	175.1	174.4	0	113.5
1102	R	30.3	Very low	29	Very low	211 Å²	211	132.4 Å²	132.4	80%	0.796	67%	0.672	S	S	*	*			trans	76.8	135.1	141.2	-61.2	170.3	171	-177.3	-6	118.9
1103	R	31.6	Very low	29.1	Very low	193 Å²	193	133.1 Å²	133.1	73%	0.728	67%	0.668	S	S	*	*			trans	59.8	101	145.6	-75.5	-169.1	170.5	-160.3	-3.8	117.8
1104	S	27.6	Very low	29.2	Very low	61 Å²	61	132.2 Å²	132.2	43%	0.427	66%	0.662	S	S	.	*				80.7	172.7	66.7	70.5	0	0	0	0	115.5	H794	H794-S1104 VanDerWaalsContact CE1-CB 3.42Å; H794-S1104 WeakPolarHBondContact CE1-CB 3.44Å; H794-S1104 PolarHBondContact CE1-OG 3.32Å; H794-S1104 PolarHBondContact NE2-O 3.25Å; H794-S1104 PolarHBondContact NE2-OG 3.12Å
1105	Q	29.9	Very low	29.5	Very low	116 Å²	116	136.3 Å²	136.3	54%	0.542	67%	0.666	S	S	.	*			trans	81.4	126.8	154.7	-56	153.9	-107.3	0	0	106.6	H794	H794-Q1105 VanDerWaalsContact CB-CA 3.49Å; H794-Q1105 HydrophobicContact CB-CB 3.3Å; H794-Q1105 HydrophobicContact CB-CG 4.33Å; H794-Q1105 WeakPolarHBondContact CD2-CA 3.36Å; H794-Q1105 WeakPolarHBondContact CD2-CB 3.44Å; H794-Q1105 PolarHBondContact CD2-N 3.3Å; H794-Q1105 PolarHBondContact CD2-O 3.45Å; H794-Q1105 WeakPolarHBondContact CE1-CA 3.5Å; H794-Q1105 WeakPolarHBondContact CE1-CB 3.29Å; H794-Q1105 WeakPolarHBondContact CE1-CG 3.31Å; H794-Q1105 PolarHBondContact CE1-N 3.15Å; H794-Q1105 VanDerWaalsContact CG-CG 3.47Å; H794-Q1105 WeakPolarHBondContact ND1-CA 3.31Å; H794-Q1105 WeakPolarHBondContact ND1-CB 3.49Å; H794-Q1105 WeakPolarHBondContact ND1-CG 3.14Å; H794-Q1105 PolarHBondContact ND1-N 2.91Å; H794-Q1105 WeakPolarHBondContact NE2-CA 2.96Å; H794-Q1105 WeakPolarHBondContact NE2-CB 3.23Å; H794-Q1105 WeakPolarHBondContact NE2-CG 3.44Å; H794-Q1105 PolarHBondContact NE2-N 2.83Å
1106	I	32.5	Very low	29.8	Very low	60 Å²	60	137.3 Å²	137.3	31%	0.308	67%	0.673	S	S	.	*			trans	86	123.5	175.3	-91.2	131.5	0	0	0	115.2	G793 H794 R796	G793-I1106 PolarHBondContact O-N 3.46Å; H794-I1106 HydrophobicContact CB-CB 4.42Å; H794-I1106 HydrophobicContact CB-CD1 3.99Å; H794-I1106 HydrophobicContact CB-CG1 3.97Å; H794-I1106 VanDerWaalsContact CB-N 3.27Å; H794-I1106 PolarHBondContact CD2-N 2.71Å; H794-I1106 VanDerWaalsContact N-N 3.1Å; R796-I1106 HydrophobicContact CB-CD1 3.84Å; R796-I1106 HydrophobicContact CG-CD1 3.43Å; R796-I1106 VanDerWaalsContact CG-CD1 3.43Å
1107	S	27.6	Very low	29.9	Very low	73 Å²	73	141.3 Å²	141.3	51%	0.51	68%	0.677	S	S	.	*				73.3	149.3	50.4	101.7	0	0	0	0	112.5
1108	T	29.7	Very low	30.2	Very low	109 Å²	109	145.4 Å²	145.4	67%	0.669	69%	0.686	S	S	*	*			cis	-160.6	144.8	10.6	1.6	0	0	0	0	106.4
1109	L	29.7	Very low	30.5	Very low	149 Å²	149	150.7 Å²	150.7	78%	0.78	70%	0.697	S	S	*	*			trans	62.5	151.9	160.3	-54.8	169.1	0	0	0	116.1
1110	D	29.7	Very low	30.5	Very low	138 Å²	138	147 Å²	147	74%	0.738	70%	0.696	S	S	*	*			cis	-143	-179.1	-8.6	-118.3	-31.3	0	0	0	111.1
1111	D	28.1	Very low	30.5	Very low	121 Å²	121	143.1 Å²	143.1	65%	0.647	70%	0.696	S	S	*	*			trans	-59.9	149.3	-178.8	-107	-57.8	0	0	0	114.7
1112	H	31.6	Very low	30.3	Very low	171 Å²	171	140.2 Å²	140.2	79%	0.792	70%	0.697	S	S	*	*				-166.1	99.5	109.8	-108	-84.5	0	0	0	112.6
1113	F	29.1	Very low	30.6	Very low	156 Å²	156	136.9 Å²	136.9	68%	0.684	69%	0.694	S	S	*	*			trans	58.8	108.9	145.7	-80.3	-104.5	0	0	0	122
1114	S	28.9	Very low	30.5	Very low	82 Å²	82	136.3 Å²	136.3	57%	0.573	70%	0.699	S	S	*	*				56.6	130.4	123	-69.4	0	0	0	0	121.3
1115	K	33.4	Very low	31.1	Very low	193 Å²	193	141.4 Å²	141.4	84%	0.839	72%	0.716	S	S	*	*			cis	-152.4	152.1	1.6	-103.7	147.1	-168.8	158.6	0	109.7
1116	S	30.2	Very low	31.3	Very low	112 Å²	112	145.1 Å²	145.1	78%	0.783	73%	0.731	S	S	*	*			trans	-95	146.6	-158.1	59.7	0	0	0	0	117.4
1117	R	29.6	Very low	31.8	Very low	242 Å²	242	148.2 Å²	148.2	91%	0.913	74%	0.744	S	S	*	*			trans	-61.3	148.4	156.2	-67.3	170.7	165.6	173.2	-5.8	112.6
1118	K	34.3	Very low	32.7	Very low	201 Å²	201	151.7 Å²	151.7	87%	0.874	76%	0.757	S	S	*	*			trans	-169.2	126	140	-100.3	156.2	-175.7	178.7	0	107.4
1119	R	34.8	Very low	34.1	Very low	232 Å²	232	153.8 Å²	153.8	88%	0.875	76%	0.756	S	S	*	*				69.2	83.1	65.4	-90.4	-169.7	170.2	173.9	-2.4	115.4
1120	S	28.4	Very low	36.1	Very low	90 Å²	90	153.4 Å²	153.4	63%	0.629	75%	0.748	S	S	*	*				52.4	124.2	119.6	61.8	0	0	0	0	121.7
1121	T	30.7	Very low	38.3	Very low	127 Å²	127	149 Å²	149	78%	0.779	73%	0.728	S	S	*	*			trans	59.5	109.4	141.3	58.9	0	0	0	0	119.9
1122	S	29.4	Very low	40.4	Very low	107 Å²	107	151 Å²	151	75%	0.748	73%	0.731	S	S	*	*				159.6	169.7	94.6	58.4	0	0	0	0	113.2
1123	I	35.2	Very low	42.5	Very low	142 Å²	142	148.9 Å²	148.9	73%	0.728	72%	0.722	S	S	*	*			trans	74.1	99.1	165.5	-56.8	170	0	0	0	117.1
1124	E	30.3	Very low	44.8	Very low	180 Å²	180	145.4 Å²	145.4	84%	0.841	71%	0.711	S	S	*	*	S	Bend	trans	62.5	165.4	143.7	-61.1	-177.2	170.4	0	0	120.3
1125	Q	39.9	Very low	47.2	Very low	168 Å²	168	145.1 Å²	145.1	79%	0.785	71%	0.705	S	S	*	*			trans	52.9	81.4	-174.9	-59.3	-179.5	3.3	0	0	113.4	E1127	Q1125-E1127 PolarHBondContact O-N 3.38Å
1126	K	34.1	Very low	49.3	Very low	195 Å²	195	144 Å²	144	85%	0.848	70%	0.696	S	S	*	*			trans	-76.1	62	-177.8	-154.1	-174.3	-177.3	-163	0	112.2
1127	E	43.3	Very low	51.7	Low	125 Å²	125	143.4 Å²	143.4	58%	0.584	68%	0.682	S	S	*	*			trans	-70.8	120.2	163.4	-60.3	179.4	130.5	0	0	108.5	Q1125 K1129	Q1125-E1127 PolarHBondContact O-N 3.38Å; E1127-K1129 HydrophobicContact CB-CG 4.37Å; E1127-K1129 PolarHBondContact O-N 2.81Å; E1127-K1129 WeakPolarHBondContact OE2-CE 3.34Å; E1127-K1129 IonicContact OE2-NZ 2.82Å; E1127-K1129 PolarHBondContact OE2-NZ 3.29Å
1128	D	46.9	Very low	54.2	Low	146 Å²	146	133.3 Å²	133.3	78%	0.781	65%	0.65	S	S	*	*			trans	-73.2	77.8	173.6	-66.9	-45.4	0	0	0	110	K1130	D1128-K1130 PolarHBondContact O-N 3.43Å
1129	K	58.7	Low	56.6	Low	152 Å²	152	127 Å²	127	66%	0.661	62%	0.624	S	S	*	*			trans	-62.4	106	173.5	-68.9	179.7	175	72.4	0	108	E1127 S1131	E1127-K1129 HydrophobicContact CB-CG 4.37Å; E1127-K1129 PolarHBondContact O-N 2.81Å; E1127-K1129 WeakPolarHBondContact OE2-CE 3.34Å; E1127-K1129 IonicContact OE2-NZ 2.82Å; E1127-K1129 PolarHBondContact OE2-NZ 3.29Å; K1129-S1131 PolarHBondContact O-N 3.28Å
1130	K	70.8	Confident	59	Low	141 Å²	141	118 Å²	118	61%	0.613	60%	0.595	S	S	*	*			trans	-34.3	134.5	169.4	-76.8	-166.3	174.8	-164	0	110.6	D1128 D1134 V1135	D1128-K1130 PolarHBondContact O-N 3.43Å; K1130-D1134 HydrophobicContact CB-CB 3.82Å; K1130-D1134 HydrophobicContact CD-CB 4.37Å; K1130-D1134 HydrophobicContact CG-CB 4.37Å; K1130-V1135 HydrophobicContact CB-CG2 3.76Å
1131	S	76.4	Confident	61.8	Low	45 Å²	45	119 Å²	119	32%	0.315	59%	0.592	S	S	.	*			trans	-57.5	161.8	-176.5	66.4	0	0	0	0	111.2	K1129 E1133 D1134 V1135	K1129-S1131 PolarHBondContact O-N 3.28Å; S1131-E1133 PolarHBondContact O-N 3.25Å; S1131-D1134 WeakPolarHBondContact CB-OD2 3.46Å; S1131-D1134 PolarHBondContact N-OD2 2.57Å; S1131-D1134 WeakPolarHBondContact O-CB 3.49Å; S1131-D1134 PolarHBondContact O-N 3.45Å; S1131-D1134 WeakPolarHBondContact OG-CB 3.33Å; S1131-D1134 PolarHBondContact OG-N 3.28Å; S1131-D1134 PolarHBondContact OG-OD2 3.11Å; S1131-V1135 WeakPolarHBondContact O-CG2 3.3Å; S1131-V1135 PolarHBondContact O-N 3.16Å
1132	K	72.1	Confident	64.6	Low	163 Å²	163	119.3 Å²	119.3	71%	0.709	58%	0.579	S	S	*	*	H	α-helix	trans	-64	-31.3	178.5	-169.1	173.2	-178.5	177.6	0	110.5	W1136	K1132-W1136 WeakPolarHBondContact O-CB 3.33Å; K1132-W1136 PolarHBondContact O-N 2.79Å
1133	E	75.6	Confident	67	Low	128 Å²	128	121.4 Å²	121.4	60%	0.598	57%	0.57	S	S	*	*	H	α-helix	trans	-62.2	-49.4	169.6	-64.5	63	-143.3	0	0	110.5	S1131 V1135 W1136 M1137	S1131-E1133 PolarHBondContact O-N 3.25Å; E1133-V1135 PolarHBondContact O-N 3.26Å; E1133-W1136 PolarHBondContact O-N 3.19Å; E1133-M1137 WeakPolarHBondContact O-CB 3.18Å; E1133-M1137 WeakPolarHBondContact O-CG 3.34Å; E1133-M1137 PolarHBondContact O-N 2.82Å
1134	D	76.9	Confident	69.4	Low	83 Å²	83	118.2 Å²	118.2	44%	0.444	55%	0.554	S	S	.	*	H	α-helix	trans	-62.7	-40.9	175.2	-69.6	-56.2	0	0	0	113.3	K1130 S1131 A1138	K1130-D1134 HydrophobicContact CB-CB 3.82Å; K1130-D1134 HydrophobicContact CD-CB 4.37Å; K1130-D1134 HydrophobicContact CG-CB 4.37Å; S1131-D1134 WeakPolarHBondContact CB-OD2 3.46Å; S1131-D1134 PolarHBondContact N-OD2 2.57Å; S1131-D1134 WeakPolarHBondContact O-CB 3.49Å; S1131-D1134 PolarHBondContact O-N 3.45Å; S1131-D1134 WeakPolarHBondContact OG-CB 3.33Å; S1131-D1134 PolarHBondContact OG-N 3.28Å; S1131-D1134 PolarHBondContact OG-OD2 3.11Å; D1134-A1138 WeakPolarHBondContact O-CB 3.21Å; D1134-A1138 PolarHBondContact O-N 3.22Å
1135	V	79.5	Confident	72.3	Confident	76 Å²	76	114.3 Å²	114.3	46%	0.461	54%	0.536	S	S	.	.	H	α-helix	trans	-72.1	-37.8	179.7	175.1	0	0	0	0	110.3	K1130 S1131 E1133 E1139	K1130-V1135 HydrophobicContact CB-CG2 3.76Å; S1131-V1135 WeakPolarHBondContact O-CG2 3.3Å; S1131-V1135 PolarHBondContact O-N 3.16Å; E1133-V1135 PolarHBondContact O-N 3.26Å; V1135-E1139 WeakPolarHBondContact O-CB 3.23Å; V1135-E1139 PolarHBondContact O-N 3.46Å
1136	W	78.1	Confident	74.4	Confident	169 Å²	169	111.3 Å²	111.3	64%	0.64	52%	0.518	S	S	*	.	H	α-helix	trans	-70.2	-41.9	173.1	-179.9	69.2	0	0	0	111.6	K1132 E1133 E1139 V1140	K1132-W1136 WeakPolarHBondContact O-CB 3.33Å; K1132-W1136 PolarHBondContact O-N 2.79Å; E1133-W1136 PolarHBondContact O-N 3.19Å; W1136-E1139 CarbonylContact O-C 3.53Å; W1136-E1139 PolarHBondContact O-N 3.4Å; W1136-V1140 HydrophobicContact CD2-CG2 3.96Å; W1136-V1140 HydrophobicContact CG-CG2 4.29Å; W1136-V1140 HydrophobicContact CZ2-CG2 3.91Å; W1136-V1140 VanDerWaalsContact O-CB 3.27Å; W1136-V1140 WeakPolarHBondContact O-CB 3.49Å; W1136-V1140 WeakPolarHBondContact O-CG2 3.44Å; W1136-V1140 PolarHBondContact O-N 2.86Å
1137	M	81.4	Confident	76.4	Confident	99 Å²	99	105.9 Å²	105.9	49%	0.488	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-43.5	173.4	-77.7	-71.8	-75.4	0	0	111.3	E1133 E1139 V1140 L1141	E1133-M1137 WeakPolarHBondContact O-CB 3.18Å; E1133-M1137 WeakPolarHBondContact O-CG 3.34Å; E1133-M1137 PolarHBondContact O-N 2.82Å; M1137-E1139 VanDerWaalsContact C-N 3.34Å; M1137-E1139 PolarHBondContact O-N 2.67Å; M1137-V1140 PolarHBondContact O-N 3.13Å; M1137-L1141 VanDerWaalsContact O-CB 3.32Å; M1137-L1141 WeakPolarHBondContact O-CB 3.27Å; M1137-L1141 VanDerWaalsContact O-CG 3.25Å; M1137-L1141 WeakPolarHBondContact O-CG 3.34Å; M1137-L1141 PolarHBondContact O-N 3.04Å
1138	A	82.4	Confident	78.5	Confident	31 Å²	31	101.7 Å²	101.7	26%	0.256	48%	0.476	S	S	.	.	H	α-helix	trans	-63.7	-39	173	0	0	0	0	0	111.8	D1134 R1142	D1134-A1138 WeakPolarHBondContact O-CB 3.21Å; D1134-A1138 PolarHBondContact O-N 3.22Å; A1138-R1142 WeakPolarHBondContact O-CB 3.25Å; A1138-R1142 VanDerWaalsContact O-CG 3.25Å; A1138-R1142 WeakPolarHBondContact O-CG 3.25Å; A1138-R1142 PolarHBondContact O-N 3.38Å
1139	E	84.3	Confident	80.4	Confident	69 Å²	69	100.9 Å²	100.9	32%	0.322	47%	0.466	S	S	.	.	H	α-helix	trans	-72.6	-33.9	175.8	-175.5	55.9	-162.7	0	0	112.8	V1135 W1136 M1137 R1142 R1143 R1146	V1135-E1139 WeakPolarHBondContact O-CB 3.23Å; V1135-E1139 PolarHBondContact O-N 3.46Å; W1136-E1139 CarbonylContact O-C 3.53Å; W1136-E1139 PolarHBondContact O-N 3.4Å; M1137-E1139 VanDerWaalsContact C-N 3.34Å; M1137-E1139 PolarHBondContact O-N 2.67Å; E1139-R1142 CarbonylContact O-C 3.47Å; E1139-R1142 IonicContact OE2-CZ 3.1Å; E1139-R1142 VanDerWaalsContact OE2-CZ 3.29Å; E1139-R1142 IonicContact OE2-NE 2.65Å; E1139-R1142 PolarHBondContact OE2-NE 2.8Å; E1139-R1142 IonicContact OE2-NH2 2.76Å; E1139-R1142 PolarHBondContact OE2-NH2 3.11Å; E1139-R1143 WeakPolarHBondContact O-CA 3.37Å; E1139-R1143 WeakPolarHBondContact O-CB 3.3Å; E1139-R1143 PolarHBondContact O-N 3.24Å; E1139-R1146 PolarHBondContact O-NH2 2.86Å; E1139-R1146 IonicContact OE1-CZ 3.03Å; E1139-R1146 IonicContact OE1-NH1 2.6Å; E1139-R1146 PolarHBondContact OE1-NH1 2.91Å; E1139-R1146 IonicContact OE1-NH2 3.33Å; E1139-R1146 PolarHBondContact OE1-NH2 2.84Å; E1139-R1146 IonicContact OE2-NH2 3.41Å; E1139-R1146 PolarHBondContact OE2-NH2 2.69Å
1140	V	84.2	Confident	81.6	Confident	43 Å²	43	101 Å²	101	26%	0.261	47%	0.467	S	S	.	.	H	α-helix	trans	-67.7	-45.5	173.1	164.5	0	0	0	0	110.3	W1136 M1137 R1143 I1144	W1136-V1140 HydrophobicContact CD2-CG2 3.96Å; W1136-V1140 HydrophobicContact CG-CG2 4.29Å; W1136-V1140 HydrophobicContact CZ2-CG2 3.91Å; W1136-V1140 VanDerWaalsContact O-CB 3.27Å; W1136-V1140 WeakPolarHBondContact O-CB 3.49Å; W1136-V1140 WeakPolarHBondContact O-CG2 3.44Å; W1136-V1140 PolarHBondContact O-N 2.86Å; M1137-V1140 PolarHBondContact O-N 3.13Å; V1140-R1143 CarbonylContact O-C 3.57Å; V1140-R1143 WeakPolarHBondContact O-CA 3.16Å; V1140-R1143 WeakPolarHBondContact O-CB 3.3Å; V1140-R1143 PolarHBondContact O-N 3.08Å; V1140-I1144 HydrophobicContact CG1-CD1 3.82Å; V1140-I1144 HydrophobicContact CG1-CG1 4.42Å; V1140-I1144 WeakPolarHBondContact O-CB 3.33Å; V1140-I1144 VanDerWaalsContact O-CG1 3.28Å; V1140-I1144 WeakPolarHBondContact O-CG1 3.19Å; V1140-I1144 PolarHBondContact O-N 2.9Å
1141	L	87.9	Confident	81.9	Confident	109 Å²	109	99.3 Å²	99.3	57%	0.571	46%	0.456	S	S	*	.	H	α-helix	trans	-61.7	-46.6	173	-72.9	169.3	0	0	0	110.9	M1137 R1143 I1144 E1145	M1137-L1141 VanDerWaalsContact O-CB 3.32Å; M1137-L1141 WeakPolarHBondContact O-CB 3.27Å; M1137-L1141 VanDerWaalsContact O-CG 3.25Å; M1137-L1141 WeakPolarHBondContact O-CG 3.34Å; M1137-L1141 PolarHBondContact O-N 3.04Å; L1141-R1143 PolarHBondContact O-N 2.95Å; L1141-I1144 PolarHBondContact O-N 2.87Å; L1141-E1145 WeakPolarHBondContact O-CB 3.47Å; L1141-E1145 PolarHBondContact O-N 3.44Å
1142	R	88.3	Confident	82	Confident	134 Å²	134	99.6 Å²	99.6	51%	0.506	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-27.6	171.7	-71	-172.6	-53.2	-151.6	3.8	112.6	A1138 E1139 R1146	A1138-R1142 WeakPolarHBondContact O-CB 3.25Å; A1138-R1142 VanDerWaalsContact O-CG 3.25Å; A1138-R1142 WeakPolarHBondContact O-CG 3.25Å; A1138-R1142 PolarHBondContact O-N 3.38Å; E1139-R1142 CarbonylContact O-C 3.47Å; E1139-R1142 IonicContact OE2-CZ 3.1Å; E1139-R1142 VanDerWaalsContact OE2-CZ 3.29Å; E1139-R1142 IonicContact OE2-NE 2.65Å; E1139-R1142 PolarHBondContact OE2-NE 2.8Å; E1139-R1142 IonicContact OE2-NH2 2.76Å; E1139-R1142 PolarHBondContact OE2-NH2 3.11Å; R1142-R1146 VanDerWaalsContact C-NH2 3.26Å; R1142-R1146 VanDerWaalsContact CB-NH2 3.34Å; R1142-R1146 WeakPolarHBondContact O-CB 3.49Å; R1142-R1146 WeakPolarHBondContact O-CG 3.32Å; R1142-R1146 PolarHBondContact O-N 2.82Å; R1142-R1146 PolarHBondContact O-NE 3.43Å; R1142-R1146 PolarHBondContact O-NH2 2.98Å
1143	R	80.3	Confident	82.1	Confident	151 Å²	151	99.8 Å²	99.8	57%	0.57	46%	0.455	S	S	*	.	H	α-helix	trans	-79.3	-38.8	179.2	178.8	66.2	178	-163.2	0	110.6	E1139 V1140 L1141 R1146 M1147	E1139-R1143 WeakPolarHBondContact O-CA 3.37Å; E1139-R1143 WeakPolarHBondContact O-CB 3.3Å; E1139-R1143 PolarHBondContact O-N 3.24Å; V1140-R1143 CarbonylContact O-C 3.57Å; V1140-R1143 WeakPolarHBondContact O-CA 3.16Å; V1140-R1143 WeakPolarHBondContact O-CB 3.3Å; V1140-R1143 PolarHBondContact O-N 3.08Å; L1141-R1143 PolarHBondContact O-N 2.95Å; R1143-R1146 PolarHBondContact O-N 3.03Å; R1143-M1147 VanDerWaalsContact O-CB 3.29Å; R1143-M1147 WeakPolarHBondContact O-CB 3.32Å; R1143-M1147 WeakPolarHBondContact O-CG 3.44Å; R1143-M1147 PolarHBondContact O-N 3.37Å
1144	I	87	Confident	81.9	Confident	75 Å²	75	99.7 Å²	99.7	39%	0.385	45%	0.454	S	S	.	.	H	α-helix	trans	-60.5	-54	168.3	-68.7	164.1	0	0	0	107.9	V1140 L1141 R1146 M1147 E1148	V1140-I1144 HydrophobicContact CG1-CD1 3.82Å; V1140-I1144 HydrophobicContact CG1-CG1 4.42Å; V1140-I1144 WeakPolarHBondContact O-CB 3.33Å; V1140-I1144 VanDerWaalsContact O-CG1 3.28Å; V1140-I1144 WeakPolarHBondContact O-CG1 3.19Å; V1140-I1144 PolarHBondContact O-N 2.9Å; L1141-I1144 PolarHBondContact O-N 2.87Å; I1144-R1146 VanDerWaalsContact C-N 3.33Å; I1144-R1146 PolarHBondContact O-N 3.09Å; I1144-M1147 CarbonylContact O-C 3.59Å; I1144-M1147 PolarHBondContact O-N 3.36Å; I1144-E1148 HydrophobicContact CG2-CG 4.15Å; I1144-E1148 VanDerWaalsContact O-CB 3.25Å; I1144-E1148 WeakPolarHBondContact O-CB 3.26Å; I1144-E1148 WeakPolarHBondContact O-CG 3.47Å; I1144-E1148 PolarHBondContact O-N 2.87Å
1145	E	89.4	Confident	81.1	Confident	98 Å²	98	100.7 Å²	100.7	46%	0.458	45%	0.452	S	S	.	.	H	α-helix	trans	-55	-44.4	176.2	-163.7	-150	152.8	0	0	112	L1141 K1149	L1141-E1145 WeakPolarHBondContact O-CB 3.47Å; L1141-E1145 PolarHBondContact O-N 3.44Å; E1145-K1149 WeakPolarHBondContact O-CB 3.45Å; E1145-K1149 PolarHBondContact O-N 3.35Å; E1145-K1149 IonicContact OE1-NZ 2.77Å; E1145-K1149 PolarHBondContact OE1-NZ 2.9Å
1146	R	85	Confident	80.1	Confident	106 Å²	106	100.5 Å²	100.5	40%	0.4	45%	0.451	S	S	.	.	H	α-helix	trans	-65.4	-39.1	175.1	-85.5	170.2	-71.9	166.7	2	113.1	E1139 R1142 R1143 I1144 K1150	E1139-R1146 PolarHBondContact O-NH2 2.86Å; E1139-R1146 IonicContact OE1-CZ 3.03Å; E1139-R1146 IonicContact OE1-NH1 2.6Å; E1139-R1146 PolarHBondContact OE1-NH1 2.91Å; E1139-R1146 IonicContact OE1-NH2 3.33Å; E1139-R1146 PolarHBondContact OE1-NH2 2.84Å; E1139-R1146 IonicContact OE2-NH2 3.41Å; E1139-R1146 PolarHBondContact OE2-NH2 2.69Å; R1142-R1146 VanDerWaalsContact C-NH2 3.26Å; R1142-R1146 VanDerWaalsContact CB-NH2 3.34Å; R1142-R1146 WeakPolarHBondContact O-CB 3.49Å; R1142-R1146 WeakPolarHBondContact O-CG 3.32Å; R1142-R1146 PolarHBondContact O-N 2.82Å; R1142-R1146 PolarHBondContact O-NE 3.43Å; R1142-R1146 PolarHBondContact O-NH2 2.98Å; R1143-R1146 PolarHBondContact O-N 3.03Å; I1144-R1146 VanDerWaalsContact C-N 3.33Å; I1144-R1146 PolarHBondContact O-N 3.09Å; R1146-K1150 VanDerWaalsContact O-CB 3.28Å; R1146-K1150 WeakPolarHBondContact O-CB 3.24Å; R1146-K1150 WeakPolarHBondContact O-CG 3.41Å; R1146-K1150 PolarHBondContact O-N 3.49Å
1147	M	76.8	Confident	78.9	Confident	81 Å²	81	96.9 Å²	96.9	40%	0.399	45%	0.451	S	S	.	.	H	α-helix	trans	-68.3	-45.1	176.8	-77.2	-71.2	-72.3	0	0	110.9	R1143 I1144 R1151	R1143-M1147 VanDerWaalsContact O-CB 3.29Å; R1143-M1147 WeakPolarHBondContact O-CB 3.32Å; R1143-M1147 WeakPolarHBondContact O-CG 3.44Å; R1143-M1147 PolarHBondContact O-N 3.37Å; I1144-M1147 CarbonylContact O-C 3.59Å; I1144-M1147 PolarHBondContact O-N 3.36Å; M1147-R1151 WeakPolarHBondContact O-CB 3.18Å; M1147-R1151 WeakPolarHBondContact O-CD 3.43Å; M1147-R1151 WeakPolarHBondContact O-CG 3.4Å; M1147-R1151 PolarHBondContact O-N 3.39Å
1148	E	86.3	Confident	77.4	Confident	36 Å²	36	95.8 Å²	95.8	17%	0.168	45%	0.453	C	S	.	.	H	α-helix	trans	-54.7	-61	171.3	-80.6	-160.6	171	0	0	110.5	I1144 K1150 R1151 L1152 K2048 F2049 S2050	I1144-E1148 HydrophobicContact CG2-CG 4.15Å; I1144-E1148 VanDerWaalsContact O-CB 3.25Å; I1144-E1148 WeakPolarHBondContact O-CB 3.26Å; I1144-E1148 WeakPolarHBondContact O-CG 3.47Å; I1144-E1148 PolarHBondContact O-N 2.87Å; E1148-K1150 VanDerWaalsContact C-N 3.32Å; E1148-K1150 PolarHBondContact O-N 3.29Å; E1148-R1151 CarbonylContact O-C 3.59Å; E1148-R1151 PolarHBondContact O-N 2.9Å; E1148-L1152 WeakPolarHBondContact O-CB 3.35Å; E1148-L1152 PolarHBondContact O-N 3.22Å; E1148-K2048 CarbonylContact C-O 3.59Å; E1148-K2048 VanDerWaalsContact CB-O 3.3Å; E1148-K2048 WeakPolarHBondContact CB-O 3.36Å; E1148-F2049 VanDerWaalsContact CD-CA 3.47Å; E1148-F2049 VanDerWaalsContact OE1-CA 3.3Å; E1148-F2049 WeakPolarHBondContact OE1-CA 3.22Å; E1148-F2049 PolarHBondContact OE1-N 2.84Å; E1148-F2049 WeakPolarHBondContact OE2-CA 3.48Å; E1148-F2049 PolarHBondContact OE2-N 2.76Å; E1148-S2050 PolarHBondContact OE1-N 3.31Å
1149	K	87.7	Confident	75.6	Confident	129 Å²	129	98.2 Å²	98.2	56%	0.561	46%	0.461	S	S	*	.	H	α-helix	trans	-61.1	-33.6	-178.5	-153.2	169.1	-159.5	162	0	113.4	E1145 K1153	E1145-K1149 WeakPolarHBondContact O-CB 3.45Å; E1145-K1149 PolarHBondContact O-N 3.35Å; E1145-K1149 IonicContact OE1-NZ 2.77Å; E1145-K1149 PolarHBondContact OE1-NZ 2.9Å; K1149-K1153 PolarHBondContact O-N 2.88Å
1150	K	83.3	Confident	73	Confident	156 Å²	156	99.4 Å²	99.4	68%	0.678	48%	0.477	S	S	*	.	H	α-helix	trans	-65.3	-53.6	168.4	-90.1	-162.8	171.3	-165	0	112	R1146 E1148 L1152 K1153 Q1154	R1146-K1150 VanDerWaalsContact O-CB 3.28Å; R1146-K1150 WeakPolarHBondContact O-CB 3.24Å; R1146-K1150 WeakPolarHBondContact O-CG 3.41Å; R1146-K1150 PolarHBondContact O-N 3.49Å; E1148-K1150 VanDerWaalsContact C-N 3.32Å; E1148-K1150 PolarHBondContact O-N 3.29Å; K1150-L1152 PolarHBondContact O-N 2.77Å; K1150-K1153 PolarHBondContact O-N 3.21Å; K1150-Q1154 PolarHBondContact O-N 2.77Å
1151	R	77.1	Confident	70.5	Confident	105 Å²	105	105 Å²	105	40%	0.396	51%	0.505	S	S	.	.	H	α-helix	trans	-66.2	-25.4	-178.7	-68	169	126	-164.1	1.3	111.1	M1147 E1148 R1155 K2048 S2050	M1147-R1151 WeakPolarHBondContact O-CB 3.18Å; M1147-R1151 WeakPolarHBondContact O-CD 3.43Å; M1147-R1151 WeakPolarHBondContact O-CG 3.4Å; M1147-R1151 PolarHBondContact O-N 3.39Å; E1148-R1151 CarbonylContact O-C 3.59Å; E1148-R1151 PolarHBondContact O-N 2.9Å; R1151-R1155 PolarHBondContact O-N 3.03Å; R1151-K2048 HydrophobicContact CB-CB 4.48Å; R1151-K2048 HydrophobicContact CB-CD 3.31Å; R1151-K2048 HydrophobicContact CG-CD 4.41Å; R1151-K2048 WeakPolarHBondContact O-CD 3.5Å; R1151-K2048 WeakPolarHBondContact O-CE 3.17Å; R1151-K2048 PolarHBondContact O-NZ 2.86Å; R1151-S2050 PolarHBondContact NH1-OG 2.89Å
1152	L	77.9	Confident	68	Low	51 Å²	51	109.6 Å²	109.6	27%	0.267	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-58.6	171.8	-170.2	169.5	0	0	0	108	E1148 K1150 Q1154 R1155 V1156 T2046 K2048	E1148-L1152 WeakPolarHBondContact O-CB 3.35Å; E1148-L1152 PolarHBondContact O-N 3.22Å; K1150-L1152 PolarHBondContact O-N 2.77Å; L1152-Q1154 VanDerWaalsContact C-N 3.28Å; L1152-Q1154 PolarHBondContact O-N 3.19Å; L1152-R1155 PolarHBondContact O-N 2.59Å; L1152-V1156 HydrophobicContact CD2-CG2 3.89Å; L1152-V1156 PolarHBondContact O-N 3.3Å; L1152-T2046 WeakPolarHBondContact CD2-OG1 3.46Å; L1152-K2048 HydrophobicContact CB-CB 4.38Å; L1152-K2048 WeakPolarHBondContact CD1-O 3.27Å
1153	K	75.8	Confident	65.3	Low	166 Å²	166	108 Å²	108	72%	0.722	53%	0.529	S	S	*	.	H	α-helix	trans	-48.9	-46.8	172.7	-103.8	-166	172.2	-168	0	112.7	K1149 K1150 R1155 V1156 S1157	K1149-K1153 PolarHBondContact O-N 2.88Å; K1150-K1153 PolarHBondContact O-N 3.21Å; K1153-R1155 VanDerWaalsContact C-N 3.31Å; K1153-R1155 PolarHBondContact O-N 2.8Å; K1153-V1156 PolarHBondContact O-N 3.31Å; K1153-S1157 PolarHBondContact O-N 3.24Å; K1153-S1157 PolarHBondContact O-OG 3.28Å; K1153-S1157 VanDerWaalsContact O-OG 3.13Å
1154	Q	69.6	Low	63	Low	126 Å²	126	105.2 Å²	105.2	59%	0.589	53%	0.533	S	S	*	.	H	α-helix	trans	-59.3	-32.9	176.9	-84.1	-174.9	-43.8	0	0	114.9	K1150 L1152 S1157 S1158	K1150-Q1154 PolarHBondContact O-N 2.77Å; L1152-Q1154 VanDerWaalsContact C-N 3.28Å; L1152-Q1154 PolarHBondContact O-N 3.19Å; Q1154-S1157 WeakPolarHBondContact CA-OG 3.34Å; Q1154-S1157 PolarHBondContact O-OG 3.03Å; Q1154-S1158 PolarHBondContact O-OG 2.87Å
1155	R	60.2	Low	60.6	Low	105 Å²	105	108.3 Å²	108.3	40%	0.396	55%	0.546	S	S	.	.	H	α-helix	trans	-80.4	-40.9	175.1	-99.1	-170.2	-169.6	155.2	-4.9	110.8	R1151 L1152 K1153 S1157 S1158 I1159 N2045 T2046 K2047 K2048	R1151-R1155 PolarHBondContact O-N 3.03Å; L1152-R1155 PolarHBondContact O-N 2.59Å; K1153-R1155 VanDerWaalsContact C-N 3.31Å; K1153-R1155 PolarHBondContact O-N 2.8Å; R1155-S1157 PolarHBondContact O-N 2.16Å; R1155-S1158 WeakPolarHBondContact CA-OG 3.36Å; R1155-S1158 PolarHBondContact O-N 2.71Å; R1155-S1158 PolarHBondContact O-OG 2.96Å; R1155-S1158 VanDerWaalsContact O-OG 3.08Å; R1155-I1159 PolarHBondContact O-N 3.34Å; R1155-N2045 VanDerWaalsContact C-ND2 3.34Å; R1155-N2045 WeakPolarHBondContact CD-OD1 3.11Å; R1155-N2045 PolarHBondContact O-ND2 2.65Å; R1155-T2046 HydrophobicContact CB-CG2 3.14Å; R1155-T2046 HydrophobicContact CG-CG2 4.25Å; R1155-K2047 PolarHBondContact NH1-O 3.06Å; R1155-K2048 VanDerWaalsContact CD-CE 3.5Å
1156	V	59.9	Low	57.9	Low	71 Å²	71	108 Å²	108	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-53.8	-46.5	173.3	-178.9	0	0	0	0	110	L1152 K1153 S1158 I1159 T2046	L1152-V1156 HydrophobicContact CD2-CG2 3.89Å; L1152-V1156 PolarHBondContact O-N 3.3Å; K1153-V1156 PolarHBondContact O-N 3.31Å; V1156-S1158 PolarHBondContact O-N 3.31Å; V1156-I1159 PolarHBondContact O-N 2.89Å; V1156-T2046 HydrophobicContact CG2-CG2 3.94Å; V1156-T2046 WeakPolarHBondContact CG2-OG1 3.45Å
1157	S	52.7	Low	55.3	Low	94 Å²	94	106.2 Å²	106.2	66%	0.657	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	15.3	176.9	69.1	0	0	0	0	115.2	K1153 Q1154 R1155	K1153-S1157 PolarHBondContact O-N 3.24Å; K1153-S1157 PolarHBondContact O-OG 3.28Å; K1153-S1157 VanDerWaalsContact O-OG 3.13Å; Q1154-S1157 WeakPolarHBondContact CA-OG 3.34Å; Q1154-S1157 PolarHBondContact O-OG 3.03Å; R1155-S1157 PolarHBondContact O-N 2.16Å
1158	S	49.5	Very low	53.2	Low	75 Å²	75	109 Å²	109	52%	0.524	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-133.9	-2.4	174.1	43.3	0	0	0	0	115.3	Q1154 R1155 V1156	Q1154-S1158 PolarHBondContact O-OG 2.87Å; R1155-S1158 WeakPolarHBondContact CA-OG 3.36Å; R1155-S1158 PolarHBondContact O-N 2.71Å; R1155-S1158 PolarHBondContact O-OG 2.96Å; R1155-S1158 VanDerWaalsContact O-OG 3.08Å; V1156-S1158 PolarHBondContact O-N 3.31Å
1159	I	43.9	Very low	50.5	Low	82 Å²	82	111.5 Å²	111.5	42%	0.421	59%	0.592	S	S	.	*	S	Bend	trans	-123.5	67.6	156.5	-72.3	91.6	0	0	0	108.2	R1155 V1156 L2044 N2045	R1155-I1159 PolarHBondContact O-N 3.34Å; V1156-I1159 PolarHBondContact O-N 2.89Å; I1159-L2044 HydrophobicContact CD1-CB 4.48Å; I1159-L2044 HydrophobicContact CD1-CD1 4.47Å; I1159-L2044 HydrophobicContact CG2-CB 4.49Å; I1159-N2045 HydrophobicContact CB-CB 4.33Å; I1159-N2045 WeakPolarHBondContact CD1-ND2 3.19Å
1160	S	30.7	Very low	47.7	Very low	94 Å²	94	108.9 Å²	108.9	66%	0.657	59%	0.587	S	S	*	*			trans	-139.2	140.2	147.4	-178.2	0	0	0	0	106.2
1161	L	32.4	Very low	45.1	Very low	161 Å²	161	108.8 Å²	108.8	84%	0.843	59%	0.587	S	S	*	*			trans	98.4	134.7	-171.4	-59.8	167.3	0	0	0	116.4
1162	K	33.7	Very low	42.8	Very low	205 Å²	205	106.8 Å²	106.8	89%	0.891	58%	0.584	S	S	*	*			trans	67	123.4	-173.7	-50	178.7	-176.6	-177.2	0	113.7
1163	S	32.1	Very low	40.9	Very low	100 Å²	100	108.6 Å²	108.6	70%	0.699	59%	0.591	S	S	*	*			cis	-158	121.3	-9.5	40.6	0	0	0	0	106.4
1164	S	31.7	Very low	39	Very low	93 Å²	93	106.4 Å²	106.4	65%	0.65	59%	0.593	S	S	*	*				67.7	126.5	65.4	75.3	0	0	0	0	114
1165	Q	37.1	Very low	37.1	Very low	141 Å²	141	106 Å²	106	66%	0.659	60%	0.595	S	S	*	*			trans	73.6	142.3	163.2	-61.3	175.7	-52.9	0	0	117.2	S1364 D1365	Q1165-S1364 PolarHBondContact NE2-O 3.12Å; Q1165-D1365 WeakPolarHBondContact CB-O 3.3Å; Q1165-D1365 WeakPolarHBondContact CG-O 3.46Å; Q1165-D1365 PolarHBondContact NE2-O 3.12Å
1166	N	32.4	Very low	36	Very low	91 Å²	91	107.3 Å²	107.3	49%	0.487	61%	0.61	S	S	.	*			cis	-155.8	171	-21.7	-127.2	-26	0	0	0	114.1	S1364 D1365	N1166-S1364 PolarHBondContact ND2-O 2.75Å; N1166-D1365 WeakPolarHBondContact CB-O 3.2Å; N1166-D1365 PolarHBondContact ND2-N 2.96Å; N1166-D1365 PolarHBondContact ND2-O 3.23Å
1167	A	31.4	Very low	34.8	Very low	68 Å²	68	113.2 Å²	113.2	56%	0.562	63%	0.63	S	S	*	*			trans	-63	165.5	166.5	0	0	0	0	0	112.6
1168	D	32.4	Very low	33.9	Very low	141 Å²	141	111.8 Å²	111.8	75%	0.754	62%	0.62	S	S	*	*				-178.6	-176.1	93.9	-163.9	14.7	0	0	0	111.7
1169	C	28.6	Very low	32.8	Very low	87 Å²	87	110.9 Å²	110.9	59%	0.588	61%	0.612	S	S	*	*			trans	93	69.3	154.4	-76.2	0	0	0	0	119.9
1170	T	29.8	Very low	31.7	Very low	75 Å²	75	110.4 Å²	110.4	46%	0.46	61%	0.613	S	S	.	*				82.8	125.7	112.2	52.5	0	0	0	0	123	R1468	T1170-R1468 PolarHBondContact O-NH1 3.37Å; T1170-R1468 PolarHBondContact O-NH2 3.5Å
1171	K	29	Very low	31.3	Very low	153 Å²	153	109.8 Å²	109.8	67%	0.665	60%	0.6	S	S	*	*				72.6	115.8	122.3	-67.7	171.2	-176	172.6	0	121.2	R1468	K1171-R1468 PolarHBondContact O-NH1 2.82Å
1172	N	27.3	Very low	30.9	Very low	64 Å²	64	110.8 Å²	110.8	34%	0.342	60%	0.597	S	S	.	*			trans	83.6	129.3	134.6	-56.4	-9.3	0	0	0	119.9	R1470	N1172-R1470 PolarHBondContact ND2-NH2 3.07Å; N1172-R1470 PolarHBondContact OD1-NE 3.3Å; N1172-R1470 PolarHBondContact OD1-NH2 2.88Å
1173	H	39.5	Very low	30.5	Very low	88 Å²	88	104.7 Å²	104.7	41%	0.407	58%	0.581	S	S	.	*			trans	-19.3	149.3	136.4	-73.2	-76.7	0	0	0	116.3	N1175 R1468 R1470	H1173-N1175 PolarHBondContact ND1-N 3.32Å; H1173-R1468 PolarHBondContact CD2-O 3.07Å; H1173-R1468 PolarHBondContact ND1-O 2.91Å; H1173-R1468 PolarHBondContact NE2-O 2.79Å; H1173-R1470 WeakPolarHBondContact NE2-CB 3.36Å; H1173-R1470 PolarHBondContact NE2-N 3.16Å
1174	P	35.9	Very low	30.3	Very low	120 Å²	120	105 Å²	105	78%	0.779	58%	0.58	S	S	*	*				-78.7	139.1	68.7	-28	38.6	0	0	0	114.4
1175	N	30.1	Very low	30.1	Very low	117 Å²	117	107.4 Å²	107.4	63%	0.626	58%	0.581	S	S	*	*				59.8	100.1	65.1	-68.3	11	0	0	0	111.7	H1173	H1173-N1175 PolarHBondContact ND1-N 3.32Å
1176	L	36.5	Very low	30	Very low	134 Å²	134	106 Å²	106	70%	0.702	58%	0.584	S	S	*	*				75.1	113.5	85.4	-94.9	89.8	0	0	0	113
1177	F	33.4	Very low	29.9	Very low	194 Å²	194	106.5 Å²	106.5	85%	0.851	59%	0.587	S	S	*	*			trans	-145.7	84.2	149.4	-98.6	-69.2	0	0	0	111.5
