A0A5K4F683_SCHMA Loading...

KAP NTPase domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F683, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,628 aa.

						>A0A5K4F683_SCHMA|A0A5K4F683
MIQDRMTKFQTNNFTRNSLNYVENVKEPGLMHSSVITNNDVGLKPYTDMSAYNIPIECSSPNVENHAANTIRVLADMFTCRLSNFPMTVGIFTQQNNKEYLSQLASELHNLNRLENPIPLKFSKLLFIFPLVISAILGYFVGMLTNWQVGLSIGHIGMFIQITFLALIITGSRFCQKPFAIRASYSIACFLQWIKLFLNICFCYPVRSINTKTPVRVIVVYHRICPSSTTNMALFSLVEKMWFGLVRHYGQILIRLQRAGKPSGNPNIKYKRVCCLPAFIVMIAFWIAFLISTSIIRLYSGQLTKLLGHGGLLSLFVIMSSIMFLSFVGSLPSIFRIIKGLLINPITPIKTALTTFLQSNNDIDKEFFITKSIGKLNDTLMYSSSTSFKDLAITVEEKKACKADLFIKSEFAKLCNLSITFDQFNNIQQTRFILCLDASSILQKDLLAKLIYQIHNLLLTVINAPVAIVLEANFKILLGDLVCSTILSPNNTTFCNSFTQESKFIAQIVGDNFHLVHASLYLPIYLEPPIFTDLPEIKKSNNEQMKHNQLLHSSLNGYSSANATFQSSIISTSEISTISVSSKKVSSSPNCVSSHVPRAMFDNFHGTNSNNRHCSKIISINNEKEQNKIEVTEENEFSVNDIASMFLHNHELADWNGKVIKQLVLSTAFTYRLLKLYNMNIEIELVVLWVTLVHHWPYHTTWLIIYLEDLNASNSLNSDKEQSPEMKINLMEAFLEIKKRVGESIEILEALATEDRDLERLKKFLYSKSSTQVPVNSLKQLIACSLIHNPFIHYSIQALVGMINGRQSSGLHHSFFNPLDAVIEEKSDTTNQSLALDKVRQTNSVPIYASIQLNSSIGQTNQMGCKTTGSLSSAENLPPNAYWPCSSGTITTGDNFFNKPCPIRLKKRYPSLPIHQFTVNDVCELFSSIVDIHPSHMQSYISKIKQLNINGIVLSVCDLESLRQELMIEISDWQVIYKLITWLRSSSTDGHRTFSESSQQRLGGISSNEFDVSDLLTGYNMNFKGKYQQPQQRLSNHTLLTSMPSLNSEKMSCASDQKPKISNPFLVRQTPWLVSPKIPITSLSNGKSLEPFQEFTLEQRPSPDTSDQQNSCSAMEEPESLWKTDDFTNVSATKDKTPVTHPNMLVGSIENSHITSNPNLFSHQEGSSKPKEIRKTSKHLNNLEVIINKPEVKVTPGHSFHRSLQNSMHSNRFVNKNGYASRSSIDLRTVFGPEQKNPPDTNLFSNYRIIHNSKRSRVKKALIEQHRRQQLQRRHHLTHNPNFNYFADPEFCSPLVCPLSKRNVNFYNHDIFNNKNHPFDSNLQNINASNLRRITKQPRRNCDYQTIEDNTPILIANGYNNESSIINNEDHINNITPSKIHIKQCHLQESLKNVESETDDTVQSSDNKSSQLKFLNQNKSFLNHLKYYPSYKINPKAVFSSPALTPAQLTSLQAYTEWSTKMNPYFANPTVMTNTGSVIPNNSTNVWSSYLEQHQVNKFPIFKPSTHKTSDHKSFRPSQKKRPRKTNPDENEFIINPNKEFQPTTLTKPNVYSLTLSCDSEAELCTCDYWYELEKAKEKFTISEPSLRAESDLISIDDYIIDNDYQTSATESLNSMHIVQTDKSKHLK
					

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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	30.6	Very low	27.7	Very low	234 Å²	234	176.1 Å²	176.1	100%	1.153	85%	0.85	S	S	*	*				0	154.5	0	-66.8	174.1	80	0	0	108.5
2	I	29.4	Very low	27.8	Very low	181 Å²	181	173.5 Å²	173.5	93%	0.928	84%	0.844	S	S	*	*			trans	61.8	54.8	-159.6	-41.7	179.9	0	0	0	111.3
3	Q	24.4	Very low	27.7	Very low	188 Å²	188	170.3 Å²	170.3	88%	0.879	83%	0.833	S	S	*	*			trans	-143.9	50.9	164.4	-171.2	169.8	-17.9	0	0	108.1
4	D	25.9	Very low	27.8	Very low	156 Å²	156	172.8 Å²	172.8	83%	0.834	84%	0.838	S	S	*	*	S	Bend	trans	-160.7	32.5	-165.8	-140.9	-5	0	0	0	113.9