1178	S	33.8	Very low	29.7	Very low	65 Å²	65	107.6 Å²	107.6	46%	0.455	59%	0.591	S	S	.	*			trans	-49.7	146.3	150.9	45.2	0	0	0	0	110.7	N78	N78-S1178 VanDerWaalsContact ND2-CB 3.33Å; N78-S1178 WeakPolarHBondContact ND2-CB 3.26Å
1179	P	27.3	Very low	29.2	Very low	55 Å²	55	106.1 Å²	106.1	36%	0.357	58%	0.582	S	S	.	*				-157.1	158.4	101.7	39.9	-22.3	0	0	0	117.7	N78 K79	N78-P1179 WeakPolarHBondContact OD1-CA 3.32Å; N78-P1179 PolarHBondContact OD1-O 3.3Å; K79-P1179 VanDerWaalsContact CD-O 3.24Å; K79-P1179 WeakPolarHBondContact CD-O 3.47Å; K79-P1179 PolarHBondContact NZ-O 2.92Å
1180	T	21.3	Very low	29	Very low	73 Å²	73	104.6 Å²	104.6	45%	0.448	57%	0.572	S	S	.	*			trans	52.8	128.8	175.9	44	0	0	0	0	118.8	N78 K79	N78-T1180 VanDerWaalsContact OD1-CA 3.27Å; N78-T1180 WeakPolarHBondContact OD1-CA 3.42Å; N78-T1180 PolarHBondContact OD1-N 3.1Å; N78-T1180 PolarHBondContact OD1-O 3.09Å; K79-T1180 WeakPolarHBondContact CG-O 3.33Å; K79-T1180 PolarHBondContact NZ-O 3.2Å; K79-T1180 PolarHBondContact NZ-OG1 2.85Å
1181	E	21.1	Very low	28.6	Very low	80 Å²	80	104 Å²	104	37%	0.374	57%	0.566	S	S	.	*				30.2	153.9	112.5	-62.7	161.7	135.3	0	0	121.5	R76 K79	R76-E1181 HydrophobicContact CG-CG 3.94Å; R76-E1181 IonicContact CZ-OE1 2.7Å; R76-E1181 IonicContact NE-OE1 2.99Å; R76-E1181 PolarHBondContact NE-OE1 3.43Å; R76-E1181 IonicContact NH2-OE1 3.66Å; R76-E1181 PolarHBondContact NH2-OE1 3.05Å; K79-E1181 PolarHBondContact NZ-O 2.81Å; K79-E1181 VanDerWaalsContact NZ-O 3.16Å
1182	K	25.3	Very low	28.5	Very low	182 Å²	182	101.4 Å²	101.4	79%	0.791	56%	0.559	S	S	*	*			trans	85.8	111.9	-164.2	-61.6	-166.8	177	-164.2	0	115.2
1183	S	24.8	Very low	28.3	Very low	78 Å²	78	104 Å²	104	55%	0.545	57%	0.573	S	S	.	*			cis	54.8	107.1	13.1	170.7	0	0	0	0	112.4
1184	P	28.3	Very low	27.7	Very low	105 Å²	105	105.6 Å²	105.6	68%	0.682	59%	0.585	S	S	*	*				-107.1	165.5	57.5	4.8	19.5	0	0	0	109.8
1185	E	27.4	Very low	27.4	Very low	145 Å²	145	103.1 Å²	103.1	68%	0.678	57%	0.567	S	S	*	*			cis	-1.7	99.7	40.6	-78.8	-160.4	111.8	0	0	117.6
1186	P	33.7	Very low	27.4	Very low	110 Å²	110	104.9 Å²	104.9	71%	0.714	57%	0.569	S	S	*	*				-62.3	109.4	93.9	19.4	2.6	0	0	0	108.6
1187	D	31.5	Very low	27.1	Very low	102 Å²	102	102.8 Å²	102.8	55%	0.545	57%	0.566	S	S	.	*			cis	48.3	143.2	45.6	-65.8	-56.3	0	0	0	113
1188	S	25.6	Very low	26.9	Very low	92 Å²	92	98.6 Å²	98.6	64%	0.643	56%	0.556	S	S	*	*			trans	63.4	128.4	141.7	69.1	0	0	0	0	120.1
1189	I	23.1	Very low	26.6	Very low	109 Å²	109	102.6 Å²	102.6	56%	0.559	57%	0.573	S	S	*	*			trans	75.4	129.7	140.8	-62.5	168.8	0	0	0	110.3	P1805	I1189-P1805 HydrophobicContact CG1-CG 4.43Å
1190	S	25	Very low	26.9	Very low	56 Å²	56	103.3 Å²	103.3	39%	0.392	59%	0.59	S	S	.	*				35.5	157.5	86.4	73.4	0	0	0	0	113
1191	D	21.6	Very low	27.3	Very low	63 Å²	63	102.8 Å²	102.8	34%	0.337	59%	0.593	S	S	.	*			cis	-155.4	156.3	47.3	-82.4	-37.5	0	0	0	106.9	N1193 S1803	D1191-N1193 HydrophobicContact CB-CB 3.99Å; D1191-N1193 WeakPolarHBondContact CB-ND2 3.27Å; D1191-N1193 PolarHBondContact O-N 2.89Å; D1191-N1193 VanDerWaalsContact O-N 3.14Å; D1191-N1193 PolarHBondContact OD2-ND2 2.77Å; D1191-S1803 PolarHBondContact OD1-OG 2.83Å
1192	N	26.1	Very low	27.9	Very low	97 Å²	97	103.1 Å²	103.1	52%	0.519	60%	0.596	S	S	.	*				52	8.8	58	-53.6	-56.9	0	0	0	114.7	S1803	N1192-S1803 WeakPolarHBondContact CB-OG 3.27Å
1193	N	23.1	Very low	28.4	Very low	119 Å²	119	100.5 Å²	100.5	64%	0.636	59%	0.587	S	S	*	*			trans	-125.5	111.6	176.7	-79.8	-45.1	0	0	0	110.9	D1191	D1191-N1193 HydrophobicContact CB-CB 3.99Å; D1191-N1193 WeakPolarHBondContact CB-ND2 3.27Å; D1191-N1193 PolarHBondContact O-N 2.89Å; D1191-N1193 VanDerWaalsContact O-N 3.14Å; D1191-N1193 PolarHBondContact OD2-ND2 2.77Å
1194	D	25.8	Very low	28.9	Very low	122 Å²	122	101.5 Å²	101.5	65%	0.652	59%	0.591	S	S	*	*			cis	-153.1	168.2	-12.5	-152.4	-0.5	0	0	0	112.9
1195	V	29.7	Very low	28.8	Very low	67 Å²	67	99.4 Å²	99.4	41%	0.406	59%	0.589	S	S	.	*			trans	6	115.4	145.2	161	0	0	0	0	115	S1197	V1195-S1197 VanDerWaalsContact C-N 3.32Å; V1195-S1197 PolarHBondContact O-N 3.06Å
1196	K	31.4	Very low	29.1	Very low	154 Å²	154	96.7 Å²	96.7	67%	0.67	60%	0.6	S	S	*	*				57.2	44	71.3	-164.8	-174	169.4	171.3	0	112.7
1197	S	30.1	Very low	28.9	Very low	91 Å²	91	96.6 Å²	96.6	64%	0.636	60%	0.602	S	S	*	*			trans	-116.4	109.7	156.3	-63	0	0	0	0	105.9	V1195	V1195-S1197 VanDerWaalsContact C-N 3.32Å; V1195-S1197 PolarHBondContact O-N 3.06Å
1198	T	28.8	Very low	28.8	Very low	105 Å²	105	96.4 Å²	96.4	64%	0.644	61%	0.608	S	S	*	*				65.8	151.9	78	67.2	0	0	0	0	112.6
1199	D	28.4	Very low	29.1	Very low	150 Å²	150	98.8 Å²	98.8	80%	0.802	61%	0.614	S	S	*	*			trans	61.9	77.9	168.4	-38.3	-55.6	0	0	0	113.3
1200	G	33	Very low	29.8	Very low	70 Å²	70	100.5 Å²	100.5	72%	0.722	62%	0.622	S	S	*	*			cis	101.4	146.9	24.7	0	0	0	0	0	110.7
1201	A	30	Very low	30.4	Very low	62 Å²	62	104.7 Å²	104.7	51%	0.512	64%	0.64	S	S	.	*			trans	70.4	156.9	-173.6	0	0	0	0	0	115.7	T1730	A1201-T1730 VanDerWaalsContact CA-OG1 3.23Å; A1201-T1730 WeakPolarHBondContact CA-OG1 3.46Å; A1201-T1730 WeakPolarHBondContact CB-OG1 3.24Å
1202	M	32.8	Very low	30.8	Very low	87 Å²	87	105.3 Å²	105.3	43%	0.429	65%	0.65	S	S	.	*			trans	100.9	158.6	158.4	-43.9	-44.3	-179.5	0	0	121.4	L1727 L1728 T1730	M1202-L1727 VanDerWaalsContact CB-C 3.47Å; M1202-L1727 HydrophobicContact CE-CD2 4.49Å; M1202-L1728 HydrophobicContact CE-CD2 3.99Å; M1202-L1728 HydrophobicContact SD-CD2 3.72Å; M1202-T1730 PolarHBondContact N-OG1 3.45Å
1203	E	35.9	Very low	31.3	Very low	127 Å²	127	109.3 Å²	109.3	59%	0.593	66%	0.663	S	S	*	*			trans	-121.5	-165.6	172.2	-127.2	-152.9	-114.9	0	0	107.3	G1205 L1727 L1728 I1729	E1203-G1205 PolarHBondContact OE2-N 2.91Å; E1203-L1727 CarbonylContact O-C 3Å; E1203-L1728 CarbonylContact C-O 3.56Å; E1203-L1728 WeakPolarHBondContact CA-O 3.09Å; E1203-L1728 WeakPolarHBondContact CB-O 3.31Å; E1203-L1728 PolarHBondContact N-O 2.78Å; E1203-L1728 CarbonylContact O-C 3.36Å; E1203-L1728 PolarHBondContact O-N 2.65Å; E1203-I1729 WeakPolarHBondContact CB-O 3.43Å
1204	P	35.1	Very low	31.5	Very low	99 Å²	99	108 Å²	108	64%	0.643	67%	0.668	S	S	*	*			cis	-135.4	176.4	14.3	44.8	-27.2	0	0	0	118.4
1205	G	27.1	Very low	31.6	Very low	61 Å²	61	109 Å²	109	63%	0.629	67%	0.673	S	S	*	*				38	123.2	129.2	0	0	0	0	0	121.1	E1203	E1203-G1205 PolarHBondContact OE2-N 2.91Å
1206	G	32.7	Very low	31.5	Very low	88 Å²	88	113.1 Å²	113.1	91%	0.907	69%	0.688	S	S	*	*			trans	-71.5	139	172.1	0	0	0	0	0	114.9
1207	S	30.4	Very low	31.3	Very low	108 Å²	108	110.2 Å²	110.2	76%	0.755	69%	0.686	S	S	*	*			trans	-149.5	157	152.5	58.2	0	0	0	0	105.8
1208	S	30.1	Very low	31.3	Very low	98 Å²	98	110.9 Å²	110.9	69%	0.685	68%	0.682	S	S	*	*			cis	-164.6	151.6	39	27.8	0	0	0	0	107.1
1209	D	31.3	Very low	31.3	Very low	142 Å²	142	113 Å²	113	76%	0.759	68%	0.682	S	S	*	*			cis	-147.8	177.6	-3.5	-90.1	-29.8	0	0	0	105.7
1210	I	37.5	Very low	31.4	Very low	144 Å²	144	111.8 Å²	111.8	74%	0.738	68%	0.676	S	S	*	*			cis	-158.2	135	44.5	-69.4	166.8	0	0	0	110.5
1211	N	37.4	Very low	31.2	Very low	144 Å²	144	113.8 Å²	113.8	77%	0.77	67%	0.67	S	S	*	*			trans	70.7	143.7	159.8	-76.9	-28.9	0	0	0	119.9
1212	S	30.8	Very low	31.2	Very low	77 Å²	77	119 Å²	119	54%	0.538	68%	0.681	S	S	.	*			cis	-178.7	148	-23.3	-118.4	0	0	0	0	109.3
1213	K	35.8	Very low	31	Very low	181 Å²	181	121.3 Å²	121.3	79%	0.787	70%	0.695	S	S	*	*			trans	61.2	97.4	157.7	-59.8	161.7	-171.1	177.1	0	113.9
1214	A	28.2	Very low	30.6	Very low	91 Å²	91	120 Å²	120	75%	0.752	70%	0.695	S	S	*	*			cis	60	158.3	44.4	0	0	0	0	0	113.7
1215	L	27.8	Very low	30.1	Very low	142 Å²	142	122.6 Å²	122.6	74%	0.743	70%	0.702	S	S	*	*			trans	73.4	134.2	-179.2	-59.1	165.9	0	0	0	113.7
1216	E	26.3	Very low	30	Very low	155 Å²	155	124.7 Å²	124.7	72%	0.724	70%	0.698	S	S	*	*			cis	-163.9	-156	-11.5	-152.4	167.1	-153	0	0	108.1
1217	C	27.6	Very low	29.8	Very low	93 Å²	93	126.4 Å²	126.4	63%	0.628	69%	0.687	S	S	*	*			trans	15.2	131	136.6	-75.5	0	0	0	0	117.2
1218	D	29.4	Very low	29.8	Very low	105 Å²	105	127.5 Å²	127.5	56%	0.561	68%	0.68	S	S	*	*			cis	174.2	-166.8	24.6	-129.6	-42.8	0	0	0	109.3
1219	K	30.4	Very low	29.6	Very low	149 Å²	149	126.3 Å²	126.3	65%	0.648	67%	0.668	S	S	*	*			trans	36.4	131.1	136.5	-63.1	166.3	-172.3	101.3	0	117.9
1220	D	29.6	Very low	29.5	Very low	124 Å²	124	128.6 Å²	128.6	66%	0.663	67%	0.668	S	S	*	*			cis	173.6	179.8	15.7	-116.2	-6.6	0	0	0	106.8
1221	N	29.1	Very low	29	Very low	112 Å²	112	127 Å²	127	60%	0.599	66%	0.66	S	S	*	*			trans	38.1	115.1	142.3	-70.2	-61.9	0	0	0	117.4
1222	K	30.5	Very low	28.5	Very low	173 Å²	173	125.2 Å²	125.2	75%	0.752	65%	0.651	S	S	*	*				-167.7	164.5	65.2	-105.2	118.5	-162.1	156.5	0	112.5
1223	N	28.1	Very low	28.4	Very low	135 Å²	135	127 Å²	127	72%	0.722	65%	0.654	S	S	*	*			trans	71	105	160.8	-66.3	11.5	0	0	0	114.1
1224	V	26.8	Very low	28.1	Very low	98 Å²	98	125 Å²	125	59%	0.594	65%	0.651	S	S	*	*			cis	49.5	84.3	31.2	-156.8	0	0	0	0	108.4	I1226	V1224-I1226 HydrophobicContact CG1-CD1 3.43Å; V1224-I1226 VanDerWaalsContact CG1-CD1 3.43Å; V1224-I1226 HydrophobicContact CG1-CG1 3.74Å
1225	I	26.3	Very low	28.3	Very low	154 Å²	154	128.3 Å²	128.3	79%	0.79	65%	0.651	S	S	*	*				-137	108	80	-88.8	162.9	0	0	0	105.4
1226	I	25	Very low	28.3	Very low	105 Å²	105	125.2 Å²	125.2	54%	0.538	64%	0.64	S	S	.	*				37	87	82.3	-43.7	170.4	0	0	0	109.4	V1224 E1228	V1224-I1226 HydrophobicContact CG1-CD1 3.43Å; V1224-I1226 VanDerWaalsContact CG1-CD1 3.43Å; V1224-I1226 HydrophobicContact CG1-CG1 3.74Å; I1226-E1228 HydrophobicContact CG2-CG 4.17Å
1227	N	27.2	Very low	28.4	Very low	125 Å²	125	123 Å²	123	67%	0.668	64%	0.636	S	S	*	*				-162.6	104.5	113.6	-90	-38.6	0	0	0	105.9
1228	E	30.3	Very low	28.1	Very low	131 Å²	131	124.4 Å²	124.4	61%	0.612	64%	0.638	S	S	*	*				70.1	118.2	79.5	-83.9	-169	-169.2	0	0	109	I1226	I1226-E1228 HydrophobicContact CG2-CG 4.17Å
1229	T	27.1	Very low	28	Very low	73 Å²	73	124.2 Å²	124.2	45%	0.448	64%	0.64	S	S	.	*			trans	69.8	172.9	136.9	76.4	0	0	0	0	115.8	L1231	T1229-L1231 HydrophobicContact CG2-CB 4.47Å; T1229-L1231 HydrophobicContact CG2-CD1 3.67Å; T1229-L1231 HydrophobicContact CG2-CG 3.87Å
1230	Y	27.5	Very low	27.8	Very low	189 Å²	189	125.6 Å²	125.6	74%	0.741	65%	0.647	S	S	*	*			cis	-75.8	115.3	-27.2	-83.3	-102.6	0	0	0	107.5
1231	L	27.4	Very low	27.6	Very low	112 Å²	112	125.8 Å²	125.8	59%	0.586	64%	0.644	S	S	*	*				57.7	165.3	72.6	-98.8	176.2	0	0	0	110.3	T1229	T1229-L1231 HydrophobicContact CG2-CB 4.47Å; T1229-L1231 HydrophobicContact CG2-CD1 3.67Å; T1229-L1231 HydrophobicContact CG2-CG 3.87Å
1232	N	27.8	Very low	28	Very low	106 Å²	106	129.7 Å²	129.7	57%	0.567	66%	0.655	S	S	*	*			trans	71.6	126.8	155.3	-69.2	15.1	0	0	0	115.4
1233	D	27.9	Very low	28	Very low	114 Å²	114	126.1 Å²	126.1	61%	0.61	65%	0.65	S	S	*	*			cis	-168.6	177.9	-3.7	-127.7	-23.9	0	0	0	111.6
1234	L	29	Very low	27.8	Very low	138 Å²	138	126.6 Å²	126.6	72%	0.723	65%	0.647	S	S	*	*			trans	47.3	113.7	139.2	-68.7	164.6	0	0	0	117.8	P1236	L1234-P1236 WeakPolarHBondContact O-CD 3.49Å
1235	E	33.2	Very low	27.7	Very low	162 Å²	162	126.7 Å²	126.7	76%	0.757	64%	0.644	S	S	*	*				-29.6	126.2	126	-57.9	-178.1	123.2	0	0	110.8	T1237	E1235-T1237 HydrophobicContact CB-CG2 4.37Å
1236	P	28.5	Very low	27.7	Very low	77 Å²	77	127.2 Å²	127.2	50%	0.5	64%	0.641	S	S	.	*				-135.3	144.5	92.7	38.2	-27.9	0	0	0	112	L1234 N1238	L1234-P1236 WeakPolarHBondContact O-CD 3.49Å; P1236-N1238 HydrophobicContact CB-CB 4.3Å; P1236-N1238 HydrophobicContact CG-CB 4.28Å; P1236-N1238 VanDerWaalsContact CG-ND2 3.3Å; P1236-N1238 WeakPolarHBondContact CG-ND2 3.18Å; P1236-N1238 PolarHBondContact O-N 3.25Å
1237	T	28.2	Very low	27.7	Very low	107 Å²	107	126.8 Å²	126.8	66%	0.656	64%	0.64	S	S	*	*			cis	48.9	20.1	45.7	76.6	0	0	0	0	114.2	E1235 V1239	E1235-T1237 HydrophobicContact CB-CG2 4.37Å; T1237-V1239 VanDerWaalsContact O-CG2 3.31Å; T1237-V1239 WeakPolarHBondContact O-CG2 3.4Å
1238	N	22.1	Very low	27.7	Very low	123 Å²	123	125.7 Å²	125.7	66%	0.658	64%	0.641	S	S	*	*			trans	-107.4	108.8	155.3	-74.9	-35.9	0	0	0	105.8	P1236	P1236-N1238 HydrophobicContact CB-CB 4.3Å; P1236-N1238 HydrophobicContact CG-CB 4.28Å; P1236-N1238 VanDerWaalsContact CG-ND2 3.3Å; P1236-N1238 WeakPolarHBondContact CG-ND2 3.18Å; P1236-N1238 PolarHBondContact O-N 3.25Å
1239	V	27.2	Very low	27.4	Very low	101 Å²	101	127 Å²	127	61%	0.612	65%	0.647	S	S	*	*			cis	52.7	64.2	46.9	-163.1	0	0	0	0	109.9	T1237	T1237-V1239 VanDerWaalsContact O-CG2 3.31Å; T1237-V1239 WeakPolarHBondContact O-CG2 3.4Å
1240	F	25.7	Very low	27.4	Very low	178 Å²	178	128.2 Å²	128.2	78%	0.781	66%	0.659	S	S	*	*				-109.6	117.6	112.3	-78.7	-89.9	0	0	0	105.5
1241	E	25.2	Very low	27.4	Very low	129 Å²	129	124.2 Å²	124.2	60%	0.603	65%	0.65	S	S	*	*				55.7	104.2	81.5	-62.6	-175.4	154.6	0	0	108.2	P1243	E1241-P1243 WeakPolarHBondContact O-CD 3.39Å
1242	K	36.5	Very low	27.4	Very low	193 Å²	193	125.3 Å²	125.3	84%	0.839	65%	0.652	S	S	*	*				32.9	72.5	64	-165.1	-176	180	179.3	0	109.7
1243	P	30.8	Very low	27.2	Very low	98 Å²	98	125.4 Å²	125.4	64%	0.636	66%	0.66	S	S	*	*				-117.5	151.6	104.2	-2.2	21.9	0	0	0	112.3	E1241	E1241-P1243 WeakPolarHBondContact O-CD 3.39Å
1244	E	23.6	Very low	27.3	Very low	145 Å²	145	125.4 Å²	125.4	68%	0.678	67%	0.668	S	S	*	*			cis	-173	-167.9	-11.4	-121.9	166.6	-177.7	0	0	108
1245	L	25	Very low	27.1	Very low	100 Å²	100	121.8 Å²	121.8	52%	0.524	67%	0.665	S	S	.	*			trans	1.9	150.4	132.8	-44.8	155.8	0	0	0	117.2	D1247	L1245-D1247 VanDerWaalsContact CD2-OD2 3.25Å; L1245-D1247 WeakPolarHBondContact CD2-OD2 3.43Å
1246	F	26.7	Very low	26.7	Very low	165 Å²	165	121.7 Å²	121.7	72%	0.724	67%	0.669	S	S	*	*			cis	-117.9	149.7	8.6	-75.6	-93	0	0	0	108.4
1247	D	25.3	Very low	26.4	Very low	97 Å²	97	121.7 Å²	121.7	52%	0.519	67%	0.67	S	S	.	*				49.8	143.1	66.7	-34.3	-54.7	0	0	0	111.6	L1245	L1245-D1247 VanDerWaalsContact CD2-OD2 3.25Å; L1245-D1247 WeakPolarHBondContact CD2-OD2 3.43Å
1248	C	26.5	Very low	26.2	Very low	101 Å²	101	123.9 Å²	123.9	68%	0.682	67%	0.673	S	S	*	*			cis	-118.2	151.1	17	-58.5	0	0	0	0	109.8
1249	E	24.7	Very low	26.4	Very low	159 Å²	159	124.7 Å²	124.7	74%	0.743	68%	0.677	S	S	*	*				36.6	123.6	78.2	-37.3	-179.1	117.1	0	0	111.2
1250	S	27	Very low	26.2	Very low	99 Å²	99	126.4 Å²	126.4	69%	0.692	68%	0.681	S	S	*	*				154.8	153.8	88.5	55.3	0	0	0	0	106.6
1251	N	26.7	Very low	26.2	Very low	105 Å²	105	125.8 Å²	125.8	56%	0.561	68%	0.679	S	S	*	*			cis	-156.8	156.1	-5.8	-122.9	-19.6	0	0	0	110.8
1252	H	28.3	Very low	26.2	Very low	135 Å²	135	127 Å²	127	63%	0.625	68%	0.684	S	S	*	*			trans	64	143.7	141.1	-65.4	-17.9	0	0	0	120.6
1253	C	23.9	Very low	25.8	Very low	108 Å²	108	122.8 Å²	122.8	73%	0.73	67%	0.671	S	S	*	*			cis	-158.4	153.5	-19.2	-130.9	0	0	0	0	113.2
1254	S	29.8	Very low	25.8	Very low	113 Å²	113	125 Å²	125	79%	0.79	67%	0.67	S	S	*	*			trans	-49.7	135.5	156.4	-46.3	0	0	0	0	113.2
1255	G	25.1	Very low	26	Very low	63 Å²	63	124.1 Å²	124.1	65%	0.649	67%	0.671	S	S	*	*			trans	-149.9	122.8	156.4	0	0	0	0	0	107.5
1256	L	23.9	Very low	26.2	Very low	160 Å²	160	125.5 Å²	125.5	84%	0.838	68%	0.677	S	S	*	*				53.2	124.5	57.7	-55.1	172	0	0	0	110.4
1257	S	23.2	Very low	26.5	Very low	76 Å²	76	122.4 Å²	122.4	53%	0.531	68%	0.676	S	S	.	*			cis	-165.4	168.7	16.1	-134.5	0	0	0	0	112.8
1258	Q	24.4	Very low	27	Very low	154 Å²	154	123.5 Å²	123.5	72%	0.72	69%	0.689	S	S	*	*			trans	46.4	104.6	139.4	-65.1	162.3	16.7	0	0	117.6
1259	N	24.4	Very low	27	Very low	139 Å²	139	122.5 Å²	122.5	74%	0.743	68%	0.683	S	S	*	*				92	172.9	97	-81.3	-39.3	0	0	0	114.3
1260	I	24.3	Very low	27.3	Very low	137 Å²	137	123.9 Å²	123.9	70%	0.703	69%	0.686	S	S	*	*			trans	73.4	103.6	154.3	-71.8	150.2	0	0	0	116.1
1261	K	25.7	Very low	27.2	Very low	166 Å²	166	123.4 Å²	123.4	72%	0.722	69%	0.688	S	S	*	*			trans	76.7	136.4	144.1	-69	175.2	-172.3	175.7	0	116.3
1262	Q	25.1	Very low	27.1	Very low	154 Å²	154	123.3 Å²	123.3	72%	0.72	69%	0.694	S	S	*	*				59.4	129.2	97.7	-51.1	172.2	-45.9	0	0	112.8
1263	D	26.7	Very low	27	Very low	105 Å²	105	122.3 Å²	122.3	56%	0.561	69%	0.694	S	S	*	*			cis	-155.3	-179.8	3.3	-131.2	-15.4	0	0	0	113.1
1264	K	30.9	Very low	27.2	Very low	143 Å²	143	124 Å²	124	62%	0.622	69%	0.691	S	S	*	*			trans	-17.8	145.3	146.9	-43.7	153.9	-167.5	73.9	0	112.7
1265	N	27.7	Very low	27	Very low	128 Å²	128	124.5 Å²	124.5	68%	0.684	69%	0.685	S	S	*	*				170.1	157.1	89.3	-81	-49.6	0	0	0	106.7
1266	I	30.2	Very low	27.1	Very low	128 Å²	128	128.3 Å²	128.3	66%	0.656	69%	0.689	S	S	*	*			cis	-154.7	131.5	-10.6	-109.3	161.3	0	0	0	102.3
1267	S	33.8	Very low	27.2	Very low	101 Å²	101	124.9 Å²	124.9	71%	0.706	68%	0.678	S	S	*	*				58.8	170.2	69.1	-54.6	0	0	0	0	112.5
1268	P	35.9	Very low	27.4	Very low	120 Å²	120	129.4 Å²	129.4	78%	0.779	69%	0.691	S	S	*	*			cis	-114.4	-155	-9.7	39.3	-19.6	0	0	0	108.5
1269	S	26	Very low	27.4	Very low	80 Å²	80	128.3 Å²	128.3	56%	0.559	69%	0.686	S	S	*	*			cis	-153.7	141.6	7.8	105.7	0	0	0	0	113.9
1270	K	29.8	Very low	27.4	Very low	188 Å²	188	126.9 Å²	126.9	82%	0.817	69%	0.686	S	S	*	*			trans	65.1	109.1	145	-60.7	162.8	-170.2	167.3	0	116.5
1271	A	25.6	Very low	27.5	Very low	89 Å²	89	126 Å²	126	74%	0.736	68%	0.684	S	S	*	*				72.5	139.3	59.1	0	0	0	0	0	112.7
1272	C	25.2	Very low	27.4	Very low	102 Å²	102	124.1 Å²	124.1	69%	0.689	69%	0.686	S	S	*	*			cis	-158.1	162.8	1.3	-128.2	0	0	0	0	113.4
1273	N	25.6	Very low	27.5	Very low	114 Å²	114	119.9 Å²	119.9	61%	0.61	68%	0.684	S	S	*	*			trans	64.3	100.2	140.5	-70.3	0.5	0	0	0	121.8
1274	Q	28.7	Very low	27.4	Very low	145 Å²	145	124.7 Å²	124.7	68%	0.678	70%	0.7	S	S	*	*				80.4	127.5	99.7	-78.3	169.6	-0.1	0	0	121.1
1275	N	25.2	Very low	27.1	Very low	122 Å²	122	125.3 Å²	125.3	65%	0.652	71%	0.705	S	S	*	*				98.8	114.4	125.5	-71.2	4	0	0	0	122.4
1276	I	27	Very low	27	Very low	144 Å²	144	129.4 Å²	129.4	74%	0.738	71%	0.711	S	S	*	*				86.1	117.9	122	-65.8	171.3	0	0	0	120
1277	S	26	Very low	27	Very low	88 Å²	88	131.4 Å²	131.4	62%	0.615	72%	0.715	S	S	*	*			trans	58.2	132.7	143.6	-71.9	0	0	0	0	126.5
1278	E	26.4	Very low	26.6	Very low	170 Å²	170	134 Å²	134	79%	0.794	72%	0.716	S	S	*	*				82.9	-172.1	129.7	-72.9	154.3	-123.1	0	0	122.3
1279	E	25.6	Very low	26.2	Very low	132 Å²	132	135.4 Å²	135.4	62%	0.617	71%	0.71	S	S	*	*				-96.9	170.5	-121.2	-64.4	-172.6	132.5	0	0	117.7	Q393	Q393-E1279 VanDerWaalsContact NE2-CD 3.27Å; Q393-E1279 PolarHBondContact NE2-OE1 3.12Å; Q393-E1279 VanDerWaalsContact NE2-OE1 3.11Å; Q393-E1279 PolarHBondContact NE2-OE2 3.22Å
1280	S	23.8	Very low	26.3	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	72%	0.718	S	S	*	*			trans	85.9	104	144.4	74.7	0	0	0	0	121.7
1281	D	26.6	Very low	26.2	Very low	120 Å²	120	136.8 Å²	136.8	64%	0.642	71%	0.708	S	S	*	*				71	151.6	114.5	-145.8	5	0	0	0	123.7
1282	T	24.7	Very low	26.3	Very low	126 Å²	126	140.7 Å²	140.7	77%	0.773	71%	0.709	S	S	*	*			trans	74.4	173.2	162.6	81.9	0	0	0	0	120.5
1283	G	25.7	Very low	26.4	Very low	65 Å²	65	141.7 Å²	141.7	67%	0.67	71%	0.712	S	S	*	*			trans	77.3	62	162.6	0	0	0	0	0	117.9
1284	F	24.1	Very low	26.7	Very low	206 Å²	206	140 Å²	140	90%	0.904	72%	0.721	S	S	*	*				40.6	131.5	88.3	-104.6	-85.3	0	0	0	118.5
1285	Q	26.4	Very low	26.8	Very low	156 Å²	156	137.1 Å²	137.1	73%	0.729	72%	0.717	S	S	*	*			trans	85.3	133.3	169	-48.8	-156.7	63.2	0	0	117.6
1286	R	25.7	Very low	27.3	Very low	213 Å²	213	139.7 Å²	139.7	80%	0.804	72%	0.722	S	S	*	*			cis	105.9	89.9	11	-171.3	-159.4	-169.3	-165.7	6.6	115.6
1287	K	28.3	Very low	27.6	Very low	171 Å²	171	141.3 Å²	141.3	74%	0.743	72%	0.724	S	S	*	*			trans	-169.3	134.1	139.3	-92	135.2	-169	174	0	107.5
1288	Q	26.7	Very low	27.7	Very low	155 Å²	155	145.2 Å²	145.2	72%	0.724	73%	0.73	S	S	*	*				58.2	134.6	77.3	-57.1	180	-25.1	0	0	112
1289	F	26.6	Very low	28.1	Very low	149 Å²	149	146.9 Å²	146.9	65%	0.654	73%	0.731	S	S	*	*			cis	-133.4	158.8	34.1	-93.1	-113.2	0	0	0	111.6
1290	K	28.2	Very low	28.2	Very low	169 Å²	169	146.7 Å²	146.7	74%	0.735	73%	0.73	S	S	*	*				57.7	142.1	69.7	-92.9	174.3	173.9	-179.3	0	112.6
1291	Q	28.7	Very low	28.6	Very low	128 Å²	128	149 Å²	149	60%	0.598	73%	0.726	S	S	*	*			cis	-141.3	179.5	16.6	-102.7	139.9	-98.2	0	0	110.1
1292	F	27.4	Very low	28.7	Very low	172 Å²	172	151.1 Å²	151.1	75%	0.754	73%	0.732	S	S	*	*				-163.1	129.2	56.3	-93.7	-94.7	0	0	0	111.4
1293	T	27	Very low	29	Very low	123 Å²	123	150.3 Å²	150.3	76%	0.755	73%	0.73	S	S	*	*				55.4	136.3	110	71.2	0	0	0	0	117.9
1294	G	31.2	Very low	28.9	Very low	78 Å²	78	152.1 Å²	152.1	80%	0.804	73%	0.733	S	S	*	*			cis	-156.6	-153.3	3.6	0	0	0	0	0	110.8
1295	S	32.1	Very low	29.2	Very low	85 Å²	85	148.5 Å²	148.5	59%	0.594	73%	0.727	S	S	*	*			cis	-167	122.1	5.3	146.8	0	0	0	0	112.7
1296	K	35.1	Very low	29.4	Very low	176 Å²	176	145.7 Å²	145.7	77%	0.765	72%	0.724	S	S	*	*			trans	69	168.5	156.4	-50.4	159.8	-161	162	0	115.9
1297	F	32.3	Very low	29.6	Very low	178 Å²	178	144.1 Å²	144.1	78%	0.781	73%	0.726	S	S	*	*			cis	-136.6	-170.2	6.9	-121.8	-61.8	0	0	0	113.3
1298	K	29.8	Very low	29.9	Very low	169 Å²	169	145.9 Å²	145.9	74%	0.735	73%	0.733	S	S	*	*			trans	-99.9	163.2	-162.6	-59	167.9	-178.6	175.4	0	114.4
1299	Y	34	Very low	30.2	Very low	206 Å²	206	146.8 Å²	146.8	81%	0.808	74%	0.738	S	S	*	*				153.4	153	123.4	-95.7	-88.3	0	0	0	110.4
1300	Q	28.4	Very low	30.4	Very low	128 Å²	128	149.7 Å²	149.7	60%	0.598	74%	0.744	S	S	*	*			cis	-173.7	164.1	-40.4	-166.5	-163.9	21	0	0	107.7
1301	K	32.6	Very low	30.5	Very low	155 Å²	155	149.2 Å²	149.2	67%	0.674	74%	0.738	S	S	*	*			trans	82.4	115.7	164.1	-50	-168	-178	179.8	0	115.6
1302	H	28.1	Very low	30.8	Very low	165 Å²	165	152.1 Å²	152.1	76%	0.764	74%	0.743	S	S	*	*				80.1	139.4	77.8	-61.1	-48.1	0	0	0	112.7
1303	C	29.7	Very low	31.3	Very low	109 Å²	109	153.5 Å²	153.5	74%	0.736	74%	0.744	S	S	*	*			cis	-128.2	154.8	0.2	-54.7	0	0	0	0	107.9
1304	S	25.2	Very low	31.5	Very low	104 Å²	104	151.4 Å²	151.4	73%	0.727	73%	0.734	S	S	*	*				51.7	134.2	53.2	69.6	0	0	0	0	116.5
1305	V	29.7	Very low	31.8	Very low	130 Å²	130	155.2 Å²	155.2	79%	0.788	73%	0.731	S	S	*	*			trans	164.9	135.6	132.3	155	0	0	0	0	114.4
1306	S	29.7	Very low	31.9	Very low	96 Å²	96	154.4 Å²	154.4	67%	0.671	73%	0.729	S	S	*	*			trans	62.2	105	159.3	68.7	0	0	0	0	122.3
1307	H	31.2	Very low	31.6	Very low	180 Å²	180	147.8 Å²	147.8	83%	0.833	71%	0.708	S	S	*	*				-49.7	146.8	127.4	-108.8	-116.9	0	0	0	111.1
1308	K	34.5	Very low	31.4	Very low	208 Å²	208	145.5 Å²	145.5	90%	0.904	70%	0.701	S	S	*	*			trans	-144.8	145.2	149.1	-116.1	166.6	-172.1	171.3	0	111.5
1309	Q	33	Very low	31.4	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.813	70%	0.697	S	S	*	*			trans	-140.2	126.7	-152.4	172.1	-168.7	11.3	0	0	109.5
1310	R	29.8	Very low	31.1	Very low	210 Å²	210	136.1 Å²	136.1	79%	0.792	68%	0.677	S	S	*	*			trans	178.1	148.1	168.6	-103.3	171.4	-177.2	-149.9	3.7	108.7
1311	R	30.8	Very low	31.1	Very low	160 Å²	160	134.2 Å²	134.2	60%	0.604	67%	0.671	S	S	*	*			cis	-172.5	150.5	-15.8	-132.5	-172.4	-170.7	172.5	-1.8	109
1312	R	35.7	Very low	30.9	Very low	188 Å²	188	130.5 Å²	130.5	71%	0.709	66%	0.664	S	S	*	*			trans	67.4	155.7	154.9	-67.4	177.7	172.6	176.3	-6.5	115.8
1313	R	38	Very low	31	Very low	201 Å²	201	130.3 Å²	130.3	76%	0.758	67%	0.668	S	S	*	*			cis	-152.4	145.1	-6.2	-132.4	-173.4	173.2	168.8	-5.8	110.7
1314	S	31.5	Very low	31	Very low	80 Å²	80	131 Å²	131	56%	0.559	67%	0.674	S	S	*	*			trans	35.5	150.2	131.9	68.2	0	0	0	0	121.6
1315	Q	36.9	Very low	31.1	Very low	157 Å²	157	131.2 Å²	131.2	73%	0.734	68%	0.675	S	S	*	*			cis	-165.9	161.5	20.8	-141.9	150.6	-21.7	0	0	112.7	I362	I362-Q1315 VanDerWaalsContact CD1-O 3.24Å; I362-Q1315 WeakPolarHBondContact CD1-O 3.26Å
1316	A	32.8	Very low	31.3	Very low	68 Å²	68	131.8 Å²	131.8	56%	0.562	68%	0.679	S	S	*	*			trans	30.5	126.5	155.3	0	0	0	0	0	120.8
1317	A	28.9	Very low	31.6	Very low	38 Å²	38	134 Å²	134	31%	0.314	68%	0.683	S	S	.	*				78.9	160.7	52.5	0	0	0	0	0	115.1	P361	P361-A1317 VanDerWaalsContact O-CA 3.28Å; P361-A1317 WeakPolarHBondContact O-CA 3.39Å; P361-A1317 PolarHBondContact O-N 2.86Å
1318	M	29.9	Very low	32.2	Very low	129 Å²	129	134.5 Å²	134.5	64%	0.635	69%	0.686	S	S	*	*			trans	94.8	68.8	176.5	-53.8	-69.8	91.7	0	0	119.5	A360	A360-M1318 VanDerWaalsContact CB-O 3.28Å; A360-M1318 WeakPolarHBondContact CB-O 3.38Å
1319	L	29.5	Very low	32.6	Very low	123 Å²	123	128.4 Å²	128.4	64%	0.644	68%	0.683	S	S	*	*				62.9	140.5	125.1	-62.3	165.5	0	0	0	122.7	R359	R359-L1319 WeakPolarHBondContact CB-O 3.38Å; R359-L1319 CarbonylContact O-C 3.55Å; R359-L1319 VanDerWaalsContact O-C 3.29Å
1320	S	26.5	Very low	33.5	Very low	56 Å²	56	122.1 Å²	122.1	39%	0.392	66%	0.664	S	S	.	*			trans	72.4	118	164.4	75.1	0	0	0	0	120.9	I357 S358 R359	I357-S1320 CarbonylContact C-O 3.41Å; I357-S1320 VanDerWaalsContact C-O 3.27Å; S358-S1320 CarbonylContact C-O 3.02Å; S358-S1320 WeakPolarHBondContact CA-O 3.48Å; S358-S1320 PolarHBondContact N-O 3.48Å; S358-S1320 CarbonylContact O-C 3.5Å; R359-S1320 CarbonylContact O-C 3.57Å; R359-S1320 PolarHBondContact O-N 2.91Å; R359-S1320 VanDerWaalsContact O-N 3.09Å
1321	D	29.2	Very low	35.4	Very low	87 Å²	87	114.3 Å²	114.3	47%	0.465	64%	0.642	S	S	.	*				98.6	131.5	121	-72.4	-1.1	0	0	0	126.1	R356 I357 S358	R356-D1321 HydrophobicContact CB-CB 3.71Å; R356-D1321 WeakPolarHBondContact CB-OD2 3.33Å; R356-D1321 WeakPolarHBondContact O-CB 3.25Å; I357-D1321 CarbonylContact C-O 3.48Å; I357-D1321 WeakPolarHBondContact CA-O 3.49Å; I357-D1321 PolarHBondContact N-O 2.6Å; S358-D1321 PolarHBondContact N-O 3.43Å; S358-D1321 CarbonylContact O-C 3.27Å; S358-D1321 PolarHBondContact O-N 2.85Å
1322	S	28.9	Very low	37.2	Very low	77 Å²	77	115.8 Å²	115.8	54%	0.538	65%	0.647	S	S	.	*			trans	60.1	128.4	162.9	-74.3	0	0	0	0	123.4	R356	R356-S1322 WeakPolarHBondContact O-CB 3.49Å; R356-S1322 PolarHBondContact O-OG 2.92Å
1323	L	28.7	Very low	38.8	Very low	161 Å²	161	112.3 Å²	112.3	84%	0.843	64%	0.639	S	S	*	*			trans	80.7	154.9	132.1	-72.3	172.6	0	0	0	122.5
1324	S	29.6	Very low	40.7	Very low	125 Å²	125	105.9 Å²	105.9	87%	0.874	62%	0.62	S	S	*	*			trans	78.4	133.4	177.4	71.6	0	0	0	0	117.3
1325	S	28.1	Very low	42.9	Very low	107 Å²	107	111.3 Å²	111.3	75%	0.748	63%	0.628	S	S	*	*			trans	-100.6	152.6	-173.5	48.9	0	0	0	0	112.5
1326	V	33.9	Very low	44.9	Very low	142 Å²	142	111 Å²	111	86%	0.861	62%	0.621	S	S	*	*			trans	-137.6	112.6	163.1	-179.9	0	0	0	0	107.2
1327	D	35.6	Very low	47.3	Very low	142 Å²	142	111.9 Å²	111.9	76%	0.759	62%	0.615	S	S	*	*			trans	-62.1	137.9	-179.6	-73.6	-59.3	0	0	0	112	G1329	D1327-G1329 PolarHBondContact O-N 2.86Å
1328	Q	43.7	Very low	49.8	Very low	191 Å²	191	116.2 Å²	116.2	89%	0.893	63%	0.629	S	S	*	*			trans	-66.4	123.4	166.2	-63.6	-173.7	16.7	0	0	107.7	G1330	Q1328-G1330 PolarHBondContact O-N 2.76Å
1329	G	43.7	Very low	52.2	Low	81 Å²	81	115 Å²	115	84%	0.835	62%	0.623	S	S	*	*			trans	-55.9	111	-171.3	0	0	0	0	0	112.1	D1327	D1327-G1329 PolarHBondContact O-N 2.86Å
1330	G	52	Low	54.6	Low	41 Å²	41	112.2 Å²	112.2	42%	0.423	61%	0.607	S	S	.	*			trans	-56.7	163.9	178.8	0	0	0	0	0	113	Q1328 D1334	Q1328-G1330 PolarHBondContact O-N 2.76Å; G1330-D1334 WeakPolarHBondContact CA-OD2 3.44Å
1331	S	69.1	Low	57.3	Low	47 Å²	47	114.5 Å²	114.5	33%	0.329	61%	0.614	S	S	.	*			trans	-61.6	175	-177.7	87.5	0	0	0	0	112.6	E1333 D1334 R1335	S1331-E1333 WeakPolarHBondContact CB-OE2 3.47Å; S1331-E1333 PolarHBondContact O-N 3.02Å; S1331-E1333 WeakPolarHBondContact OG-CB 3.19Å; S1331-E1333 PolarHBondContact OG-N 3.04Å; S1331-E1333 PolarHBondContact OG-OE2 3.47Å; S1331-D1334 PolarHBondContact N-OD2 2.76Å; S1331-D1334 PolarHBondContact O-N 3.29Å; S1331-D1334 PolarHBondContact OG-N 2.96Å; S1331-D1334 VanDerWaalsContact OG-N 3.11Å; S1331-R1335 WeakPolarHBondContact O-CB 3.46Å; S1331-R1335 PolarHBondContact O-N 3.27Å
1332	R	68.9	Low	59.7	Low	190 Å²	190	118.2 Å²	118.2	72%	0.717	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-24.5	173.2	-157.9	-175.7	76.6	138.5	6.4	111.4	W1336	R1332-W1336 WeakPolarHBondContact O-CB 3.42Å; R1332-W1336 PolarHBondContact O-N 3.22Å
1333	E	69.4	Low	61.5	Low	116 Å²	116	121 Å²	121	54%	0.542	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.8	-50.4	173.9	-53	70.1	-119	0	0	110.2	S1331 R1335 W1336 L1337	S1331-E1333 WeakPolarHBondContact CB-OE2 3.47Å; S1331-E1333 PolarHBondContact O-N 3.02Å; S1331-E1333 WeakPolarHBondContact OG-CB 3.19Å; S1331-E1333 PolarHBondContact OG-N 3.04Å; S1331-E1333 PolarHBondContact OG-OE2 3.47Å; E1333-R1335 VanDerWaalsContact C-N 3.28Å; E1333-R1335 PolarHBondContact O-N 3.04Å; E1333-W1336 PolarHBondContact O-N 2.79Å; E1333-L1337 WeakPolarHBondContact O-CB 3.36Å; E1333-L1337 PolarHBondContact O-N 2.85Å
1334	D	77.8	Confident	63.5	Low	66 Å²	66	118.1 Å²	118.1	35%	0.353	61%	0.605	S	S	.	*	H	α-helix	trans	-55.3	-43.6	175.6	-69.7	-51.1	0	0	0	111.7	G1330 S1331 W1336 L1337 Q1338	G1330-D1334 WeakPolarHBondContact CA-OD2 3.44Å; S1331-D1334 PolarHBondContact N-OD2 2.76Å; S1331-D1334 PolarHBondContact O-N 3.29Å; S1331-D1334 PolarHBondContact OG-N 2.96Å; S1331-D1334 VanDerWaalsContact OG-N 3.11Å; D1334-W1336 VanDerWaalsContact C-N 3.25Å; D1334-W1336 PolarHBondContact O-N 3.48Å; D1334-L1337 PolarHBondContact O-N 3.46Å; D1334-Q1338 WeakPolarHBondContact O-CB 3.49Å; D1334-Q1338 WeakPolarHBondContact O-CG 3.41Å; D1334-Q1338 PolarHBondContact O-N 3.05Å
1335	R	77.6	Confident	65.6	Low	193 Å²	193	114 Å²	114	73%	0.728	58%	0.578	S	S	*	*	H	α-helix	trans	-74.7	-15.7	-178.1	-153	174.1	-169.6	175.6	5.1	113.3	S1331 E1333	S1331-R1335 WeakPolarHBondContact O-CB 3.46Å; S1331-R1335 PolarHBondContact O-N 3.27Å; E1333-R1335 VanDerWaalsContact C-N 3.28Å; E1333-R1335 PolarHBondContact O-N 3.04Å
1336	W	78.6	Confident	67.8	Low	152 Å²	152	113 Å²	113	58%	0.576	56%	0.562	S	S	*	*	H	α-helix	trans	-86.7	-41.5	168.4	178.4	86.8	0	0	0	111	R1332 E1333 D1334 M1339 Q1340	R1332-W1336 WeakPolarHBondContact O-CB 3.42Å; R1332-W1336 PolarHBondContact O-N 3.22Å; E1333-W1336 PolarHBondContact O-N 2.79Å; D1334-W1336 VanDerWaalsContact C-N 3.25Å; D1334-W1336 PolarHBondContact O-N 3.48Å; W1336-M1339 WeakPolarHBondContact O-CA 3.48Å; W1336-M1339 WeakPolarHBondContact O-CB 3.39Å; W1336-M1339 PolarHBondContact O-N 3.16Å; W1336-Q1340 HydrophobicContact CD2-CG 4.15Å; W1336-Q1340 HydrophobicContact CE3-CG 4.35Å; W1336-Q1340 HydrophobicContact CH2-CG 4.11Å; W1336-Q1340 HydrophobicContact CZ2-CG 3.89Å; W1336-Q1340 HydrophobicContact CZ3-CG 4.33Å; W1336-Q1340 PolarHBondContact O-N 2.9Å
1337	L	83	Confident	68.9	Low	85 Å²	85	112.3 Å²	112.3	45%	0.445	55%	0.552	S	S	.	*	H	α-helix	trans	-58.2	-48.2	172	-97.8	155.6	0	0	0	111.5	E1333 D1334 M1339 Q1340 L1341	E1333-L1337 WeakPolarHBondContact O-CB 3.36Å; E1333-L1337 PolarHBondContact O-N 2.85Å; D1334-L1337 PolarHBondContact O-N 3.46Å; L1337-M1339 PolarHBondContact O-N 3.18Å; L1337-Q1340 PolarHBondContact O-N 2.82Å; L1337-L1341 WeakPolarHBondContact O-CB 3.35Å; L1337-L1341 VanDerWaalsContact O-CG 3.32Å; L1337-L1341 WeakPolarHBondContact O-CG 3.4Å; L1337-L1341 PolarHBondContact O-N 3.05Å
1338	Q	82	Confident	69.7	Low	129 Å²	129	108.7 Å²	108.7	60%	0.603	54%	0.538	S	S	*	.	H	α-helix	trans	-61.2	-29.3	173.1	-78	-174.9	-25.6	0	0	112.9	D1334 R1342	D1334-Q1338 WeakPolarHBondContact O-CB 3.49Å; D1334-Q1338 WeakPolarHBondContact O-CG 3.41Å; D1334-Q1338 PolarHBondContact O-N 3.05Å; Q1338-R1342 WeakPolarHBondContact O-CB 3.13Å; Q1338-R1342 PolarHBondContact O-N 2.97Å
1339	M	80.7	Confident	70	Confident	105 Å²	105	105 Å²	105	52%	0.517	52%	0.524	S	S	.	.	H	α-helix	trans	-76	-36.1	175.3	-169.2	-176.2	-63.3	0	0	112	W1336 L1337 R1343	W1336-M1339 WeakPolarHBondContact O-CA 3.48Å; W1336-M1339 WeakPolarHBondContact O-CB 3.39Å; W1336-M1339 PolarHBondContact O-N 3.16Å; L1337-M1339 PolarHBondContact O-N 3.18Å; M1339-R1343 WeakPolarHBondContact O-CG 3.41Å; M1339-R1343 PolarHBondContact O-N 3.46Å; M1339-R1343 VanDerWaalsContact O-N 3.08Å
1340	Q	79.3	Confident	70	Confident	64 Å²	64	109.1 Å²	109.1	30%	0.299	52%	0.522	S	S	.	.	H	α-helix	trans	-74.6	-45	175	-65.8	-68.2	15.2	0	0	111.8	W1336 L1337 R1342 R1343 I1344	W1336-Q1340 HydrophobicContact CD2-CG 4.15Å; W1336-Q1340 HydrophobicContact CE3-CG 4.35Å; W1336-Q1340 HydrophobicContact CH2-CG 4.11Å; W1336-Q1340 HydrophobicContact CZ2-CG 3.89Å; W1336-Q1340 HydrophobicContact CZ3-CG 4.33Å; W1336-Q1340 PolarHBondContact O-N 2.9Å; L1337-Q1340 PolarHBondContact O-N 2.82Å; Q1340-R1342 VanDerWaalsContact C-N 3.27Å; Q1340-R1342 PolarHBondContact O-N 3.49Å; Q1340-R1343 WeakPolarHBondContact O-CB 3.39Å; Q1340-R1343 PolarHBondContact O-N 3.45Å; Q1340-R1343 VanDerWaalsContact O-N 3.07Å; Q1340-I1344 WeakPolarHBondContact O-CG1 3.36Å; Q1340-I1344 PolarHBondContact O-N 3.48Å
1341	L	82.8	Confident	69.4	Low	104 Å²	104	115.3 Å²	115.3	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-60.6	-37.9	173.5	-70.3	170.3	0	0	0	111.3	L1337 I1344 A1345	L1337-L1341 WeakPolarHBondContact O-CB 3.35Å; L1337-L1341 VanDerWaalsContact O-CG 3.32Å; L1337-L1341 WeakPolarHBondContact O-CG 3.4Å; L1337-L1341 PolarHBondContact O-N 3.05Å; L1341-I1344 PolarHBondContact O-N 3.35Å; L1341-A1345 WeakPolarHBondContact O-CB 3.05Å; L1341-A1345 PolarHBondContact O-N 3.33Å
1342	R	80.9	Confident	67.6	Low	165 Å²	165	121.9 Å²	121.9	62%	0.623	57%	0.565	S	S	*	*	H	α-helix	trans	-63.1	-42.1	170.9	173.4	168	-76.3	-100.5	-1.9	112.5	Q1338 Q1340 I1344 A1345 E1346	Q1338-R1342 WeakPolarHBondContact O-CB 3.13Å; Q1338-R1342 PolarHBondContact O-N 2.97Å; Q1340-R1342 VanDerWaalsContact C-N 3.27Å; Q1340-R1342 PolarHBondContact O-N 3.49Å; R1342-I1344 VanDerWaalsContact C-N 3.32Å; R1342-I1344 PolarHBondContact O-N 3.04Å; R1342-A1345 PolarHBondContact O-N 3.44Å; R1342-E1346 VanDerWaalsContact CD-OE1 3.28Å; R1342-E1346 WeakPolarHBondContact CD-OE1 3.4Å; R1342-E1346 HydrophobicContact CG-CG 4.16Å; R1342-E1346 WeakPolarHBondContact CG-OE1 3.33Å; R1342-E1346 IonicContact NH1-OE1 3.56Å; R1342-E1346 VanDerWaalsContact O-CB 3.27Å; R1342-E1346 WeakPolarHBondContact O-CB 3.33Å; R1342-E1346 WeakPolarHBondContact O-CG 2.97Å; R1342-E1346 PolarHBondContact O-N 2.76Å
1343	R	65.3	Low	65.8	Low	136 Å²	136	118.6 Å²	118.6	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-65.8	-33.3	173.8	-75.9	178.9	-175.7	-175.8	0.7	113.5	M1339 Q1340 L1347	M1339-R1343 WeakPolarHBondContact O-CG 3.41Å; M1339-R1343 PolarHBondContact O-N 3.46Å; M1339-R1343 VanDerWaalsContact O-N 3.08Å; Q1340-R1343 WeakPolarHBondContact O-CB 3.39Å; Q1340-R1343 PolarHBondContact O-N 3.45Å; Q1340-R1343 VanDerWaalsContact O-N 3.07Å; R1343-L1347 WeakPolarHBondContact O-CB 3.44Å; R1343-L1347 WeakPolarHBondContact O-CD1 3.24Å; R1343-L1347 VanDerWaalsContact O-CG 3.22Å; R1343-L1347 WeakPolarHBondContact O-CG 3.38Å; R1343-L1347 PolarHBondContact O-N 2.89Å
1344	I	72.7	Confident	64	Low	100 Å²	100	119 Å²	119	51%	0.513	58%	0.581	S	S	.	*	H	α-helix	trans	-70.1	-44.9	176.3	-67.6	164.6	0	0	0	109.1	Q1340 L1341 R1342 L1347 S1348	Q1340-I1344 WeakPolarHBondContact O-CG1 3.36Å; Q1340-I1344 PolarHBondContact O-N 3.48Å; L1341-I1344 PolarHBondContact O-N 3.35Å; R1342-I1344 VanDerWaalsContact C-N 3.32Å; R1342-I1344 PolarHBondContact O-N 3.04Å; I1344-L1347 CarbonylContact O-C 3.51Å; I1344-L1347 PolarHBondContact O-N 2.96Å; I1344-L1347 VanDerWaalsContact O-N 3.11Å; I1344-S1348 PolarHBondContact O-N 2.81Å; I1344-S1348 PolarHBondContact O-OG 2.83Å; I1344-S1348 VanDerWaalsContact O-OG 3.05Å
1345	A	72.9	Confident	61.7	Low	39 Å²	39	124.7 Å²	124.7	32%	0.322	61%	0.606	S	S	.	*	H	α-helix	trans	-59.8	-48.4	171.5	0	0	0	0	0	112.1	L1341 R1342 L1347 S1348 D1349	L1341-A1345 WeakPolarHBondContact O-CB 3.05Å; L1341-A1345 PolarHBondContact O-N 3.33Å; R1342-A1345 PolarHBondContact O-N 3.44Å; A1345-L1347 PolarHBondContact O-N 3.33Å; A1345-S1348 WeakPolarHBondContact O-CA 3.08Å; A1345-S1348 PolarHBondContact O-N 3.5Å; A1345-D1349 WeakPolarHBondContact O-CB 3.41Å; A1345-D1349 PolarHBondContact O-N 3.47Å
1346	E	73.3	Confident	59.5	Low	85 Å²	85	123.1 Å²	123.1	40%	0.397	61%	0.611	S	S	.	*	H	α-helix	trans	-61.6	-15.2	174.9	-71.9	163.6	178.3	0	0	113.3	R1342 H1350	R1342-E1346 VanDerWaalsContact CD-OE1 3.28Å; R1342-E1346 WeakPolarHBondContact CD-OE1 3.4Å; R1342-E1346 HydrophobicContact CG-CG 4.16Å; R1342-E1346 WeakPolarHBondContact CG-OE1 3.33Å; R1342-E1346 IonicContact NH1-OE1 3.56Å; R1342-E1346 VanDerWaalsContact O-CB 3.27Å; R1342-E1346 WeakPolarHBondContact O-CB 3.33Å; R1342-E1346 WeakPolarHBondContact O-CG 2.97Å; R1342-E1346 PolarHBondContact O-N 2.76Å; E1346-H1350 PolarHBondContact O-CD2 3.45Å
1347	L	57.1	Low	57.2	Low	127 Å²	127	120.2 Å²	120.2	67%	0.665	61%	0.614	S	S	*	*	H	α-helix	trans	-96.7	-22.7	170.5	-74.4	168.8	0	0	0	113.3	R1343 I1344 A1345	R1343-L1347 WeakPolarHBondContact O-CB 3.44Å; R1343-L1347 WeakPolarHBondContact O-CD1 3.24Å; R1343-L1347 VanDerWaalsContact O-CG 3.22Å; R1343-L1347 WeakPolarHBondContact O-CG 3.38Å; R1343-L1347 PolarHBondContact O-N 2.89Å; I1344-L1347 CarbonylContact O-C 3.51Å; I1344-L1347 PolarHBondContact O-N 2.96Å; I1344-L1347 VanDerWaalsContact O-N 3.11Å; A1345-L1347 PolarHBondContact O-N 3.33Å
1348	S	53	Low	54.6	Low	67 Å²	67	120.3 Å²	120.3	47%	0.469	62%	0.622	S	S	.	*	H	α-helix	trans	-79.9	-47.7	173.1	-59.2	0	0	0	0	111.6	I1344 A1345 H1350 Q1351	I1344-S1348 PolarHBondContact O-N 2.81Å; I1344-S1348 PolarHBondContact O-OG 2.83Å; I1344-S1348 VanDerWaalsContact O-OG 3.05Å; A1345-S1348 WeakPolarHBondContact O-CA 3.08Å; A1345-S1348 PolarHBondContact O-N 3.5Å; S1348-H1350 PolarHBondContact O-N 3.38Å; S1348-Q1351 PolarHBondContact O-N 3.35Å
1349	D	50.6	Low	52.3	Low	112 Å²	112	119.6 Å²	119.6	60%	0.599	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-9.4	177.8	-60.4	-14.6	0	0	0	112.9	A1345	A1345-D1349 WeakPolarHBondContact O-CB 3.41Å; A1345-D1349 PolarHBondContact O-N 3.47Å
1350	H	43.3	Very low	49.7	Very low	168 Å²	168	122.2 Å²	122.2	78%	0.778	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	6	175.3	-78.3	-24.9	0	0	0	114.4	E1346 S1348	E1346-H1350 PolarHBondContact O-CD2 3.45Å; S1348-H1350 PolarHBondContact O-N 3.38Å
1351	Q	38.8	Very low	47.4	Very low	172 Å²	172	126.1 Å²	126.1	80%	0.804	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.5	-12.4	175.9	-161.3	158.7	8	0	0	114.3	S1348	S1348-Q1351 PolarHBondContact O-N 3.35Å
1352	E	32.4	Very low	44.9	Very low	185 Å²	185	126.9 Å²	126.9	86%	0.864	66%	0.658	S	S	*	*	S	Bend	trans	-106.9	46	177.2	-64.3	-162.9	146.1	0	0	114.1
1353	V	31.2	Very low	42.6	Very low	120 Å²	120	125.3 Å²	125.3	73%	0.727	66%	0.66	S	S	*	*			trans	-136.7	77	169.5	-169.9	0	0	0	0	111.4
1354	S	31.3	Very low	40.8	Very low	124 Å²	124	121.9 Å²	121.9	87%	0.867	66%	0.658	S	S	*	*			trans	176.1	88.7	150.8	-79.6	0	0	0	0	111.4
1355	Q	30.1	Very low	39	Very low	186 Å²	186	120.6 Å²	120.6	87%	0.869	65%	0.652	S	S	*	*			trans	-128.4	166.5	156.3	-78	-169.4	-13.3	0	0	108.5
1356	L	31.1	Very low	37.2	Very low	160 Å²	160	125.2 Å²	125.2	84%	0.838	67%	0.665	S	S	*	*			trans	87.6	157.5	172.1	-50.5	173.6	0	0	0	117.1
1357	S	29.6	Very low	35.1	Very low	92 Å²	92	124.3 Å²	124.3	64%	0.643	67%	0.667	S	S	*	*			trans	60	110.2	-156.1	66.9	0	0	0	0	113.6
1358	S	29	Very low	33.9	Very low	87 Å²	87	125.5 Å²	125.5	61%	0.608	67%	0.669	S	S	*	*			cis	101.6	158.1	20.7	88.8	0	0	0	0	115.1
1359	D	33	Very low	32.9	Very low	114 Å²	114	128.8 Å²	128.8	61%	0.61	68%	0.679	S	S	*	*			trans	75.3	143.6	168.4	-45	-5.4	0	0	0	117
1360	M	27.4	Very low	31.8	Very low	159 Å²	159	128 Å²	128	78%	0.783	68%	0.682	S	S	*	*			cis	-162	162.4	-39.4	-121.6	-46.7	-173.1	0	0	109.1
1361	E	30.5	Very low	31.1	Very low	147 Å²	147	126 Å²	126	69%	0.687	69%	0.687	S	S	*	*			trans	60.6	138.8	147.5	-81.3	-171.9	-169.9	0	0	124.5
1362	N	29.8	Very low	30.5	Very low	120 Å²	120	120.7 Å²	120.7	64%	0.642	68%	0.679	S	S	*	*			trans	74.3	143.4	132.3	-70.6	-18	0	0	0	121.9
1363	I	32.5	Very low	30.4	Very low	131 Å²	131	118.5 Å²	118.5	67%	0.672	67%	0.673	S	S	*	*			cis	-160.3	149.6	-14.7	-136	166.3	0	0	0	113.2
1364	S	28.3	Very low	30.2	Very low	65 Å²	65	123.3 Å²	123.3	46%	0.455	68%	0.678	S	S	.	*			trans	69.1	150.4	151.4	77.6	0	0	0	0	124.2	Q1165 N1166	Q1165-S1364 PolarHBondContact NE2-O 3.12Å; N1166-S1364 PolarHBondContact ND2-O 2.75Å
1365	D	33.6	Very low	30.2	Very low	73 Å²	73	124.4 Å²	124.4	39%	0.39	67%	0.673	S	S	.	*			trans	66.4	145.5	138.5	-74.5	22.5	0	0	0	122.5	Q1165 N1166	Q1165-D1365 WeakPolarHBondContact CB-O 3.3Å; Q1165-D1365 WeakPolarHBondContact CG-O 3.46Å; Q1165-D1365 PolarHBondContact NE2-O 3.12Å; N1166-D1365 WeakPolarHBondContact CB-O 3.2Å; N1166-D1365 PolarHBondContact ND2-N 2.96Å; N1166-D1365 PolarHBondContact ND2-O 3.23Å
1366	K	34.5	Very low	30.1	Very low	136 Å²	136	122.7 Å²	122.7	59%	0.591	66%	0.663	S	S	*	*			cis	-157.6	156.2	-26.5	-125.2	-179	-162.7	78.1	0	111.1
1367	S	29.3	Very low	30.1	Very low	65 Å²	65	121.2 Å²	121.2	46%	0.455	66%	0.656	S	S	.	*			trans	-35.7	155.7	163.6	52.6	0	0	0	0	118.1
1368	H	32.5	Very low	30.3	Very low	153 Å²	153	120.1 Å²	120.1	71%	0.708	66%	0.658	S	S	*	*				-176.8	138.7	107.7	-104.5	-74.2	0	0	0	116.4
1369	M	32	Very low	30.3	Very low	136 Å²	136	120.6 Å²	120.6	67%	0.67	66%	0.662	S	S	*	*			trans	59.4	127.6	156.5	-48.3	-64.5	73.2	0	0	118.8
1370	S	28.2	Very low	30	Very low	94 Å²	94	122 Å²	122	66%	0.657	67%	0.669	S	S	*	*			cis	77.8	138.1	28.8	-45.2	0	0	0	0	115.8
1371	S	27.7	Very low	30.2	Very low	126 Å²	126	122.6 Å²	122.6	88%	0.881	67%	0.672	S	S	*	*			trans	61.2	140.5	179	66.2	0	0	0	0	116.1
1372	G	27.4	Very low	29.9	Very low	62 Å²	62	126.9 Å²	126.9	64%	0.639	68%	0.682	S	S	*	*			cis	158.9	-170.7	-1	0	0	0	0	0	111.2
1373	N	29.5	Very low	30.1	Very low	139 Å²	139	127.1 Å²	127.1	74%	0.743	69%	0.688	S	S	*	*			trans	68.9	123	-177.1	-61.1	-30.2	0	0	0	113.6
1374	R	27.5	Very low	30	Very low	220 Å²	220	126.3 Å²	126.3	83%	0.83	69%	0.689	S	S	*	*				72.4	155.1	57.1	-67.4	176.5	176.2	-130.5	1.3	111.8
1375	I	29.9	Very low	30.2	Very low	148 Å²	148	129.6 Å²	129.6	76%	0.759	70%	0.701	S	S	*	*			trans	77.8	128.9	168	-60.1	144.7	0	0	0	112.8
1376	K	29.8	Very low	30.1	Very low	150 Å²	150	134 Å²	134	65%	0.652	72%	0.717	S	S	*	*			cis	-179.4	164.8	-19.2	-125.9	169.7	143	-70.1	0	109.1
1377	D	30.8	Very low	29.9	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	73%	0.725	S	S	*	*			trans	57.3	169.9	151.5	-48.3	-29.3	0	0	0	119.5
1378	G	33.1	Very low	30.2	Very low	68 Å²	68	136.3 Å²	136.3	70%	0.701	74%	0.737	S	S	*	*			trans	74.9	100.2	169.3	0	0	0	0	0	115.7
1379	S	28.2	Very low	30.3	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	74%	0.744	S	S	*	*			cis	77.6	121.2	32.3	103.6	0	0	0	0	116.1
1380	N	27.3	Very low	30.2	Very low	143 Å²	143	133.6 Å²	133.6	77%	0.765	75%	0.746	S	S	*	*			trans	72	161.2	153.3	-62.4	-44.6	0	0	0	121.6
1381	M	31.3	Very low	30.4	Very low	172 Å²	172	134.9 Å²	134.9	85%	0.847	75%	0.749	S	S	*	*			trans	74.4	117.2	177.1	-58.7	174.6	-77.8	0	0	114.2
1382	R	25.2	Very low	30.5	Very low	237 Å²	237	136.9 Å²	136.9	89%	0.894	74%	0.742	S	S	*	*			cis	69.8	160.4	46.7	-71.5	-169.5	164.1	-174.9	-3.4	114.1
1383	V	34	Very low	30.4	Very low	126 Å²	126	139 Å²	139	76%	0.764	75%	0.747	S	S	*	*			trans	80.5	91.1	-169.2	-170.5	0	0	0	0	110.9
1384	T	29.6	Very low	30.4	Very low	113 Å²	113	141.2 Å²	141.2	69%	0.693	75%	0.753	S	S	*	*				61.3	121.7	50.3	79.6	0	0	0	0	114.9
1385	L	31.8	Very low	30.4	Very low	135 Å²	135	135.8 Å²	135.8	71%	0.707	75%	0.749	S	S	*	*				-169.4	145.5	126.7	-128.2	56.5	0	0	0	113.2
1386	F	32.3	Very low	30.6	Very low	166 Å²	166	133.4 Å²	133.4	73%	0.728	74%	0.743	S	S	*	*			trans	56.6	141.5	164.9	-61	-63.2	0	0	0	120.9
1387	E	30.9	Very low	30.4	Very low	163 Å²	163	134.5 Å²	134.5	76%	0.762	75%	0.748	S	S	*	*			cis	-176.6	168.8	-49.4	-110.2	179	174.2	0	0	109.4
1388	A	34.5	Very low	30.2	Very low	86 Å²	86	134.5 Å²	134.5	71%	0.711	75%	0.748	S	S	*	*			trans	61.4	122.9	155.3	0	0	0	0	0	118.2
1389	L	36	Very low	30.1	Very low	164 Å²	164	136.7 Å²	136.7	86%	0.859	74%	0.743	S	S	*	*			cis	-135.2	155.2	-2.4	-61	169.6	0	0	0	106.3
1390	G	29.9	Very low	30.2	Very low	68 Å²	68	140 Å²	140	70%	0.701	75%	0.747	S	S	*	*				81.1	131.7	50.5	0	0	0	0	0	109.6
1391	V	31.5	Very low	30.4	Very low	121 Å²	121	140.1 Å²	140.1	73%	0.733	75%	0.748	S	S	*	*			cis	-158.4	131.9	19.6	168.5	0	0	0	0	110.6
1392	K	30.4	Very low	30.5	Very low	168 Å²	168	135.9 Å²	135.9	73%	0.73	73%	0.733	S	S	*	*			trans	51.9	140.3	156.6	-60.3	167.9	-169.5	-178.7	0	119.6
1393	S	24.4	Very low	30.5	Very low	105 Å²	105	131.2 Å²	131.2	73%	0.734	73%	0.726	S	S	*	*			cis	72.7	80.5	22.9	91.2	0	0	0	0	116.4
1394	E	30.9	Very low	30.1	Very low	187 Å²	187	130.1 Å²	130.1	87%	0.874	72%	0.724	S	S	*	*			trans	-145.1	93.9	158.7	-128.7	158.6	-110.6	0	0	111.9
1395	S	27	Very low	30.2	Very low	106 Å²	106	130 Å²	130	74%	0.741	73%	0.726	S	S	*	*			trans	-119.8	175.2	158.8	70	0	0	0	0	106.8
1396	P	33.8	Very low	30.2	Very low	97 Å²	97	130.6 Å²	130.6	63%	0.63	73%	0.73	S	S	*	*			cis	-129.1	-150.1	-12.7	21.1	5.1	0	0	0	110
1397	K	25.6	Very low	30	Very low	174 Å²	174	129.4 Å²	129.4	76%	0.757	73%	0.727	S	S	*	*			trans	93.3	149.7	147.8	-65	174.4	-178.1	-179.3	0	119.5
1398	N	27.2	Very low	29.9	Very low	129 Å²	129	128.9 Å²	128.9	69%	0.69	72%	0.724	S	S	*	*			trans	64.4	140.7	162.8	-69.3	41.5	0	0	0	115.9
1399	D	29.3	Very low	29.9	Very low	113 Å²	113	131.6 Å²	131.6	60%	0.604	73%	0.725	S	S	*	*			cis	-156.4	166.7	-4.1	-107.5	-20.9	0	0	0	111.8
1400	H	31.8	Very low	29.6	Very low	166 Å²	166	129.1 Å²	129.1	77%	0.769	72%	0.719	S	S	*	*			trans	44.4	93.3	150.6	-69	-59.8	0	0	0	120.6
1401	N	31.6	Very low	29.6	Very low	146 Å²	146	130.5 Å²	130.5	78%	0.781	72%	0.716	S	S	*	*				-26.3	135.5	116.7	-178.6	59.6	0	0	0	111.6
1402	P	32	Very low	29.3	Very low	83 Å²	83	130.6 Å²	130.6	54%	0.539	71%	0.712	S	S	.	*			cis	-155.1	-171.4	48.1	45.5	-25.4	0	0	0	118.7
1403	N	26.1	Very low	29.1	Very low	139 Å²	139	129.8 Å²	129.8	74%	0.743	72%	0.715	S	S	*	*			trans	70.3	158.7	148.4	-67	-17.8	0	0	0	120.4
1404	S	26.2	Very low	29.2	Very low	103 Å²	103	128 Å²	128	72%	0.72	70%	0.703	S	S	*	*			trans	49	116.5	154.8	51.1	0	0	0	0	117.8
1405	C	30.6	Very low	29	Very low	110 Å²	110	127 Å²	127	74%	0.743	70%	0.695	S	S	*	*			cis	-141.7	144.6	22.7	-79.6	0	0	0	0	109.1
1406	L	33.2	Very low	28.8	Very low	149 Å²	149	130.1 Å²	130.1	78%	0.78	70%	0.696	S	S	*	*			cis	51.7	107	15.8	-127.9	-170.1	0	0	0	114.9
1407	Q	27.6	Very low	28.5	Very low	141 Å²	141	131.5 Å²	131.5	66%	0.659	70%	0.698	S	S	*	*			trans	71.2	136.8	-168.1	-42.2	171.4	16	0	0	111.2
1408	H	27.7	Very low	28.5	Very low	151 Å²	151	130.7 Å²	130.7	70%	0.699	70%	0.7	S	S	*	*			cis	-130.2	146.4	5.8	-55.8	-100.8	0	0	0	107.5
1409	L	35.8	Very low	28.4	Very low	143 Å²	143	128.4 Å²	128.4	75%	0.749	70%	0.699	S	S	*	*			cis	59.1	59.6	41.3	-125	-178.3	0	0	0	115.7
1410	P	28.4	Very low	28.4	Very low	112 Å²	112	128.3 Å²	128.3	73%	0.727	71%	0.708	S	S	*	*			trans	-94	144.5	145.7	35.8	-30.2	0	0	0	110.2
1411	P	30.5	Very low	28.3	Very low	97 Å²	97	123.6 Å²	123.6	63%	0.63	70%	0.704	S	S	*	*				-136.6	-165.4	-87.6	35.6	-18.9	0	0	0	113.4	L1413	P1411-L1413 PolarHBondContact O-N 3.48Å
1412	N	25.5	Very low	28.2	Very low	124 Å²	124	121.9 Å²	121.9	66%	0.663	70%	0.702	S	S	*	*			trans	-29.9	122.4	149	-52.3	-68.9	0	0	0	113.2
1413	L	26	Very low	28.1	Very low	151 Å²	151	123.8 Å²	123.8	79%	0.791	71%	0.708	S	S	*	*				-144.2	113.2	107.4	-80.4	169	0	0	0	104.9	P1411	P1411-L1413 PolarHBondContact O-N 3.48Å
1414	S	26.4	Very low	28.2	Very low	67 Å²	67	122.3 Å²	122.3	47%	0.469	70%	0.704	S	S	.	*			cis	63.7	100.3	20.6	130.3	0	0	0	0	111.8
1415	K	26	Very low	28.1	Very low	165 Å²	165	122.6 Å²	122.6	72%	0.717	70%	0.701	S	S	*	*			trans	67.3	143	-167.7	-45.9	153.5	-173.6	173.5	0	110.9
1416	F	23.8	Very low	27.9	Very low	173 Å²	173	122.3 Å²	122.3	76%	0.759	70%	0.696	S	S	*	*			cis	-134.5	157	10.7	-63.5	-100.1	0	0	0	107.8
1417	N	26.3	Very low	27.5	Very low	125 Å²	125	121.8 Å²	121.8	67%	0.668	69%	0.688	S	S	*	*			cis	-152.4	144.3	-0.2	-115.9	-3.3	0	0	0	105.8
1418	I	27.3	Very low	27.7	Very low	157 Å²	157	119.5 Å²	119.5	81%	0.805	68%	0.684	S	S	*	*				34.6	72.2	61.2	-46.1	-175.4	0	0	0	113.6
1419	A	25.2	Very low	27.5	Very low	81 Å²	81	115.8 Å²	115.8	67%	0.669	69%	0.686	S	S	*	*			trans	-156.2	106.9	134.6	0	0	0	0	0	106.8
1420	S	28.1	Very low	27.1	Very low	112 Å²	112	112 Å²	112	78%	0.783	68%	0.681	S	S	*	*				65.2	139	62.1	80	0	0	0	0	112.8
1421	G	30.4	Very low	27	Very low	67 Å²	67	113.5 Å²	113.5	69%	0.691	68%	0.679	S	S	*	*			cis	-104.3	-160.7	3	0	0	0	0	0	114.3
1422	C	28.7	Very low	26.7	Very low	109 Å²	109	116 Å²	116	74%	0.736	68%	0.682	S	S	*	*			cis	-174.3	152	-15.2	-101.8	0	0	0	0	105.1
1423	D	30	Very low	26.7	Very low	123 Å²	123	114.9 Å²	114.9	66%	0.658	68%	0.683	S	S	*	*			cis	-154	137.4	10.1	-113.3	-31.2	0	0	0	108.1
1424	T	27.5	Very low	26.8	Very low	109 Å²	109	112.6 Å²	112.6	67%	0.669	68%	0.68	S	S	*	*				74.7	125	88.9	-70	0	0	0	0	112.2
1425	T	24.5	Very low	26.8	Very low	108 Å²	108	115 Å²	115	66%	0.663	69%	0.688	S	S	*	*			cis	-154.4	142.4	6.9	17.8	0	0	0	0	109.8
1426	V	26.3	Very low	26.8	Very low	105 Å²	105	111.3 Å²	111.3	64%	0.636	67%	0.673	S	S	*	*				56.1	118.2	84	-173.6	0	0	0	0	114.8
1427	F	25.5	Very low	26.9	Very low	137 Å²	137	109 Å²	109	60%	0.601	67%	0.667	S	S	*	*				-166.6	170.7	111.5	-109.1	-70	0	0	0	113.6	K1753	F1427-K1753 WeakPolarHBondContact CE1-O 3.41Å
1428	T	31.3	Very low	26.9	Very low	93 Å²	93	109.5 Å²	109.5	57%	0.571	67%	0.67	S	S	*	*			trans	-136.8	156	-159.1	53.4	0	0	0	0	114.4
1429	G	25.1	Very low	27	Very low	73 Å²	73	107 Å²	107	75%	0.753	67%	0.666	S	S	*	*			trans	98.4	140.7	170.9	0	0	0	0	0	113.4
1430	G	26.1	Very low	27	Very low	63 Å²	63	109.8 Å²	109.8	65%	0.649	67%	0.67	S	S	*	*			cis	165.4	-169.6	-1.5	0	0	0	0	0	110.7
1431	H	25.9	Very low	27	Very low	145 Å²	145	113.1 Å²	113.1	67%	0.671	67%	0.673	S	S	*	*			trans	66.9	144.1	175.4	-73.4	-102.1	0	0	0	115.8
1432	E	25	Very low	26.8	Very low	150 Å²	150	118 Å²	118	70%	0.701	68%	0.678	S	S	*	*			cis	-163.5	161.8	-21.1	-158.8	155.5	-145.5	0	0	109.8
1433	S	26	Very low	26.6	Very low	99 Å²	99	117.6 Å²	117.6	69%	0.692	68%	0.682	S	S	*	*			trans	59.8	129	164.5	59.2	0	0	0	0	117.7
1434	S	27.6	Very low	26.5	Very low	103 Å²	103	118 Å²	118	72%	0.72	68%	0.684	S	S	*	*				65.2	136.5	51.3	-54.7	0	0	0	0	111.9
1435	N	26.1	Very low	26.4	Very low	118 Å²	118	117.9 Å²	117.9	63%	0.631	68%	0.679	S	S	*	*			cis	-161.5	169.1	14.2	-134.8	-22.4	0	0	0	114.6
1436	Q	26.9	Very low	26.4	Very low	88 Å²	88	116.9 Å²	116.9	41%	0.411	68%	0.677	S	S	.	*			trans	73.4	114.8	142.6	-78	165.7	23.6	0	0	122.5	K1739	Q1436-K1739 PolarHBondContact O-NZ 2.84Å
1437	I	25.8	Very low	26.6	Very low	123 Å²	123	116.4 Å²	116.4	63%	0.631	67%	0.671	S	S	*	*				112.4	112.5	118.5	-76	167.8	0	0	0	118.5
1438	N	25.6	Very low	27.1	Very low	137 Å²	137	115.1 Å²	115.1	73%	0.733	69%	0.685	S	S	*	*			trans	52.2	134.9	150.4	-57.6	-1.1	0	0	0	120.4
1439	S	29.7	Very low	27.1	Very low	103 Å²	103	117.2 Å²	117.2	72%	0.72	69%	0.693	S	S	*	*			cis	-160.1	163.4	-7.4	52.7	0	0	0	0	110.5
1440	N	26	Very low	27.3	Very low	141 Å²	141	118.6 Å²	118.6	75%	0.754	69%	0.69	S	S	*	*			cis	119.4	33.8	-2.1	-60.6	11.6	0	0	0	117.9
1441	Q	27.2	Very low	27.8	Very low	181 Å²	181	119.4 Å²	119.4	85%	0.846	70%	0.698	S	S	*	*			trans	-123.7	119.5	156.6	-81.3	164.7	-17.1	0	0	108.1
1442	Q	25.3	Very low	27.9	Very low	170 Å²	170	120.8 Å²	120.8	79%	0.794	70%	0.703	S	S	*	*				71	115.1	66.6	-67.5	177.2	-53.2	0	0	111.1
1443	A	25.6	Very low	28.3	Very low	100 Å²	100	121.9 Å²	121.9	83%	0.826	71%	0.711	S	S	*	*			cis	88.6	159.7	45.3	0	0	0	0	0	113.1
1444	L	27	Very low	28.4	Very low	131 Å²	131	120.9 Å²	120.9	69%	0.686	70%	0.701	S	S	*	*	S	Bend	trans	-57.4	148	-166.8	-56	159.7	0	0	0	114.3
1445	D	25.6	Very low	28.6	Very low	108 Å²	108	126.4 Å²	126.4	58%	0.578	71%	0.707	S	S	*	*			trans	66.7	155.4	156.2	-53.6	-50.2	0	0	0	121.4
1446	S	26	Very low	28.7	Very low	87 Å²	87	130.4 Å²	130.4	61%	0.608	71%	0.714	S	S	*	*			trans	88.9	147.9	159.1	-42	0	0	0	0	120.3
1447	D	30	Very low	28.8	Very low	95 Å²	95	131.9 Å²	131.9	51%	0.508	73%	0.729	S	S	.	*			trans	-85.5	163.1	-172.5	-52.7	-109.9	0	0	0	114.1
1448	A	34.7	Very low	29.1	Very low	109 Å²	109	134.7 Å²	134.7	90%	0.901	73%	0.732	S	S	*	*			trans	-157.1	155.6	166.5	0	0	0	0	0	111.9
1449	D	33	Very low	29.6	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	72%	0.718	S	S	*	*			trans	-128.4	162	-157.5	-158.7	-2.7	0	0	0	114.8
1450	C	29.2	Very low	29.9	Very low	101 Å²	101	131.9 Å²	131.9	68%	0.682	70%	0.701	S	S	*	*			trans	53.5	132.5	156.9	-83	0	0	0	0	122.6
1451	G	36.2	Very low	30.4	Very low	80 Å²	80	127.5 Å²	127.5	83%	0.825	68%	0.678	S	S	*	*			trans	-160.7	66.8	171.1	0	0	0	0	0	114.1
1452	F	28.5	Very low	30.9	Very low	175 Å²	175	121 Å²	121	77%	0.768	65%	0.652	S	S	*	*			trans	-70	134.1	-179.2	-89.6	-97.6	0	0	0	114	V1454	F1452-V1454 HydrophobicContact CD1-CG2 4.09Å
1453	I	32.4	Very low	31.1	Very low	172 Å²	172	119.4 Å²	119.4	88%	0.882	65%	0.645	S	S	*	*			trans	-130.8	136.8	143.6	-63.3	-174.6	0	0	0	108.8
1454	V	28.3	Very low	31.3	Very low	78 Å²	78	117.7 Å²	117.7	47%	0.473	63%	0.632	S	S	.	*			trans	-110.8	137.9	-171.3	169.5	0	0	0	0	110.2	F1452	F1452-V1454 HydrophobicContact CD1-CG2 4.09Å
1455	Y	30.9	Very low	31.6	Very low	219 Å²	219	120.8 Å²	120.8	86%	0.859	64%	0.639	S	S	*	*			trans	-168.2	99.7	135.1	-86.3	-61.1	0	0	0	109.5
1456	R	28	Very low	31.9	Very low	202 Å²	202	125.1 Å²	125.1	76%	0.762	65%	0.654	S	S	*	*				80.3	133.1	71.6	-124.6	-179.1	-167.7	160.1	5.5	115.8
1457	T	30.9	Very low	32	Very low	119 Å²	119	124.4 Å²	124.4	73%	0.73	65%	0.648	S	S	*	*			trans	73.4	147	158.6	69.3	0	0	0	0	118.6
1458	R	30.9	Very low	31.9	Very low	183 Å²	183	125.2 Å²	125.2	69%	0.691	64%	0.644	S	S	*	*			cis	-168.3	176.3	-12.4	-108.3	-174	85.2	163.5	9.8	110.5	E88	E88-R1458 VanDerWaalsContact OE1-CB 3.25Å; E88-R1458 WeakPolarHBondContact OE1-CB 3.46Å; E88-R1458 WeakPolarHBondContact OE1-CD 3.37Å; E88-R1458 WeakPolarHBondContact OE1-CG 3.41Å; E88-R1458 IonicContact OE1-CZ 2.82Å; E88-R1458 IonicContact OE1-NE 3.31Å; E88-R1458 PolarHBondContact OE1-NE 2.89Å; E88-R1458 IonicContact OE1-NH2 3.23Å; E88-R1458 IonicContact OE2-CZ 3.18Å; E88-R1458 IonicContact OE2-NE 3.8Å; E88-R1458 PolarHBondContact OE2-NE 2.64Å; E88-R1458 IonicContact OE2-NH2 3.25Å; E88-R1458 PolarHBondContact OE2-NH2 3.33Å
1459	E	37	Very low	31.7	Very low	96 Å²	96	125.6 Å²	125.6	45%	0.449	64%	0.636	S	S	.	*			trans	80.2	137.6	146.8	-81.4	-150.7	126.3	0	0	125.4	H86 N87 E88	H86-E1459 IonicContact CE1-OE1 2.79Å; H86-E1459 IonicContact ND1-OE1 2.85Å; N87-E1459 PolarHBondContact ND2-OE1 3.43Å; E88-E1459 VanDerWaalsContact CD-CG 3.44Å; E88-E1459 HydrophobicContact CG-CG 4.33Å; E88-E1459 VanDerWaalsContact OE1-CA 3.28Å; E88-E1459 WeakPolarHBondContact OE1-CA 3.41Å; E88-E1459 WeakPolarHBondContact OE1-CG 3.44Å; E88-E1459 PolarHBondContact OE1-N 2.81Å
1460	K	35.2	Very low	31.3	Very low	84 Å²	84	126.1 Å²	126.1	37%	0.365	63%	0.627	S	S	.	*			trans	90	115.2	161.1	-51.3	-60.4	113.8	100.7	0	121.4	Y85 H86 N87	Y85-K1460 HydrophobicContact CD1-CD 3.7Å; Y85-K1460 HydrophobicContact CE1-CD 4.1Å; H86-K1460 WeakPolarHBondContact CE1-CE 3.38Å; H86-K1460 PolarHBondContact CE1-NZ 2.63Å; H86-K1460 WeakPolarHBondContact ND1-CE 3Å; H86-K1460 WeakPolarHBondContact NE2-CE 3.01Å; H86-K1460 PolarHBondContact NE2-NZ 2.68Å; N87-K1460 VanDerWaalsContact OD1-CA 3.25Å; N87-K1460 WeakPolarHBondContact OD1-CA 3.46Å; N87-K1460 WeakPolarHBondContact OD1-CE 3.31Å; N87-K1460 PolarHBondContact OD1-N 3.23Å
1461	D	37.4	Very low	31.2	Very low	50 Å²	50	125.2 Å²	125.2	27%	0.267	62%	0.622	S	S	.	*			trans	-120.7	-123.6	177.2	-177.8	44.3	0	0	0	113.9	Y85 N2120	Y85-D1461 CarbonylContact C-O 3.49Å; Y85-D1461 VanDerWaalsContact C-O 3.25Å; Y85-D1461 PolarHBondContact N-O 2.82Å; Y85-D1461 CarbonylContact O-C 3.56Å; D1461-N2120 VanDerWaalsContact CG-CG 3.42Å; D1461-N2120 PolarHBondContact OD1-ND2 3.33Å; D1461-N2120 WeakPolarHBondContact OD2-CB 3.46Å; D1461-N2120 PolarHBondContact OD2-ND2 3.33Å; D1461-N2120 VanDerWaalsContact OD2-ND2 3.07Å; D1461-N2120 PolarHBondContact OD2-OD1 3.07Å
1462	P	37.9	Very low	30.6	Very low	45 Å²	45	129.4 Å²	129.4	29%	0.292	63%	0.625	S	S	.	*			trans	-124.4	-160.1	-131.9	47.3	-31.1	0	0	0	117.3	Y85 H86 N2119	Y85-P1462 VanDerWaalsContact O-CD 3.25Å; Y85-P1462 WeakPolarHBondContact O-CD 3.35Å; Y85-P1462 VanDerWaalsContact O-N 3.1Å; H86-P1462 WeakPolarHBondContact O-CD 3.31Å; P1462-N2119 VanDerWaalsContact CD-CG 3.42Å; P1462-N2119 VanDerWaalsContact CD-ND2 3.28Å; P1462-N2119 WeakPolarHBondContact CD-ND2 3.3Å; P1462-N2119 HydrophobicContact CG-CB 3.88Å; P1462-N2119 VanDerWaalsContact CG-CG 3.48Å
1463	M	27.9	Very low	30.5	Very low	135 Å²	135	127 Å²	127	67%	0.665	62%	0.62	S	S	*	*			trans	99.5	156.3	141.2	-107.6	-174.6	47.1	0	0	121.2	N2119	M1463-N2119 PolarHBondContact SD-OD1 3.45Å; M1463-N2119 VanDerWaalsContact SD-OD1 3.39Å
1464	A	29.7	Very low	30.3	Very low	65 Å²	65	126.1 Å²	126.1	54%	0.537	61%	0.614	S	S	.	*			trans	61	91	171.5	0	0	0	0	0	116.2
1465	K	33.3	Very low	30.2	Very low	195 Å²	195	131.4 Å²	131.4	85%	0.848	63%	0.633	S	S	*	*				49.2	83.1	78.7	-57.4	175.1	177.2	173	0	114.3
1466	F	32.3	Very low	29.9	Very low	200 Å²	200	125.4 Å²	125.4	88%	0.877	62%	0.623	S	S	*	*			trans	-155.7	150.5	140	-77.6	-69.3	0	0	0	110.1
1467	S	28.7	Very low	29.8	Very low	71 Å²	71	121.9 Å²	121.9	50%	0.497	62%	0.619	S	S	.	*			cis	-172.3	159.4	-41.3	54.6	0	0	0	0	109
1468	R	27.7	Very low	29.6	Very low	112 Å²	112	122.9 Å²	122.9	42%	0.423	61%	0.613	S	S	.	*			trans	60	99.6	156.5	-67	155.9	173.3	-145.1	-12.7	115.5	T1170 K1171 H1173	T1170-R1468 PolarHBondContact O-NH1 3.37Å; T1170-R1468 PolarHBondContact O-NH2 3.5Å; K1171-R1468 PolarHBondContact O-NH1 2.82Å; H1173-R1468 PolarHBondContact CD2-O 3.07Å; H1173-R1468 PolarHBondContact ND1-O 2.91Å; H1173-R1468 PolarHBondContact NE2-O 2.79Å
1469	T	30.3	Very low	29.3	Very low	117 Å²	117	119.9 Å²	119.9	72%	0.718	62%	0.617	S	S	*	*				54.3	97.5	82.3	71.4	0	0	0	0	115.8
1470	R	25.1	Very low	28.7	Very low	149 Å²	149	119.2 Å²	119.2	56%	0.562	62%	0.62	S	S	*	*			trans	-149.8	121.5	140.5	-85.9	-172.9	168.9	-125.4	-18.3	105.1	N1172 H1173	N1172-R1470 PolarHBondContact ND2-NH2 3.07Å; N1172-R1470 PolarHBondContact OD1-NE 3.3Å; N1172-R1470 PolarHBondContact OD1-NH2 2.88Å; H1173-R1470 WeakPolarHBondContact NE2-CB 3.36Å; H1173-R1470 PolarHBondContact NE2-N 3.16Å