5	R	28.2	Very low	27.9	Very low	243 Å²	243	166.5 Å²	166.5	92%	0.917	81%	0.814	S	S	*	*			trans	-153.5	26.9	-177.2	-124.9	176.1	-161.6	-163.8	3.8	117.8
6	M	27	Very low	27.9	Very low	193 Å²	193	169.8 Å²	169.8	95%	0.951	82%	0.815	S	S	*	*			trans	-132.4	63	170.2	-78.4	-170.5	167.9	0	0	112.1
7	T	24.8	Very low	27.9	Very low	119 Å²	119	167.3 Å²	167.3	73%	0.73	81%	0.807	S	S	*	*			trans	-144.2	143.1	165.2	56.2	0	0	0	0	109
8	K	27.4	Very low	27.8	Very low	180 Å²	180	162.8 Å²	162.8	78%	0.783	80%	0.796	S	S	*	*			trans	67.5	122.3	-170.7	-47.3	172.1	-176.6	177.4	0	111.3
9	F	28.8	Very low	27.8	Very low	187 Å²	187	162 Å²	162	82%	0.82	80%	0.795	S	S	*	*			cis	-113.7	150.8	23.8	-79.2	-107.7	0	0	0	111.3
10	Q	28.5	Very low	27.7	Very low	147 Å²	147	159.2 Å²	159.2	69%	0.687	78%	0.783	S	S	*	*				60.2	135.8	51.2	-64	-178	-62	0	0	111.8
11	T	29.9	Very low	27.6	Very low	109 Å²	109	161.4 Å²	161.4	67%	0.669	78%	0.784	S	S	*	*			cis	-160.8	164.2	-3.7	10.6	0	0	0	0	105
12	N	28.8	Very low	27.5	Very low	145 Å²	145	155.3 Å²	155.3	78%	0.775	76%	0.76	S	S	*	*			cis	-153.1	167.8	27.9	-119.5	-21.3	0	0	0	111.5
13	N	26.8	Very low	27.3	Very low	132 Å²	132	154.1 Å²	154.1	71%	0.706	75%	0.751	S	S	*	*			trans	-95.9	160.5	174.7	-52.1	-76.8	0	0	0	112.1	T15	N13-T15 HydrophobicContact CB-CG2 4.03Å
14	F	28.3	Very low	27.5	Very low	205 Å²	205	151.2 Å²	151.2	90%	0.899	74%	0.741	S	S	*	*			trans	-156	77	134.8	-118.3	-88.9	0	0	0	107.6
15	T	30.1	Very low	27.6	Very low	79 Å²	79	149.7 Å²	149.7	49%	0.485	74%	0.737	S	S	.	*				75.1	120.2	89.5	59.2	0	0	0	0	116.4	N13	N13-T15 HydrophobicContact CB-CG2 4.03Å
16	R	26.8	Very low	27.5	Very low	218 Å²	218	146 Å²	146	82%	0.823	73%	0.728	S	S	*	*				69.8	153.1	125.6	-67.8	-171.8	151.3	150.7	-4.6	118.3
17	N	28	Very low	27.5	Very low	128 Å²	128	144.4 Å²	144.4	68%	0.684	72%	0.718	S	S	*	*			cis	-158.9	170.6	-0.6	-115.5	3.7	0	0	0	106.6
18	S	27.5	Very low	27.9	Very low	87 Å²	87	144.6 Å²	144.6	61%	0.608	72%	0.721	S	S	*	*			cis	-168.3	155.7	-5.8	38.8	0	0	0	0	110.2
19	L	27	Very low	27.8	Very low	147 Å²	147	139.5 Å²	139.5	77%	0.77	72%	0.72	S	S	*	*			trans	13.4	152	134.9	-77.6	63.4	0	0	0	119.4
20	N	25.8	Very low	27.7	Very low	105 Å²	105	139 Å²	139	56%	0.561	72%	0.724	S	S	*	*			cis	-166	-178.3	34.6	-142.7	2	0	0	0	115.8
21	Y	26.1	Very low	27.5	Very low	206 Å²	206	140.1 Å²	140.1	81%	0.808	73%	0.732	S	S	*	*			trans	74.7	114.2	170	-65.6	-73.1	0	0	0	117.4
22	V	27.5	Very low	27.3	Very low	107 Å²	107	144 Å²	144	65%	0.648	74%	0.742	S	S	*	*			cis	108.5	125.9	8.2	-175.2	0	0	0	0	115.3