1471	S	26.3	Very low	28.3	Very low	82 Å²	82	121.3 Å²	121.3	57%	0.573	63%	0.634	S	S	*	*				62.2	77.8	69.7	79.8	0	0	0	0	112.9
1472	L	24.6	Very low	27.7	Very low	168 Å²	168	126 Å²	126	88%	0.88	65%	0.654	S	S	*	*				-80	135	127.4	-68	174.9	0	0	0	105.4
1473	D	25.4	Very low	27.1	Very low	124 Å²	124	129.6 Å²	129.6	66%	0.663	67%	0.671	S	S	*	*			cis	52.3	77	16.5	-81.2	-23.4	0	0	0	112.3
1474	M	28.1	Very low	27.3	Very low	155 Å²	155	130.7 Å²	130.7	76%	0.764	67%	0.674	S	S	*	*				67.7	88	95.1	-73.8	-70.7	162.8	0	0	113
1475	H	26.3	Very low	27.4	Very low	189 Å²	189	134.4 Å²	134.4	88%	0.875	68%	0.683	S	S	*	*				-165	123.8	124.9	-75.2	-51.1	0	0	0	104.1
1476	S	24	Very low	27.5	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	67%	0.673	S	S	*	*			cis	-146	152.6	37	-90.5	0	0	0	0	113.3
1477	L	25.9	Very low	27.5	Very low	127 Å²	127	126.9 Å²	126.9	67%	0.665	66%	0.664	S	S	*	*			trans	42.7	129.6	132.1	-47.6	-174.3	0	0	0	118.8
1478	F	27.6	Very low	27.9	Very low	140 Å²	140	130.4 Å²	130.4	61%	0.614	67%	0.67	S	S	*	*			cis	-167.6	135.1	7.1	-108.9	-44.9	0	0	0	110.7	T1480	F1478-T1480 VanDerWaalsContact C-N 3.27Å; F1478-T1480 HydrophobicContact CD1-CG2 3.77Å; F1478-T1480 WeakPolarHBondContact CD1-OG1 3.34Å; F1478-T1480 WeakPolarHBondContact CD2-OG1 3.18Å; F1478-T1480 HydrophobicContact CE1-CG2 3.81Å; F1478-T1480 WeakPolarHBondContact CE1-OG1 3.46Å; F1478-T1480 HydrophobicContact CG-CG2 4.48Å; F1478-T1480 WeakPolarHBondContact CG-OG1 3.26Å
1479	P	25	Very low	27.9	Very low	120 Å²	120	130.2 Å²	130.2	78%	0.779	68%	0.682	S	S	*	*			trans	-91.3	59.4	146.7	34.9	-31.5	0	0	0	110.4	I1481	P1479-I1481 CarbonylContact C-O 3.49Å
1480	T	24.1	Very low	27.8	Very low	83 Å²	83	129 Å²	129	51%	0.509	67%	0.674	S	S	.	*			trans	-128	75.1	157.9	58.4	0	0	0	0	104.9	F1478	F1478-T1480 VanDerWaalsContact C-N 3.27Å; F1478-T1480 HydrophobicContact CD1-CG2 3.77Å; F1478-T1480 WeakPolarHBondContact CD1-OG1 3.34Å; F1478-T1480 WeakPolarHBondContact CD2-OG1 3.18Å; F1478-T1480 HydrophobicContact CE1-CG2 3.81Å; F1478-T1480 WeakPolarHBondContact CE1-OG1 3.46Å; F1478-T1480 HydrophobicContact CG-CG2 4.48Å; F1478-T1480 WeakPolarHBondContact CG-OG1 3.26Å
1481	I	25.6	Very low	28.2	Very low	127 Å²	127	125.6 Å²	125.6	65%	0.651	68%	0.678	S	S	*	*				-83.1	119.7	63.2	-58.8	174.6	0	0	0	112.1	P1479 D1483	P1479-I1481 CarbonylContact C-O 3.49Å; I1481-D1483 VanDerWaalsContact CG2-C 3.42Å; I1481-D1483 WeakPolarHBondContact CG2-O 3.12Å
1482	H	25.2	Very low	28.2	Very low	149 Å²	149	127.3 Å²	127.3	69%	0.69	68%	0.68	S	S	*	*			cis	24.9	110.1	28.7	-131.7	-69.8	0	0	0	117
1483	D	26.9	Very low	28.6	Very low	121 Å²	121	123.4 Å²	123.4	65%	0.647	66%	0.664	S	S	*	*			trans	65.5	90.5	176.3	-49.4	-43.7	0	0	0	114.9	I1481	I1481-D1483 VanDerWaalsContact CG2-C 3.42Å; I1481-D1483 WeakPolarHBondContact CG2-O 3.12Å
1484	E	31.9	Very low	28.8	Very low	157 Å²	157	128.9 Å²	128.9	73%	0.734	68%	0.675	S	S	*	*	S	Bend		-150.5	145.2	51	-80	-164.8	133.8	0	0	115.9
1485	I	31.2	Very low	28.8	Very low	143 Å²	143	127.6 Å²	127.6	73%	0.733	67%	0.667	S	S	*	*			trans	55.2	110.2	135.1	-57.3	169.2	0	0	0	115.6
1486	S	35.8	Very low	29	Very low	89 Å²	89	123.9 Å²	123.9	62%	0.622	65%	0.654	S	S	*	*			cis	-164.8	156.3	14.8	-161	0	0	0	0	112.5	K1488	S1486-K1488 PolarHBondContact O-N 3.02Å
1487	E	32.3	Very low	29.1	Very low	149 Å²	149	124.5 Å²	124.5	70%	0.696	65%	0.653	S	S	*	*			trans	-39.4	125	145.4	21.3	149.5	98.9	0	0	113
1488	K	35.6	Very low	29.3	Very low	145 Å²	145	124.5 Å²	124.5	63%	0.63	65%	0.646	S	S	*	*				-170.7	107.5	125.4	-96.7	148.3	-155.4	77	0	110	S1486	S1486-K1488 PolarHBondContact O-N 3.02Å
1489	T	29.5	Very low	29.1	Very low	108 Å²	108	120.8 Å²	120.8	66%	0.663	63%	0.634	S	S	*	*				66.5	123.8	91.9	63.5	0	0	0	0	111.9
1490	V	27.3	Very low	29.2	Very low	92 Å²	92	116.9 Å²	116.9	56%	0.558	61%	0.61	S	S	*	*				55	90.1	72	-177.8	0	0	0	0	110.1
1491	A	32.9	Very low	29.4	Very low	77 Å²	77	118.3 Å²	118.3	64%	0.636	62%	0.618	S	S	*	*			trans	-171.7	78.1	169.6	0	0	0	0	0	104.8
1492	D	26.7	Very low	29.8	Very low	117 Å²	117	118.6 Å²	118.6	63%	0.626	62%	0.621	S	S	*	*				60.2	152	58.7	-163.2	24.1	0	0	0	113.3
1493	T	33.7	Very low	30.2	Very low	87 Å²	87	117.4 Å²	117.4	53%	0.534	62%	0.62	S	S	.	*			trans	59.6	119.1	169.1	42.4	0	0	0	0	117
1494	R	29.7	Very low	30.6	Very low	238 Å²	238	118.1 Å²	118.1	90%	0.898	62%	0.621	S	S	*	*			cis	68.4	33.3	29.4	-39.2	172	70.3	169.5	2.9	115.5
1495	Q	28.3	Very low	30.6	Very low	128 Å²	128	115.3 Å²	115.3	60%	0.598	62%	0.619	S	S	*	*			trans	-124.7	134.1	162.5	-104.9	77.8	18.7	0	0	112.1
1496	D	30.8	Very low	30.7	Very low	112 Å²	112	113.8 Å²	113.8	60%	0.599	62%	0.616	S	S	*	*			trans	50.5	132.2	141.1	-39.3	-33.1	0	0	0	120.1	Y1498	D1496-Y1498 HydrophobicContact CB-CD2 3.97Å; D1496-Y1498 HydrophobicContact CB-CE2 4.32Å
1497	V	25.6	Very low	30.7	Very low	105 Å²	105	114.1 Å²	114.1	64%	0.636	62%	0.618	S	S	*	*			cis	68.3	40.4	22.8	-154.3	0	0	0	0	114.5
1498	Y	28.7	Very low	30.7	Very low	128 Å²	128	111.6 Å²	111.6	50%	0.502	62%	0.616	S	S	.	*			trans	-103.7	125.7	148.7	-81.8	-139.1	0	0	0	107.3	D1496 E1533 D1534	D1496-Y1498 HydrophobicContact CB-CD2 3.97Å; D1496-Y1498 HydrophobicContact CB-CE2 4.32Å; Y1498-E1533 HydrophobicContact CE1-CB 4.42Å; Y1498-E1533 HydrophobicContact CE1-CG 4.38Å; Y1498-D1534 VanDerWaalsContact CD1-N 3.32Å; Y1498-D1534 WeakPolarHBondContact CE1-OD1 3.3Å; Y1498-D1534 VanDerWaalsContact OH-CG 3.27Å; Y1498-D1534 PolarHBondContact OH-OD1 3.06Å; Y1498-D1534 PolarHBondContact OH-OD2 3.14Å
1499	T	24.3	Very low	30.7	Very low	61 Å²	61	111.6 Å²	111.6	37%	0.374	62%	0.622	S	S	.	*			cis	70.2	159.7	28.6	83.4	0	0	0	0	114.7	D1534 V1535	T1499-D1534 WeakPolarHBondContact CB-O 3.19Å; T1499-D1534 PolarHBondContact OG1-O 3.49Å; T1499-V1535 WeakPolarHBondContact OG1-CA 3.23Å; T1499-V1535 PolarHBondContact OG1-N 3.39Å; T1499-V1535 VanDerWaalsContact OG1-N 3.08Å
1500	S	27.9	Very low	31.1	Very low	38 Å²	38	110.9 Å²	110.9	27%	0.266	62%	0.618	S	S	.	*			trans	58.4	111	-158.1	-159.4	0	0	0	0	113.5	E1532 E1533 D1534	S1500-E1532 WeakPolarHBondContact CB-O 3.38Å; S1500-E1532 PolarHBondContact OG-O 2.83Å; S1500-E1533 WeakPolarHBondContact CB-O 3.08Å; S1500-D1534 PolarHBondContact N-O 3.35Å
1501	V	28	Very low	31.3	Very low	113 Å²	113	112.2 Å²	112.2	69%	0.685	62%	0.618	S	S	*	*				64.9	154.4	58.5	-41.3	0	0	0	0	113.8
1502	D	34	Very low	31.6	Very low	133 Å²	133	113.3 Å²	113.3	71%	0.711	62%	0.619	S	S	*	*			trans	66.1	142.8	162.4	-62.4	-0.6	0	0	0	118
1503	D	33.9	Very low	31.8	Very low	124 Å²	124	116.1 Å²	116.1	66%	0.663	63%	0.626	S	S	*	*			cis	-148.1	-178.5	-20.1	-153.5	2.4	0	0	0	113
1504	M	33.7	Very low	31.8	Very low	137 Å²	137	118.3 Å²	118.3	68%	0.675	63%	0.631	S	S	*	*			trans	10.2	116.2	143.9	-121.1	60.5	73	0	0	117.7
1505	S	32.5	Very low	32	Very low	98 Å²	98	113.1 Å²	113.1	69%	0.685	62%	0.617	S	S	*	*				175.5	136.2	102.7	-83.7	0	0	0	0	112
1506	T	34.3	Very low	32.8	Very low	110 Å²	110	114.5 Å²	114.5	68%	0.675	62%	0.623	S	S	*	*				48.3	101.8	83	15.6	0	0	0	0	112
1507	S	34.6	Very low	33.5	Very low	96 Å²	96	113.8 Å²	113.8	67%	0.671	62%	0.623	S	S	*	*				85.2	150.1	83.7	74.6	0	0	0	0	111.7
1508	C	32.8	Very low	34.3	Very low	97 Å²	97	114.5 Å²	114.5	66%	0.655	63%	0.63	S	S	*	*			cis	-176.3	-179.6	-4.8	43.1	0	0	0	0	109.5
1509	L	35.1	Very low	34.9	Very low	144 Å²	144	119 Å²	119	75%	0.754	65%	0.646	S	S	*	*			trans	49.5	137.4	137.1	-72.3	162.7	0	0	0	121.9
1510	T	37.7	Very low	35.5	Very low	93 Å²	93	121.3 Å²	121.3	57%	0.571	66%	0.663	S	S	*	*			trans	72.1	102.6	140.1	50.6	0	0	0	0	122.4
1511	Q	32.9	Very low	36.1	Very low	120 Å²	120	124.1 Å²	124.1	56%	0.561	68%	0.678	S	S	*	*				66.4	-173.4	119.1	-64.5	169.3	-4.1	0	0	116.6
1512	P	37.5	Very low	36.4	Very low	101 Å²	101	126.8 Å²	126.8	66%	0.656	68%	0.68	S	S	*	*			cis	-130.2	154.9	-20.1	14.4	11	0	0	0	116.5
1513	F	31.9	Very low	36.6	Very low	176 Å²	176	129.6 Å²	129.6	77%	0.772	69%	0.686	S	S	*	*			trans	63.2	131.5	136.3	-83.2	-120.4	0	0	0	124.9
1514	M	32.8	Very low	36.9	Very low	132 Å²	132	132.1 Å²	132.1	65%	0.65	69%	0.687	S	S	*	*			trans	69.8	155.7	148.1	-60.7	-57.8	110	0	0	118.6
1515	H	34.1	Very low	36.7	Very low	130 Å²	130	134 Å²	134	60%	0.602	69%	0.687	S	S	*	*			cis	-151.5	162.8	-7.5	-124	-29.6	0	0	0	106.6
1516	Q	46.5	Very low	36.7	Very low	156 Å²	156	133.5 Å²	133.5	73%	0.729	68%	0.675	S	S	*	*	S	Bend	cis	-134.9	13.1	-0.5	-175.4	-172.5	83.7	0	0	109
1517	T	44.8	Very low	36.5	Very low	97 Å²	97	133.3 Å²	133.3	60%	0.595	68%	0.679	S	S	*	*	S	Bend		159.2	176.2	-120.8	56.7	0	0	0	0	103.4
1518	P	41.4	Very low	36.4	Very low	121 Å²	121	139.8 Å²	139.8	79%	0.786	69%	0.689	S	S	*	*				-132.6	93	-101.9	29	-4.7	0	0	0	111.2
1519	R	41.9	Very low	36.3	Very low	222 Å²	222	139.6 Å²	139.6	84%	0.838	69%	0.694	S	S	*	*			trans	-120.7	158.2	-157.5	-71.8	-178.3	168.1	-176.9	-4.9	115.9
1520	P	36.6	Very low	36.2	Very low	110 Å²	110	139.5 Å²	139.5	71%	0.714	69%	0.693	S	S	*	*			trans	-121.6	179.5	-162.7	43.1	-29.6	0	0	0	114.3
1521	T	40.5	Very low	36	Very low	97 Å²	97	141.9 Å²	141.9	60%	0.595	70%	0.7	S	S	*	*			trans	179	-163	143.4	25.4	0	0	0	0	113.2
1522	K	34.9	Very low	36.2	Very low	168 Å²	168	143.4 Å²	143.4	73%	0.73	71%	0.707	S	S	*	*			trans	-144.2	157.5	-156.8	-62.6	173.1	179.7	171	0	114.6	D48	D48-K1522 VanDerWaalsContact OD1-O 3.1Å
1523	K	39	Very low	36.1	Very low	193 Å²	193	145.5 Å²	145.5	84%	0.839	71%	0.708	S	S	*	*			trans	17.3	130.6	147.3	-64.2	-174.4	176.7	-174.1	0	120.5
1524	R	39.3	Very low	36.4	Very low	176 Å²	176	140.8 Å²	140.8	66%	0.664	69%	0.691	S	S	*	*			trans	83.2	113.3	132.5	-173	-168.2	-168.9	-175.2	4.6	120.3
1525	W	28.8	Very low	36.5	Very low	178 Å²	178	138.4 Å²	138.4	67%	0.674	68%	0.684	S	S	*	*			trans	-132.3	131.2	146.1	-100.1	68.1	0	0	0	106.8	D48 Y49	D48-W1525 PolarHBondContact O-NE1 3.2Å; Y49-W1525 PolarHBondContact O-NE1 3.28Å
1526	L	33.5	Very low	36.3	Very low	86 Å²	86	139 Å²	139	45%	0.45	69%	0.686	S	S	.	*				71.5	119	64.3	-66.9	166.6	0	0	0	110.9
1527	S	29	Very low	35.6	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	68%	0.683	S	S	*	*			cis	69.3	128.2	23.1	-34.4	0	0	0	0	114.5
1528	R	33.7	Very low	34.9	Very low	232 Å²	232	136.3 Å²	136.3	88%	0.875	69%	0.689	S	S	*	*			trans	77.7	69.6	172.4	-156.3	-176.6	-163.2	113.6	5	117.2
1529	A	30.3	Very low	34.4	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	69%	0.687	S	S	*	*			trans	-160	130.4	149.4	0	0	0	0	0	107.7
1530	L	33.1	Very low	33.7	Very low	141 Å²	141	133.3 Å²	133.3	74%	0.738	68%	0.677	S	S	*	*			cis	-137.8	134.9	-20.9	-80.8	166.9	0	0	0	104.5
1531	M	34.1	Very low	33.2	Very low	143 Å²	143	134.1 Å²	134.1	70%	0.704	68%	0.676	S	S	*	*				56.3	85.2	81.2	-74.9	172.4	49.1	0	0	114.3
1532	E	36.4	Very low	32.5	Very low	153 Å²	153	139.2 Å²	139.2	72%	0.715	69%	0.69	S	S	*	*			trans	175.6	110	145.2	-97.2	159.8	-139.6	0	0	103.8	S1500	S1500-E1532 WeakPolarHBondContact CB-O 3.38Å; S1500-E1532 PolarHBondContact OG-O 2.83Å
1533	E	36	Very low	32.2	Very low	145 Å²	145	136.9 Å²	136.9	68%	0.678	70%	0.695	S	S	*	*				89	123	60.1	-73.7	-178.1	175.3	0	0	114	Y1498 S1500	Y1498-E1533 HydrophobicContact CE1-CB 4.42Å; Y1498-E1533 HydrophobicContact CE1-CG 4.38Å; S1500-E1533 WeakPolarHBondContact CB-O 3.08Å
1534	D	36.9	Very low	31.6	Very low	76 Å²	76	135.4 Å²	135.4	41%	0.406	70%	0.696	S	S	.	*			trans	70.8	161.2	152.7	-70	55.7	0	0	0	117.9	Y1498 T1499 S1500	Y1498-D1534 VanDerWaalsContact CD1-N 3.32Å; Y1498-D1534 WeakPolarHBondContact CE1-OD1 3.3Å; Y1498-D1534 VanDerWaalsContact OH-CG 3.27Å; Y1498-D1534 PolarHBondContact OH-OD1 3.06Å; Y1498-D1534 PolarHBondContact OH-OD2 3.14Å; T1499-D1534 WeakPolarHBondContact CB-O 3.19Å; T1499-D1534 PolarHBondContact OG1-O 3.49Å; S1500-D1534 PolarHBondContact N-O 3.35Å
1535	V	35.2	Very low	31.1	Very low	83 Å²	83	132.8 Å²	132.8	50%	0.503	70%	0.704	S	S	.	*			cis	-145	158.3	-34.1	111.1	0	0	0	0	111.2	T1499	T1499-V1535 WeakPolarHBondContact OG1-CA 3.23Å; T1499-V1535 PolarHBondContact OG1-N 3.39Å; T1499-V1535 VanDerWaalsContact OG1-N 3.08Å
1536	E	31.2	Very low	31	Very low	141 Å²	141	129.8 Å²	129.8	66%	0.659	71%	0.709	S	S	*	*			trans	30.9	124.3	158	-62.8	-173	125.7	0	0	124.9
1537	S	30.5	Very low	30.9	Very low	96 Å²	96	134 Å²	134	67%	0.671	73%	0.727	S	S	*	*				83.1	155.3	124.1	85	0	0	0	0	124.7
1538	S	31.9	Very low	31.1	Very low	101 Å²	101	134 Å²	134	71%	0.706	73%	0.727	S	S	*	*			trans	81.3	110.2	151.9	81.7	0	0	0	0	121.6
1539	H	29.8	Very low	31	Very low	163 Å²	163	129.7 Å²	129.7	76%	0.755	72%	0.719	S	S	*	*			trans	47.5	124.9	132.6	-80.8	-67	0	0	0	124.6
1540	N	27.4	Very low	30.9	Very low	118 Å²	118	130.8 Å²	130.8	63%	0.631	71%	0.712	S	S	*	*			trans	78.4	112.7	130.3	-63.3	-10.2	0	0	0	121.4
1541	N	26.5	Very low	30.8	Very low	127 Å²	127	132.1 Å²	132.1	68%	0.679	71%	0.714	S	S	*	*				75.5	116.8	123.3	-62.6	-20.4	0	0	0	122.2
1542	F	25.8	Very low	30.6	Very low	203 Å²	203	129.4 Å²	129.4	89%	0.89	71%	0.709	S	S	*	*			trans	54.2	99.8	130.4	-73.7	-84.3	0	0	0	120.7
1543	S	28.5	Very low	30.2	Very low	120 Å²	120	130 Å²	130	84%	0.839	72%	0.716	S	S	*	*			trans	-169.8	173.7	142.1	45.4	0	0	0	0	108.8
1544	N	26.1	Very low	29.7	Very low	162 Å²	162	126.7 Å²	126.7	87%	0.866	71%	0.71	S	S	*	*				-161.7	167.2	-63.9	-125.2	-14.1	0	0	0	105.2
1545	C	28.1	Very low	29.3	Very low	121 Å²	121	128.5 Å²	128.5	82%	0.818	72%	0.723	S	S	*	*			trans	-78.3	152.3	-175.8	-65.6	0	0	0	0	114.9
1546	S	28	Very low	29.1	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	74%	0.737	S	S	*	*			trans	-173.1	169.1	164.7	-83.3	0	0	0	0	110.6
1547	H	30.5	Very low	28.9	Very low	176 Å²	176	130.5 Å²	130.5	82%	0.815	73%	0.734	S	S	*	*				-174.8	124.7	-50.6	-116	-59.2	0	0	0	108.8
1548	S	34	Very low	28.8	Very low	106 Å²	106	132.8 Å²	132.8	74%	0.741	74%	0.739	S	S	*	*			trans	-169.2	135.9	162.1	-88.5	0	0	0	0	110.2
1549	I	31.4	Very low	28.6	Very low	142 Å²	142	132.3 Å²	132.3	73%	0.728	74%	0.735	S	S	*	*			cis	80.4	125.2	49.9	-66	168.6	0	0	0	110.8
1550	N	27.8	Very low	28.5	Very low	115 Å²	115	129.1 Å²	129.1	62%	0.615	73%	0.731	S	S	*	*			cis	-165.6	171.6	-11.7	-110	-8.5	0	0	0	110.2
1551	H	31	Very low	28.5	Very low	169 Å²	169	130.5 Å²	130.5	78%	0.782	74%	0.738	S	S	*	*			trans	67.3	152.6	158.7	-60.2	-42.9	0	0	0	118.1
1552	S	30	Very low	28.5	Very low	86 Å²	86	130 Å²	130	60%	0.601	74%	0.739	S	S	*	*			cis	-171.2	152.3	-19.7	53.4	0	0	0	0	111.4
1553	L	27.1	Very low	28.8	Very low	165 Å²	165	126.9 Å²	126.9	86%	0.864	73%	0.731	S	S	*	*			trans	66.2	158.3	149.8	-71.3	166.3	0	0	0	116.1
1554	S	26.8	Very low	28.7	Very low	76 Å²	76	128.8 Å²	128.8	53%	0.531	73%	0.726	S	S	.	*			cis	-166.1	136.1	-15.1	174.3	0	0	0	0	110.4
1555	T	28.4	Very low	28.9	Very low	114 Å²	114	128.7 Å²	128.7	70%	0.699	73%	0.726	S	S	*	*			trans	63.4	157	148.6	55.7	0	0	0	0	117.7
1556	K	30.2	Very low	29.1	Very low	181 Å²	181	128.4 Å²	128.4	79%	0.787	73%	0.725	S	S	*	*			cis	-167.6	178.6	-2	-125.2	168.5	-171.8	178.3	0	108.6
1557	S	27.8	Very low	29	Very low	85 Å²	85	128.8 Å²	128.8	59%	0.594	73%	0.727	S	S	*	*			trans	32.7	135.4	137.5	76	0	0	0	0	121.1
1558	D	28.2	Very low	28.8	Very low	144 Å²	144	124.4 Å²	124.4	77%	0.77	72%	0.72	S	S	*	*			cis	-165.7	164.4	-6.7	-118.8	-49.5	0	0	0	112.2
1559	S	27.7	Very low	28.7	Very low	91 Å²	91	125.3 Å²	125.3	64%	0.636	72%	0.722	S	S	*	*			trans	23.2	138.5	144.8	81.4	0	0	0	0	121.6
1560	S	26.8	Very low	28.5	Very low	96 Å²	96	120.6 Å²	120.6	67%	0.671	70%	0.701	S	S	*	*				110.9	160.7	118.9	81.8	0	0	0	0	118.6
1561	L	27.6	Very low	28.6	Very low	147 Å²	147	120.7 Å²	120.7	77%	0.77	71%	0.705	S	S	*	*			trans	67.9	82.2	166.9	-59.2	172.8	0	0	0	115
1562	V	27.5	Very low	28.6	Very low	117 Å²	117	116.1 Å²	116.1	71%	0.709	69%	0.686	S	S	*	*				83	165.5	70.9	175.3	0	0	0	0	111.7
1563	I	30.4	Very low	28.6	Very low	138 Å²	138	115.7 Å²	115.7	71%	0.708	68%	0.681	S	S	*	*			trans	74.8	73.8	-177.4	-43.6	-177.9	0	0	0	111.6
1564	Q	26.7	Very low	28.7	Very low	159 Å²	159	117 Å²	117	74%	0.743	68%	0.68	S	S	*	*				48.8	106.7	77.2	-53.1	176.4	-35.8	0	0	113.6
1565	N	30.4	Very low	29	Very low	160 Å²	160	121.7 Å²	121.7	86%	0.856	69%	0.691	S	S	*	*			trans	-160.8	50	143.7	-104.1	-36.7	0	0	0	113.4	C1567	N1565-C1567 PolarHBondContact O-N 3.1Å
1566	S	32.1	Very low	29.2	Very low	115 Å²	115	125.7 Å²	125.7	80%	0.804	69%	0.693	S	S	*	*			trans	-74.8	106.1	161.6	54.2	0	0	0	0	110.2
1567	C	26.4	Very low	29.1	Very low	123 Å²	123	124.4 Å²	124.4	83%	0.831	69%	0.693	S	S	*	*			trans	-165.1	164.6	168.2	-129.9	0	0	0	0	115.3	N1565	N1565-C1567 PolarHBondContact O-N 3.1Å
1568	A	27.1	Very low	29	Very low	83 Å²	83	127 Å²	127	69%	0.686	70%	0.699	S	S	*	*			trans	80.8	89	177.7	0	0	0	0	0	117.2
1569	T	30.3	Very low	28.9	Very low	126 Å²	126	125 Å²	125	77%	0.773	70%	0.696	S	S	*	*				73.6	136.6	67.8	66.8	0	0	0	0	113.9
1570	P	28.2	Very low	28.9	Very low	43 Å²	43	131.6 Å²	131.6	28%	0.279	71%	0.707	S	S	.	*			cis	-128.9	137.3	39.3	39.8	-23.9	0	0	0	117.2	E1858 K1859	P1570-E1858 HydrophobicContact CB-CG 4.17Å; P1570-E1858 WeakPolarHBondContact CB-OE1 3.3Å; P1570-E1858 HydrophobicContact CG-CG 3.51Å; P1570-E1858 WeakPolarHBondContact CG-OE1 3.3Å; P1570-K1859 PolarHBondContact O-NZ 3.16Å; P1570-K1859 VanDerWaalsContact O-NZ 3.12Å
1571	V	29.1	Very low	29.1	Very low	116 Å²	116	134.8 Å²	134.8	70%	0.703	72%	0.716	S	S	*	*				102.5	148.8	92.3	168.7	0	0	0	0	112.6
1572	N	32.6	Very low	29.2	Very low	73 Å²	73	132.2 Å²	132.2	39%	0.39	71%	0.71	S	S	.	*			trans	-154	133.2	-165.1	169.9	-14.8	0	0	0	110.7	S1038 K1574	S1038-N1572 PolarHBondContact O-ND2 3.12Å; S1038-N1572 PolarHBondContact OG-ND2 3.04Å; N1572-K1574 PolarHBondContact OD1-N 2.99Å
1573	P	28.3	Very low	29.4	Very low	77 Å²	77	130.2 Å²	130.2	50%	0.5	71%	0.713	S	S	.	*			trans	-128.3	142	140.6	30.5	-17.1	0	0	0	111.3
1574	K	30.5	Very low	29.4	Very low	194 Å²	194	130.8 Å²	130.8	84%	0.843	72%	0.716	S	S	*	*			cis	-146.7	137.2	1.9	-86.3	143.9	176.5	178.3	0	110.1	N1572	N1572-K1574 PolarHBondContact OD1-N 2.99Å
1575	K	33.4	Very low	29.5	Very low	173 Å²	173	127.4 Å²	127.4	75%	0.752	71%	0.71	S	S	*	*	S	Bend	trans	-143.4	125.5	142.7	-92.8	-165.2	176.9	-177.9	0	109.5
1576	R	32.4	Very low	29.5	Very low	199 Å²	199	127 Å²	127	75%	0.751	70%	0.703	S	S	*	*			trans	62.1	109.1	-173	-77	-173.2	172.3	160.6	0.4	116.8	R1041	R1041-R1576 PolarHBondContact O-NH1 3.01Å
1577	I	27.8	Very low	29.4	Very low	154 Å²	154	128.2 Å²	128.2	79%	0.79	70%	0.7	S	S	*	*				-151.2	134	122.1	-105.4	166.5	0	0	0	106.9
1578	I	25.3	Very low	29.6	Very low	138 Å²	138	128.8 Å²	128.8	71%	0.708	69%	0.694	S	S	*	*			trans	29.6	103.7	149.9	-55.9	169.1	0	0	0	115.3
1579	S	26.7	Very low	29.7	Very low	102 Å²	102	130.3 Å²	130.3	71%	0.713	70%	0.697	S	S	*	*				62.6	128.1	69.7	-56.2	0	0	0	0	114
1580	R	28.1	Very low	29.4	Very low	230 Å²	230	130.9 Å²	130.9	87%	0.868	69%	0.694	S	S	*	*			trans	73.8	130.9	-163.5	-48.3	167.3	-176.1	178.8	-0.5	111.2
1581	L	29.9	Very low	29.3	Very low	164 Å²	164	134 Å²	134	86%	0.859	72%	0.715	S	S	*	*			cis	-93.2	140.3	-1.6	-59.1	160.5	0	0	0	109.2
1582	S	29	Very low	29	Very low	93 Å²	93	133.6 Å²	133.6	65%	0.65	71%	0.713	S	S	*	*			cis	80.2	115.1	24.2	83.2	0	0	0	0	115.1
1583	G	32.5	Very low	28.6	Very low	74 Å²	74	139.9 Å²	139.9	76%	0.763	73%	0.733	S	S	*	*			trans	78.9	142.5	-164.7	0	0	0	0	0	110.5
1584	I	30.8	Very low	28.4	Very low	151 Å²	151	142.3 Å²	142.3	77%	0.774	74%	0.736	S	S	*	*			cis	-131.8	136	-2.5	-53.4	179.2	0	0	0	102.7
1585	S	28.6	Very low	28.3	Very low	87 Å²	87	141.1 Å²	141.1	61%	0.608	73%	0.733	S	S	*	*				49.9	143	77.5	-101.4	0	0	0	0	111
1586	E	30	Very low	27.9	Very low	152 Å²	152	137.5 Å²	137.5	71%	0.71	73%	0.73	S	S	*	*			cis	-156.1	173.5	8.4	-97.9	118.5	-147.4	0	0	104.3
1587	D	31.3	Very low	27.6	Very low	141 Å²	141	134.4 Å²	134.4	75%	0.754	73%	0.729	S	S	*	*			cis	-166.3	-173.3	-30.2	-102.5	-7.3	0	0	0	107.1
1588	L	30.7	Very low	27.6	Very low	135 Å²	135	134.7 Å²	134.7	71%	0.707	73%	0.732	S	S	*	*			trans	-57.7	154.4	172.3	-81.4	72.5	0	0	0	112.8	I1590	L1588-I1590 HydrophobicContact CD2-CB 4.45Å; L1588-I1590 HydrophobicContact CD2-CD1 3.96Å; L1588-I1590 HydrophobicContact CD2-CG1 4.38Å
1589	P	27.4	Very low	27.6	Very low	114 Å²	114	134.5 Å²	134.5	74%	0.74	73%	0.732	S	S	*	*				-128.9	170.6	69.1	11.8	12.5	0	0	0	113.3
1590	I	25.7	Very low	27.6	Very low	138 Å²	138	135.3 Å²	135.3	71%	0.708	73%	0.728	S	S	*	*			cis	52.6	86.9	-5	-45.3	-173.8	0	0	0	117.7	L1588	L1588-I1590 HydrophobicContact CD2-CB 4.45Å; L1588-I1590 HydrophobicContact CD2-CD1 3.96Å; L1588-I1590 HydrophobicContact CD2-CG1 4.38Å
1591	C	24.3	Very low	27.5	Very low	108 Å²	108	132.4 Å²	132.4	73%	0.73	72%	0.721	S	S	*	*			trans	171.8	122.6	145.6	-92.5	0	0	0	0	107.1
1592	T	23.3	Very low	27.4	Very low	108 Å²	108	131.9 Å²	131.9	66%	0.663	71%	0.712	S	S	*	*				84.8	112.1	52.5	63.1	0	0	0	0	115.1
1593	Y	24.9	Very low	27.2	Very low	206 Å²	206	134.3 Å²	134.3	81%	0.808	71%	0.713	S	S	*	*			trans	60.3	142.3	172.9	-62.8	-87.3	0	0	0	114.9
1594	F	23.5	Very low	26.9	Very low	127 Å²	127	136 Å²	136	56%	0.557	71%	0.714	S	S	*	*			cis	-151.5	167.5	49	-93.2	-80.5	0	0	0	114.3
1595	E	29.7	Very low	26.6	Very low	169 Å²	169	134.2 Å²	134.2	79%	0.79	71%	0.71	S	S	*	*			trans	-69.1	148	160.1	-61.3	146.6	128.1	0	0	111.8
1596	S	24.4	Very low	26.5	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	71%	0.712	S	S	*	*			trans	-164	126.4	149.3	-73.7	0	0	0	0	107.6
1597	D	25.8	Very low	26.3	Very low	134 Å²	134	134.4 Å²	134.4	72%	0.717	71%	0.711	S	S	*	*			trans	-62.6	147.6	167.9	-51.5	-96.7	0	0	0	111.2
1598	D	28.2	Very low	26	Very low	160 Å²	160	134.2 Å²	134.2	86%	0.856	71%	0.709	S	S	*	*				-169.2	75.8	125	-96.7	-26.4	0	0	0	110.4
1599	N	24.9	Very low	25.9	Very low	133 Å²	133	131.9 Å²	131.9	71%	0.711	71%	0.705	S	S	*	*				-8.7	165.3	126	-153.9	-11.2	0	0	0	117.4
1600	L	27	Very low	25.8	Very low	120 Å²	120	132 Å²	132	63%	0.628	70%	0.699	S	S	*	*			trans	73.2	145.3	-179	-68.8	55	0	0	0	114.2
1601	K	25.9	Very low	25.9	Very low	168 Å²	168	134.9 Å²	134.9	73%	0.73	70%	0.701	S	S	*	*			cis	-158	151.3	2.8	-125.4	161.4	-167.1	163.8	0	112.1
1602	K	27.4	Very low	25.9	Very low	154 Å²	154	136.8 Å²	136.8	67%	0.67	70%	0.703	S	S	*	*			trans	66.4	117.3	159	-57.7	-156.7	162.2	-79.1	0	116.8
1603	E	25.6	Very low	26.1	Very low	143 Å²	143	136.9 Å²	136.9	67%	0.668	70%	0.703	S	S	*	*				72.7	142.1	58	-66.6	171.3	135.2	0	0	113.9
1604	S	24.7	Very low	26.1	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	70%	0.698	S	S	*	*			trans	70.2	145	159.2	77.5	0	0	0	0	116.4
1605	V	26	Very low	26.7	Very low	113 Å²	113	133.2 Å²	133.2	69%	0.685	70%	0.703	S	S	*	*			cis	-152.2	127.7	-5.8	109.9	0	0	0	0	106
1606	T	25.8	Very low	27.2	Very low	107 Å²	107	128.8 Å²	128.8	66%	0.656	69%	0.689	S	S	*	*				46.3	117.1	95.6	-19	0	0	0	0	112.5
1607	I	25	Very low	27.3	Very low	135 Å²	135	129 Å²	129	69%	0.692	68%	0.683	S	S	*	*				162.7	118.9	109	-90.5	153.1	0	0	0	103
1608	L	25.9	Very low	27.6	Very low	137 Å²	137	128.8 Å²	128.8	72%	0.717	68%	0.682	S	S	*	*				57.4	124.3	85.7	-69	166	0	0	0	111.3
1609	S	28.5	Very low	27.8	Very low	87 Å²	87	128.1 Å²	128.1	61%	0.608	67%	0.673	S	S	*	*				58.2	124.3	106.2	-48.7	0	0	0	0	112.8
1610	D	24.8	Very low	27.9	Very low	116 Å²	116	128.8 Å²	128.8	62%	0.62	67%	0.672	S	S	*	*			cis	-145.9	149.7	36.7	-92.5	-71.7	0	0	0	110.3
1611	R	28.2	Very low	28	Very low	198 Å²	198	128.6 Å²	128.6	75%	0.747	68%	0.676	S	S	*	*				75.3	142.8	64.9	-147.3	-152.5	-135.8	132.6	-16	111.9
1612	L	24.6	Very low	28	Very low	148 Å²	148	127.5 Å²	127.5	78%	0.775	68%	0.677	S	S	*	*			trans	72.5	151.1	166.3	-54.8	170.1	0	0	0	117.7
1613	V	27.4	Very low	28	Very low	111 Å²	111	125.2 Å²	125.2	67%	0.673	68%	0.678	S	S	*	*			cis	-166.3	178.1	-29.8	75.4	0	0	0	0	109.3
1614	N	25.3	Very low	28.1	Very low	129 Å²	129	125.7 Å²	125.7	69%	0.69	69%	0.686	S	S	*	*			trans	75.3	132.1	177.1	-59.4	-29.7	0	0	0	116.1
1615	N	36.5	Very low	28.5	Very low	126 Å²	126	125.3 Å²	125.3	67%	0.674	68%	0.681	S	S	*	*				65.6	142.6	52.5	-120.8	14.2	0	0	0	111.9
1616	P	38.5	Very low	28.5	Very low	76 Å²	76	126.9 Å²	126.9	49%	0.494	69%	0.685	S	S	.	*			cis	-141.7	167.9	43.3	42.7	-25.2	0	0	0	118.4
1617	N	27.7	Very low	28.4	Very low	103 Å²	103	125.5 Å²	125.5	55%	0.551	68%	0.679	S	S	*	*			trans	65.7	158.4	145.1	-72.8	28.7	0	0	0	119.6
1618	D	32.3	Very low	28.4	Very low	129 Å²	129	127.5 Å²	127.5	69%	0.69	68%	0.683	S	S	*	*			cis	-146	176.2	6.2	-135.4	-46.3	0	0	0	113.8
1619	E	31.2	Very low	28.3	Very low	146 Å²	146	127.1 Å²	127.1	68%	0.682	69%	0.686	S	S	*	*			trans	67.3	81.5	162.9	-57.3	-146.5	113	0	0	121.6
1620	Q	27.7	Very low	28	Very low	147 Å²	147	130 Å²	130	69%	0.687	69%	0.693	S	S	*	*				74.3	165.9	109.6	-72.1	169.2	59.5	0	0	123.3
1621	V	29.3	Very low	28	Very low	117 Å²	117	128.6 Å²	128.6	71%	0.709	69%	0.692	S	S	*	*			trans	78.8	87.3	167.2	-164.3	0	0	0	0	115.7
1622	I	26.5	Very low	27.8	Very low	145 Å²	145	126.8 Å²	126.8	74%	0.744	69%	0.692	S	S	*	*				75.4	132	77	-67.6	164.5	0	0	0	112.3
1623	C	27.2	Very low	27.7	Very low	105 Å²	105	124 Å²	124	71%	0.709	69%	0.685	S	S	*	*			cis	-162.9	157.5	-12.2	-110.4	0	0	0	0	111.2
1624	N	26.4	Very low	27.6	Very low	153 Å²	153	126.4 Å²	126.4	82%	0.818	69%	0.689	S	S	*	*			trans	26.8	161	132.7	-95.1	13.4	0	0	0	123.9
1625	P	34.4	Very low	27.7	Very low	104 Å²	104	127.1 Å²	127.1	68%	0.675	69%	0.688	S	S	*	*			trans	-83.9	173	-170.9	37.7	-38.8	0	0	0	113.1
1626	D	25.8	Very low	27.3	Very low	146 Å²	146	127.7 Å²	127.7	78%	0.781	69%	0.691	S	S	*	*				-164.3	156	122.6	-124.9	-33.2	0	0	0	117.6
1627	C	24.1	Very low	26.8	Very low	78 Å²	78	129.5 Å²	129.5	53%	0.527	70%	0.7	S	S	.	*			trans	21.7	142.1	144.1	-82.5	0	0	0	0	125.5
1628	K	25.3	Very low	26.8	Very low	176 Å²	176	132.8 Å²	132.8	77%	0.765	71%	0.713	S	S	*	*			trans	75	128	136.7	-67.4	161	-167.6	151.3	0	117.1
1629	V	23.3	Very low	26.5	Very low	130 Å²	130	133.9 Å²	133.9	79%	0.788	71%	0.712	S	S	*	*				79.8	143.9	56.1	174.8	0	0	0	0	111.7
1630	I	22.7	Very low	26.4	Very low	147 Å²	147	129.6 Å²	129.6	75%	0.754	70%	0.697	S	S	*	*			trans	77	102.8	-168.5	-48.4	-173.6	0	0	0	110
1631	S	23.1	Very low	26.5	Very low	87 Å²	87	126.3 Å²	126.3	61%	0.608	68%	0.684	S	S	*	*				54.8	147	89.9	79.3	0	0	0	0	114
1632	E	24.7	Very low	26.3	Very low	160 Å²	160	121.9 Å²	121.9	75%	0.748	66%	0.66	S	S	*	*			cis	-162	157.1	35.9	-144.5	136.8	-95	0	0	113.2
1633	S	22.9	Very low	26.4	Very low	88 Å²	88	122 Å²	122	62%	0.615	66%	0.661	S	S	*	*			trans	38.2	146.9	144.6	66	0	0	0	0	125
1634	H	25.5	Very low	26.5	Very low	162 Å²	162	120.5 Å²	120.5	75%	0.75	65%	0.652	S	S	*	*			trans	74	137.7	139	-86.6	-124.6	0	0	0	118.6
1635	E	26.8	Very low	26.5	Very low	145 Å²	145	118.4 Å²	118.4	68%	0.678	65%	0.645	S	S	*	*			cis	-140.3	161.8	-10.2	-71.2	-170.9	142.3	0	0	111.1
1636	D	28.3	Very low	26.2	Very low	138 Å²	138	121.8 Å²	121.8	74%	0.738	65%	0.651	S	S	*	*			trans	10.7	145.6	135.4	-48.5	-19.6	0	0	0	118.2
1637	T	27.6	Very low	26.7	Very low	113 Å²	113	123.1 Å²	123.1	69%	0.693	66%	0.658	S	S	*	*				-173.8	136.7	65.7	-55.3	0	0	0	0	111.7
1638	E	27.4	Very low	26.8	Very low	172 Å²	172	123.9 Å²	123.9	80%	0.804	67%	0.669	S	S	*	*			trans	58.6	123.9	156.1	-70.4	175.6	174.1	0	0	120.9
1639	F	27.3	Very low	26.8	Very low	153 Å²	153	121.1 Å²	121.1	67%	0.671	67%	0.669	S	S	*	*				75.3	126.8	81	-121.1	-115.2	0	0	0	112.7
1640	C	28.5	Very low	27.7	Very low	56 Å²	56	123.5 Å²	123.5	38%	0.378	68%	0.677	S	S	.	*			cis	-175.5	159	-0	-122.4	0	0	0	0	108.9	F484 M485	F484-C1640 CarbonylContact C-O 3.6Å; M485-C1640 PolarHBondContact N-O 3.46Å
1641	D	29.2	Very low	27.8	Very low	77 Å²	77	121.3 Å²	121.3	41%	0.412	67%	0.672	S	S	.	*			cis	-170.3	-87.3	2.9	126.4	55.6	0	0	0	113	C483 F484	C483-D1641 VanDerWaalsContact CA-OD2 3.24Å; C483-D1641 WeakPolarHBondContact CA-OD2 3.38Å; F484-D1641 PolarHBondContact N-OD2 2.81Å; F484-D1641 VanDerWaalsContact O-CG 3.32Å; F484-D1641 VanDerWaalsContact O-OD2 3.08Å
1642	A	26.5	Very low	28	Very low	24 Å²	24	122.9 Å²	122.9	20%	0.198	68%	0.68	C	S	.	*	B	Isolated β-bridge	trans	-82.9	145.4	-160.1	0	0	0	0	0	113.9	F484 M485 E486	F484-A1642 PolarHBondContact O-N 3.08Å; M485-A1642 CarbonylContact C-O 3.12Å; M485-A1642 WeakPolarHBondContact CA-O 3.24Å; M485-A1642 WeakPolarHBondContact CB-O 3.35Å; M485-A1642 WeakPolarHBondContact CG-O 3.37Å; E486-A1642 PolarHBondContact N-O 3.19Å
1643	L	28.4	Very low	28.2	Very low	149 Å²	149	123.9 Å²	123.9	78%	0.78	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	cis	-131.5	60.9	26.4	-73.6	161	0	0	0	112
1644	S	27.9	Very low	29	Very low	73 Å²	73	128.5 Å²	128.5	51%	0.51	69%	0.691	S	S	.	*			trans	-73.6	135.2	178.7	-156.2	0	0	0	0	112.9
1645	T	28	Very low	29.7	Very low	109 Å²	109	124.2 Å²	124.2	67%	0.669	68%	0.684	S	S	*	*				-11.1	138.8	127.7	15.2	0	0	0	0	115.7
1646	H	28.1	Very low	30.6	Very low	174 Å²	174	119.9 Å²	119.9	81%	0.806	67%	0.667	S	S	*	*				-172.1	159	103.8	-99.6	-74.7	0	0	0	112
1647	L	36.1	Very low	31.4	Very low	175 Å²	175	119 Å²	119	92%	0.916	67%	0.667	S	S	*	*			trans	-91.6	121.2	-177.5	-69.8	151.6	0	0	0	110.4
1648	A	25.7	Very low	32.7	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	67%	0.667	S	S	*	*			trans	-157.1	168.6	173.4	0	0	0	0	0	110.1
1649	P	26.1	Very low	34.1	Very low	119 Å²	119	118.8 Å²	118.8	77%	0.773	66%	0.655	S	S	*	*				-105.8	-173.3	-101.2	39.6	-34.4	0	0	0	114.4	P1651	P1649-P1651 VanDerWaalsContact O-CD 3.31Å; P1649-P1651 WeakPolarHBondContact O-CD 3.29Å
1650	L	41.4	Very low	35.4	Very low	180 Å²	180	116.8 Å²	116.8	94%	0.942	65%	0.648	S	S	*	*			trans	-47.1	133.2	-177.7	-65.4	165.8	0	0	0	115.3
1651	P	25	Very low	37.1	Very low	101 Å²	101	117 Å²	117	66%	0.656	65%	0.653	S	S	*	*			trans	-136.7	143.3	148.4	25.9	-5.3	0	0	0	114.2	P1649 K1653	P1649-P1651 VanDerWaalsContact O-CD 3.31Å; P1649-P1651 WeakPolarHBondContact O-CD 3.29Å; P1651-K1653 PolarHBondContact O-N 2.88Å
1652	P	28	Very low	38.9	Very low	120 Å²	120	118.2 Å²	118.2	78%	0.779	66%	0.657	S	S	*	*			trans	-81.3	88.7	-172.5	32	-36.3	0	0	0	113.9
1653	K	27.9	Very low	40.8	Very low	180 Å²	180	122.1 Å²	122.1	78%	0.783	67%	0.671	S	S	*	*			trans	-149	135.2	155.3	-76.3	100.1	-163.6	176.9	0	107.3	P1651	P1651-K1653 PolarHBondContact O-N 2.88Å
1654	K	40.5	Very low	42.6	Very low	185 Å²	185	120 Å²	120	80%	0.804	66%	0.66	S	S	*	*			cis	-129.2	86.5	43.8	-74.3	164.6	-175.7	164.9	0	112.8	T1656	K1654-T1656 WeakPolarHBondContact CB-OG1 3.44Å; K1654-T1656 PolarHBondContact O-N 3.47Å
1655	A	38.7	Very low	44.2	Very low	73 Å²	73	123.9 Å²	123.9	60%	0.603	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	82.9	149.7	0	0	0	0	0	108.1	Q1659	A1655-Q1659 PolarHBondContact O-OE1 3.44Å
1656	T	45.3	Very low	46.2	Very low	54 Å²	54	122.4 Å²	122.4	33%	0.331	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-149.9	-25.2	-179.3	-24.6	0	0	0	0	111.3	K1654 Q1660	K1654-T1656 WeakPolarHBondContact CB-OG1 3.44Å; K1654-T1656 PolarHBondContact O-N 3.47Å; T1656-Q1660 HydrophobicContact CG2-CG 4.3Å; T1656-Q1660 WeakPolarHBondContact O-CA 3.39Å; T1656-Q1660 WeakPolarHBondContact O-CB 2.99Å; T1656-Q1660 WeakPolarHBondContact O-CG 3.25Å; T1656-Q1660 PolarHBondContact O-N 2.82Å
1657	V	46.1	Very low	47.8	Very low	119 Å²	119	117.6 Å²	117.6	72%	0.721	63%	0.629	S	S	*	*	H	α-helix	trans	-74.6	-44.7	163.6	-177.9	0	0	0	0	110.5	A1661	V1657-A1661 VanDerWaalsContact O-CB 3.22Å; V1657-A1661 WeakPolarHBondContact O-CB 3.42Å; V1657-A1661 PolarHBondContact O-N 3.47Å
1658	K	54.2	Low	48.8	Very low	162 Å²	162	115.6 Å²	115.6	70%	0.704	62%	0.615	S	S	*	*	H	α-helix	trans	-61.6	-47.7	170.1	-168.5	176.9	179.1	-175.9	0	110.5	Q1660 A1661 E1662	K1658-Q1660 PolarHBondContact O-N 3.21Å; K1658-A1661 PolarHBondContact O-N 2.85Å; K1658-E1662 WeakPolarHBondContact O-CB 3.35Å; K1658-E1662 PolarHBondContact O-N 2.65Å
1659	Q	58.5	Low	50.2	Low	118 Å²	118	115.7 Å²	115.7	55%	0.551	60%	0.601	S	S	*	*	H	α-helix	trans	-68.9	-31.8	-179.2	-155.3	176.5	23.6	0	0	113.7	A1655 E1663	A1655-Q1659 PolarHBondContact O-OE1 3.44Å; Q1659-E1663 WeakPolarHBondContact O-CB 3.48Å; Q1659-E1663 PolarHBondContact O-N 2.8Å
1660	Q	54.6	Low	51.2	Low	112 Å²	112	117.6 Å²	117.6	52%	0.523	59%	0.593	S	S	.	*	H	α-helix	trans	-78.9	-28.5	171.8	-72.9	169.2	-9.4	0	0	112.7	T1656 K1658 E1662 L1664	T1656-Q1660 HydrophobicContact CG2-CG 4.3Å; T1656-Q1660 WeakPolarHBondContact O-CA 3.39Å; T1656-Q1660 WeakPolarHBondContact O-CB 2.99Å; T1656-Q1660 WeakPolarHBondContact O-CG 3.25Å; T1656-Q1660 PolarHBondContact O-N 2.82Å; K1658-Q1660 PolarHBondContact O-N 3.21Å; Q1660-E1662 VanDerWaalsContact C-N 3.32Å; Q1660-L1664 WeakPolarHBondContact O-CB 3.37Å; Q1660-L1664 WeakPolarHBondContact O-CD1 3.42Å; Q1660-L1664 WeakPolarHBondContact O-CG 3.38Å; Q1660-L1664 PolarHBondContact O-N 2.81Å
1661	A	63.6	Low	51.6	Low	59 Å²	59	116.5 Å²	116.5	49%	0.488	58%	0.581	S	S	.	*	H	α-helix	trans	-67.7	-36.8	169	0	0	0	0	0	111	V1657 K1658 R1665	V1657-A1661 VanDerWaalsContact O-CB 3.22Å; V1657-A1661 WeakPolarHBondContact O-CB 3.42Å; V1657-A1661 PolarHBondContact O-N 3.47Å; K1658-A1661 PolarHBondContact O-N 2.85Å; A1661-R1665 WeakPolarHBondContact O-CB 3.28Å; A1661-R1665 PolarHBondContact O-N 2.78Å
1662	E	67.3	Low	52.7	Low	104 Å²	104	117.1 Å²	117.1	49%	0.486	58%	0.582	S	S	.	*	H	α-helix	trans	-74.4	-39	175.9	-167.7	151	-138.3	0	0	112	K1658 Q1660 R1665 L1666	K1658-E1662 WeakPolarHBondContact O-CB 3.35Å; K1658-E1662 PolarHBondContact O-N 2.65Å; Q1660-E1662 VanDerWaalsContact C-N 3.32Å; E1662-R1665 CarbonylContact O-C 3.55Å; E1662-R1665 VanDerWaalsContact O-CB 3.23Å; E1662-R1665 WeakPolarHBondContact O-CB 3.47Å; E1662-R1665 PolarHBondContact O-N 3.5Å; E1662-L1666 WeakPolarHBondContact O-CB 3.35Å; E1662-L1666 WeakPolarHBondContact O-CG 3.11Å; E1662-L1666 PolarHBondContact O-N 2.76Å
1663	E	64.7	Low	53.2	Low	105 Å²	105	119.9 Å²	119.9	49%	0.491	58%	0.577	S	S	.	*	H	α-helix	trans	-72	-33.6	172.4	-166	-177.7	166.7	0	0	111.9	Q1659 L1666 Q1667	Q1659-E1663 WeakPolarHBondContact O-CB 3.48Å; Q1659-E1663 PolarHBondContact O-N 2.8Å; E1663-L1666 CarbonylContact O-C 3.52Å; E1663-L1666 PolarHBondContact O-N 2.76Å; E1663-Q1667 WeakPolarHBondContact O-CB 3.34Å; E1663-Q1667 VanDerWaalsContact O-CG 3.29Å; E1663-Q1667 WeakPolarHBondContact O-CG 3.35Å; E1663-Q1667 PolarHBondContact O-N 3.07Å; E1663-Q1667 PolarHBondContact OE1-NE2 3.21Å
1664	L	66.5	Low	54.3	Low	104 Å²	104	114.4 Å²	114.4	55%	0.545	56%	0.559	S	S	.	*	H	α-helix	trans	-65.7	-42.1	167.7	-80.2	167	0	0	0	111	Q1660 L1666 Q1667 E1668	Q1660-L1664 WeakPolarHBondContact O-CB 3.37Å; Q1660-L1664 WeakPolarHBondContact O-CD1 3.42Å; Q1660-L1664 WeakPolarHBondContact O-CG 3.38Å; Q1660-L1664 PolarHBondContact O-N 2.81Å; L1664-L1666 VanDerWaalsContact C-N 3.33Å; L1664-L1666 PolarHBondContact O-N 2.7Å; L1664-Q1667 CarbonylContact O-C 3.47Å; L1664-Q1667 PolarHBondContact O-N 2.9Å; L1664-Q1667 VanDerWaalsContact O-N 3.17Å; L1664-E1668 PolarHBondContact O-N 3.25Å
1665	R	61.2	Low	54.6	Low	155 Å²	155	108.1 Å²	108.1	59%	0.585	54%	0.538	S	S	*	.	H	α-helix	trans	-53.2	-50.7	169.6	-124.8	176.8	171	109.4	-5.6	110.4	A1661 E1662 Q1667 E1668 I1669	A1661-R1665 WeakPolarHBondContact O-CB 3.28Å; A1661-R1665 PolarHBondContact O-N 2.78Å; E1662-R1665 CarbonylContact O-C 3.55Å; E1662-R1665 VanDerWaalsContact O-CB 3.23Å; E1662-R1665 WeakPolarHBondContact O-CB 3.47Å; E1662-R1665 PolarHBondContact O-N 3.5Å; R1665-Q1667 PolarHBondContact O-N 3.05Å; R1665-E1668 PolarHBondContact O-N 3.12Å; R1665-I1669 WeakPolarHBondContact O-CB 3.47Å; R1665-I1669 WeakPolarHBondContact O-CD1 3.28Å; R1665-I1669 WeakPolarHBondContact O-CG1 3.46Å; R1665-I1669 PolarHBondContact O-N 2.79Å
1666	L	71.7	Confident	55.1	Low	78 Å²	78	110.5 Å²	110.5	41%	0.408	54%	0.54	S	S	.	.	H	α-helix	trans	-66.9	-31.8	178.6	-72.3	166.6	0	0	0	112.9	E1662 E1663 L1664 R1670	E1662-L1666 WeakPolarHBondContact O-CB 3.35Å; E1662-L1666 WeakPolarHBondContact O-CG 3.11Å; E1662-L1666 PolarHBondContact O-N 2.76Å; E1663-L1666 CarbonylContact O-C 3.52Å; E1663-L1666 PolarHBondContact O-N 2.76Å; L1664-L1666 VanDerWaalsContact C-N 3.33Å; L1664-L1666 PolarHBondContact O-N 2.7Å; L1666-R1670 VanDerWaalsContact O-CB 3.23Å; L1666-R1670 WeakPolarHBondContact O-CB 3.38Å; L1666-R1670 WeakPolarHBondContact O-CD 3.48Å; L1666-R1670 WeakPolarHBondContact O-CG 3.36Å; L1666-R1670 PolarHBondContact O-N 3.09Å
1667	Q	60.4	Low	55.7	Low	73 Å²	73	111.1 Å²	111.1	34%	0.341	55%	0.546	S	S	.	.	H	α-helix	trans	-77.1	-28.6	174.8	-75.9	-170.7	31.8	0	0	113	E1663 L1664 R1665 K1671	E1663-Q1667 WeakPolarHBondContact O-CB 3.34Å; E1663-Q1667 VanDerWaalsContact O-CG 3.29Å; E1663-Q1667 WeakPolarHBondContact O-CG 3.35Å; E1663-Q1667 PolarHBondContact O-N 3.07Å; E1663-Q1667 PolarHBondContact OE1-NE2 3.21Å; L1664-Q1667 CarbonylContact O-C 3.47Å; L1664-Q1667 PolarHBondContact O-N 2.9Å; L1664-Q1667 VanDerWaalsContact O-N 3.17Å; R1665-Q1667 PolarHBondContact O-N 3.05Å; Q1667-K1671 WeakPolarHBondContact O-CB 3.34Å; Q1667-K1671 VanDerWaalsContact O-CD 3.31Å; Q1667-K1671 WeakPolarHBondContact O-CD 3.25Å; Q1667-K1671 WeakPolarHBondContact O-CG 3.07Å; Q1667-K1671 PolarHBondContact O-N 2.85Å; Q1667-K1671 VanDerWaalsContact O-N 3.12Å
1668	E	56.6	Low	56.9	Low	133 Å²	133	108.8 Å²	108.8	62%	0.621	53%	0.528	S	S	*	.	H	α-helix	trans	-73.5	-45.1	168.4	-71.5	-169.9	135.6	0	0	110.5	L1664 R1665 R1670 K1671 V1672	L1664-E1668 PolarHBondContact O-N 3.25Å; R1665-E1668 PolarHBondContact O-N 3.12Å; E1668-R1670 PolarHBondContact O-N 3.46Å; E1668-K1671 CarbonylContact O-C 3.55Å; E1668-K1671 WeakPolarHBondContact O-CA 3.23Å; E1668-K1671 PolarHBondContact O-N 3.49Å; E1668-V1672 WeakPolarHBondContact O-CG2 3.28Å; E1668-V1672 PolarHBondContact O-N 2.99Å
1669	I	56	Low	57	Low	95 Å²	95	106.4 Å²	106.4	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-56.7	-35	171.2	-69.5	162.8	0	0	0	111.5	R1665 R1673	R1665-I1669 WeakPolarHBondContact O-CB 3.47Å; R1665-I1669 WeakPolarHBondContact O-CD1 3.28Å; R1665-I1669 WeakPolarHBondContact O-CG1 3.46Å; R1665-I1669 PolarHBondContact O-N 2.79Å; I1669-R1673 WeakPolarHBondContact O-CG 3.23Å
1670	R	46.7	Very low	57.5	Low	159 Å²	159	105.8 Å²	105.8	60%	0.6	51%	0.508	S	S	*	.	H	α-helix	trans	-79.4	-16.6	174.5	-73.6	167.2	-177.8	-175.1	-0.6	114.1	L1666 E1668	L1666-R1670 VanDerWaalsContact O-CB 3.23Å; L1666-R1670 WeakPolarHBondContact O-CB 3.38Å; L1666-R1670 WeakPolarHBondContact O-CD 3.48Å; L1666-R1670 WeakPolarHBondContact O-CG 3.36Å; L1666-R1670 PolarHBondContact O-N 3.09Å; E1668-R1670 PolarHBondContact O-N 3.46Å
1671	K	51	Low	57.9	Low	157 Å²	157	110 Å²	110	68%	0.683	52%	0.519	S	S	*	.	H	α-helix	trans	-95.1	-19.7	174.3	-74.2	164.5	-169.5	156.2	0	113.2	Q1667 E1668 R1673	Q1667-K1671 WeakPolarHBondContact O-CB 3.34Å; Q1667-K1671 VanDerWaalsContact O-CD 3.31Å; Q1667-K1671 WeakPolarHBondContact O-CD 3.25Å; Q1667-K1671 WeakPolarHBondContact O-CG 3.07Å; Q1667-K1671 PolarHBondContact O-N 2.85Å; Q1667-K1671 VanDerWaalsContact O-N 3.12Å; E1668-K1671 CarbonylContact O-C 3.55Å; E1668-K1671 WeakPolarHBondContact O-CA 3.23Å; E1668-K1671 PolarHBondContact O-N 3.49Å; K1671-R1673 VanDerWaalsContact C-N 3.32Å; K1671-R1673 PolarHBondContact O-N 2.99Å
1672	V	46.6	Very low	58.1	Low	114 Å²	114	115.9 Å²	115.9	69%	0.691	53%	0.528	S	S	*	.			trans	-98.8	44.7	171	-166.6	0	0	0	0	110.4	E1668 V1674	E1668-V1672 WeakPolarHBondContact O-CG2 3.28Å; E1668-V1672 PolarHBondContact O-N 2.99Å; V1672-V1674 PolarHBondContact O-N 3.44Å
1673	R	38.5	Very low	58	Low	178 Å²	178	115.5 Å²	115.5	67%	0.672	52%	0.522	S	S	*	.			trans	-96.5	69.3	167.7	-73.3	-176.7	173.7	-178.7	-8.1	110.6	I1669 K1671 S1675	I1669-R1673 WeakPolarHBondContact O-CG 3.23Å; K1671-R1673 VanDerWaalsContact C-N 3.32Å; K1671-R1673 PolarHBondContact O-N 2.99Å; R1673-S1675 PolarHBondContact O-N 2.95Å
1674	V	51	Low	57.2	Low	65 Å²	65	113.9 Å²	113.9	39%	0.394	53%	0.534	S	S	.	.			trans	-65.2	120.5	151.9	-179.1	0	0	0	0	105.2	V1672 E1678	V1672-V1674 PolarHBondContact O-N 3.44Å; V1674-E1678 HydrophobicContact CG1-CB 3.79Å; V1674-E1678 HydrophobicContact CG1-CG 4.06Å
1675	S	47.6	Very low	56.3	Low	53 Å²	53	114 Å²	114	37%	0.371	54%	0.535	S	S	.	.			trans	-61.9	154.2	-178.5	64.9	0	0	0	0	110.5	R1673 S1677 E1678 Y1679	R1673-S1675 PolarHBondContact O-N 2.95Å; S1675-S1677 WeakPolarHBondContact CB-OG 2.97Å; S1675-S1677 PolarHBondContact O-N 2.92Å; S1675-S1677 VanDerWaalsContact O-N 3.16Å; S1675-S1677 PolarHBondContact OG-OG 3.21Å; S1675-E1678 CarbonylContact O-C 3.16Å; S1675-E1678 PolarHBondContact O-N 2.82Å; S1675-E1678 WeakPolarHBondContact OG-CB 3.46Å; S1675-E1678 PolarHBondContact OG-N 3.41Å; S1675-Y1679 PolarHBondContact O-N 3.31Å
1676	L	48	Very low	55.2	Low	124 Å²	124	112 Å²	112	65%	0.649	54%	0.542	S	S	*	.	H	α-helix	trans	-57.9	-32.1	176.1	-155.9	155.1	0	0	0	110.8	R1680	L1676-R1680 HydrophobicContact CD2-CG 4.48Å; L1676-R1680 WeakPolarHBondContact O-CG 3.29Å; L1676-R1680 PolarHBondContact O-N 2.92Å
1677	S	60	Low	53.4	Low	66 Å²	66	111.6 Å²	111.6	46%	0.462	55%	0.55	S	S	.	.	H	α-helix	trans	-67.2	-34.8	170.6	51.7	0	0	0	0	114.6	S1675 R1681	S1675-S1677 WeakPolarHBondContact CB-OG 2.97Å; S1675-S1677 PolarHBondContact O-N 2.92Å; S1675-S1677 VanDerWaalsContact O-N 3.16Å; S1675-S1677 PolarHBondContact OG-OG 3.21Å; S1677-R1681 WeakPolarHBondContact O-CG 3.17Å; S1677-R1681 PolarHBondContact O-N 3.29Å; S1677-R1681 VanDerWaalsContact O-N 3.13Å
1678	E	69.8	Low	52.2	Low	70 Å²	70	115.4 Å²	115.4	33%	0.327	57%	0.572	S	S	.	*	H	α-helix	trans	-82.1	-28.5	174.6	-166.9	179.1	147.3	0	0	112.4	V1674 S1675 R1680 R1681 R1682	V1674-E1678 HydrophobicContact CG1-CB 3.79Å; V1674-E1678 HydrophobicContact CG1-CG 4.06Å; S1675-E1678 CarbonylContact O-C 3.16Å; S1675-E1678 PolarHBondContact O-N 2.82Å; S1675-E1678 WeakPolarHBondContact OG-CB 3.46Å; S1675-E1678 PolarHBondContact OG-N 3.41Å; E1678-R1680 VanDerWaalsContact C-N 3.33Å; E1678-R1681 PolarHBondContact O-N 3.37Å; E1678-R1682 HydrophobicContact CG-CG 4.4Å; E1678-R1682 WeakPolarHBondContact O-CB 3.4Å; E1678-R1682 WeakPolarHBondContact O-CG 3.15Å; E1678-R1682 PolarHBondContact O-N 3.3Å; E1678-R1682 IonicContact OE1-CZ 3.18Å; E1678-R1682 IonicContact OE1-NE 2.88Å; E1678-R1682 PolarHBondContact OE1-NE 2.9Å; E1678-R1682 IonicContact OE1-NH2 2.66Å; E1678-R1682 PolarHBondContact OE1-NH2 3.37Å
1679	Y	57.4	Low	51.1	Low	112 Å²	112	114.7 Å²	114.7	44%	0.439	58%	0.576	S	S	.	*	H	α-helix	trans	-60.1	-44.2	167.4	-176	-96.5	0	0	0	110.8	S1675 R1682 R1683	S1675-Y1679 PolarHBondContact O-N 3.31Å; Y1679-R1682 PolarHBondContact O-N 2.92Å; Y1679-R1683 HydrophobicContact CE1-CG 4.23Å; Y1679-R1683 PolarHBondContact O-N 3.09Å
1680	R	68.2	Low	49.6	Very low	106 Å²	106	115.7 Å²	115.7	40%	0.4	59%	0.592	S	S	.	*	H	α-helix	trans	-57.2	-52.3	170.2	-72.1	175.4	-176.1	-170.8	1.3	111.4	L1676 E1678 R1682 R1683 G1684	L1676-R1680 HydrophobicContact CD2-CG 4.48Å; L1676-R1680 WeakPolarHBondContact O-CG 3.29Å; L1676-R1680 PolarHBondContact O-N 2.92Å; E1678-R1680 VanDerWaalsContact C-N 3.33Å; R1680-R1682 VanDerWaalsContact C-N 3.31Å; R1680-R1682 PolarHBondContact O-N 2.99Å; R1680-R1683 PolarHBondContact O-N 3.32Å; R1680-R1683 VanDerWaalsContact O-N 3.11Å; R1680-G1684 PolarHBondContact O-N 3.01Å
1681	R	63.1	Low	48.9	Very low	201 Å²	201	112.9 Å²	112.9	76%	0.758	60%	0.596	S	S	*	*	H	α-helix	trans	-54.6	-40.8	177.4	-70.5	176.5	-161	-171.8	4.6	113.7	S1677 E1678 R1683	S1677-R1681 WeakPolarHBondContact O-CG 3.17Å; S1677-R1681 PolarHBondContact O-N 3.29Å; S1677-R1681 VanDerWaalsContact O-N 3.13Å; E1678-R1681 PolarHBondContact O-N 3.37Å; R1681-R1683 VanDerWaalsContact C-N 3.34Å
1682	R	68.9	Low	47.8	Very low	181 Å²	181	109.8 Å²	109.8	68%	0.683	60%	0.6	S	S	*	*	H	α-helix	trans	-78.5	-13.8	-177.9	-69.3	177	-177.2	-142.8	6.8	114.1	E1678 Y1679 R1680	E1678-R1682 HydrophobicContact CG-CG 4.4Å; E1678-R1682 WeakPolarHBondContact O-CB 3.4Å; E1678-R1682 WeakPolarHBondContact O-CG 3.15Å; E1678-R1682 PolarHBondContact O-N 3.3Å; E1678-R1682 IonicContact OE1-CZ 3.18Å; E1678-R1682 IonicContact OE1-NE 2.88Å; E1678-R1682 PolarHBondContact OE1-NE 2.9Å; E1678-R1682 IonicContact OE1-NH2 2.66Å; E1678-R1682 PolarHBondContact OE1-NH2 3.37Å; Y1679-R1682 PolarHBondContact O-N 2.92Å; R1680-R1682 VanDerWaalsContact C-N 3.31Å; R1680-R1682 PolarHBondContact O-N 2.99Å
1683	R	64.1	Low	47	Very low	96 Å²	96	111.5 Å²	111.5	36%	0.362	60%	0.601	S	S	.	*	H	α-helix	trans	-93.2	-12.8	177.5	-86.9	-78	-172.5	163.6	-0.5	114	Y1679 R1680 R1681 L1685 R1822	Y1679-R1683 HydrophobicContact CE1-CG 4.23Å; Y1679-R1683 PolarHBondContact O-N 3.09Å; R1680-R1683 PolarHBondContact O-N 3.32Å; R1680-R1683 VanDerWaalsContact O-N 3.11Å; R1681-R1683 VanDerWaalsContact C-N 3.34Å; R1683-L1685 HydrophobicContact CB-CB 4.48Å; R1683-L1685 HydrophobicContact CB-CD1 3.94Å; R1683-L1685 HydrophobicContact CB-CG 4.05Å; R1683-L1685 HydrophobicContact CG-CD1 4.45Å; R1683-L1685 PolarHBondContact O-N 2.92Å; R1683-R1822 PolarHBondContact NH1-O 2.8Å; R1683-R1822 PolarHBondContact NH2-O 3.38Å
1684	G	47.2	Very low	46.7	Very low	71 Å²	71	111.8 Å²	111.8	73%	0.732	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.7	10.8	-172.8	0	0	0	0	0	114.1	R1680	R1680-G1684 PolarHBondContact O-N 3.01Å
1685	L	49.4	Very low	45.8	Very low	107 Å²	107	114.9 Å²	114.9	56%	0.56	62%	0.616	S	S	*	*			trans	-75.6	135.9	177.2	-72.6	167	0	0	0	109.9	R1683 A1687	R1683-L1685 HydrophobicContact CB-CB 4.48Å; R1683-L1685 HydrophobicContact CB-CD1 3.94Å; R1683-L1685 HydrophobicContact CB-CG 4.05Å; R1683-L1685 HydrophobicContact CG-CD1 4.45Å; R1683-L1685 PolarHBondContact O-N 2.92Å; L1685-A1687 PolarHBondContact O-N 2.73Å
1686	P	37.2	Very low	45.1	Very low	113 Å²	113	119.3 Å²	119.3	73%	0.734	63%	0.631	S	S	*	*			trans	-60.9	134.1	177.7	25.6	-33.5	0	0	0	110.3	L1688	P1686-L1688 PolarHBondContact O-N 3.3Å; P1686-L1688 VanDerWaalsContact O-N 3.12Å
1687	A	34.8	Very low	44.3	Very low	70 Å²	70	121.2 Å²	121.2	58%	0.579	63%	0.634	S	S	*	*			trans	-86.3	77.8	178.8	0	0	0	0	0	109.9	L1685 T1689	L1685-A1687 PolarHBondContact O-N 2.73Å; A1687-T1689 PolarHBondContact O-N 3.07Å
1688	L	34.8	Very low	43	Very low	153 Å²	153	125.3 Å²	125.3	80%	0.801	65%	0.646	S	S	*	*			trans	-58.3	121.9	163.5	-82.9	169.6	0	0	0	108.7	P1686	P1686-L1688 PolarHBondContact O-N 3.3Å; P1686-L1688 VanDerWaalsContact O-N 3.12Å
1689	T	32.5	Very low	41.1	Very low	117 Å²	117	128.4 Å²	128.4	72%	0.718	67%	0.67	S	S	*	*			trans	-88.4	121.8	-170.1	41.1	0	0	0	0	110.6	A1687 S1691	A1687-T1689 PolarHBondContact O-N 3.07Å; T1689-S1691 VanDerWaalsContact C-N 3.33Å; T1689-S1691 PolarHBondContact O-N 3.2Å
1690	S	25.5	Very low	39.6	Very low	117 Å²	117	131.8 Å²	131.8	82%	0.818	69%	0.687	S	S	*	*			trans	-74.2	88.2	162.7	55.3	0	0	0	0	109.5
1691	S	30.8	Very low	37.7	Very low	99 Å²	99	134.1 Å²	134.1	69%	0.692	70%	0.702	S	S	*	*			trans	-112.5	113.9	157	-74.2	0	0	0	0	106	T1689	T1689-S1691 VanDerWaalsContact C-N 3.33Å; T1689-S1691 PolarHBondContact O-N 3.2Å
1692	A	28.2	Very low	36.4	Very low	93 Å²	93	129.1 Å²	129.1	77%	0.769	70%	0.695	S	S	*	*				72.9	45.8	50.7	0	0	0	0	0	113.2
1693	E	30.7	Very low	34.2	Very low	149 Å²	149	126.2 Å²	126.2	70%	0.696	69%	0.693	S	S	*	*			trans	-130.3	150.5	160	-70.6	-146.8	135.7	0	0	108.5
1694	R	32.2	Very low	32.3	Very low	184 Å²	184	127.5 Å²	127.5	69%	0.694	71%	0.707	S	S	*	*			cis	174	140.5	-26.3	-115	168.6	-170.7	173.1	-4	104.6
1695	N	31.1	Very low	31.4	Very low	131 Å²	131	131.5 Å²	131.5	70%	0.701	71%	0.707	S	S	*	*			trans	62.9	169.7	160.1	-51.5	-19	0	0	0	113.5
1696	H	33.3	Very low	30.2	Very low	146 Å²	146	131 Å²	131	68%	0.676	71%	0.712	S	S	*	*			cis	-144.7	139.7	-27	-116.6	-7.3	0	0	0	106
1697	K	31.5	Very low	29.6	Very low	163 Å²	163	132.6 Å²	132.6	71%	0.709	72%	0.715	S	S	*	*				73.3	146.7	94.3	-161.4	-177.1	-176.1	176.9	0	113.5
1698	Q	31.7	Very low	29.5	Very low	152 Å²	152	133.2 Å²	133.2	71%	0.71	73%	0.728	S	S	*	*			trans	71.6	88.5	173.4	-81	161.4	-12	0	0	116.9	K1700	Q1698-K1700 PolarHBondContact O-N 3.42Å
1699	T	30	Very low	29	Very low	135 Å²	135	132.1 Å²	132.1	83%	0.828	72%	0.722	S	S	*	*				-18.6	113.7	114.9	-38.7	0	0	0	0	112.8
1700	K	26.5	Very low	28.8	Very low	184 Å²	184	133 Å²	133	80%	0.8	72%	0.722	S	S	*	*			trans	178.7	122.3	155.4	-99	-167.9	177.9	-170.2	0	106.4	Q1698	Q1698-K1700 PolarHBondContact O-N 3.42Å
1701	E	27.3	Very low	28.9	Very low	155 Å²	155	132.5 Å²	132.5	72%	0.724	71%	0.71	S	S	*	*			cis	63.6	133.2	14.5	-132.7	-111	-160	0	0	113.5
1702	P	37.3	Very low	28.8	Very low	95 Å²	95	133.4 Å²	133.4	62%	0.617	71%	0.707	S	S	*	*			cis	-124.5	-131.5	-21.5	39.8	-23.6	0	0	0	108.7
1703	L	23.1	Very low	28.9	Very low	120 Å²	120	135.1 Å²	135.1	63%	0.628	70%	0.702	S	S	*	*			trans	86.1	116.1	150.4	-139.7	70.1	0	0	0	116.2
1704	D	23	Very low	28.9	Very low	123 Å²	123	134.7 Å²	134.7	66%	0.658	70%	0.7	S	S	*	*			trans	8.9	135.4	132.5	-22.7	-35.4	0	0	0	115.9
1705	Q	27.6	Very low	28.9	Very low	156 Å²	156	132.2 Å²	132.2	73%	0.729	70%	0.7	S	S	*	*				-167.9	127.7	90.7	-106.8	137.8	93.9	0	0	113.8
1706	S	25.4	Very low	29	Very low	97 Å²	97	133.1 Å²	133.1	68%	0.678	70%	0.703	S	S	*	*			trans	72.1	152	136.2	78.7	0	0	0	0	119.6
1707	N	25.1	Very low	29	Very low	146 Å²	146	132.8 Å²	132.8	78%	0.781	71%	0.705	S	S	*	*			cis	-155	89.7	-25.9	-107.6	-17.9	0	0	0	108.3
1708	G	31.1	Very low	29.3	Very low	83 Å²	83	130.3 Å²	130.3	86%	0.856	71%	0.705	S	S	*	*			trans	60	-140	165.1	0	0	0	0	0	114.9
1709	N	25.8	Very low	29.5	Very low	129 Å²	129	128.1 Å²	128.1	69%	0.69	70%	0.704	S	S	*	*			cis	-147	122.9	7.4	-148	26.8	0	0	0	113.6
1710	I	28.1	Very low	29.5	Very low	137 Å²	137	126.9 Å²	126.9	70%	0.703	70%	0.697	S	S	*	*			trans	58.7	-164.5	165.8	-25.3	155.7	0	0	0	112.1
1711	D	27	Very low	29.4	Very low	105 Å²	105	125.3 Å²	125.3	56%	0.561	70%	0.696	S	S	*	*			trans	65.2	83.3	145.9	-62.6	-24.4	0	0	0	119.1
1712	N	28.1	Very low	29.5	Very low	119 Å²	119	124.2 Å²	124.2	64%	0.636	69%	0.694	S	S	*	*				98	130.5	99	-77.5	-20.6	0	0	0	119.5
1713	L	31.3	Very low	29.3	Very low	129 Å²	129	125.3 Å²	125.3	68%	0.675	70%	0.704	S	S	*	*				64.2	136.6	127.1	-55	171.7	0	0	0	117.6
1714	E	31.4	Very low	29.8	Very low	140 Å²	140	123.4 Å²	123.4	65%	0.654	70%	0.698	S	S	*	*			cis	-160.7	123.8	14.7	-130.1	159.8	163.4	0	0	114.3
1715	I	31.7	Very low	30.1	Very low	132 Å²	132	122.6 Å²	122.6	68%	0.677	69%	0.694	S	S	*	*			trans	64.9	176.7	143.4	-57.7	170.1	0	0	0	116.9
1716	I	32.9	Very low	30.3	Very low	149 Å²	149	124 Å²	124	76%	0.764	69%	0.693	S	S	*	*			trans	72.6	88.1	168.9	-42.2	-179.8	0	0	0	113.8
1717	I	33.9	Very low	30.9	Very low	140 Å²	140	124.1 Å²	124.1	72%	0.718	69%	0.685	S	S	*	*			cis	56	125.2	32.6	-48.5	175.9	0	0	0	112.9
1718	P	37.6	Very low	31.3	Very low	111 Å²	111	121.5 Å²	121.5	72%	0.721	67%	0.671	S	S	*	*			cis	-129.2	-129	-24.6	41.3	-21.3	0	0	0	108
1719	P	34.9	Very low	31.6	Very low	106 Å²	106	123 Å²	123	69%	0.688	66%	0.658	S	S	*	*				-110.2	-168.9	-50.9	40	-24.7	0	0	0	109.9
1720	T	29.4	Very low	31.8	Very low	109 Å²	109	120.1 Å²	120.1	67%	0.669	65%	0.645	S	S	*	*			cis	-125.4	154.6	-0.6	57.3	0	0	0	0	107.1
1721	L	26.2	Very low	31.9	Very low	150 Å²	150	120.6 Å²	120.6	79%	0.785	65%	0.648	S	S	*	*				57.5	150.4	51.9	-58.9	173.6	0	0	0	114
1722	I	27.9	Very low	32.2	Very low	132 Å²	132	120.6 Å²	120.6	68%	0.677	65%	0.654	S	S	*	*			trans	88.4	68.6	164.1	-56.8	140.3	0	0	0	116
1723	S	34.5	Very low	32.2	Very low	118 Å²	118	121.4 Å²	121.4	83%	0.825	66%	0.658	S	S	*	*				-77.9	127.5	91.4	65.8	0	0	0	0	106.7
1724	P	33.8	Very low	31.9	Very low	80 Å²	80	122 Å²	122	52%	0.519	66%	0.661	S	S	.	*				-143.8	-150.5	72.5	32.7	-9.6	0	0	0	111.7
1725	D	28.1	Very low	31.7	Very low	107 Å²	107	122.9 Å²	122.9	57%	0.572	67%	0.665	S	S	*	*			trans	85.6	120.6	148.7	-71.2	0.4	0	0	0	118.2
1726	R	32.3	Very low	31.5	Very low	186 Å²	186	122.8 Å²	122.8	70%	0.702	67%	0.666	S	S	*	*			cis	-175.9	160	-3.1	-137.7	-179.5	-120.7	-175.2	10.9	114.9
1727	L	37.1	Very low	31.2	Very low	99 Å²	99	122.6 Å²	122.6	52%	0.518	66%	0.662	S	S	.	*			trans	65.8	166.6	154.5	-58.5	-170.5	0	0	0	116.9	M1202 E1203	M1202-L1727 VanDerWaalsContact CB-C 3.47Å; M1202-L1727 HydrophobicContact CE-CD2 4.49Å; E1203-L1727 CarbonylContact O-C 3Å
1728	L	34.5	Very low	30.9	Very low	91 Å²	91	120 Å²	120	48%	0.476	66%	0.656	S	S	.	*			cis	-150.6	135.8	-28.9	-106.7	-168	0	0	0	106.7	M1202 E1203	M1202-L1728 HydrophobicContact CE-CD2 3.99Å; M1202-L1728 HydrophobicContact SD-CD2 3.72Å; E1203-L1728 CarbonylContact C-O 3.56Å; E1203-L1728 WeakPolarHBondContact CA-O 3.09Å; E1203-L1728 WeakPolarHBondContact CB-O 3.31Å; E1203-L1728 PolarHBondContact N-O 2.78Å; E1203-L1728 CarbonylContact O-C 3.36Å; E1203-L1728 PolarHBondContact O-N 2.65Å
1729	I	36.6	Very low	30.7	Very low	115 Å²	115	122.2 Å²	122.2	59%	0.59	65%	0.654	S	S	*	*			cis	-148.9	153.6	10.9	-166.4	165.8	0	0	0	112.3	E1203	E1203-I1729 WeakPolarHBondContact CB-O 3.43Å
1730	T	30	Very low	30.8	Very low	68 Å²	68	121.6 Å²	121.6	42%	0.417	65%	0.65	S	S	.	*			trans	-72	146.6	-175.7	-38.7	0	0	0	0	115.7	A1201 M1202	A1201-T1730 VanDerWaalsContact CA-OG1 3.23Å; A1201-T1730 WeakPolarHBondContact CA-OG1 3.46Å; A1201-T1730 WeakPolarHBondContact CB-OG1 3.24Å; M1202-T1730 PolarHBondContact N-OG1 3.45Å
1731	L	29.9	Very low	31	Very low	147 Å²	147	120.9 Å²	120.9	77%	0.77	65%	0.65	S	S	*	*				157.6	141	119.9	-85.5	167	0	0	0	113.8
1732	P	34.8	Very low	31.4	Very low	104 Å²	104	117.6 Å²	117.6	68%	0.675	64%	0.639	S	S	*	*			trans	-81.7	141.7	151.8	34.5	-30.1	0	0	0	110
1733	N	27	Very low	31.8	Very low	137 Å²	137	117.8 Å²	117.8	73%	0.733	64%	0.642	S	S	*	*			trans	-172.7	134.1	149.4	-106.4	-15.7	0	0	0	114.4
1734	L	25.2	Very low	31.8	Very low	140 Å²	140	117 Å²	117	73%	0.733	63%	0.631	S	S	*	*			trans	66.6	145	136	-64.3	168.7	0	0	0	122.6
1735	H	28.5	Very low	32	Very low	159 Å²	159	121.7 Å²	121.7	74%	0.736	64%	0.644	S	S	*	*			trans	72.6	101.2	155	-89.5	-111.7	0	0	0	121
1736	N	25.7	Very low	32.2	Very low	131 Å²	131	121.9 Å²	121.9	70%	0.701	65%	0.652	S	S	*	*				47.5	162.7	98.2	-82.9	10.3	0	0	0	121.8
1737	E	27.3	Very low	32.4	Very low	145 Å²	145	117.2 Å²	117.2	68%	0.678	65%	0.649	S	S	*	*			trans	69	72.5	167.2	-58.1	-35.7	102.8	0	0	119.6
1738	S	26.8	Very low	32.6	Very low	84 Å²	84	119.7 Å²	119.7	59%	0.587	66%	0.662	S	S	*	*				59.2	106.1	102.3	76.5	0	0	0	0	120.6
1739	K	35.2	Very low	32.7	Very low	158 Å²	158	118.2 Å²	118.2	69%	0.687	67%	0.669	S	S	*	*			trans	62.4	-164.8	132.2	-112.3	-177.7	176.1	-171	0	114.9	Q1436	Q1436-K1739 PolarHBondContact O-NZ 2.84Å
1740	P	36.1	Very low	32.4	Very low	93 Å²	93	119.7 Å²	119.7	60%	0.604	68%	0.677	S	S	*	*			cis	-126.7	163.4	-33.3	31.6	-15.7	0	0	0	115.2
1741	S	34.2	Very low	32.5	Very low	94 Å²	94	122.2 Å²	122.2	66%	0.657	69%	0.687	S	S	*	*			trans	67.8	174.7	145.4	71.5	0	0	0	0	116.9
1742	S	33.8	Very low	32.5	Very low	81 Å²	81	119.1 Å²	119.1	57%	0.566	67%	0.669	S	S	*	*			cis	-152.4	-178.3	17.5	56.3	0	0	0	0	115
1743	D	35.5	Very low	32.3	Very low	136 Å²	136	120 Å²	120	73%	0.727	66%	0.662	S	S	*	*			trans	85.5	137.7	142.2	-73.5	-31	0	0	0	122.7
1744	V	35.8	Very low	32.5	Very low	101 Å²	101	118.8 Å²	118.8	61%	0.612	66%	0.655	S	S	*	*			cis	-165.3	171.1	-8.3	73.1	0	0	0	0	113.6
1745	K	37.6	Very low	32.7	Very low	179 Å²	179	117.3 Å²	117.3	78%	0.778	65%	0.651	S	S	*	*			trans	74.2	145.6	163.1	-75.1	160	-163.9	163.7	0	117.1
1746	C	33.3	Very low	32.7	Very low	111 Å²	111	114.5 Å²	114.5	75%	0.75	65%	0.649	S	S	*	*			cis	-175	-175.6	-14	-112.7	0	0	0	0	106.7
1747	S	36.4	Very low	32.8	Very low	89 Å²	89	115.8 Å²	115.8	62%	0.622	66%	0.655	S	S	*	*			cis	179.9	151.5	-8.3	42.3	0	0	0	0	106.1
1748	D	39.6	Very low	32.8	Very low	151 Å²	151	114.9 Å²	114.9	81%	0.807	66%	0.655	S	S	*	*			cis	-158	-176.1	-12.6	-73.5	-29.5	0	0	0	105.1
1749	G	37	Very low	32.9	Very low	59 Å²	59	117.2 Å²	117.2	61%	0.608	66%	0.66	S	S	*	*			cis	-174.8	161.2	4.7	0	0	0	0	0	110.7
1750	L	31.3	Very low	32.6	Very low	146 Å²	146	118.6 Å²	118.6	76%	0.764	67%	0.666	S	S	*	*				78	135.6	101	-64.9	178.1	0	0	0	114.8
1751	L	31.4	Very low	32.6	Very low	121 Å²	121	118.4 Å²	118.4	63%	0.634	67%	0.665	S	S	*	*			cis	-155.9	138.4	0.5	-89.6	152.9	0	0	0	107.9
1752	Q	30.7	Very low	32.3	Very low	82 Å²	82	122.3 Å²	122.3	38%	0.383	67%	0.672	S	S	.	*				88.7	149.5	75.4	-138	-170.7	52.2	0	0	115.9
1753	K	30.9	Very low	32	Very low	123 Å²	123	123.9 Å²	123.9	54%	0.535	68%	0.678	S	S	.	*			trans	95.7	128.9	141.7	-86.5	175.2	167.7	127.1	0	123.4	F1427	F1427-K1753 WeakPolarHBondContact CE1-O 3.41Å
1754	I	30.3	Very low	31.5	Very low	112 Å²	112	123.2 Å²	123.2	57%	0.574	67%	0.674	S	S	*	*			trans	78.8	132	131.4	-70	171.7	0	0	0	117.4
1755	T	28.5	Very low	31.2	Very low	109 Å²	109	125.4 Å²	125.4	67%	0.669	68%	0.678	S	S	*	*			cis	-162.6	150.2	-6.5	21.8	0	0	0	0	111.6
1756	S	29.6	Very low	30.7	Very low	99 Å²	99	121.6 Å²	121.6	69%	0.692	67%	0.666	S	S	*	*			trans	49.7	159.4	132.3	-49.9	0	0	0	0	123.6
1757	L	28.7	Very low	30.5	Very low	158 Å²	158	124.2 Å²	124.2	83%	0.827	67%	0.665	S	S	*	*			trans	87.1	138.8	163.4	-54.4	174.7	0	0	0	116.8
1758	N	27.1	Very low	30	Very low	126 Å²	126	125.5 Å²	125.5	67%	0.674	67%	0.665	S	S	*	*			cis	-166.1	171.3	-30.5	-146.3	-16.6	0	0	0	110.1
1759	I	27.8	Very low	29.7	Very low	133 Å²	133	124.1 Å²	124.1	68%	0.682	65%	0.653	S	S	*	*			trans	62.9	97.8	155.1	-64.3	158.4	0	0	0	114.8
1760	K	29.4	Very low	29.3	Very low	188 Å²	188	126.8 Å²	126.8	82%	0.817	66%	0.66	S	S	*	*				64.9	151.1	90.4	-83	-165.8	173	-168.5	0	115.6
1761	P	35.9	Very low	29	Very low	89 Å²	89	125.7 Å²	125.7	58%	0.578	65%	0.654	S	S	*	*			cis	-142.2	-155	-35.6	39.9	-20.1	0	0	0	111.3
1762	E	27.2	Very low	28.6	Very low	175 Å²	175	124.6 Å²	124.6	82%	0.818	66%	0.657	S	S	*	*			trans	71.8	137.8	152.9	-78.4	162.8	-137.7	0	0	118.3
1763	V	27.4	Very low	28.2	Very low	114 Å²	114	127.2 Å²	127.2	69%	0.691	67%	0.672	S	S	*	*			cis	-153.9	156.5	-7.2	92	0	0	0	0	111.2
1764	L	26.1	Very low	27.9	Very low	122 Å²	122	130.7 Å²	130.7	64%	0.639	68%	0.684	S	S	*	*			trans	2.4	147.3	154.9	-76.7	46.1	0	0	0	119
1765	H	29.3	Very low	27.6	Very low	148 Å²	148	130.4 Å²	130.4	69%	0.685	69%	0.687	S	S	*	*			cis	-148.4	144.7	7.8	-98.7	-46.9	0	0	0	106.8
1766	D	27.4	Very low	27.3	Very low	99 Å²	99	132.5 Å²	132.5	53%	0.529	69%	0.694	S	S	.	*				66.3	144.1	59.4	-59.2	-22.3	0	0	0	113.9
1767	F	27.9	Very low	27.2	Very low	166 Å²	166	134.1 Å²	134.1	73%	0.728	70%	0.7	S	S	*	*			cis	-142.7	132.4	-16.1	-117.7	-67	0	0	0	103.4
1768	N	27.4	Very low	27.1	Very low	116 Å²	116	132.5 Å²	132.5	62%	0.62	70%	0.699	S	S	*	*				49.8	140.1	59	-72.9	-34.1	0	0	0	110.9
1769	Q	31.8	Very low	27.1	Very low	121 Å²	121	136 Å²	136	57%	0.565	71%	0.709	S	S	*	*			cis	-168.3	-166.9	4.9	-116.8	166.9	22.1	0	0	107.3	L1771	Q1769-L1771 HydrophobicContact CG-CD1 4.16Å; Q1769-L1771 HydrophobicContact CG-CG 3.87Å
1770	P	29.2	Very low	26.9	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	72%	0.717	S	S	*	*			cis	-106.6	162.5	6.9	43	-32.2	0	0	0	112.6
1771	L	25.3	Very low	26.6	Very low	122 Å²	122	135.6 Å²	135.6	64%	0.639	71%	0.705	S	S	*	*			cis	57.2	150	49.4	-65.6	-176	0	0	0	113.3	Q1769	Q1769-L1771 HydrophobicContact CG-CD1 4.16Å; Q1769-L1771 HydrophobicContact CG-CG 3.87Å
1772	S	22.6	Very low	26.2	Very low	99 Å²	99	139 Å²	139	69%	0.692	71%	0.713	S	S	*	*			cis	-160.3	-174.5	-29.4	52.5	0	0	0	0	109.3
1773	L	23.3	Very low	26.1	Very low	136 Å²	136	137.6 Å²	137.6	71%	0.712	71%	0.705	S	S	*	*			trans	-70.6	175.5	173.1	-69.7	67.1	0	0	0	112.3
1774	Y	23.6	Very low	26	Very low	197 Å²	197	137.9 Å²	137.9	77%	0.773	70%	0.702	S	S	*	*			trans	89.4	102.4	151.6	-80.2	-73.5	0	0	0	121
1775	T	23.2	Very low	26	Very low	106 Å²	106	135 Å²	135	65%	0.65	70%	0.702	S	S	*	*			trans	66	147.4	132.9	46.9	0	0	0	0	122.7
1776	N	23.5	Very low	25.9	Very low	152 Å²	152	135.9 Å²	135.9	81%	0.813	71%	0.707	S	S	*	*			trans	93.8	120.6	159.6	-52.3	-40	0	0	0	118.3
1777	T	26.8	Very low	26.2	Very low	133 Å²	133	140.6 Å²	140.6	82%	0.816	72%	0.717	S	S	*	*			trans	-66.8	152.3	154.7	50.5	0	0	0	0	109.4
1778	P	28.1	Very low	26.3	Very low	125 Å²	125	138.3 Å²	138.3	81%	0.812	71%	0.712	S	S	*	*				-150	-169.9	77.3	39.8	-19	0	0	0	116.3
1779	K	25.4	Very low	26.4	Very low	200 Å²	200	141.8 Å²	141.8	87%	0.87	72%	0.722	S	S	*	*			trans	-60.9	161.1	175.1	-47.1	172.7	-176.5	-179.6	0	110.8
1780	R	24.1	Very low	26.5	Very low	228 Å²	228	142.5 Å²	142.5	86%	0.86	73%	0.728	S	S	*	*				178.5	151.2	51.7	170.4	173.7	-176.7	174.2	4.4	112.3
1781	C	23.2	Very low	26.6	Very low	83 Å²	83	142.6 Å²	142.6	56%	0.561	72%	0.723	S	S	*	*			trans	66.9	134.1	164.7	-72.4	0	0	0	0	118.6
1782	E	27.3	Very low	27.2	Very low	160 Å²	160	141.3 Å²	141.3	75%	0.748	73%	0.73	S	S	*	*				80.4	123.5	64.4	-122.9	164.6	-151.3	0	0	110.1
1783	F	25.5	Very low	27.6	Very low	147 Å²	147	143.9 Å²	143.9	65%	0.645	73%	0.729	S	S	*	*				-156.1	164.4	50.5	-116.4	-103.8	0	0	0	112.5
1784	D	25.4	Very low	28.3	Very low	120 Å²	120	144.1 Å²	144.1	64%	0.642	74%	0.735	S	S	*	*			trans	35	156.2	153.1	-65.3	-1.9	0	0	0	123.9
1785	G	25.9	Very low	28.6	Very low	62 Å²	62	140.3 Å²	140.3	64%	0.639	73%	0.728	S	S	*	*			cis	172.8	167.4	-4.2	0	0	0	0	0	113.7
1786	E	27.9	Very low	29.1	Very low	165 Å²	165	141.2 Å²	141.2	77%	0.771	73%	0.725	S	S	*	*			trans	64.2	151.2	165.8	-58.7	-109.6	95.7	0	0	117.3
1787	R	31.9	Very low	29.5	Very low	199 Å²	199	144.6 Å²	144.6	75%	0.751	73%	0.726	S	S	*	*			cis	74.3	152.3	34.6	-71.5	-170.9	-172.2	160	-0.4	114.6
1788	D	30.8	Very low	29.8	Very low	118 Å²	118	141.6 Å²	141.6	63%	0.631	72%	0.722	S	S	*	*			cis	-125	-164.4	-5.7	-111.6	-30.5	0	0	0	110.6
1789	F	30.1	Very low	30.3	Very low	189 Å²	189	140.9 Å²	140.9	83%	0.829	72%	0.717	S	S	*	*				158.3	154.4	90.9	-99	-52.6	0	0	0	108.2
1790	I	33.8	Very low	30.6	Very low	135 Å²	135	138.9 Å²	138.9	69%	0.692	71%	0.705	S	S	*	*			cis	-144.3	140.8	11.9	-77.9	-146.7	0	0	0	110.3
1791	D	31.6	Very low	31.3	Very low	119 Å²	119	134.5 Å²	134.5	64%	0.636	70%	0.703	S	S	*	*			trans	36.3	160.7	150.4	-78.4	-52.2	0	0	0	122.6	K1793	D1791-K1793 IonicContact OD1-NZ 2.96Å; D1791-K1793 PolarHBondContact OD1-NZ 2.77Å; D1791-K1793 IonicContact OD2-NZ 2.81Å
1792	A	37.2	Very low	31.8	Very low	95 Å²	95	136 Å²	136	79%	0.785	71%	0.712	S	S	*	*			cis	-142.5	154.6	21.2	0	0	0	0	0	116.3
1793	K	31.5	Very low	32.1	Very low	153 Å²	153	131.1 Å²	131.1	67%	0.665	70%	0.695	S	S	*	*			trans	-55.7	156.5	176.4	-57.3	117.6	178.2	129.4	0	115.1	D1791	D1791-K1793 IonicContact OD1-NZ 2.96Å; D1791-K1793 PolarHBondContact OD1-NZ 2.77Å; D1791-K1793 IonicContact OD2-NZ 2.81Å
1794	V	37.9	Very low	32.7	Very low	141 Å²	141	131.2 Å²	131.2	86%	0.855	70%	0.698	S	S	*	*				-166.9	106.6	113.5	147.8	0	0	0	0	112.1
1795	N	30.4	Very low	33.4	Very low	116 Å²	116	129.7 Å²	129.7	62%	0.62	69%	0.694	S	S	*	*			trans	23	127.5	140.2	-69.4	40.5	0	0	0	124.6
1796	E	32.4	Very low	34	Very low	126 Å²	126	132.2 Å²	132.2	59%	0.589	70%	0.699	S	S	*	*				102.4	127.2	117.8	-82.2	179.8	-104.7	0	0	124.5
1797	R	32.2	Very low	34.4	Very low	222 Å²	222	131.6 Å²	131.6	84%	0.838	70%	0.702	S	S	*	*			trans	77.5	120.4	150.9	-62.7	167.6	-157.8	-143	3.6	120.6
1798	G	34	Very low	34.9	Very low	71 Å²	71	129.8 Å²	129.8	73%	0.732	71%	0.707	S	S	*	*			trans	-98.3	-137.5	157.9	0	0	0	0	0	111.1
1799	P	38.4	Very low	35.4	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	71%	0.714	S	S	*	*			cis	-144.4	-167.6	-1.8	45.1	-26.5	0	0	0	116.1
1800	R	31.2	Very low	35.9	Very low	159 Å²	159	130 Å²	130	60%	0.6	71%	0.711	S	S	*	*			trans	76	158.1	158.1	-79.5	-177.7	166.9	112.5	-12.6	120
1801	T	37.7	Very low	36.4	Very low	136 Å²	136	129.2 Å²	129.2	83%	0.834	71%	0.709	S	S	*	*			trans	-143.7	148.3	-179.4	47.8	0	0	0	0	110.3
1802	P	35	Very low	36.5	Very low	115 Å²	115	131.1 Å²	131.1	75%	0.747	72%	0.717	S	S	*	*			trans	-142.4	164.4	152.1	38.2	-22.2	0	0	0	116
1803	S	33.7	Very low	36.5	Very low	56 Å²	56	130 Å²	130	39%	0.392	72%	0.715	S	S	.	*			trans	28.3	143.8	152	-40.6	0	0	0	0	126	D1191 N1192	D1191-S1803 PolarHBondContact OD1-OG 2.83Å; N1192-S1803 WeakPolarHBondContact CB-OG 3.27Å
1804	E	37.7	Very low	36.5	Very low	149 Å²	149	129 Å²	129	70%	0.696	72%	0.722	S	S	*	*			trans	-67.9	-176.1	151.3	-78.4	170.6	137.4	0	0	111.3
1805	P	40.1	Very low	36.1	Very low	88 Å²	88	128.2 Å²	128.2	57%	0.571	71%	0.713	S	S	*	*			cis	-121.7	-156	6.8	46.3	-30.4	0	0	0	111.6	I1189	I1189-P1805 HydrophobicContact CG1-CG 4.43Å
1806	P	38	Very low	36	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	70%	0.701	S	S	*	*			cis	-134.7	-164.5	-1.9	44.9	-26.1	0	0	0	115.7
1807	D	36.8	Very low	36.1	Very low	153 Å²	153	127.2 Å²	127.2	82%	0.818	71%	0.714	S	S	*	*			trans	-80	161.4	171.3	-50	-91.3	0	0	0	114.5
1808	D	43.4	Very low	35.8	Very low	161 Å²	161	118.5 Å²	118.5	86%	0.861	68%	0.684	S	S	*	*			trans	-154.2	149.1	153.4	-106.7	-35.4	0	0	0	108.2
1809	D	39.6	Very low	35.9	Very low	145 Å²	145	119.8 Å²	119.8	78%	0.775	68%	0.679	S	S	*	*			trans	-70.7	168.2	-172.2	-62.7	-83.7	0	0	0	113.7
1810	E	42.2	Very low	35.3	Very low	165 Å²	165	120.5 Å²	120.5	77%	0.771	68%	0.681	S	S	*	*				-167	156.4	71.9	-81.6	-86.4	71.3	0	0	113.9
1811	D	44	Very low	35.1	Very low	120 Å²	120	118 Å²	118	64%	0.642	69%	0.689	S	S	*	*			trans	69.2	95.3	148.6	-93.3	8.8	0	0	0	123.8
1812	I	34	Very low	34.6	Very low	158 Å²	158	120.7 Å²	120.7	81%	0.81	68%	0.683	S	S	*	*				61	125.3	115.2	-64.4	173.6	0	0	0	119.2
1813	G	36.2	Very low	34.1	Very low	73 Å²	73	118.9 Å²	118.9	75%	0.753	69%	0.685	S	S	*	*			trans	171.8	33.2	163.7	0	0	0	0	0	117.3
1814	V	31.9	Very low	33.8	Very low	131 Å²	131	119 Å²	119	79%	0.794	69%	0.689	S	S	*	*			trans	-72.7	163.2	-177.2	-164	0	0	0	0	111.6
1815	D	28.9	Very low	33.4	Very low	125 Å²	125	118.3 Å²	118.3	67%	0.668	69%	0.69	S	S	*	*			trans	80.6	112.8	167.3	-73.5	-48.8	0	0	0	118.9
1816	S	29.2	Very low	32.7	Very low	54 Å²	54	116.4 Å²	116.4	38%	0.378	68%	0.679	S	S	.	*				92.2	72.6	62.8	-69.2	0	0	0	0	113
1817	I	33.7	Very low	32.3	Very low	167 Å²	167	113.7 Å²	113.7	86%	0.856	66%	0.662	S	S	*	*			trans	-118.3	137.8	156.1	-69	85.6	0	0	0	108.7
1818	N	26.3	Very low	31.9	Very low	38 Å²	38	107.7 Å²	107.7	20%	0.203	63%	0.633	C	S	.	*			trans	-115.5	-153.7	-159.5	-161	29.4	0	0	0	112.5	K332 A333 T336 V1820	K332-N1818 VanDerWaalsContact C-ND2 3.3Å; K332-N1818 PolarHBondContact O-ND2 3.13Å; A333-N1818 WeakPolarHBondContact CA-ND2 3.33Å; A333-N1818 PolarHBondContact N-ND2 2.76Å; T336-N1818 HydrophobicContact CG2-CB 3.68Å; T336-N1818 VanDerWaalsContact OG1-CB 3.25Å; T336-N1818 WeakPolarHBondContact OG1-CB 3.39Å; T336-N1818 PolarHBondContact OG1-ND2 3.23Å; N1818-V1820 PolarHBondContact O-N 2.83Å
1819	P	36.2	Very low	31.3	Very low	98 Å²	98	104 Å²	104	64%	0.636	62%	0.617	S	S	*	*				-104.5	69.8	-110.9	36.9	-23.2	0	0	0	112.7	S1821	P1819-S1821 PolarHBondContact O-N 3.4Å
1820	V	25.9	Very low	30.7	Very low	125 Å²	125	100.6 Å²	100.6	76%	0.758	60%	0.597	S	S	*	*			trans	-91.2	94.6	-171.4	-171.9	0	0	0	0	113.8	N1818 R1822	N1818-V1820 PolarHBondContact O-N 2.83Å; V1820-R1822 PolarHBondContact O-N 3.2Å
1821	S	26.9	Very low	30.1	Very low	107 Å²	107	96.7 Å²	96.7	75%	0.748	59%	0.585	S	S	*	*			trans	-44	113.8	166.1	-51.3	0	0	0	0	113.7	P1819	P1819-S1821 PolarHBondContact O-N 3.4Å
1822	R	26.3	Very low	29.2	Very low	192 Å²	192	95.2 Å²	95.2	73%	0.725	57%	0.574	S	S	*	*			trans	-176.6	123.4	150.6	-96.1	138.3	-177.5	171.6	-0.7	107.9	R1683 V1820	R1683-R1822 PolarHBondContact NH1-O 2.8Å; R1683-R1822 PolarHBondContact NH2-O 3.38Å; V1820-R1822 PolarHBondContact O-N 3.2Å
1823	G	25.3	Very low	28.9	Very low	76 Å²	76	94.1 Å²	94.1	78%	0.784	57%	0.568	S	S	*	*			cis	99.5	71.1	44.9	0	0	0	0	0	108.7
1824	A	26.3	Very low	28.5	Very low	58 Å²	58	98.5 Å²	98.5	48%	0.479	56%	0.562	S	S	.	*			trans	-149.2	109.3	171.8	0	0	0	0	0	109.2	S1826	A1824-S1826 PolarHBondContact O-N 2.68Å
1825	L	29.8	Very low	28.2	Very low	135 Å²	135	100 Å²	100	71%	0.707	56%	0.558	S	S	*	*			trans	51.7	60	149.9	-50.3	-178.3	0	0	0	115.5	S1827	L1825-S1827 PolarHBondContact O-N 3.28Å
1826	S	24.9	Very low	28.5	Very low	48 Å²	48	98.7 Å²	98.7	34%	0.336	56%	0.556	S	S	.	*				-39.5	87.6	101.2	177.5	0	0	0	0	111.4	R258 T259 A1824	R258-S1826 WeakPolarHBondContact CD-O 3.07Å; R258-S1826 PolarHBondContact NH1-O 2.81Å; T259-S1826 PolarHBondContact O-OG 2.84Å; A1824-S1826 PolarHBondContact O-N 2.68Å
1827	S	31.3	Very low	28.4	Very low	58 Å²	58	99.5 Å²	99.5	41%	0.406	57%	0.573	S	S	.	*			trans	-134.1	68.3	165.8	64.2	0	0	0	0	109.1	L1825 P1829	L1825-S1827 PolarHBondContact O-N 3.28Å; S1827-P1829 VanDerWaalsContact O-CD 3.24Å; S1827-P1829 WeakPolarHBondContact O-CD 3.26Å; S1827-P1829 VanDerWaalsContact O-N 3.13Å
1828	S	26.6	Very low	28.1	Very low	28 Å²	28	100.7 Å²	100.7	20%	0.196	57%	0.572	C	S	.	*			trans	-44.6	116.1	145.9	168.4	0	0	0	0	107.7	F615 E1830	F615-S1828 VanDerWaalsContact CD2-OG 3.3Å; F615-S1828 WeakPolarHBondContact CD2-OG 3.35Å; F615-S1828 WeakPolarHBondContact CE2-OG 3.39Å; S1828-E1830 PolarHBondContact O-N 3.5Å
1829	P	32.1	Very low	28.1	Very low	83 Å²	83	105.4 Å²	105.4	54%	0.539	60%	0.602	S	S	.	*			trans	-74.5	92.2	171.6	30.4	-29.6	0	0	0	106.6	S1827	S1827-P1829 VanDerWaalsContact O-CD 3.24Å; S1827-P1829 WeakPolarHBondContact O-CD 3.26Å; S1827-P1829 VanDerWaalsContact O-N 3.13Å
1830	E	26.3	Very low	27.7	Very low	74 Å²	74	107.3 Å²	107.3	35%	0.346	61%	0.606	S	S	.	*			trans	0.5	120.4	163.6	-59.4	173.5	112.1	0	0	114.4	I256 S1828 F1832	I256-E1830 VanDerWaalsContact CD1-OE1 3.28Å; I256-E1830 WeakPolarHBondContact CD1-OE1 2.82Å; S1828-E1830 PolarHBondContact O-N 3.5Å; E1830-F1832 HydrophobicContact CB-CB 4.1Å; E1830-F1832 HydrophobicContact CB-CD2 4.05Å; E1830-F1832 HydrophobicContact CB-CG 4.34Å; E1830-F1832 VanDerWaalsContact CD-CD2 3.47Å; E1830-F1832 HydrophobicContact CG-CD2 4.38Å; E1830-F1832 PolarHBondContact O-N 2.83Å; E1830-F1832 WeakPolarHBondContact OE1-CE2 3.28Å; E1830-F1832 WeakPolarHBondContact OE2-CD2 3.34Å; E1830-F1832 VanDerWaalsContact OE2-CE2 3.32Å; E1830-F1832 WeakPolarHBondContact OE2-CE2 3.45Å
1831	P	29.6	Very low	27.7	Very low	82 Å²	82	106.4 Å²	106.4	53%	0.532	61%	0.605	S	S	.	*			trans	-63.9	75.6	145.8	29.9	-33	0	0	0	107.5	I1833	P1831-I1833 PolarHBondContact O-N 3.48Å
1832	F	25.3	Very low	27.8	Very low	90 Å²	90	106 Å²	106	40%	0.395	60%	0.603	S	S	.	*			trans	-72.7	63.1	166.6	-126.9	-39.7	0	0	0	106.9	H254 E1830 R1834	H254-F1832 AromaticContact CE1-CE1 3.79Å; H254-F1832 AromaticContact CE1-CZ 3.46Å; H254-F1832 VanDerWaalsContact CE1-CZ 3.46Å; H254-F1832 WeakPolarHBondContact CE1-CZ 3.48Å; E1830-F1832 HydrophobicContact CB-CB 4.1Å; E1830-F1832 HydrophobicContact CB-CD2 4.05Å; E1830-F1832 HydrophobicContact CB-CG 4.34Å; E1830-F1832 VanDerWaalsContact CD-CD2 3.47Å; E1830-F1832 HydrophobicContact CG-CD2 4.38Å; E1830-F1832 PolarHBondContact O-N 2.83Å; E1830-F1832 WeakPolarHBondContact OE1-CE2 3.28Å; E1830-F1832 WeakPolarHBondContact OE2-CD2 3.34Å; E1830-F1832 VanDerWaalsContact OE2-CE2 3.32Å; E1830-F1832 WeakPolarHBondContact OE2-CE2 3.45Å; F1832-R1834 HydrophobicContact CD1-CG 3.45Å; F1832-R1834 VanDerWaalsContact CD1-CG 3.45Å; F1832-R1834 HydrophobicContact CE1-CG 3.86Å; F1832-R1834 HydrophobicContact CG-CG 4.27Å; F1832-R1834 PolarHBondContact O-N 3.31Å
1833	I	29	Very low	27.9	Very low	135 Å²	135	105 Å²	105	69%	0.692	61%	0.606	S	S	*	*			trans	-67.2	67.7	150.9	-52.1	-177.4	0	0	0	106.2	P1831 F1835	P1831-I1833 PolarHBondContact O-N 3.48Å; I1833-F1835 HydrophobicContact CG2-CD2 4.39Å; I1833-F1835 HydrophobicContact CG2-CE2 4.32Å; I1833-F1835 PolarHBondContact O-N 2.8Å
1834	R	27.3	Very low	28.2	Very low	164 Å²	164	107 Å²	107	62%	0.619	61%	0.607	S	S	*	*			trans	-48.8	135.8	136.4	-61.2	-175.3	175.7	177.4	-1.9	104.9	F1832 P1836	F1832-R1834 HydrophobicContact CD1-CG 3.45Å; F1832-R1834 VanDerWaalsContact CD1-CG 3.45Å; F1832-R1834 HydrophobicContact CE1-CG 3.86Å; F1832-R1834 HydrophobicContact CG-CG 4.27Å; F1832-R1834 PolarHBondContact O-N 3.31Å; R1834-P1836 HydrophobicContact CB-CB 4.26Å; R1834-P1836 HydrophobicContact CB-CG 4.36Å; R1834-P1836 WeakPolarHBondContact O-CD 3.49Å
1835	F	26.1	Very low	28.3	Very low	163 Å²	163	109.1 Å²	109.1	72%	0.715	62%	0.619	S	S	*	*			trans	-81.9	94.6	137.4	-79.5	-99.9	0	0	0	105.4	I1833 G1837	I1833-F1835 HydrophobicContact CG2-CD2 4.39Å; I1833-F1835 HydrophobicContact CG2-CE2 4.32Å; I1833-F1835 PolarHBondContact O-N 2.8Å; F1835-G1837 PolarHBondContact O-N 3.45Å
1836	P	33.7	Very low	28.4	Very low	98 Å²	98	108.6 Å²	108.6	64%	0.636	62%	0.623	S	S	*	*			trans	-77.7	67.2	170.8	36.9	-35.4	0	0	0	108	R1834 K1838	R1834-P1836 HydrophobicContact CB-CB 4.26Å; R1834-P1836 HydrophobicContact CB-CG 4.36Å; R1834-P1836 WeakPolarHBondContact O-CD 3.49Å; P1836-K1838 PolarHBondContact O-N 2.81Å
1837	G	28.2	Very low	28.5	Very low	70 Å²	70	111.9 Å²	111.9	72%	0.722	64%	0.642	S	S	*	*			trans	-64.1	84.8	166.1	0	0	0	0	0	108.7	F1835	F1835-G1837 PolarHBondContact O-N 3.45Å
1838	K	26.3	Very low	28.4	Very low	193 Å²	193	114.6 Å²	114.6	84%	0.839	66%	0.66	S	S	*	*			trans	-174.3	58.7	173.9	-103.6	149.9	-169	176.2	0	111.7	P1836 L1840	P1836-K1838 PolarHBondContact O-N 2.81Å; K1838-L1840 VanDerWaalsContact C-N 3.31Å; K1838-L1840 PolarHBondContact O-N 3.04Å
1839	V	27.8	Very low	28.5	Very low	137 Å²	137	118 Å²	118	83%	0.83	69%	0.691	S	S	*	*			trans	-71.1	104.8	133.5	173.5	0	0	0	0	105.5
1840	L	26.8	Very low	28.1	Very low	137 Å²	137	123.7 Å²	123.7	72%	0.717	71%	0.707	S	S	*	*			trans	35.7	110.3	131	-57	167.5	0	0	0	115.4	K1838	K1838-L1840 VanDerWaalsContact C-N 3.31Å; K1838-L1840 PolarHBondContact O-N 3.04Å
1841	S	26	Very low	28.1	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	73%	0.729	S	S	*	*				77.1	125.4	99.8	-60.9	0	0	0	0	112.5
1842	S	29.3	Very low	27.9	Very low	100 Å²	100	129 Å²	129	70%	0.699	74%	0.742	S	S	*	*			cis	-145.4	158.7	43.2	52.6	0	0	0	0	115.7
1843	H	28.6	Very low	27.8	Very low	171 Å²	171	128.7 Å²	128.7	79%	0.792	75%	0.751	S	S	*	*			trans	-1.8	141.4	144.6	-39	-69.7	0	0	0	117.2
1844	S	31.5	Very low	27.6	Very low	116 Å²	116	133 Å²	133	81%	0.811	76%	0.759	S	S	*	*			cis	-160.8	158.1	41.1	46.7	0	0	0	0	115.2
1845	S	28.2	Very low	27.6	Very low	104 Å²	104	132.7 Å²	132.7	73%	0.727	77%	0.768	S	S	*	*			trans	-87.9	164.4	169.3	54.8	0	0	0	0	112.4
1846	P	31.6	Very low	27.7	Very low	123 Å²	123	129 Å²	129	80%	0.799	77%	0.768	S	S	*	*				-141.9	135.6	107.9	35	-20.8	0	0	0	117.4
1847	T	27.7	Very low	27.5	Very low	118 Å²	118	128.6 Å²	128.6	72%	0.724	77%	0.767	S	S	*	*			trans	-11.4	124.4	145.3	43.1	0	0	0	0	120.6
1848	S	29.4	Very low	27.6	Very low	114 Å²	114	131.5 Å²	131.5	80%	0.797	76%	0.762	S	S	*	*				28.9	123.8	125.6	63.6	0	0	0	0	121.2
1849	A	28	Very low	27.8	Very low	101 Å²	101	129.5 Å²	129.5	84%	0.835	75%	0.753	S	S	*	*			trans	-144.2	158.3	149.3	0	0	0	0	0	111.6
1850	F	24.4	Very low	28.1	Very low	202 Å²	202	131 Å²	131	89%	0.886	76%	0.756	S	S	*	*			trans	-72.3	172.7	-176.7	-70	-105.8	0	0	0	114
1851	S	25.2	Very low	28.3	Very low	114 Å²	114	128.6 Å²	128.6	80%	0.797	75%	0.748	S	S	*	*			trans	84.7	110.7	167.6	-28.7	0	0	0	0	113.3
1852	D	24.5	Very low	28.6	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	76%	0.758	S	S	*	*				82.3	127.8	56.1	-165.5	13.9	0	0	0	113.4
1853	S	24.8	Very low	28.5	Very low	83 Å²	83	139.1 Å²	139.1	58%	0.58	76%	0.762	S	S	*	*			trans	77.4	97	166.9	73.3	0	0	0	0	123.2
1854	R	24.6	Very low	28.4	Very low	227 Å²	227	136.7 Å²	136.7	86%	0.857	76%	0.756	S	S	*	*				85	157.5	121.3	-64.4	170	-165	-167.6	3.6	122.3
1855	I	27.8	Very low	28.1	Very low	156 Å²	156	136 Å²	136	80%	0.8	75%	0.751	S	S	*	*			trans	77.5	101.2	167.4	-60.1	135.1	0	0	0	112.6
1856	A	27.9	Very low	28	Very low	86 Å²	86	135.9 Å²	135.9	71%	0.711	75%	0.75	S	S	*	*				64.8	129.1	60.4	0	0	0	0	0	111.7
1857	S	28.4	Very low	27.8	Very low	89 Å²	89	136.1 Å²	136.1	62%	0.622	75%	0.751	S	S	*	*			cis	-166.7	176	45.8	-103.2	0	0	0	0	108.3
1858	E	30.7	Very low	27.8	Very low	132 Å²	132	135.3 Å²	135.3	62%	0.617	75%	0.748	S	S	*	*			cis	-155	177.7	-6	-125	157	136.1	0	0	110.6	P1570	P1570-E1858 HydrophobicContact CB-CG 4.17Å; P1570-E1858 WeakPolarHBondContact CB-OE1 3.3Å; P1570-E1858 HydrophobicContact CG-CG 3.51Å; P1570-E1858 WeakPolarHBondContact CG-OE1 3.3Å
1859	K	31.2	Very low	27.5	Very low	150 Å²	150	132 Å²	132	65%	0.652	72%	0.721	S	S	*	*			trans	-98.6	144.1	-173.2	-55.6	162.5	-176	158.5	0	113.3	P1570	P1570-K1859 PolarHBondContact O-NZ 3.16Å; P1570-K1859 VanDerWaalsContact O-NZ 3.12Å
1860	L	33.7	Very low	27.5	Very low	170 Å²	170	133 Å²	133	89%	0.89	72%	0.717	S	S	*	*			trans	-138.8	113.9	153	-80.7	179.2	0	0	0	110.9
1861	P	30.1	Very low	27.5	Very low	85 Å²	85	131.8 Å²	131.8	55%	0.552	72%	0.719	S	S	*	*			trans	-101.3	144.6	175.3	36.1	-30.6	0	0	0	112.7
1862	F	33.3	Very low	27.5	Very low	217 Å²	217	130.8 Å²	130.8	95%	0.952	71%	0.712	S	S	*	*			trans	-115.9	150.3	160.2	-98.2	-94.4	0	0	0	110.2
1863	R	27.7	Very low	27.5	Very low	210 Å²	210	128 Å²	128	79%	0.792	71%	0.705	S	S	*	*			trans	-156.8	151.5	-174.3	-161.1	-164.4	-173	-98.6	5.5	109.5
1864	N	25.1	Very low	27.6	Very low	121 Å²	121	132.2 Å²	132.2	65%	0.647	71%	0.713	S	S	*	*			trans	73.1	155.1	179.5	-29.9	-40.8	0	0	0	112.4
1865	S	25.7	Very low	27.7	Very low	101 Å²	101	128.6 Å²	128.6	71%	0.706	70%	0.704	S	S	*	*			cis	-162.3	144.2	3.6	7.1	0	0	0	0	112.4
1866	S	26.1	Very low	27.7	Very low	102 Å²	102	124.1 Å²	124.1	71%	0.713	69%	0.686	S	S	*	*			trans	66.5	171	153.6	-46.9	0	0	0	0	115.6
1867	P	26.4	Very low	27.7	Very low	128 Å²	128	123.3 Å²	123.3	83%	0.831	67%	0.67	S	S	*	*				-105.7	155	66.6	35	-37.5	0	0	0	114.9
1868	P	28.3	Very low	27.7	Very low	100 Å²	100	123 Å²	123	65%	0.649	67%	0.668	S	S	*	*			trans	-101.8	179.6	172.7	41.7	-34.1	0	0	0	111.7
1869	D	24.3	Very low	27.9	Very low	45 Å²	45	122 Å²	122	24%	0.241	67%	0.674	C	S	.	*			trans	-61.9	147	151.7	-64.6	-71	0	0	0	112.7	V11 N12 S13	V11-D1869 WeakPolarHBondContact CG1-OD1 3.28Å; N12-D1869 VanDerWaalsContact CB-OD1 3.26Å; N12-D1869 WeakPolarHBondContact CB-OD1 3.28Å; N12-D1869 WeakPolarHBondContact CB-OD2 3.36Å; S13-D1869 VanDerWaalsContact CB-OD2 3.23Å; S13-D1869 WeakPolarHBondContact CB-OD2 3.24Å; S13-D1869 PolarHBondContact OG-OD2 3.47Å
1870	V	28	Very low	28.4	Very low	122 Å²	122	123.7 Å²	123.7	74%	0.739	68%	0.682	S	S	*	*				173.7	131	129.2	147.8	0	0	0	0	109.5	S1872	V1870-S1872 PolarHBondContact O-N 3.06Å
1871	N	24	Very low	28.1	Very low	176 Å²	176	125.3 Å²	125.3	94%	0.941	68%	0.676	S	S	*	*			trans	-71.3	101.1	164	-92.7	-37.8	0	0	0	110.1
1872	S	24.6	Very low	28.1	Very low	93 Å²	93	126.1 Å²	126.1	65%	0.65	68%	0.676	S	S	*	*			trans	-154.8	90.1	161.9	67.2	0	0	0	0	113.5	V1870	V1870-S1872 PolarHBondContact O-N 3.06Å
1873	S	24	Very low	27.6	Very low	96 Å²	96	121.5 Å²	121.5	67%	0.671	66%	0.661	S	S	*	*			trans	7.7	150.7	140.3	72.6	0	0	0	0	121.3
1874	K	27	Very low	27.5	Very low	171 Å²	171	118.3 Å²	118.3	74%	0.743	66%	0.657	S	S	*	*			trans	100.4	103.3	150.6	-63.3	175.9	-173.8	176.3	0	119.2
1875	F	27.6	Very low	27.5	Very low	151 Å²	151	120.9 Å²	120.9	66%	0.662	66%	0.663	S	S	*	*				69.7	147.2	125.9	-66.6	-50.9	0	0	0	120.4
1876	S	27.2	Very low	27.3	Very low	61 Å²	61	122.2 Å²	122.2	43%	0.427	67%	0.667	S	S	.	*			cis	-162.7	142.1	-6	48.3	0	0	0	0	113.7
1877	D	28.2	Very low	27.3	Very low	69 Å²	69	121.9 Å²	121.9	37%	0.369	67%	0.665	S	S	.	*			trans	45.8	108.3	131.1	-39.2	-23.3	0	0	0	121.6
1878	S	27.8	Very low	27.2	Very low	83 Å²	83	120.3 Å²	120.3	58%	0.58	66%	0.656	S	S	*	*	S	Bend		-171.7	126	129	59.6	0	0	0	0	109.8
1879	C	36.4	Very low	27.1	Very low	111 Å²	111	124.9 Å²	124.9	75%	0.75	67%	0.666	S	S	*	*			cis	-137.6	137.9	0.5	-55.3	0	0	0	0	107.5
1880	F	40.8	Very low	27.2	Very low	185 Å²	185	127 Å²	127	81%	0.811	68%	0.682	S	S	*	*			cis	60.5	65.1	6.2	-81.8	-73.1	0	0	0	116.5
1881	R	26.6	Very low	27	Very low	205 Å²	205	127.2 Å²	127.2	77%	0.774	68%	0.678	S	S	*	*			trans	-159.9	148.2	147.5	-99.6	-172.5	174.2	-121.5	9.7	106.5
1882	D	30.9	Very low	27	Very low	102 Å²	102	121.5 Å²	121.5	55%	0.545	65%	0.647	S	S	.	*			cis	-118.4	166.9	-3.5	-95.9	-58.9	0	0	0	107.3
1883	N	23.3	Very low	27	Very low	119 Å²	119	123.3 Å²	123.3	64%	0.636	64%	0.64	S	S	*	*				42.8	134	72.8	-87.2	-6.4	0	0	0	111.5
1884	M	25.4	Very low	27	Very low	144 Å²	144	123.7 Å²	123.7	71%	0.709	63%	0.631	S	S	*	*			cis	-154.2	147.5	17.3	-114.3	150	86.9	0	0	108.4
1885	F	24.2	Very low	27	Very low	174 Å²	174	121.5 Å²	121.5	76%	0.763	63%	0.627	S	S	*	*				49.9	149.3	102.7	-81.7	-103.2	0	0	0	116.7
1886	T	23	Very low	27	Very low	130 Å²	130	119.8 Å²	119.8	80%	0.798	63%	0.625	S	S	*	*			trans	66.1	128.6	162.1	49.8	0	0	0	0	116.9
1887	S	24.6	Very low	27.2	Very low	95 Å²	95	122.6 Å²	122.6	66%	0.664	63%	0.634	S	S	*	*			cis	-164.8	147.4	-4.1	51.4	0	0	0	0	112.4
1888	S	25.1	Very low	27.4	Very low	94 Å²	94	126 Å²	126	66%	0.657	65%	0.648	S	S	*	*			trans	40.8	120.1	141.9	67.6	0	0	0	0	118.7
1889	K	26.3	Very low	27.7	Very low	197 Å²	197	127.5 Å²	127.5	86%	0.857	65%	0.649	S	S	*	*				-161	164	92.3	-98.4	160.9	-177.3	-173.9	0	110.2
1890	P	25.6	Very low	27.7	Very low	89 Å²	89	128 Å²	128	58%	0.578	64%	0.643	S	S	*	*			trans	-123.3	-160.7	-151.9	34.1	-13.1	0	0	0	111.6
1891	I	24	Very low	27.3	Very low	127 Å²	127	124.9 Å²	124.9	65%	0.651	64%	0.635	S	S	*	*			trans	43.1	123.9	134.5	-72.9	160.6	0	0	0	117.3
1892	N	23.6	Very low	27.6	Very low	55 Å²	55	122 Å²	122	29%	0.294	63%	0.63	S	S	.	*			trans	79.6	152.7	153.9	-85.9	-13.5	0	0	0	117.1	R196	R196-N1892 WeakPolarHBondContact CD-OD1 2.23Å; R196-N1892 PolarHBondContact NE-OD1 3.4Å; R196-N1892 PolarHBondContact NH1-OD1 3.29Å
1893	R	25.8	Very low	27.6	Very low	131 Å²	131	122 Å²	122	49%	0.494	63%	0.633	S	S	.	*				68.1	130.1	61.2	-136.1	-154.6	176.7	166.1	1.1	108.4	R197	R197-R1893 VanDerWaalsContact NH1-CA 3.29Å
1894	E	24.7	Very low	28	Very low	104 Å²	104	123.5 Å²	123.5	49%	0.486	63%	0.634	S	S	.	*			cis	-77.1	-163.5	1.6	-106.3	54	-151.7	0	0	109.6
1895	N	26.2	Very low	28.2	Very low	125 Å²	125	123.2 Å²	123.2	67%	0.668	63%	0.632	S	S	*	*			cis	48.7	168.1	39.9	-30.1	-12.7	0	0	0	109.4
1896	L	28.2	Very low	28.5	Very low	115 Å²	115	119.7 Å²	119.7	60%	0.602	63%	0.627	S	S	*	*			cis	-148.6	167.3	30.4	-155.8	71.1	0	0	0	108.2
1897	L	30.6	Very low	29	Very low	121 Å²	121	119.4 Å²	119.4	63%	0.634	62%	0.621	S	S	*	*			trans	-10.5	133.9	146.8	-64.5	36.9	0	0	0	112.6
1898	H	32.1	Very low	29.4	Very low	141 Å²	141	120.9 Å²	120.9	65%	0.653	62%	0.617	S	S	*	*				-174.4	147	77.3	-83.3	-71	0	0	0	107.1
1899	D	34.3	Very low	29.7	Very low	113 Å²	113	122 Å²	122	60%	0.604	62%	0.619	S	S	*	*			cis	-166.7	178.9	8.4	-129	-9.9	0	0	0	114.4
1900	I	36.3	Very low	29.8	Very low	122 Å²	122	121.4 Å²	121.4	63%	0.626	61%	0.612	S	S	*	*			trans	64.4	96.4	141.2	-71.2	163.2	0	0	0	116.3
1901	D	33.5	Very low	29.9	Very low	120 Å²	120	122.9 Å²	122.9	64%	0.642	61%	0.614	S	S	*	*				72.3	154.4	114.7	-62.8	-34.9	0	0	0	121.2
1902	H	32.6	Very low	30.3	Very low	145 Å²	145	120.6 Å²	120.6	67%	0.671	62%	0.621	S	S	*	*			cis	-147.8	146.7	0.5	-122.6	9.6	0	0	0	110.7
1903	T	30	Very low	30.5	Very low	100 Å²	100	121.2 Å²	121.2	61%	0.613	63%	0.63	S	S	*	*			trans	15.1	137.2	140.6	67.3	0	0	0	0	118.7
1904	K	31.8	Very low	30.7	Very low	151 Å²	151	122.9 Å²	122.9	66%	0.657	64%	0.643	S	S	*	*				-171.7	140.7	80.6	-102.7	171.5	169.1	-76	0	115.4
1905	E	29.2	Very low	30.9	Very low	139 Å²	139	123 Å²	123	65%	0.65	65%	0.651	S	S	*	*			trans	58.3	114.4	134.1	-73.4	155.2	178.7	0	0	121.3
1906	C	31.9	Very low	31	Very low	99 Å²	99	122.6 Å²	122.6	67%	0.669	65%	0.653	S	S	*	*				55.7	147.2	102.2	-76.9	0	0	0	0	121
1907	D	33.1	Very low	31.1	Very low	124 Å²	124	122.8 Å²	122.8	66%	0.663	65%	0.654	S	S	*	*			cis	-128.3	141.2	7.7	-88.7	-49	0	0	0	111.6
1908	Q	33.3	Very low	31	Very low	127 Å²	127	124 Å²	124	59%	0.593	66%	0.657	S	S	*	*			cis	85.5	156.3	49.3	-155	-160.2	139.3	0	0	112.7
1909	V	30	Very low	31.4	Very low	116 Å²	116	126.4 Å²	126.4	70%	0.703	67%	0.665	S	S	*	*			trans	88.3	114.2	167.3	-169.7	0	0	0	0	115.7
1910	R	28.8	Very low	31.4	Very low	185 Å²	185	126 Å²	126	70%	0.698	67%	0.669	S	S	*	*			cis	-166	168.6	-24.2	-128.1	173.2	163.2	163.9	-5.9	110.2
1911	I	28.7	Very low	30.9	Very low	121 Å²	121	124.9 Å²	124.9	62%	0.621	67%	0.672	S	S	*	*			trans	16.1	119.6	142.9	-64.3	162.3	0	0	0	114.5
1912	G	31.1	Very low	30.5	Very low	78 Å²	78	123.5 Å²	123.5	80%	0.804	67%	0.668	S	S	*	*			cis	104.2	-166	47	0	0	0	0	0	108.8
1913	S	29.2	Very low	30.2	Very low	69 Å²	69	122.7 Å²	122.7	48%	0.483	67%	0.668	S	S	.	*			cis	-150.3	141.5	2	-126.5	0	0	0	0	109.2
1914	E	28.3	Very low	30.1	Very low	165 Å²	165	120.6 Å²	120.6	77%	0.771	65%	0.653	S	S	*	*			trans	64.8	156.1	131.7	-69.5	174.3	114.7	0	0	121
1915	V	30	Very low	29.9	Very low	108 Å²	108	118.3 Å²	118.3	66%	0.655	65%	0.653	S	S	*	*			cis	-169.7	177.5	-26.1	61.6	0	0	0	0	106.9
1916	V	28.9	Very low	29.9	Very low	116 Å²	116	115.4 Å²	115.4	70%	0.703	65%	0.645	S	S	*	*			trans	73.6	129.9	147.2	133.5	0	0	0	0	116.5
1917	D	28.5	Very low	29.6	Very low	118 Å²	118	115.3 Å²	115.3	63%	0.631	65%	0.645	S	S	*	*			cis	-167.1	-168.9	-4.5	-150.9	-4.7	0	0	0	113.3
1918	Q	28.5	Very low	29.2	Very low	146 Å²	146	113.7 Å²	113.7	68%	0.682	64%	0.64	S	S	*	*			trans	71	70.7	141.3	-79	156.9	59.1	0	0	116.5
1919	K	40.7	Very low	28.9	Very low	192 Å²	192	117.5 Å²	117.5	84%	0.835	66%	0.655	S	S	*	*				-24.6	155.6	111.6	-103.1	-179.6	-179.9	174.5	0	113.8
1920	P	35.2	Very low	28.7	Very low	104 Å²	104	118.8 Å²	118.8	68%	0.675	65%	0.653	S	S	*	*			cis	-142.1	-174.7	12.5	40.3	-21.1	0	0	0	116
1921	S	24.7	Very low	28.7	Very low	100 Å²	100	117.6 Å²	117.6	70%	0.699	66%	0.659	S	S	*	*			trans	79.1	163.5	143.5	77.3	0	0	0	0	119.4
1922	V	25.7	Very low	28.6	Very low	90 Å²	90	119.3 Å²	119.3	55%	0.545	66%	0.664	S	S	.	*			trans	41.5	100.5	170.6	-109.1	0	0	0	0	117	I1924	V1922-I1924 HydrophobicContact CG1-CD1 4.01Å; V1922-I1924 HydrophobicContact CG1-CG1 4.11Å
1923	N	26.2	Very low	28.4	Very low	128 Å²	128	126 Å²	126	68%	0.684	67%	0.672	S	S	*	*				-163.5	149.4	82.9	-101.9	-66.1	0	0	0	112.1
1924	I	29.3	Very low	28.3	Very low	56 Å²	56	127.6 Å²	127.6	29%	0.287	68%	0.675	S	S	.	*			trans	-139	74.7	-143.6	-11.6	-175.8	0	0	0	103.6	V1922 V1926 V1956 I1957 S1958	V1922-I1924 HydrophobicContact CG1-CD1 4.01Å; V1922-I1924 HydrophobicContact CG1-CG1 4.11Å; I1924-V1926 PolarHBondContact O-N 3.25Å; I1924-V1956 HydrophobicContact CB-CB 3.63Å; I1924-V1956 HydrophobicContact CB-CG1 3.77Å; I1924-V1956 HydrophobicContact CD1-CB 3.85Å; I1924-V1956 HydrophobicContact CD1-CG1 4.35Å; I1924-V1956 HydrophobicContact CD1-CG2 4.33Å; I1924-V1956 HydrophobicContact CG1-CB 3.66Å; I1924-V1956 HydrophobicContact CG1-CG1 3.7Å; I1924-V1956 CarbonylContact O-C 3.33Å; I1924-V1956 VanDerWaalsContact O-C 3.31Å; I1924-V1956 VanDerWaalsContact O-CA 3.23Å; I1924-V1956 WeakPolarHBondContact O-CA 3.28Å; I1924-V1956 VanDerWaalsContact O-CG1 3.27Å; I1924-V1956 WeakPolarHBondContact O-CG1 3.39Å; I1924-I1957 CarbonylContact C-O 3.53Å; I1924-I1957 PolarHBondContact O-N 3.14Å; I1924-S1958 VanDerWaalsContact CG2-CB 3.5Å
1925	P	26.4	Very low	28.2	Very low	103 Å²	103	131.2 Å²	131.2	67%	0.669	68%	0.681	S	S	*	*	B	Isolated β-bridge	trans	-92.7	11.9	-144.9	37.1	-38.7	0	0	0	116.2	S1927 S1958	P1925-S1927 PolarHBondContact O-N 2.86Å; P1925-S1927 VanDerWaalsContact O-N 3.1Å; P1925-S1958 WeakPolarHBondContact CD-OG 2.82Å
1926	V	30.6	Very low	28.6	Very low	79 Å²	79	134.1 Å²	134.1	48%	0.479	69%	0.692	S	S	.	*			trans	-73	104.8	-177.7	177.2	0	0	0	0	110.9	I1924 I1957	I1924-V1926 PolarHBondContact O-N 3.25Å; V1926-I1957 HydrophobicContact CB-CB 4.38Å; V1926-I1957 WeakPolarHBondContact CB-O 3.43Å; V1926-I1957 VanDerWaalsContact CG2-O 3.25Å; V1926-I1957 WeakPolarHBondContact CG2-O 3.36Å; V1926-I1957 PolarHBondContact N-O 3.02Å; V1926-I1957 WeakPolarHBondContact O-CD1 3.24Å
1927	S	24.9	Very low	28.4	Very low	96 Å²	96	131.9 Å²	131.9	67%	0.671	69%	0.686	S	S	*	*			trans	-119.2	171.4	143	-165.2	0	0	0	0	108.5	P1925 K1929	P1925-S1927 PolarHBondContact O-N 2.86Å; P1925-S1927 VanDerWaalsContact O-N 3.1Å; S1927-K1929 PolarHBondContact O-N 3.46Å
1928	T	24.9	Very low	28.4	Very low	90 Å²	90	133 Å²	133	55%	0.552	69%	0.687	S	S	*	*			trans	-52.8	130	169.2	40.1	0	0	0	0	111.6	E1930	T1928-E1930 WeakPolarHBondContact CB-OE2 2.91Å; T1928-E1930 HydrophobicContact CG2-CG 3.94Å; T1928-E1930 WeakPolarHBondContact CG2-OE2 3.25Å; T1928-E1930 PolarHBondContact O-N 2.8Å; T1928-E1930 PolarHBondContact OG1-OE2 2.96Å
1929	K	26.6	Very low	28.7	Very low	207 Å²	207	135.8 Å²	135.8	90%	0.9	69%	0.692	S	S	*	*			trans	-91	64.6	143.8	-85.6	-169.4	175	-179.8	0	108.7	S1927 I1931	S1927-K1929 PolarHBondContact O-N 3.46Å; K1929-I1931 PolarHBondContact O-N 3.11Å; K1929-I1931 VanDerWaalsContact O-N 3.14Å
1930	E	26.2	Very low	28.3	Very low	143 Å²	143	135.4 Å²	135.4	67%	0.668	69%	0.687	S	S	*	*			trans	-56.4	112.9	154.2	-80.1	156.4	128.8	0	0	106.7	T1928 H1932	T1928-E1930 WeakPolarHBondContact CB-OE2 2.91Å; T1928-E1930 HydrophobicContact CG2-CG 3.94Å; T1928-E1930 WeakPolarHBondContact CG2-OE2 3.25Å; T1928-E1930 PolarHBondContact O-N 2.8Å; T1928-E1930 PolarHBondContact OG1-OE2 2.96Å; E1930-H1932 PolarHBondContact O-N 2.88Å
1931	I	28.8	Very low	28.2	Very low	161 Å²	161	138 Å²	138	83%	0.826	69%	0.688	S	S	*	*			trans	-71.2	107.4	173.2	-64.8	-178.8	0	0	0	106.5	K1929 F1933	K1929-I1931 PolarHBondContact O-N 3.11Å; K1929-I1931 VanDerWaalsContact O-N 3.14Å; I1931-F1933 PolarHBondContact O-N 2.87Å
1932	H	25.4	Very low	28.7	Very low	157 Å²	157	141 Å²	141	73%	0.727	69%	0.688	S	S	*	*			trans	-52.1	93.1	-160.2	-137.8	-88.9	0	0	0	114.1	E1930 D1934	E1930-H1932 PolarHBondContact O-N 2.88Å; H1932-D1934 PolarHBondContact O-N 3.15Å
1933	F	27	Very low	29.1	Very low	219 Å²	219	139.8 Å²	139.8	96%	0.961	68%	0.681	S	S	*	*			trans	-75.7	59.7	161.5	-109.6	-74.5	0	0	0	110	I1931	I1931-F1933 PolarHBondContact O-N 2.87Å
1934	D	27.4	Very low	29.4	Very low	102 Å²	102	141.7 Å²	141.7	55%	0.545	68%	0.684	S	S	.	*			trans	-141.6	82.8	166.5	-155.4	-7.2	0	0	0	112.5	H1932	H1932-D1934 PolarHBondContact O-N 3.15Å
1935	R	27	Very low	29.5	Very low	241 Å²	241	144 Å²	144	91%	0.909	70%	0.697	S	S	*	*	S	Bend	trans	-152.9	65.4	156.4	-148.9	179.4	-161.6	-167.6	5.9	112
1936	L	36.9	Very low	29.8	Very low	168 Å²	168	145.3 Å²	145.3	88%	0.88	70%	0.697	S	S	*	*			trans	179.4	63.3	139.8	-97.2	165.7	0	0	0	112.8
1937	A	25.2	Very low	29.8	Very low	69 Å²	69	147.5 Å²	147.5	57%	0.57	71%	0.706	S	S	*	*			trans	-75.1	129.9	161.7	0	0	0	0	0	111
1938	H	29.3	Very low	30.3	Very low	142 Å²	142	149.5 Å²	149.5	66%	0.657	71%	0.71	S	S	*	*			trans	-156.2	144.1	162.7	-127.7	-90	0	0	0	112.7
1939	Y	33.6	Very low	30.7	Very low	204 Å²	204	148.9 Å²	148.9	80%	0.8	71%	0.709	S	S	*	*			trans	53.1	88.6	177.7	-59.8	-69.8	0	0	0	117.6
1940	Y	32.9	Very low	30.9	Very low	184 Å²	184	146.4 Å²	146.4	72%	0.722	70%	0.701	S	S	*	*			cis	89.8	126.8	8.8	-134	-27.5	0	0	0	118.3
1941	K	34.1	Very low	31	Very low	159 Å²	159	146.8 Å²	146.8	69%	0.691	70%	0.702	S	S	*	*			trans	80.1	164	151.4	-101.8	156.9	-176.9	160.1	0	118
1942	K	35	Very low	31	Very low	162 Å²	162	145 Å²	145	70%	0.704	69%	0.693	S	S	*	*			cis	-158	153.6	13.3	-147.1	-141.2	167.8	-168.3	0	108.9
1943	T	33.8	Very low	31.2	Very low	66 Å²	66	148.3 Å²	148.3	41%	0.405	70%	0.701	S	S	.	*			cis	-150.8	176.1	-22.1	14.3	0	0	0	0	106
1944	F	32.5	Very low	31.3	Very low	168 Å²	168	140.9 Å²	140.9	74%	0.737	69%	0.686	S	S	*	*				164.3	153.6	82.5	-84.1	-82.2	0	0	0	107.6
1945	N	30.6	Very low	31.5	Very low	104 Å²	104	143.7 Å²	143.7	56%	0.556	70%	0.7	S	S	*	*			cis	-170.5	146.3	-23.4	-119.2	38.5	0	0	0	108.8
1946	L	32.1	Very low	31.7	Very low	130 Å²	130	135.6 Å²	135.6	68%	0.681	68%	0.678	S	S	*	*			trans	42.2	147.8	137.2	-79.1	56.9	0	0	0	120.7
1947	D	32.6	Very low	31.5	Very low	126 Å²	126	131.9 Å²	131.9	67%	0.674	66%	0.658	S	S	*	*			cis	-159.4	169.5	12.4	-111.2	-31.4	0	0	0	112.2
1948	D	34.6	Very low	31.6	Very low	138 Å²	138	131.3 Å²	131.3	74%	0.738	65%	0.649	S	S	*	*			trans	62.5	142.8	155	-80.6	-37.7	0	0	0	121.9
1949	S	33.5	Very low	31.5	Very low	77 Å²	77	130.5 Å²	130.5	54%	0.538	66%	0.655	S	S	.	*			cis	-158.6	126	-7	-130.3	0	0	0	0	114.9
1950	Q	30.2	Very low	31.2	Very low	155 Å²	155	124 Å²	124	72%	0.724	65%	0.65	S	S	*	*			trans	68.3	150.8	135.3	-59.9	173	25.4	0	0	125.4
1951	H	29.1	Very low	31	Very low	150 Å²	150	121.5 Å²	121.5	69%	0.694	65%	0.654	S	S	*	*			trans	78.4	129.1	157.2	-72.1	-73.6	0	0	0	122.7
1952	L	28.8	Very low	31	Very low	123 Å²	123	119.6 Å²	119.6	64%	0.644	66%	0.658	S	S	*	*			cis	-170.3	123.2	-37.3	-108.3	-163.3	0	0	0	108.7
1953	Y	29.3	Very low	30.8	Very low	228 Å²	228	117.3 Å²	117.3	89%	0.894	66%	0.659	S	S	*	*			trans	63.4	158	145.2	-78	-140	0	0	0	119.8
1954	G	29.6	Very low	30.7	Very low	63 Å²	63	119.4 Å²	119.4	65%	0.649	67%	0.674	S	S	*	*			cis	-165	165.6	1.5	0	0	0	0	0	114.6
1955	L	31.1	Very low	31.1	Very low	160 Å²	160	117 Å²	117	84%	0.838	68%	0.676	S	S	*	*			trans	-86.9	134.9	-176.2	-83.2	150.2	0	0	0	113	I1957	L1955-I1957 HydrophobicContact CD2-CD1 3.77Å
1956	V	30.8	Very low	31.4	Very low	72 Å²	72	117.6 Å²	117.6	44%	0.436	69%	0.685	S	S	.	*			trans	-161.4	117.1	167.4	-117.3	0	0	0	0	107.4	I1924	I1924-V1956 HydrophobicContact CB-CB 3.63Å; I1924-V1956 HydrophobicContact CB-CG1 3.77Å; I1924-V1956 HydrophobicContact CD1-CB 3.85Å; I1924-V1956 HydrophobicContact CD1-CG1 4.35Å; I1924-V1956 HydrophobicContact CD1-CG2 4.33Å; I1924-V1956 HydrophobicContact CG1-CB 3.66Å; I1924-V1956 HydrophobicContact CG1-CG1 3.7Å; I1924-V1956 CarbonylContact O-C 3.33Å; I1924-V1956 VanDerWaalsContact O-C 3.31Å; I1924-V1956 VanDerWaalsContact O-CA 3.23Å; I1924-V1956 WeakPolarHBondContact O-CA 3.28Å; I1924-V1956 VanDerWaalsContact O-CG1 3.27Å; I1924-V1956 WeakPolarHBondContact O-CG1 3.39Å
1957	I	33.1	Very low	31.5	Very low	90 Å²	90	116.7 Å²	116.7	46%	0.462	69%	0.687	S	S	.	*	B	Isolated β-bridge	trans	-143.3	151.8	178.4	-26.1	80.1	0	0	0	110.6	I1924 V1926 L1955	I1924-I1957 CarbonylContact C-O 3.53Å; I1924-I1957 PolarHBondContact O-N 3.14Å; V1926-I1957 HydrophobicContact CB-CB 4.38Å; V1926-I1957 WeakPolarHBondContact CB-O 3.43Å; V1926-I1957 VanDerWaalsContact CG2-O 3.25Å; V1926-I1957 WeakPolarHBondContact CG2-O 3.36Å; V1926-I1957 PolarHBondContact N-O 3.02Å; V1926-I1957 WeakPolarHBondContact O-CD1 3.24Å; L1955-I1957 HydrophobicContact CD2-CD1 3.77Å
1958	S	28	Very low	31.8	Very low	56 Å²	56	116.1 Å²	116.1	39%	0.392	69%	0.69	S	S	.	*			trans	-136.4	163.4	-166.8	-158.8	0	0	0	0	116	I1924 P1925 G1960	I1924-S1958 VanDerWaalsContact CG2-CB 3.5Å; P1925-S1958 WeakPolarHBondContact CD-OG 2.82Å; S1958-G1960 PolarHBondContact O-N 3.41Å
1959	T	26.6	Very low	31.7	Very low	125 Å²	125	115.5 Å²	115.5	77%	0.767	69%	0.693	S	S	*	*			trans	-63.1	116.8	159.7	50.7	0	0	0	0	111.2
1960	G	27.1	Very low	31.5	Very low	68 Å²	68	118.8 Å²	118.8	70%	0.701	70%	0.703	S	S	*	*			trans	-151.9	110.3	169.5	0	0	0	0	0	109.5	S1958	S1958-G1960 PolarHBondContact O-N 3.41Å
1961	T	27.4	Very low	31.6	Very low	131 Å²	131	116.4 Å²	116.4	80%	0.804	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-59.5	137.6	176.4	44.7	0	0	0	0	110.5
1962	P	34.7	Very low	31.6	Very low	119 Å²	119	114.5 Å²	114.5	77%	0.773	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-59.3	134	167.8	27.2	-33.3	0	0	0	108.7
1963	P	31.2	Very low	31.5	Very low	114 Å²	114	118.4 Å²	118.4	74%	0.74	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-64.7	149	176.2	28.3	-34.3	0	0	0	109.8
1964	P	32.6	Very low	31.5	Very low	111 Å²	111	112.7 Å²	112.7	72%	0.721	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-60	146.7	173.5	27.3	-34.7	0	0	0	110.1
1965	P	40	Very low	31.3	Very low	118 Å²	118	112.8 Å²	112.8	77%	0.766	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-57.4	137.9	171.4	25.7	-33.7	0	0	0	109.3
1966	P	36.2	Very low	31.3	Very low	115 Å²	115	113.9 Å²	113.9	75%	0.747	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-62.2	140.5	-176.9	25.9	-34.2	0	0	0	110.2
1967	P	34.7	Very low	31.3	Very low	112 Å²	112	115.4 Å²	115.4	73%	0.727	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-60.8	141.2	173.1	27.1	-34	0	0	0	109.5
1968	P	38.1	Very low	31.1	Very low	113 Å²	113	117.7 Å²	117.7	73%	0.734	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-58.7	138.1	174.5	25.2	-33.5	0	0	0	109.6	I1970	P1968-I1970 PolarHBondContact O-N 2.88Å
1969	P	32.9	Very low	31.1	Very low	125 Å²	125	119.8 Å²	119.8	81%	0.812	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-66.7	120.1	-170.5	25.9	-34.2	0	0	0	111.1
1970	I	29.1	Very low	31.1	Very low	146 Å²	146	117.7 Å²	117.7	75%	0.749	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-70.6	124.8	169.8	-58.7	172.9	0	0	0	107.5	P1968 S1972	P1968-I1970 PolarHBondContact O-N 2.88Å; I1970-S1972 PolarHBondContact O-N 3.14Å; I1970-S1972 VanDerWaalsContact O-N 3.11Å
1971	P	33.8	Very low	31.2	Very low	105 Å²	105	121.3 Å²	121.3	68%	0.682	75%	0.75	S	S	*	*			trans	-73.8	103	176.1	28.9	-32.8	0	0	0	110.3	F1973	P1971-F1973 PolarHBondContact O-N 3.25Å; P1971-F1973 VanDerWaalsContact O-N 3.17Å
1972	S	27.7	Very low	31.5	Very low	111 Å²	111	120 Å²	120	78%	0.776	75%	0.746	S	S	*	*			trans	-66.2	108.3	175.6	-57.2	0	0	0	0	111.5	I1970	I1970-S1972 PolarHBondContact O-N 3.14Å; I1970-S1972 VanDerWaalsContact O-N 3.11Å
1973	F	28	Very low	31.4	Very low	204 Å²	204	118.3 Å²	118.3	90%	0.895	74%	0.735	S	S	*	*			trans	-87.3	125.3	162.6	-88.4	-90.9	0	0	0	109.7	P1971	P1971-F1973 PolarHBondContact O-N 3.25Å; P1971-F1973 VanDerWaalsContact O-N 3.17Å
1974	S	28.2	Very low	31.3	Very low	108 Å²	108	118.6 Å²	118.6	76%	0.755	73%	0.734	S	S	*	*			trans	-140.2	109.5	-175.8	58.4	0	0	0	0	112.5
1975	G	26.6	Very low	31.6	Very low	65 Å²	65	117.6 Å²	117.6	67%	0.67	74%	0.736	S	S	*	*			trans	73.7	156.9	173.2	0	0	0	0	0	115.3
1976	H	30.8	Very low	31.3	Very low	184 Å²	184	117.9 Å²	117.9	85%	0.852	74%	0.737	S	S	*	*			cis	-172.6	175.8	-8.2	-98.6	-58.9	0	0	0	106.8
1977	P	31	Very low	31.3	Very low	104 Å²	104	116.9 Å²	116.9	68%	0.675	73%	0.733	S	S	*	*			cis	-123.6	-142.6	-48.6	31.7	-10.5	0	0	0	109
1978	V	27.3	Very low	31.1	Very low	138 Å²	138	121.9 Å²	121.9	84%	0.836	74%	0.739	S	S	*	*			trans	72.1	131.4	166.7	-176.6	0	0	0	0	114.6
1979	S	28	Very low	30.8	Very low	100 Å²	100	122.8 Å²	122.8	70%	0.699	74%	0.738	S	S	*	*			cis	-172.8	155.9	-7.5	148.6	0	0	0	0	107.9
1980	S	28	Very low	30.6	Very low	80 Å²	80	124.4 Å²	124.4	56%	0.559	74%	0.738	S	S	*	*			cis	-173.8	167.4	-24.2	55.7	0	0	0	0	107.8
1981	N	27.9	Very low	30.6	Very low	144 Å²	144	124.1 Å²	124.1	77%	0.77	73%	0.734	S	S	*	*			trans	71.2	123	168.3	-47.7	-31.5	0	0	0	115.5
1982	S	34.5	Very low	30.4	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	74%	0.739	S	S	*	*			cis	69.9	153.7	29.4	-133.7	0	0	0	0	112.3
1983	P	31.8	Very low	30.7	Very low	84 Å²	84	129.8 Å²	129.8	55%	0.545	74%	0.74	S	S	.	*			cis	-143.4	161	20.5	43.2	-23.4	0	0	0	120.3
1984	V	29.7	Very low	31.3	Very low	120 Å²	120	123.8 Å²	123.8	73%	0.727	72%	0.722	S	S	*	*			trans	46.7	112.9	130.6	-177.6	0	0	0	0	121.5
1985	A	40	Very low	31.3	Very low	91 Å²	91	126.7 Å²	126.7	75%	0.752	72%	0.724	S	S	*	*				52	-177.6	120.2	0	0	0	0	0	120.2
1986	P	33.7	Very low	31.6	Very low	123 Å²	123	130.3 Å²	130.3	80%	0.799	73%	0.728	S	S	*	*			cis	-122	-171.6	18.4	43.8	-28.2	0	0	0	116.3
1987	S	35.5	Very low	31.7	Very low	95 Å²	95	126.3 Å²	126.3	66%	0.664	71%	0.712	S	S	*	*			trans	-86	164.4	176	-168	0	0	0	0	113.3
1988	Y	30.6	Very low	32.1	Very low	217 Å²	217	126 Å²	126	85%	0.851	71%	0.71	S	S	*	*			trans	-159.3	151.9	141	-99.3	-64	0	0	0	111.1
1989	D	31.1	Very low	32.5	Very low	131 Å²	131	125 Å²	125	70%	0.701	71%	0.705	S	S	*	*			trans	-84.5	167.2	-170.3	-44.4	-95.6	0	0	0	114.5
1990	I	29.6	Very low	33.1	Very low	159 Å²	159	128.3 Å²	128.3	82%	0.815	71%	0.709	S	S	*	*				178.7	133.7	112.5	-88.5	157.3	0	0	0	112
1991	E	28.1	Very low	33.7	Very low	141 Å²	141	131.3 Å²	131.3	66%	0.659	72%	0.718	S	S	*	*			trans	-23	148.1	161.6	-48.3	169.2	146.2	0	0	117.1
1992	K	30.3	Very low	34.2	Very low	184 Å²	184	129.8 Å²	129.8	80%	0.8	72%	0.719	S	S	*	*				-169	163.4	65.8	-127.9	116.1	-171.6	162.4	0	114.3
1993	N	34.2	Very low	34.4	Very low	150 Å²	150	127.7 Å²	127.7	80%	0.802	71%	0.713	S	S	*	*			trans	-97.8	-171	178.1	-134.1	9.7	0	0	0	110.4
1994	P	39.9	Very low	35.1	Very low	78 Å²	78	126.6 Å²	126.6	51%	0.506	71%	0.708	S	S	.	*			cis	-144.1	-171.6	-9.3	38.4	-16.4	0	0	0	117.4
1995	E	28.1	Very low	36.1	Very low	169 Å²	169	124.8 Å²	124.8	79%	0.79	69%	0.694	S	S	*	*			trans	93.1	146.7	134.6	-89.1	141.7	-126.4	0	0	125.8
1996	D	33.2	Very low	36.8	Very low	142 Å²	142	127.3 Å²	127.3	76%	0.759	69%	0.69	S	S	*	*			trans	81.7	73.9	161.6	-66.2	-13.2	0	0	0	125
1997	N	32.7	Very low	38.1	Very low	99 Å²	99	127.2 Å²	127.2	53%	0.529	67%	0.674	S	S	.	*				29.2	156.4	110.1	-89.9	-67.3	0	0	0	122.3
1998	P	40.4	Very low	39.3	Very low	97 Å²	97	128.9 Å²	128.9	63%	0.63	67%	0.67	S	S	*	*				-147	-177.1	-50	37.6	-15.5	0	0	0	117.1
1999	T	36.4	Very low	41.3	Very low	119 Å²	119	122.8 Å²	122.8	73%	0.73	65%	0.651	S	S	*	*			trans	40.4	124.2	146.5	51.8	0	0	0	0	124.5
2000	H	39.2	Very low	43.2	Very low	168 Å²	168	122 Å²	122	78%	0.778	64%	0.643	S	S	*	*				171.5	141	119.8	-106.2	-122.6	0	0	0	109.2
2001	L	40.4	Very low	45.2	Very low	144 Å²	144	119.7 Å²	119.7	75%	0.754	62%	0.624	S	S	*	*			cis	-155.2	125.1	-11.4	-138.2	-173.8	0	0	0	107.1
2002	S	39.6	Very low	47.5	Very low	112 Å²	112	117.6 Å²	117.6	78%	0.783	62%	0.618	S	S	*	*			trans	-94.8	141.8	179	-70.1	0	0	0	0	112	S2004	S2002-S2004 PolarHBondContact O-N 3.42Å
2003	G	39	Very low	49.7	Very low	58 Å²	58	111.8 Å²	111.8	60%	0.598	60%	0.595	S	S	*	*			trans	-67.7	103.1	177.9	0	0	0	0	0	112.1
2004	S	46.4	Very low	51.7	Low	62 Å²	62	109 Å²	109	43%	0.434	58%	0.577	S	S	.	*			trans	-56.4	146.2	173	179.2	0	0	0	0	111.1	S2002 E2006 Y2007 F2008	S2002-S2004 PolarHBondContact O-N 3.42Å; S2004-E2006 PolarHBondContact O-N 3.18Å; S2004-E2006 VanDerWaalsContact O-N 3.12Å; S2004-E2006 VanDerWaalsContact OG-CB 3.25Å; S2004-E2006 WeakPolarHBondContact OG-CB 3.31Å; S2004-E2006 PolarHBondContact OG-N 3.28Å; S2004-Y2007 WeakPolarHBondContact O-CB 3.12Å; S2004-Y2007 PolarHBondContact O-N 3.17Å; S2004-F2008 PolarHBondContact O-N 3.15Å
2005	L	49	Very low	53.4	Low	82 Å²	82	108.8 Å²	108.8	43%	0.429	57%	0.571	S	S	.	*	H	α-helix	trans	-53.3	-29.4	166.1	178.2	61.6	0	0	0	111.1	F2008 I2009	L2005-F2008 PolarHBondContact O-N 2.9Å; L2005-I2009 HydrophobicContact CD1-CD1 4.48Å; L2005-I2009 HydrophobicContact CD2-CD1 4.5Å; L2005-I2009 HydrophobicContact CG-CD1 3.97Å; L2005-I2009 HydrophobicContact CG-CG1 4.47Å; L2005-I2009 WeakPolarHBondContact O-CG1 3.13Å; L2005-I2009 PolarHBondContact O-N 3.35Å
2006	E	56.6	Low	55.5	Low	143 Å²	143	106.3 Å²	106.3	67%	0.668	56%	0.555	S	S	*	*	H	α-helix	trans	-66.4	-32.7	174.3	-158.4	161.5	-143.2	0	0	112.6	S2004 I2009 Q2010	S2004-E2006 PolarHBondContact O-N 3.18Å; S2004-E2006 VanDerWaalsContact O-N 3.12Å; S2004-E2006 VanDerWaalsContact OG-CB 3.25Å; S2004-E2006 WeakPolarHBondContact OG-CB 3.31Å; S2004-E2006 PolarHBondContact OG-N 3.28Å; E2006-I2009 PolarHBondContact O-N 3.23Å; E2006-Q2010 WeakPolarHBondContact O-CB 3.46Å; E2006-Q2010 PolarHBondContact O-N 3.42Å
2007	Y	60.4	Low	57.6	Low	122 Å²	122	103.6 Å²	103.6	48%	0.478	54%	0.543	S	S	.	.	H	α-helix	trans	-66.4	-38.9	169.9	178.6	-96.9	0	0	0	111.3	S2004 R2011	S2004-Y2007 WeakPolarHBondContact O-CB 3.12Å; S2004-Y2007 PolarHBondContact O-N 3.17Å; Y2007-R2011 WeakPolarHBondContact O-CB 3.28Å; Y2007-R2011 PolarHBondContact O-N 3.27Å; Y2007-R2011 PolarHBondContact OH-NE 3.24Å
2008	F	61.2	Low	59.8	Low	129 Å²	129	105.6 Å²	105.6	57%	0.566	54%	0.543	S	S	*	.	H	α-helix	trans	-67.7	-42.1	175	-73.9	-79.9	0	0	0	112	S2004 L2005 R2011 D2012	S2004-F2008 PolarHBondContact O-N 3.15Å; L2005-F2008 PolarHBondContact O-N 2.9Å; F2008-R2011 PolarHBondContact O-N 2.97Å; F2008-D2012 WeakPolarHBondContact O-CB 3.24Å; F2008-D2012 PolarHBondContact O-N 2.91Å
2009	I	72.5	Confident	61.2	Low	90 Å²	90	106.2 Å²	106.2	46%	0.462	54%	0.538	S	S	.	.	H	α-helix	trans	-66	-44.3	175.2	-68.4	167.9	0	0	0	111	L2005 E2006 R2011 D2012 N2013	L2005-I2009 HydrophobicContact CD1-CD1 4.48Å; L2005-I2009 HydrophobicContact CD2-CD1 4.5Å; L2005-I2009 HydrophobicContact CG-CD1 3.97Å; L2005-I2009 HydrophobicContact CG-CG1 4.47Å; L2005-I2009 WeakPolarHBondContact O-CG1 3.13Å; L2005-I2009 PolarHBondContact O-N 3.35Å; E2006-I2009 PolarHBondContact O-N 3.23Å; I2009-R2011 VanDerWaalsContact C-N 3.28Å; I2009-R2011 PolarHBondContact O-N 2.93Å; I2009-D2012 PolarHBondContact O-N 2.87Å; I2009-N2013 VanDerWaalsContact O-CB 3.24Å; I2009-N2013 WeakPolarHBondContact O-CB 3.32Å; I2009-N2013 PolarHBondContact O-N 3.45Å; I2009-N2013 PolarHBondContact O-ND2 2.75Å
2010	Q	71	Confident	63.1	Low	114 Å²	114	106.2 Å²	106.2	53%	0.533	53%	0.529	S	S	.	.	H	α-helix	trans	-56.6	-45.3	173.7	-170.5	80.9	2.9	0	0	110.1	E2006 N2013 E2014	E2006-Q2010 WeakPolarHBondContact O-CB 3.46Å; E2006-Q2010 PolarHBondContact O-N 3.42Å; Q2010-N2013 CarbonylContact O-C 3.52Å; Q2010-N2013 PolarHBondContact O-N 2.76Å; Q2010-E2014 WeakPolarHBondContact O-CB 3.49Å; Q2010-E2014 VanDerWaalsContact O-CG 3.31Å; Q2010-E2014 WeakPolarHBondContact O-CG 3.49Å; Q2010-E2014 PolarHBondContact O-N 3.36Å
2011	R	71.2	Confident	64.7	Low	110 Å²	110	101.6 Å²	101.6	42%	0.415	51%	0.513	S	S	.	.	H	α-helix	trans	-76.6	-34	-176.5	-162.3	156.4	-162.9	75.3	-13.1	113.7	Y2007 F2008 I2009 N2013 E2014 I2015	Y2007-R2011 WeakPolarHBondContact O-CB 3.28Å; Y2007-R2011 PolarHBondContact O-N 3.27Å; Y2007-R2011 PolarHBondContact OH-NE 3.24Å; F2008-R2011 PolarHBondContact O-N 2.97Å; I2009-R2011 VanDerWaalsContact C-N 3.28Å; I2009-R2011 PolarHBondContact O-N 2.93Å; R2011-N2013 VanDerWaalsContact C-N 3.34Å; R2011-E2014 IonicContact NH1-OE2 2.84Å; R2011-E2014 PolarHBondContact NH1-OE2 3.49Å; R2011-E2014 PolarHBondContact O-N 2.88Å; R2011-I2015 HydrophobicContact CG-CD1 4.27Å; R2011-I2015 VanDerWaalsContact O-CB 3.31Å; R2011-I2015 WeakPolarHBondContact O-CB 3.1Å; R2011-I2015 WeakPolarHBondContact O-CD1 3.03Å; R2011-I2015 WeakPolarHBondContact O-CG1 3.42Å; R2011-I2015 PolarHBondContact O-N 2.81Å
2012	D	76.5	Confident	65.9	Low	98 Å²	98	102 Å²	102	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-67.3	-36.5	169	-103.3	22.4	0	0	0	111.1	F2008 I2009 I2015 R2016	F2008-D2012 WeakPolarHBondContact O-CB 3.24Å; F2008-D2012 PolarHBondContact O-N 2.91Å; I2009-D2012 PolarHBondContact O-N 2.87Å; D2012-I2015 PolarHBondContact O-N 3.41Å; D2012-R2016 VanDerWaalsContact O-CB 3.27Å; D2012-R2016 WeakPolarHBondContact O-CB 3.39Å; D2012-R2016 PolarHBondContact O-N 2.78Å
2013	N	75.6	Confident	66.9	Low	62 Å²	62	100.4 Å²	100.4	33%	0.332	49%	0.493	S	S	.	.	H	α-helix	trans	-69.6	-41.8	172.8	-70	-18.8	0	0	0	111.4	I2009 Q2010 R2011 I2015 R2016 V2017	I2009-N2013 VanDerWaalsContact O-CB 3.24Å; I2009-N2013 WeakPolarHBondContact O-CB 3.32Å; I2009-N2013 PolarHBondContact O-N 3.45Å; I2009-N2013 PolarHBondContact O-ND2 2.75Å; Q2010-N2013 CarbonylContact O-C 3.52Å; Q2010-N2013 PolarHBondContact O-N 2.76Å; R2011-N2013 VanDerWaalsContact C-N 3.34Å; N2013-I2015 VanDerWaalsContact C-N 3.34Å; N2013-I2015 PolarHBondContact O-N 3.32Å; N2013-R2016 PolarHBondContact O-N 3.27Å; N2013-R2016 PolarHBondContact OD1-NH1 3.46Å; N2013-R2016 PolarHBondContact OD1-NH2 2.86Å; N2013-V2017 WeakPolarHBondContact O-CB 3.25Å; N2013-V2017 VanDerWaalsContact O-CG2 3.28Å; N2013-V2017 WeakPolarHBondContact O-CG2 3.3Å; N2013-V2017 PolarHBondContact O-N 3.18Å
2014	E	77	Confident	67.6	Low	90 Å²	90	104.9 Å²	104.9	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-57.9	-45.5	170.7	-78	170.9	-179.7	0	0	111	Q2010 R2011 W2018	Q2010-E2014 WeakPolarHBondContact O-CB 3.49Å; Q2010-E2014 VanDerWaalsContact O-CG 3.31Å; Q2010-E2014 WeakPolarHBondContact O-CG 3.49Å; Q2010-E2014 PolarHBondContact O-N 3.36Å; R2011-E2014 IonicContact NH1-OE2 2.84Å; R2011-E2014 PolarHBondContact NH1-OE2 3.49Å; R2011-E2014 PolarHBondContact O-N 2.88Å; E2014-W2018 WeakPolarHBondContact O-CB 3.36Å; E2014-W2018 PolarHBondContact O-N 3.35Å
2015	I	74.7	Confident	68	Low	75 Å²	75	106 Å²	106	39%	0.385	49%	0.492	S	S	.	.	H	α-helix	trans	-65.4	-41.4	177.6	-72.6	164.4	0	0	0	110.6	R2011 D2012 N2013 W2018 Q2019	R2011-I2015 HydrophobicContact CG-CD1 4.27Å; R2011-I2015 VanDerWaalsContact O-CB 3.31Å; R2011-I2015 WeakPolarHBondContact O-CB 3.1Å; R2011-I2015 WeakPolarHBondContact O-CD1 3.03Å; R2011-I2015 WeakPolarHBondContact O-CG1 3.42Å; R2011-I2015 PolarHBondContact O-N 2.81Å; D2012-I2015 PolarHBondContact O-N 3.41Å; N2013-I2015 VanDerWaalsContact C-N 3.34Å; N2013-I2015 PolarHBondContact O-N 3.32Å; I2015-W2018 PolarHBondContact O-N 3.16Å; I2015-Q2019 HydrophobicContact CG2-CG 4.42Å; I2015-Q2019 VanDerWaalsContact CG2-NE2 3.33Å; I2015-Q2019 WeakPolarHBondContact O-CB 3.33Å; I2015-Q2019 VanDerWaalsContact O-CG 3.24Å; I2015-Q2019 WeakPolarHBondContact O-CG 3.25Å; I2015-Q2019 PolarHBondContact O-N 2.82Å
2016	R	73.5	Confident	68.1	Low	116 Å²	116	108.3 Å²	108.3	44%	0.438	50%	0.495	S	S	.	.	H	α-helix	trans	-66.6	-48.3	177.8	-158	-179.7	-50.3	114.3	14.9	111.2	D2012 N2013 W2018 Q2019 E2020	D2012-R2016 VanDerWaalsContact O-CB 3.27Å; D2012-R2016 WeakPolarHBondContact O-CB 3.39Å; D2012-R2016 PolarHBondContact O-N 2.78Å; N2013-R2016 PolarHBondContact O-N 3.27Å; N2013-R2016 PolarHBondContact OD1-NH1 3.46Å; N2013-R2016 PolarHBondContact OD1-NH2 2.86Å; R2016-W2018 VanDerWaalsContact C-N 3.3Å; R2016-W2018 PolarHBondContact O-N 2.96Å; R2016-Q2019 PolarHBondContact O-N 3.12Å; R2016-E2020 WeakPolarHBondContact O-CB 3.41Å; R2016-E2020 WeakPolarHBondContact O-CG 3.25Å; R2016-E2020 PolarHBondContact O-N 2.81Å
2017	V	76.4	Confident	67.8	Low	86 Å²	86	107.3 Å²	107.3	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-60.7	-37.9	173.7	170.2	0	0	0	0	111.3	N2013 T2021	N2013-V2017 WeakPolarHBondContact O-CB 3.25Å; N2013-V2017 VanDerWaalsContact O-CG2 3.28Å; N2013-V2017 WeakPolarHBondContact O-CG2 3.3Å; N2013-V2017 PolarHBondContact O-N 3.18Å; V2017-T2021 WeakPolarHBondContact O-CB 3.24Å; V2017-T2021 PolarHBondContact O-N 2.69Å; V2017-T2021 PolarHBondContact O-OG1 2.75Å
2018	W	80	Confident	67.3	Low	141 Å²	141	107.9 Å²	107.9	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-71.6	-35.7	176.3	-177.4	94.2	0	0	0	112.7	E2014 I2015 R2016 R2022	E2014-W2018 WeakPolarHBondContact O-CB 3.36Å; E2014-W2018 PolarHBondContact O-N 3.35Å; I2015-W2018 PolarHBondContact O-N 3.16Å; R2016-W2018 VanDerWaalsContact C-N 3.3Å; R2016-W2018 PolarHBondContact O-N 2.96Å; W2018-R2022 VanDerWaalsContact O-CB 3.3Å; W2018-R2022 WeakPolarHBondContact O-CB 3.18Å; W2018-R2022 PolarHBondContact O-N 2.88Å
2019	Q	69.6	Low	66.8	Low	110 Å²	110	110.7 Å²	110.7	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-69.6	-41.2	172.7	-76.1	178.9	22.8	0	0	111.9	I2015 R2016 R2022 S2023	I2015-Q2019 HydrophobicContact CG2-CG 4.42Å; I2015-Q2019 VanDerWaalsContact CG2-NE2 3.33Å; I2015-Q2019 WeakPolarHBondContact O-CB 3.33Å; I2015-Q2019 VanDerWaalsContact O-CG 3.24Å; I2015-Q2019 WeakPolarHBondContact O-CG 3.25Å; I2015-Q2019 PolarHBondContact O-N 2.82Å; R2016-Q2019 PolarHBondContact O-N 3.12Å; Q2019-R2022 PolarHBondContact O-N 2.71Å; Q2019-S2023 VanDerWaalsContact O-CB 3.3Å; Q2019-S2023 WeakPolarHBondContact O-CB 3.09Å; Q2019-S2023 PolarHBondContact O-N 3.37Å; Q2019-S2023 PolarHBondContact O-OG 3.41Å
2020	E	75.9	Confident	65.4	Low	118 Å²	118	111 Å²	111	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-64.6	-46.1	172.9	-74.5	171.2	-171.3	0	0	110.4	R2016 R2022 S2023 Y2024	R2016-E2020 WeakPolarHBondContact O-CB 3.41Å; R2016-E2020 WeakPolarHBondContact O-CG 3.25Å; R2016-E2020 PolarHBondContact O-N 2.81Å; E2020-R2022 PolarHBondContact O-N 3.12Å; E2020-S2023 PolarHBondContact O-N 3.06Å; E2020-Y2024 VanDerWaalsContact O-CB 3.26Å; E2020-Y2024 WeakPolarHBondContact O-CB 3.46Å; E2020-Y2024 PolarHBondContact O-N 3.06Å
2021	T	72.1	Confident	63.8	Low	71 Å²	71	110.3 Å²	110.3	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-40.8	175.4	-58.4	0	0	0	0	111.6	V2017 E2025	V2017-T2021 WeakPolarHBondContact O-CB 3.24Å; V2017-T2021 PolarHBondContact O-N 2.69Å; V2017-T2021 PolarHBondContact O-OG1 2.75Å; T2021-E2025 VanDerWaalsContact O-CB 3.29Å; T2021-E2025 WeakPolarHBondContact O-CB 3.32Å; T2021-E2025 PolarHBondContact O-N 2.92Å
2022	R	66.4	Low	61.9	Low	154 Å²	154	109.3 Å²	109.3	58%	0.581	52%	0.518	S	S	*	.	H	α-helix	trans	-71.3	-31.6	174.4	-90.2	-170.3	164	-167.4	-0.8	113.6	W2018 Q2019 E2020 R2026	W2018-R2022 VanDerWaalsContact O-CB 3.3Å; W2018-R2022 WeakPolarHBondContact O-CB 3.18Å; W2018-R2022 PolarHBondContact O-N 2.88Å; Q2019-R2022 PolarHBondContact O-N 2.71Å; E2020-R2022 PolarHBondContact O-N 3.12Å; R2022-R2026 VanDerWaalsContact O-CB 3.23Å; R2022-R2026 WeakPolarHBondContact O-CB 3.2Å; R2022-R2026 PolarHBondContact O-N 2.96Å
2023	S	59.1	Low	59.9	Low	77 Å²	77	110.4 Å²	110.4	54%	0.538	53%	0.53	S	S	.	.	H	α-helix	trans	-69.8	-45.8	173	-63.8	0	0	0	0	110.3	Q2019 E2020 R2026 E2027	Q2019-S2023 VanDerWaalsContact O-CB 3.3Å; Q2019-S2023 WeakPolarHBondContact O-CB 3.09Å; Q2019-S2023 PolarHBondContact O-N 3.37Å; Q2019-S2023 PolarHBondContact O-OG 3.41Å; E2020-S2023 PolarHBondContact O-N 3.06Å; S2023-R2026 PolarHBondContact O-N 3.26Å; S2023-E2027 VanDerWaalsContact O-CB 3.29Å; S2023-E2027 WeakPolarHBondContact O-CB 3.37Å; S2023-E2027 PolarHBondContact O-N 3.27Å
2024	Y	54.6	Low	57.9	Low	152 Å²	152	119.5 Å²	119.5	60%	0.596	56%	0.56	S	S	*	*	H	α-helix	trans	-65.1	-38.6	176.1	-160.7	-100.7	0	0	0	111.8	E2020 E2027 K2028	E2020-Y2024 VanDerWaalsContact O-CB 3.26Å; E2020-Y2024 WeakPolarHBondContact O-CB 3.46Å; E2020-Y2024 PolarHBondContact O-N 3.06Å; Y2024-E2027 PolarHBondContact O-N 3.48Å; Y2024-K2028 HydrophobicContact CE1-CD 4.29Å; Y2024-K2028 WeakPolarHBondContact O-CB 3.09Å; Y2024-K2028 PolarHBondContact O-N 2.92Å
2025	E	55.1	Low	55.8	Low	87 Å²	87	123.8 Å²	123.8	41%	0.407	58%	0.58	S	S	.	*	H	α-helix	trans	-65.1	-43.8	169.6	-90.7	-157.2	-153.9	0	0	112.4	T2021 E2027 K2028 R2029	T2021-E2025 VanDerWaalsContact O-CB 3.29Å; T2021-E2025 WeakPolarHBondContact O-CB 3.32Å; T2021-E2025 PolarHBondContact O-N 2.92Å; E2025-E2027 VanDerWaalsContact C-N 3.31Å; E2025-E2027 PolarHBondContact O-N 3.21Å; E2025-K2028 PolarHBondContact O-N 2.71Å; E2025-R2029 WeakPolarHBondContact O-CB 3.32Å; E2025-R2029 WeakPolarHBondContact O-CD 3.33Å; E2025-R2029 WeakPolarHBondContact O-CG 3.25Å; E2025-R2029 PolarHBondContact O-N 3.48Å; E2025-R2029 IonicContact OE2-CZ 3.73Å; E2025-R2029 VanDerWaalsContact OE2-CZ 3.27Å; E2025-R2029 IonicContact OE2-NE 3.82Å; E2025-R2029 PolarHBondContact OE2-NE 2.87Å; E2025-R2029 VanDerWaalsContact OE2-NE 3.1Å; E2025-R2029 IonicContact OE2-NH2 2.76Å; E2025-R2029 PolarHBondContact OE2-NH2 2.87Å
2026	R	50.6	Low	53.7	Low	130 Å²	130	129.1 Å²	129.1	49%	0.491	60%	0.603	S	S	.	*	H	α-helix	trans	-62.1	-41.6	176.6	178.4	179.5	-74.3	-168.5	-3.4	110.8	R2022 S2023 N2030	R2022-R2026 VanDerWaalsContact O-CB 3.23Å; R2022-R2026 WeakPolarHBondContact O-CB 3.2Å; R2022-R2026 PolarHBondContact O-N 2.96Å; S2023-R2026 PolarHBondContact O-N 3.26Å; R2026-N2030 VanDerWaalsContact O-CB 3.3Å; R2026-N2030 WeakPolarHBondContact O-CB 3.25Å; R2026-N2030 VanDerWaalsContact O-CG 3.27Å; R2026-N2030 PolarHBondContact O-N 3.35Å
2027	E	50	Low	51.6	Low	122 Å²	122	135 Å²	135	57%	0.57	63%	0.625	S	S	*	*	H	α-helix	trans	-67.7	-46.6	177.8	-166.4	157.8	-128.8	0	0	110.8	S2023 Y2024 E2025 R2029 N2030 T2031	S2023-E2027 VanDerWaalsContact O-CB 3.29Å; S2023-E2027 WeakPolarHBondContact O-CB 3.37Å; S2023-E2027 PolarHBondContact O-N 3.27Å; Y2024-E2027 PolarHBondContact O-N 3.48Å; E2025-E2027 VanDerWaalsContact C-N 3.31Å; E2025-E2027 PolarHBondContact O-N 3.21Å; E2027-R2029 PolarHBondContact O-N 3.03Å; E2027-N2030 CarbonylContact O-C 3.57Å; E2027-N2030 WeakPolarHBondContact O-CA 3.25Å; E2027-N2030 PolarHBondContact O-N 3.12Å; E2027-T2031 WeakPolarHBondContact O-CB 3.4Å; E2027-T2031 PolarHBondContact O-N 2.97Å; E2027-T2031 PolarHBondContact O-OG1 3.21Å
2028	K	51.3	Low	49.4	Very low	134 Å²	134	137.2 Å²	137.2	58%	0.583	64%	0.639	S	S	*	*	H	α-helix	trans	-64.9	-34.6	176.3	-166.4	171	-174.9	177.4	0	113.3	Y2024 E2025 N2030 S2032	Y2024-K2028 HydrophobicContact CE1-CD 4.29Å; Y2024-K2028 WeakPolarHBondContact O-CB 3.09Å; Y2024-K2028 PolarHBondContact O-N 2.92Å; E2025-K2028 PolarHBondContact O-N 2.71Å; K2028-N2030 VanDerWaalsContact C-N 3.32Å; K2028-S2032 PolarHBondContact O-OG 3.17Å; K2028-S2032 VanDerWaalsContact O-OG 3.12Å
2029	R	49.7	Very low	47.1	Very low	187 Å²	187	135.9 Å²	135.9	71%	0.706	65%	0.651	S	S	*	*	H	α-helix	trans	-69.8	-25.7	169.2	-70.8	166.2	-171.2	-120.9	7.9	112.6	E2025 E2027	E2025-R2029 WeakPolarHBondContact O-CB 3.32Å; E2025-R2029 WeakPolarHBondContact O-CD 3.33Å; E2025-R2029 WeakPolarHBondContact O-CG 3.25Å; E2025-R2029 PolarHBondContact O-N 3.48Å; E2025-R2029 IonicContact OE2-CZ 3.73Å; E2025-R2029 VanDerWaalsContact OE2-CZ 3.27Å; E2025-R2029 IonicContact OE2-NE 3.82Å; E2025-R2029 PolarHBondContact OE2-NE 2.87Å; E2025-R2029 VanDerWaalsContact OE2-NE 3.1Å; E2025-R2029 IonicContact OE2-NH2 2.76Å; E2025-R2029 PolarHBondContact OE2-NH2 2.87Å; E2027-R2029 PolarHBondContact O-N 3.03Å
2030	N	42.8	Very low	45.3	Very low	96 Å²	96	135.4 Å²	135.4	51%	0.513	66%	0.66	S	S	.	*	H	α-helix	trans	-95.5	-8.4	175.8	-75	-9.6	0	0	0	113.7	R2026 E2027 K2028	R2026-N2030 VanDerWaalsContact O-CB 3.3Å; R2026-N2030 WeakPolarHBondContact O-CB 3.25Å; R2026-N2030 VanDerWaalsContact O-CG 3.27Å; R2026-N2030 PolarHBondContact O-N 3.35Å; E2027-N2030 CarbonylContact O-C 3.57Å; E2027-N2030 WeakPolarHBondContact O-CA 3.25Å; E2027-N2030 PolarHBondContact O-N 3.12Å; K2028-N2030 VanDerWaalsContact C-N 3.32Å
2031	T	38	Very low	42.9	Very low	100 Å²	100	138 Å²	138	61%	0.613	67%	0.672	S	S	*	*	S	Bend	trans	-135.9	56.9	-173	59.2	0	0	0	0	113.6	E2027	E2027-T2031 WeakPolarHBondContact O-CB 3.4Å; E2027-T2031 PolarHBondContact O-N 2.97Å; E2027-T2031 PolarHBondContact O-OG1 3.21Å
2032	S	30.1	Very low	40.9	Very low	89 Å²	89	138.5 Å²	138.5	62%	0.622	68%	0.676	S	S	*	*			trans	-143.6	148.5	162.3	42.6	0	0	0	0	111.7	K2028	K2028-S2032 PolarHBondContact O-OG 3.17Å; K2028-S2032 VanDerWaalsContact O-OG 3.12Å
2033	P	36.2	Very low	39.1	Very low	121 Å²	121	140 Å²	140	79%	0.786	68%	0.683	S	S	*	*			trans	-116.9	147.8	-141.1	37.9	-27.1	0	0	0	116
2034	W	33.1	Very low	37.9	Very low	254 Å²	254	141.6 Å²	141.6	96%	0.962	69%	0.685	S	S	*	*			trans	-96.5	118	168.5	-80.2	80.7	0	0	0	111.5
2035	H	32.1	Very low	36.8	Very low	180 Å²	180	136 Å²	136	83%	0.833	67%	0.665	S	S	*	*			trans	-152.1	106.6	171.7	-124.7	-102.5	0	0	0	111.4
2036	H	31.1	Very low	35.8	Very low	186 Å²	186	133.7 Å²	133.7	86%	0.861	66%	0.657	S	S	*	*			trans	166.5	124.3	149.3	-98.2	-70.3	0	0	0	111.3
2037	R	30.2	Very low	35	Very low	239 Å²	239	134.7 Å²	134.7	90%	0.902	67%	0.665	S	S	*	*				-178.5	141.8	103.6	-166.4	166	-69	-148.5	0.7	110.1
2038	V	30.3	Very low	34.3	Very low	134 Å²	134	130.4 Å²	130.4	81%	0.812	65%	0.645	S	S	*	*			trans	-80.4	141.1	-178.3	176.7	0	0	0	0	110.9
2039	S	30.8	Very low	33.4	Very low	113 Å²	113	131 Å²	131	79%	0.79	65%	0.647	S	S	*	*			trans	-155.3	171	147.4	-150.4	0	0	0	0	113.8
2040	S	31.5	Very low	32.4	Very low	100 Å²	100	123.9 Å²	123.9	70%	0.699	63%	0.627	S	S	*	*			trans	-66.1	157.5	-165.7	53.2	0	0	0	0	117.4
2041	Q	25.3	Very low	31.6	Very low	173 Å²	173	123.6 Å²	123.6	81%	0.808	63%	0.631	S	S	*	*			trans	5	156	136.9	-70.9	-166	16.4	0	0	120.5
2042	P	30.9	Very low	30.9	Very low	81 Å²	81	124.7 Å²	124.7	53%	0.526	64%	0.638	S	S	.	*			cis	-143.3	175.9	-26	39.9	-22.6	0	0	0	114.6
2043	Y	28.6	Very low	30.6	Very low	184 Å²	184	127.1 Å²	127.1	72%	0.722	64%	0.643	S	S	*	*			trans	60	127.8	154.8	-50.8	-37.6	0	0	0	119.5
2044	L	32.9	Very low	30.1	Very low	111 Å²	111	126.2 Å²	126.2	58%	0.581	64%	0.639	S	S	*	*			cis	-170	-148.9	-19.6	-121.2	174.8	0	0	0	104.5	I1159	I1159-L2044 HydrophobicContact CD1-CB 4.48Å; I1159-L2044 HydrophobicContact CD1-CD1 4.47Å; I1159-L2044 HydrophobicContact CG2-CB 4.49Å
2045	N	31.9	Very low	29.7	Very low	34 Å²	34	122 Å²	122	18%	0.182	63%	0.627	C	S	.	*			cis	-147.1	137.2	3.4	-141.8	-21.6	0	0	0	116.1	R1155 I1159	R1155-N2045 VanDerWaalsContact C-ND2 3.34Å; R1155-N2045 WeakPolarHBondContact CD-OD1 3.11Å; R1155-N2045 PolarHBondContact O-ND2 2.65Å; I1159-N2045 HydrophobicContact CB-CB 4.33Å; I1159-N2045 WeakPolarHBondContact CD1-ND2 3.19Å
2046	T	35.1	Very low	29.6	Very low	39 Å²	39	121 Å²	121	24%	0.239	62%	0.622	C	S	.	*			trans	69.3	166.4	160.6	81.3	0	0	0	0	119.9	L1152 R1155 V1156	L1152-T2046 WeakPolarHBondContact CD2-OG1 3.46Å; R1155-T2046 HydrophobicContact CB-CG2 3.14Å; R1155-T2046 HydrophobicContact CG-CG2 4.25Å; V1156-T2046 HydrophobicContact CG2-CG2 3.94Å; V1156-T2046 WeakPolarHBondContact CG2-OG1 3.45Å
2047	K	32.8	Very low	29.6	Very low	152 Å²	152	117.9 Å²	117.9	66%	0.661	62%	0.619	S	S	*	*			cis	66	104.9	-45.3	-57.5	171.8	-175.8	177.1	0	121.7	R1155 F2049	R1155-K2047 PolarHBondContact NH1-O 3.06Å; K2047-F2049 HydrophobicContact CB-CB 4.21Å; K2047-F2049 HydrophobicContact CB-CD2 4.46Å; K2047-F2049 HydrophobicContact CG-CD2 4.14Å
2048	K	35.7	Very low	29.4	Very low	32 Å²	32	110.3 Å²	110.3	14%	0.139	60%	0.603	C	S	.	*				-132.5	129.4	112	-72.7	170.8	-168.6	149.3	0	106.1	E1148 R1151 L1152 R1155	E1148-K2048 CarbonylContact C-O 3.59Å; E1148-K2048 VanDerWaalsContact CB-O 3.3Å; E1148-K2048 WeakPolarHBondContact CB-O 3.36Å; R1151-K2048 HydrophobicContact CB-CB 4.48Å; R1151-K2048 HydrophobicContact CB-CD 3.31Å; R1151-K2048 HydrophobicContact CG-CD 4.41Å; R1151-K2048 WeakPolarHBondContact O-CD 3.5Å; R1151-K2048 WeakPolarHBondContact O-CE 3.17Å; R1151-K2048 PolarHBondContact O-NZ 2.86Å; L1152-K2048 HydrophobicContact CB-CB 4.38Å; L1152-K2048 WeakPolarHBondContact CD1-O 3.27Å; R1155-K2048 VanDerWaalsContact CD-CE 3.5Å
2049	F	33.2	Very low	29.5	Very low	145 Å²	145	112.8 Å²	112.8	64%	0.636	60%	0.603	S	S	*	*			cis	54.4	79	1.8	-74.2	-86.6	0	0	0	114.8	E1148 K2047	E1148-F2049 VanDerWaalsContact CD-CA 3.47Å; E1148-F2049 VanDerWaalsContact OE1-CA 3.3Å; E1148-F2049 WeakPolarHBondContact OE1-CA 3.22Å; E1148-F2049 PolarHBondContact OE1-N 2.84Å; E1148-F2049 WeakPolarHBondContact OE2-CA 3.48Å; E1148-F2049 PolarHBondContact OE2-N 2.76Å; K2047-F2049 HydrophobicContact CB-CB 4.21Å; K2047-F2049 HydrophobicContact CB-CD2 4.46Å; K2047-F2049 HydrophobicContact CG-CD2 4.14Å
2050	S	28.3	Very low	29.6	Very low	39 Å²	39	117.4 Å²	117.4	27%	0.273	60%	0.604	S	S	.	*			trans	-125.7	79.4	154.7	54	0	0	0	0	106.3	E1148 R1151	E1148-S2050 PolarHBondContact OE1-N 3.31Å; R1151-S2050 PolarHBondContact NH1-OG 2.89Å
2051	C	24.9	Very low	29.5	Very low	89 Å²	89	117.1 Å²	117.1	60%	0.601	60%	0.602	S	S	*	*				53.5	105.8	56.1	-158.1	0	0	0	0	110.6
2052	T	24.5	Very low	30	Very low	124 Å²	124	117.3 Å²	117.3	76%	0.761	60%	0.6	S	S	*	*			trans	64.4	170.9	151.6	59.8	0	0	0	0	120.7
2053	I	24.2	Very low	30.2	Very low	140 Å²	140	119.9 Å²	119.9	72%	0.718	61%	0.61	S	S	*	*			trans	86.6	76.8	165.4	-47.9	-174.9	0	0	0	116.9
2054	S	24.3	Very low	30.4	Very low	101 Å²	101	116.3 Å²	116.3	71%	0.706	60%	0.603	S	S	*	*				77.7	169.2	106.8	-159.6	0	0	0	0	120.5
2055	K	26.1	Very low	30.3	Very low	165 Å²	165	119.4 Å²	119.4	72%	0.717	62%	0.615	S	S	*	*			trans	74.8	100.4	165.7	-68.5	140.1	-173.4	-175	0	117.8
2056	H	29.8	Very low	30.4	Very low	159 Å²	159	121.4 Å²	121.4	74%	0.736	64%	0.643	S	S	*	*				32.5	136.2	114.4	-68.1	-62.3	0	0	0	118.5
2057	P	29.9	Very low	30	Very low	122 Å²	122	126.6 Å²	126.6	79%	0.792	66%	0.663	S	S	*	*				-111.7	133.3	68.9	34	-33.8	0	0	0	112.9
2058	S	26.2	Very low	30	Very low	80 Å²	80	129.4 Å²	129.4	56%	0.559	68%	0.675	S	S	*	*			cis	70.8	108.4	43.8	82.9	0	0	0	0	114.5
2059	K	31.7	Very low	29.8	Very low	186 Å²	186	135.9 Å²	135.9	81%	0.809	70%	0.704	S	S	*	*			trans	158.8	109.3	146.9	-89	176.4	-178.2	-174.9	0	106.3
2060	Y	33.2	Very low	29.5	Very low	209 Å²	209	139.6 Å²	139.6	82%	0.82	72%	0.715	S	S	*	*			cis	-157.2	156.8	0.9	-103.9	-76.8	0	0	0	109.2
2061	S	30.9	Very low	29.9	Very low	94 Å²	94	142.6 Å²	142.6	66%	0.657	73%	0.734	S	S	*	*			trans	48.1	130.5	142.4	179.2	0	0	0	0	120.3
2062	K	35.7	Very low	29.9	Very low	177 Å²	177	145.9 Å²	145.9	77%	0.77	75%	0.745	S	S	*	*			cis	-168.9	157.8	6.6	-104.2	169.5	-171.3	178.5	0	108.3
2063	N	35	Very low	30.4	Very low	136 Å²	136	145.3 Å²	145.3	73%	0.727	74%	0.742	S	S	*	*			trans	38.5	144.7	141.5	-55.3	36.5	0	0	0	120.9
2064	N	33.2	Very low	30.6	Very low	109 Å²	109	144.4 Å²	144.4	58%	0.583	74%	0.742	S	S	*	*			cis	-156.7	155.6	-1.6	-120.8	40.7	0	0	0	111
2065	E	29.8	Very low	30.8	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	73%	0.728	S	S	*	*			trans	29.3	138.7	149.7	-67	166.8	-143.4	0	0	123.5
2066	G	33.1	Very low	31	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	72%	0.717	S	S	*	*			trans	167.4	94.6	169.6	0	0	0	0	0	112.8
2067	F	27.7	Very low	31.2	Very low	148 Å²	148	136.5 Å²	136.5	65%	0.649	71%	0.714	S	S	*	*			trans	-78.5	138	177.7	-89.9	-104.3	0	0	0	111.9	Y101	Y101-F2067 HydrophobicContact CD1-CZ 4.46Å; Y101-F2067 HydrophobicContact CE1-CE1 4.01Å; Y101-F2067 HydrophobicContact CE1-CE2 4.45Å; Y101-F2067 AromaticContact CE1-CZ 3.67Å; Y101-F2067 HydrophobicContact CE1-CZ 3.67Å
2068	F	32.1	Very low	31.3	Very low	210 Å²	210	138.7 Å²	138.7	92%	0.921	71%	0.711	S	S	*	*			trans	-142	137.6	154.3	-106.1	-81.2	0	0	0	111
2069	F	31.3	Very low	31.8	Very low	169 Å²	169	139 Å²	139	74%	0.741	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-80.9	146.9	-178.2	-80.2	-115.7	0	0	0	111.2
2070	Y	27.6	Very low	32.6	Very low	223 Å²	223	133.4 Å²	133.4	88%	0.875	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-74.7	132.2	152.1	-91.9	-95.8	0	0	0	108.2
2071	P	36	Very low	33.8	Very low	101 Å²	101	126.8 Å²	126.8	66%	0.656	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-76.2	139	171	30.9	-32.9	0	0	0	110.5	V2073	P2071-V2073 HydrophobicContact CG-CG2 4.32Å; P2071-V2073 PolarHBondContact O-N 3.34Å
2072	D	26.9	Very low	35.5	Very low	158 Å²	158	129 Å²	129	85%	0.845	67%	0.666	S	S	*	*			trans	-67.2	98.8	166.9	-77.2	-58.4	0	0	0	109.6	V2074	D2072-V2074 PolarHBondContact O-N 2.94Å
2073	V	33.4	Very low	37.1	Very low	113 Å²	113	124.3 Å²	124.3	69%	0.685	65%	0.648	S	S	*	*			trans	-77.9	80.3	179.7	-173.5	0	0	0	0	109.8	P2071 T2075	P2071-V2073 HydrophobicContact CG-CG2 4.32Å; P2071-V2073 PolarHBondContact O-N 3.34Å; V2073-T2075 HydrophobicContact CG1-CG2 4.28Å; V2073-T2075 PolarHBondContact O-N 3.09Å
2074	V	29.3	Very low	38.7	Very low	121 Å²	121	121.4 Å²	121.4	73%	0.733	64%	0.635	S	S	*	*			trans	-52.2	110.2	169	176.7	0	0	0	0	109	D2072	D2072-V2074 PolarHBondContact O-N 2.94Å
2075	T	29	Very low	40.8	Very low	66 Å²	66	121.3 Å²	121.3	41%	0.405	63%	0.634	S	S	.	*			trans	-115.2	51.2	169.7	43.1	0	0	0	0	109.5	K571 V2073	K571-T2075 WeakPolarHBondContact CE-O 3.22Å; K571-T2075 PolarHBondContact NZ-O 3.27Å; V2073-T2075 HydrophobicContact CG1-CG2 4.28Å; V2073-T2075 PolarHBondContact O-N 3.09Å
2076	G	29	Very low	43.1	Very low	47 Å²	47	114 Å²	114	49%	0.485	60%	0.6	S	S	.	*	S	Bend	trans	-69	169.7	149.9	0	0	0	0	0	109.7
2077	H	33.5	Very low	44.9	Very low	146 Å²	146	117.3 Å²	117.3	68%	0.676	59%	0.589	S	S	*	*			trans	-56.7	139.9	177.5	-70.5	85.1	0	0	0	111.2	D2079	H2077-D2079 HydrophobicContact CB-CB 4.42Å; H2077-D2079 IonicContact CD2-OD2 3.33Å; H2077-D2079 IonicContact CG-OD2 3.24Å; H2077-D2079 PolarHBondContact O-N 2.95Å
2078	F	33.1	Very low	47.3	Very low	168 Å²	168	114.4 Å²	114.4	74%	0.737	58%	0.579	S	S	*	*	S	Bend	trans	-74.8	-8.8	176.2	-105.2	-84.1	0	0	0	112.9	N2080 V2081	F2078-N2080 PolarHBondContact O-N 2.86Å; F2078-V2081 HydrophobicContact CD1-CG2 3.72Å; F2078-V2081 HydrophobicContact CE1-CG2 4.04Å; F2078-V2081 PolarHBondContact O-N 2.81Å
2079	D	36.1	Very low	49.7	Very low	85 Å²	85	112.8 Å²	112.8	46%	0.455	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.7	18.6	-179.5	-30.8	-27.2	0	0	0	113.3	N706 H2077	N706-D2079 VanDerWaalsContact ND2-CG 3.25Å; N706-D2079 PolarHBondContact ND2-OD2 2.76Å; N706-D2079 VanDerWaalsContact ND2-OD2 3.16Å; H2077-D2079 HydrophobicContact CB-CB 4.42Å; H2077-D2079 IonicContact CD2-OD2 3.33Å; H2077-D2079 IonicContact CG-OD2 3.24Å; H2077-D2079 PolarHBondContact O-N 2.95Å
2080	N	49.8	Very low	52.1	Low	69 Å²	69	107.6 Å²	107.6	37%	0.369	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.9	17.2	-175.7	-103	-46.6	0	0	0	114.1	F2078 E2082 Q2083 T2084	F2078-N2080 PolarHBondContact O-N 2.86Å; N2080-E2082 VanDerWaalsContact C-N 3.27Å; N2080-E2082 PolarHBondContact O-N 2.84Å; N2080-Q2083 VanDerWaalsContact OD1-CB 3.24Å; N2080-Q2083 WeakPolarHBondContact OD1-CB 3.08Å; N2080-Q2083 WeakPolarHBondContact OD1-CG 3.45Å; N2080-Q2083 PolarHBondContact OD1-OE1 2.86Å; N2080-T2084 WeakPolarHBondContact O-CB 3.49Å; N2080-T2084 PolarHBondContact O-N 3.11Å; N2080-T2084 PolarHBondContact O-OG1 3.45Å
2081	V	57	Low	54.5	Low	71 Å²	71	99.9 Å²	99.9	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-61.8	-39.7	171.2	177.9	0	0	0	0	110.5	F2078 T2084 L2085	F2078-V2081 HydrophobicContact CD1-CG2 3.72Å; F2078-V2081 HydrophobicContact CE1-CG2 4.04Å; F2078-V2081 PolarHBondContact O-N 2.81Å; V2081-T2084 PolarHBondContact O-N 2.61Å; V2081-L2085 HydrophobicContact CG1-CD1 4Å; V2081-L2085 HydrophobicContact CG1-CG 4.39Å; V2081-L2085 WeakPolarHBondContact O-CB 3.13Å; V2081-L2085 WeakPolarHBondContact O-CG 3.36Å; V2081-L2085 PolarHBondContact O-N 2.71Å
2082	E	67.9	Low	56.6	Low	139 Å²	139	99.5 Å²	99.5	65%	0.65	52%	0.518	S	S	*	.	H	α-helix	trans	-65.1	-51.1	178.8	-163.3	125.5	-137.4	0	0	111.9	N2080 T2084 L2085 L2086	N2080-E2082 VanDerWaalsContact C-N 3.27Å; N2080-E2082 PolarHBondContact O-N 2.84Å; E2082-T2084 PolarHBondContact O-N 2.95Å; E2082-L2085 CarbonylContact O-C 2.8Å; E2082-L2085 PolarHBondContact O-N 3.15Å; E2082-L2085 VanDerWaalsContact O-N 3.12Å; E2082-L2086 HydrophobicContact CG-CD1 4.43Å; E2082-L2086 WeakPolarHBondContact O-CG 3.4Å; E2082-L2086 PolarHBondContact O-N 3.02Å
2083	Q	67.9	Low	59.1	Low	80 Å²	80	96.2 Å²	96.2	37%	0.374	50%	0.497	S	S	.	.	H	α-helix	trans	-61.8	-29.6	172.8	-64.6	-164.4	11.2	0	0	113.3	N2080 R2087	N2080-Q2083 VanDerWaalsContact OD1-CB 3.24Å; N2080-Q2083 WeakPolarHBondContact OD1-CB 3.08Å; N2080-Q2083 WeakPolarHBondContact OD1-CG 3.45Å; N2080-Q2083 PolarHBondContact OD1-OE1 2.86Å; Q2083-R2087 WeakPolarHBondContact O-CB 3.35Å; Q2083-R2087 VanDerWaalsContact O-CG 3.25Å; Q2083-R2087 WeakPolarHBondContact O-CG 3.37Å; Q2083-R2087 PolarHBondContact O-N 3.12Å
2084	T	69	Low	61.1	Low	75 Å²	75	92.6 Å²	92.6	46%	0.46	48%	0.479	S	S	.	.	H	α-helix	trans	-72.3	-38.6	175.5	-56.4	0	0	0	0	110.9	N2080 V2081 E2082 I2088	N2080-T2084 WeakPolarHBondContact O-CB 3.49Å; N2080-T2084 PolarHBondContact O-N 3.11Å; N2080-T2084 PolarHBondContact O-OG1 3.45Å; V2081-T2084 PolarHBondContact O-N 2.61Å; E2082-T2084 PolarHBondContact O-N 2.95Å; T2084-I2088 HydrophobicContact CG2-CD1 4Å; T2084-I2088 WeakPolarHBondContact O-CB 3.43Å; T2084-I2088 WeakPolarHBondContact O-CD1 3.31Å; T2084-I2088 WeakPolarHBondContact O-CG1 3.28Å; T2084-I2088 PolarHBondContact O-N 2.78Å
2085	L	77.3	Confident	63.1	Low	106 Å²	106	92.3 Å²	92.3	56%	0.555	47%	0.47	S	S	*	.	H	α-helix	trans	-70.3	-35.5	174	-72.8	173	0	0	0	112.3	V2081 E2082 R2089	V2081-L2085 HydrophobicContact CG1-CD1 4Å; V2081-L2085 HydrophobicContact CG1-CG 4.39Å; V2081-L2085 WeakPolarHBondContact O-CB 3.13Å; V2081-L2085 WeakPolarHBondContact O-CG 3.36Å; V2081-L2085 PolarHBondContact O-N 2.71Å; E2082-L2085 CarbonylContact O-C 2.8Å; E2082-L2085 PolarHBondContact O-N 3.15Å; E2082-L2085 VanDerWaalsContact O-N 3.12Å; L2085-R2089 WeakPolarHBondContact O-CB 3.23Å; L2085-R2089 PolarHBondContact O-N 2.92Å
2086	L	77.7	Confident	65.2	Low	22 Å²	22	93.4 Å²	93.4	12%	0.115	47%	0.473	C	S	.	.	H	α-helix	trans	-61.5	-57.8	169.6	-73.2	164.3	0	0	0	110.2	E2082 I2088 R2089 D2090	E2082-L2086 HydrophobicContact CG-CD1 4.43Å; E2082-L2086 WeakPolarHBondContact O-CG 3.4Å; E2082-L2086 PolarHBondContact O-N 3.02Å; L2086-I2088 PolarHBondContact O-N 3.48Å; L2086-I2088 VanDerWaalsContact O-N 3.09Å; L2086-R2089 CarbonylContact O-C 3.56Å; L2086-R2089 WeakPolarHBondContact O-CA 3.27Å; L2086-R2089 VanDerWaalsContact O-CB 3.25Å; L2086-R2089 WeakPolarHBondContact O-CB 3.33Å; L2086-R2089 PolarHBondContact O-N 2.8Å; L2086-D2090 PolarHBondContact O-N 3.32Å; L2086-D2090 VanDerWaalsContact O-OD2 3.06Å
2087	R	71.1	Confident	67.3	Low	146 Å²	146	94 Å²	94	55%	0.551	47%	0.465	S	S	*	.	H	α-helix	trans	-58.7	-29.8	177.4	-67.2	176.7	-151.5	174.6	9.9	114.1	Q2083 S2091	Q2083-R2087 WeakPolarHBondContact O-CB 3.35Å; Q2083-R2087 VanDerWaalsContact O-CG 3.25Å; Q2083-R2087 WeakPolarHBondContact O-CG 3.37Å; Q2083-R2087 PolarHBondContact O-N 3.12Å; R2087-S2091 WeakPolarHBondContact O-CB 3.25Å; R2087-S2091 PolarHBondContact O-N 2.84Å
2088	I	78.1	Confident	68.4	Low	88 Å²	88	93.3 Å²	93.3	45%	0.451	47%	0.465	S	S	.	.	H	α-helix	trans	-72.5	-42	171.1	-73	167.5	0	0	0	111	T2084 L2086 D2090 L2092	T2084-I2088 HydrophobicContact CG2-CD1 4Å; T2084-I2088 WeakPolarHBondContact O-CB 3.43Å; T2084-I2088 WeakPolarHBondContact O-CD1 3.31Å; T2084-I2088 WeakPolarHBondContact O-CG1 3.28Å; T2084-I2088 PolarHBondContact O-N 2.78Å; L2086-I2088 PolarHBondContact O-N 3.48Å; L2086-I2088 VanDerWaalsContact O-N 3.09Å; I2088-D2090 VanDerWaalsContact C-N 3.35Å; I2088-L2092 HydrophobicContact CG2-CD1 3.96Å; I2088-L2092 WeakPolarHBondContact O-CB 3.48Å; I2088-L2092 VanDerWaalsContact O-CG 3.25Å; I2088-L2092 WeakPolarHBondContact O-CG 3.26Å; I2088-L2092 PolarHBondContact O-N 2.75Å
2089	R	82.6	Confident	69.6	Low	175 Å²	175	89.9 Å²	89.9	66%	0.66	46%	0.458	S	S	*	.	H	α-helix	trans	-60.7	-43.7	174.2	-174.3	-175.2	-159.3	152.4	4.5	111.3	L2085 L2086 L2092 Q2093	L2085-R2089 WeakPolarHBondContact O-CB 3.23Å; L2085-R2089 PolarHBondContact O-N 2.92Å; L2086-R2089 CarbonylContact O-C 3.56Å; L2086-R2089 WeakPolarHBondContact O-CA 3.27Å; L2086-R2089 VanDerWaalsContact O-CB 3.25Å; L2086-R2089 WeakPolarHBondContact O-CB 3.33Å; L2086-R2089 PolarHBondContact O-N 2.8Å; R2089-L2092 CarbonylContact O-C 3.31Å; R2089-L2092 PolarHBondContact O-N 2.91Å; R2089-Q2093 VanDerWaalsContact O-CB 3.26Å; R2089-Q2093 WeakPolarHBondContact O-CB 3.47Å; R2089-Q2093 PolarHBondContact O-N 2.94Å
2090	D	82.5	Confident	70.5	Confident	60 Å²	60	91.6 Å²	91.6	32%	0.321	46%	0.462	S	S	.	.	H	α-helix	trans	-75.8	-36.2	-177.9	-55.1	-31.9	0	0	0	110.9	L2086 I2088 L2092 Q2093 A2094	L2086-D2090 PolarHBondContact O-N 3.32Å; L2086-D2090 VanDerWaalsContact O-OD2 3.06Å; I2088-D2090 VanDerWaalsContact C-N 3.35Å; D2090-L2092 VanDerWaalsContact C-N 3.35Å; D2090-Q2093 PolarHBondContact O-N 3.46Å; D2090-A2094 WeakPolarHBondContact O-CB 3.46Å; D2090-A2094 PolarHBondContact O-N 3.13Å
2091	S	76.9	Confident	70.5	Confident	62 Å²	62	94.1 Å²	94.1	43%	0.434	48%	0.479	S	S	.	.	H	α-helix	trans	-63.1	-39.4	168.8	-175.7	0	0	0	0	112.1	R2087 Q2095	R2087-S2091 WeakPolarHBondContact O-CB 3.25Å; R2087-S2091 PolarHBondContact O-N 2.84Å; S2091-Q2095 WeakPolarHBondContact O-CB 3.5Å; S2091-Q2095 VanDerWaalsContact O-CG 3.25Å; S2091-Q2095 WeakPolarHBondContact O-CG 3.25Å; S2091-Q2095 PolarHBondContact O-N 3.14Å
2092	L	79.8	Confident	69.8	Low	93 Å²	93	93.8 Å²	93.8	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-72	-34.2	173.6	-73.9	170.6	0	0	0	112.7	I2088 R2089 D2090 Q2095 L2096	I2088-L2092 HydrophobicContact CG2-CD1 3.96Å; I2088-L2092 WeakPolarHBondContact O-CB 3.48Å; I2088-L2092 VanDerWaalsContact O-CG 3.25Å; I2088-L2092 WeakPolarHBondContact O-CG 3.26Å; I2088-L2092 PolarHBondContact O-N 2.75Å; R2089-L2092 CarbonylContact O-C 3.31Å; R2089-L2092 PolarHBondContact O-N 2.91Å; D2090-L2092 VanDerWaalsContact C-N 3.35Å; L2092-Q2095 PolarHBondContact O-N 3.46Å; L2092-L2096 VanDerWaalsContact O-CB 3.31Å; L2092-L2096 WeakPolarHBondContact O-CB 3.21Å; L2092-L2096 VanDerWaalsContact O-CG 3.28Å; L2092-L2096 WeakPolarHBondContact O-CG 3.23Å; L2092-L2096 PolarHBondContact O-N 3.47Å
2093	Q	79.9	Confident	68.3	Low	88 Å²	88	92.5 Å²	92.5	41%	0.411	50%	0.496	S	S	.	.	H	α-helix	trans	-69.4	-45.9	175.6	-174.9	64.3	40.2	0	0	110.4	R2089 D2090 Q2095 L2096 D2097	R2089-Q2093 VanDerWaalsContact O-CB 3.26Å; R2089-Q2093 WeakPolarHBondContact O-CB 3.47Å; R2089-Q2093 PolarHBondContact O-N 2.94Å; D2090-Q2093 PolarHBondContact O-N 3.46Å; Q2093-Q2095 VanDerWaalsContact C-N 3.35Å; Q2093-Q2095 PolarHBondContact O-N 3.4Å; Q2093-L2096 CarbonylContact O-C 3.46Å; Q2093-L2096 WeakPolarHBondContact O-CB 3.38Å; Q2093-L2096 PolarHBondContact O-N 3.03Å; Q2093-L2096 VanDerWaalsContact O-N 3.13Å; Q2093-D2097 PolarHBondContact NE2-OD1 3.37Å; Q2093-D2097 PolarHBondContact NE2-OD2 3.07Å; Q2093-D2097 WeakPolarHBondContact O-CB 3.44Å; Q2093-D2097 PolarHBondContact O-N 3.1Å
2094	A	74.9	Confident	66.8	Low	37 Å²	37	92.5 Å²	92.5	31%	0.306	51%	0.51	S	S	.	.	H	α-helix	trans	-60	-42	171.9	0	0	0	0	0	111.4	D2090 D2097 L2098	D2090-A2094 WeakPolarHBondContact O-CB 3.46Å; D2090-A2094 PolarHBondContact O-N 3.13Å; A2094-D2097 PolarHBondContact O-N 3.34Å; A2094-L2098 WeakPolarHBondContact O-CB 3.36Å; A2094-L2098 VanDerWaalsContact O-CD1 3.27Å; A2094-L2098 WeakPolarHBondContact O-CD1 3.37Å; A2094-L2098 PolarHBondContact O-N 2.86Å
2095	Q	71.6	Confident	65.1	Low	115 Å²	115	94.6 Å²	94.6	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-64.5	-38.7	172.3	-76.7	177.6	11.5	0	0	112.8	S2091 L2092 Q2093 D2097 T2099	S2091-Q2095 WeakPolarHBondContact O-CB 3.5Å; S2091-Q2095 VanDerWaalsContact O-CG 3.25Å; S2091-Q2095 WeakPolarHBondContact O-CG 3.25Å; S2091-Q2095 PolarHBondContact O-N 3.14Å; L2092-Q2095 PolarHBondContact O-N 3.46Å; Q2093-Q2095 VanDerWaalsContact C-N 3.35Å; Q2093-Q2095 PolarHBondContact O-N 3.4Å; Q2095-D2097 VanDerWaalsContact C-N 3.35Å; Q2095-T2099 WeakPolarHBondContact O-CB 3.46Å; Q2095-T2099 WeakPolarHBondContact O-CG2 3.45Å; Q2095-T2099 PolarHBondContact O-N 3.35Å; Q2095-T2099 PolarHBondContact O-OG1 3.03Å
2096	L	74.2	Confident	63	Low	89 Å²	89	98.9 Å²	98.9	47%	0.466	55%	0.545	S	S	.	.	H	α-helix	trans	-67.8	-32	174.3	-81	166.7	0	0	0	112.9	L2092 Q2093 T2099 K2100	L2092-L2096 VanDerWaalsContact O-CB 3.31Å; L2092-L2096 WeakPolarHBondContact O-CB 3.21Å; L2092-L2096 VanDerWaalsContact O-CG 3.28Å; L2092-L2096 WeakPolarHBondContact O-CG 3.23Å; L2092-L2096 PolarHBondContact O-N 3.47Å; Q2093-L2096 CarbonylContact O-C 3.46Å; Q2093-L2096 WeakPolarHBondContact O-CB 3.38Å; Q2093-L2096 PolarHBondContact O-N 3.03Å; Q2093-L2096 VanDerWaalsContact O-N 3.13Å; L2096-T2099 WeakPolarHBondContact CA-OG1 3.2Å; L2096-T2099 PolarHBondContact O-OG1 3.49Å; L2096-K2100 WeakPolarHBondContact O-CE 3.18Å; L2096-K2100 WeakPolarHBondContact O-CG 3.44Å; L2096-K2100 PolarHBondContact O-N 2.84Å
2097	D	72.1	Confident	60.8	Low	60 Å²	60	106.9 Å²	106.9	32%	0.321	58%	0.578	S	S	.	*	H	α-helix	trans	-88.2	-33.3	-179.2	-68.8	-25.7	0	0	0	112	Q2093 A2094 Q2095 T2099 K2100 V2101	Q2093-D2097 PolarHBondContact NE2-OD1 3.37Å; Q2093-D2097 PolarHBondContact NE2-OD2 3.07Å; Q2093-D2097 WeakPolarHBondContact O-CB 3.44Å; Q2093-D2097 PolarHBondContact O-N 3.1Å; A2094-D2097 PolarHBondContact O-N 3.34Å; Q2095-D2097 VanDerWaalsContact C-N 3.35Å; D2097-T2099 VanDerWaalsContact C-N 3.31Å; D2097-T2099 PolarHBondContact O-N 2.79Å; D2097-K2100 PolarHBondContact O-N 2.82Å; D2097-K2100 WeakPolarHBondContact OD1-CD 3.27Å; D2097-K2100 WeakPolarHBondContact OD1-CE 3.25Å; D2097-K2100 IonicContact OD1-NZ 3.38Å; D2097-K2100 PolarHBondContact OD1-NZ 3.27Å; D2097-V2101 WeakPolarHBondContact O-CB 3.31Å; D2097-V2101 VanDerWaalsContact O-CG2 3.25Å; D2097-V2101 WeakPolarHBondContact O-CG2 3.37Å; D2097-V2101 PolarHBondContact O-N 3.46Å
2098	L	57	Low	59	Low	131 Å²	131	107.8 Å²	107.8	69%	0.686	59%	0.591	S	S	*	*	H	α-helix	trans	-58.7	-42.9	163	-95.5	70.2	0	0	0	110.8	A2094 V2101 G2102	A2094-L2098 WeakPolarHBondContact O-CB 3.36Å; A2094-L2098 VanDerWaalsContact O-CD1 3.27Å; A2094-L2098 WeakPolarHBondContact O-CD1 3.37Å; A2094-L2098 PolarHBondContact O-N 2.86Å; L2098-V2101 PolarHBondContact O-N 3.46Å; L2098-G2102 PolarHBondContact O-N 3.19Å
2099	T	59.1	Low	56.8	Low	96 Å²	96	110.1 Å²	110.1	59%	0.589	60%	0.604	S	S	*	*	H	α-helix	trans	-73.9	-22.5	178.1	50.5	0	0	0	0	114.1	Q2095 L2096 D2097	Q2095-T2099 WeakPolarHBondContact O-CB 3.46Å; Q2095-T2099 WeakPolarHBondContact O-CG2 3.45Å; Q2095-T2099 PolarHBondContact O-N 3.35Å; Q2095-T2099 PolarHBondContact O-OG1 3.03Å; L2096-T2099 WeakPolarHBondContact CA-OG1 3.2Å; L2096-T2099 PolarHBondContact O-OG1 3.49Å; D2097-T2099 VanDerWaalsContact C-N 3.31Å; D2097-T2099 PolarHBondContact O-N 2.79Å
2100	K	53.6	Low	54.6	Low	121 Å²	121	106 Å²	106	53%	0.526	60%	0.602	S	S	.	*	H	α-helix	trans	-77.3	-41.8	168.3	-74.5	167.6	-144.9	154.4	0	112.5	L2096 D2097 G2102 C2103	L2096-K2100 WeakPolarHBondContact O-CE 3.18Å; L2096-K2100 WeakPolarHBondContact O-CG 3.44Å; L2096-K2100 PolarHBondContact O-N 2.84Å; D2097-K2100 PolarHBondContact O-N 2.82Å; D2097-K2100 WeakPolarHBondContact OD1-CD 3.27Å; D2097-K2100 WeakPolarHBondContact OD1-CE 3.25Å; D2097-K2100 IonicContact OD1-NZ 3.38Å; D2097-K2100 PolarHBondContact OD1-NZ 3.27Å; K2100-G2102 VanDerWaalsContact C-N 3.32Å; K2100-C2103 PolarHBondContact O-N 3.04Å
2101	V	51.4	Low	52.3	Low	122 Å²	122	109.5 Å²	109.5	74%	0.739	62%	0.621	S	S	*	*	H	α-helix	trans	-70.7	-29.5	-179.6	173.3	0	0	0	0	111.3	D2097 L2098 C2103	D2097-V2101 WeakPolarHBondContact O-CB 3.31Å; D2097-V2101 VanDerWaalsContact O-CG2 3.25Å; D2097-V2101 WeakPolarHBondContact O-CG2 3.37Å; D2097-V2101 PolarHBondContact O-N 3.46Å; L2098-V2101 PolarHBondContact O-N 3.46Å; V2101-C2103 PolarHBondContact O-N 2.66Å
2102	G	41.6	Very low	50.2	Low	65 Å²	65	113.1 Å²	113.1	67%	0.67	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	6.8	175.1	0	0	0	0	0	116.9	L2098 K2100	L2098-G2102 PolarHBondContact O-N 3.19Å; K2100-G2102 VanDerWaalsContact C-N 3.32Å
2103	C	36.5	Very low	48.2	Very low	112 Å²	112	113.8 Å²	113.8	76%	0.757	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	35.6	-174.1	-80	0	0	0	0	115.3	K2100 V2101	K2100-C2103 PolarHBondContact O-N 3.04Å; V2101-C2103 PolarHBondContact O-N 2.66Å
2104	A	35.2	Very low	45.9	Very low	80 Å²	80	120.1 Å²	120.1	66%	0.661	66%	0.66	S	S	*	*	S	Bend	trans	-139.2	108.9	173.8	0	0	0	0	0	114.3
2105	S	33.8	Very low	44.2	Very low	119 Å²	119	123.6 Å²	123.6	83%	0.832	68%	0.682	S	S	*	*			trans	65.5	125.1	169.9	-53.6	0	0	0	0	116
2106	Q	33.2	Very low	42.4	Very low	196 Å²	196	123 Å²	123	92%	0.916	69%	0.69	S	S	*	*			cis	-146.3	-176.3	40.3	-83.6	-162.5	4.6	0	0	115.1
2107	K	32.6	Very low	40.2	Very low	189 Å²	189	124.2 Å²	124.2	82%	0.822	70%	0.702	S	S	*	*			trans	-86.2	151.9	-174.5	-61.4	168.7	-179.9	170.5	0	113
2108	M	31.4	Very low	38.1	Very low	165 Å²	165	127.1 Å²	127.1	81%	0.813	72%	0.717	S	S	*	*			trans	57.6	129.7	140.1	-67.1	-70.1	179	0	0	120.8
2109	N	33.5	Very low	36.7	Very low	137 Å²	137	123.2 Å²	123.2	73%	0.733	70%	0.697	S	S	*	*			trans	67.3	74.9	146.4	-64.3	5.8	0	0	0	119.4
2110	S	35.3	Very low	35.2	Very low	88 Å²	88	123.9 Å²	123.9	62%	0.615	70%	0.697	S	S	*	*				49.9	106.6	108.7	69.7	0	0	0	0	119.6
2111	N	34.1	Very low	34.6	Very low	134 Å²	134	120.4 Å²	120.4	72%	0.717	70%	0.696	S	S	*	*				68.3	116.4	120.2	-59	5.7	0	0	0	120.1
2112	N	32.8	Very low	33.8	Very low	138 Å²	138	118.1 Å²	118.1	74%	0.738	69%	0.689	S	S	*	*			trans	74.3	141.2	133.1	-54.9	0.1	0	0	0	116.9
2113	D	37.7	Very low	33.6	Very low	108 Å²	108	119.5 Å²	119.5	58%	0.578	69%	0.685	S	S	*	*			cis	-150.3	148.4	24.7	-119.5	-30.8	0	0	0	113.2
2114	R	33.2	Very low	33.4	Very low	220 Å²	220	119.9 Å²	119.9	83%	0.83	69%	0.687	S	S	*	*			trans	40.3	111.7	142.6	-60.9	155.7	-159.3	-153.3	-4.2	119.9
2115	S	38.5	Very low	33.3	Very low	110 Å²	110	121.9 Å²	121.9	77%	0.769	69%	0.688	S	S	*	*			trans	-150.6	136.9	132.8	51.1	0	0	0	0	112.5
2116	S	34.5	Very low	33.3	Very low	102 Å²	102	122 Å²	122	71%	0.713	68%	0.681	S	S	*	*			trans	34.6	139.5	152.6	53	0	0	0	0	122.8
2117	T	26.1	Very low	33.3	Very low	116 Å²	116	117.9 Å²	117.9	71%	0.712	67%	0.668	S	S	*	*			cis	-175.1	139.7	-14	25.9	0	0	0	0	108.6
2118	N	28.6	Very low	33.4	Very low	120 Å²	120	113.7 Å²	113.7	64%	0.642	66%	0.659	S	S	*	*			trans	68	152.9	162.4	-53.6	-20.3	0	0	0	118.6
2119	N	27.7	Very low	33.5	Very low	50 Å²	50	110.5 Å²	110.5	27%	0.267	65%	0.649	S	S	.	*			trans	81.3	145.8	159.8	-52.3	-29.9	0	0	0	117.7	H86 N87 P1462 M1463	H86-N2119 VanDerWaalsContact O-CB 3.23Å; H86-N2119 WeakPolarHBondContact O-CB 3.48Å; H86-N2119 PolarHBondContact O-ND2 2.74Å; N87-N2119 CarbonylContact O-C 3.6Å; P1462-N2119 VanDerWaalsContact CD-CG 3.42Å; P1462-N2119 VanDerWaalsContact CD-ND2 3.28Å; P1462-N2119 WeakPolarHBondContact CD-ND2 3.3Å; P1462-N2119 HydrophobicContact CG-CB 3.88Å; P1462-N2119 VanDerWaalsContact CG-CG 3.48Å; M1463-N2119 PolarHBondContact SD-OD1 3.45Å; M1463-N2119 VanDerWaalsContact SD-OD1 3.39Å
2120	N	28.8	Very low	33.5	Very low	109 Å²	109	108.7 Å²	108.7	58%	0.583	64%	0.644	S	S	*	*			trans	39.3	-174	-178.7	-95	-9.3	0	0	0	120.5	D1461	D1461-N2120 VanDerWaalsContact CG-CG 3.42Å; D1461-N2120 PolarHBondContact OD1-ND2 3.33Å; D1461-N2120 WeakPolarHBondContact OD2-CB 3.46Å; D1461-N2120 PolarHBondContact OD2-ND2 3.33Å; D1461-N2120 VanDerWaalsContact OD2-ND2 3.07Å; D1461-N2120 PolarHBondContact OD2-OD1 3.07Å
2121	G	40.7	Very low	33.4	Very low	49 Å²	49	110.2 Å²	110.2	51%	0.505	65%	0.646	S	S	.	*			trans	91.5	105.7	-176	0	0	0	0	0	115.7	S89	S89-G2121 WeakPolarHBondContact O-CA 3.18Å; S89-G2121 PolarHBondContact O-N 2.86Å
2122	A	33.9	Very low	33.3	Very low	73 Å²	73	108.4 Å²	108.4	60%	0.603	64%	0.64	S	S	*	*			cis	69.6	137.4	1.7	0	0	0	0	0	118.3	S89 D90	S89-A2122 CarbonylContact C-O 3.59Å; D90-A2122 PolarHBondContact N-O 3.31Å
2123	V	37.4	Very low	33.3	Very low	94 Å²	94	105.9 Å²	105.9	57%	0.57	63%	0.632	S	S	*	*			trans	67.4	156.1	164.3	171.5	0	0	0	0	114.4	P91 D92	P91-V2123 CarbonylContact C-O 3.53Å; P91-V2123 WeakPolarHBondContact CA-O 3.21Å; D92-V2123 PolarHBondContact N-O 3.35Å
2124	C	33.2	Very low	33	Very low	120 Å²	120	105.7 Å²	105.7	81%	0.811	64%	0.637	S	S	*	*			cis	-73.1	0	-24.9	-57.5	0	0	0	0	111.6	D92	D92-C2124 HydrophobicContact CB-CB 3.77Å; D92-C2124 WeakPolarHBondContact OD2-CB 3.04Å

Retrieved 2,124 of 2,124 residues in 611.4 ms (Link to these results)

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