23	E	26.5	Very low	27.1	Very low	156 Å²	156	142.4 Å²	142.4	73%	0.729	74%	0.742	S	S	*	*			trans	105.7	139.2	146.9	-107.2	178.2	-138.2	0	0	124.4
24	N	27.6	Very low	26.9	Very low	127 Å²	127	141.9 Å²	141.9	68%	0.679	75%	0.749	S	S	*	*			trans	75.6	135.7	153.1	-61.8	-35.1	0	0	0	120.1
25	V	28.3	Very low	26.8	Very low	123 Å²	123	138.5 Å²	138.5	75%	0.745	75%	0.745	S	S	*	*			cis	-153.4	179.3	-5	100.9	0	0	0	0	113.6
26	K	26.4	Very low	26.6	Very low	166 Å²	166	142.5 Å²	142.5	72%	0.722	76%	0.761	S	S	*	*			trans	-62.9	-177.2	-177.3	-45.9	172.2	-167.8	169.1	0	114.1
27	E	25.9	Very low	26.5	Very low	159 Å²	159	137.5 Å²	137.5	74%	0.743	76%	0.755	S	S	*	*			cis	-164	164.2	23.6	-151.6	149.8	-114.6	0	0	112.6
28	P	33.1	Very low	26.3	Very low	124 Å²	124	138 Å²	138	81%	0.805	76%	0.758	S	S	*	*			trans	-123.6	162.1	-176.5	41.1	-29.4	0	0	0	116.9
29	G	26.1	Very low	26.2	Very low	72 Å²	72	141.5 Å²	141.5	74%	0.742	77%	0.77	S	S	*	*			trans	136.1	138.2	140.9	0	0	0	0	0	119
30	L	26.6	Very low	26.2	Very low	176 Å²	176	142.1 Å²	142.1	92%	0.921	77%	0.774	S	S	*	*				-172.4	157.4	123.2	-109.5	149.8	0	0	0	111.9
31	M	23.4	Very low	26.2	Very low	171 Å²	171	144.1 Å²	144.1	84%	0.842	79%	0.789	S	S	*	*			trans	-125	157.6	173.5	-74.8	-170.6	174.6	0	0	109.7
32	H	26.6	Very low	26.2	Very low	192 Å²	192	137.5 Å²	137.5	89%	0.889	78%	0.784	S	S	*	*			trans	-156.9	161.4	131.4	-122.3	-83	0	0	0	111.8
33	S	23.6	Very low	26	Very low	110 Å²	110	140.4 Å²	140.4	77%	0.769	80%	0.795	S	S	*	*			trans	-130.2	156.3	179	64.3	0	0	0	0	111.9
34	S	24.2	Very low	25.9	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	79%	0.794	S	S	*	*			trans	-156.4	145.4	160.1	56.8	0	0	0	0	111.1
35	V	25.4	Very low	25.9	Very low	135 Å²	135	139.3 Å²	139.3	82%	0.818	79%	0.792	S	S	*	*			trans	-94.3	149.2	178.8	173.3	0	0	0	0	109.9
36	I	26.3	Very low	25.8	Very low	163 Å²	163	141.6 Å²	141.6	84%	0.836	79%	0.788	S	S	*	*			trans	-169.8	162.7	139.7	-100.5	154	0	0	0	112.1
37	T	24	Very low	25.8	Very low	112 Å²	112	137.7 Å²	137.7	69%	0.687	78%	0.778	S	S	*	*			trans	-78.2	157.2	-158.9	51.7	0	0	0	0	117.9
38	N	25.1	Very low	25.9	Very low	140 Å²	140	136.7 Å²	136.7	75%	0.749	78%	0.778	S	S	*	*			trans	33.5	114	143.7	-59.9	-0.8	0	0	0	119.6
39	N	24.7	Very low	25.5	Very low	160 Å²	160	137 Å²	137	86%	0.856	77%	0.77	S	S	*	*				-168.1	176	103.6	-93.3	-20.7	0	0	0	110.9	V41	N39-V41 PolarHBondContact O-N 3.13Å
40	D	26.8	Very low	25.4	Very low	160 Å²	160	139.1 Å²	139.1	86%	0.856	77%	0.774	S	S	*	*			trans	-60	122	-177.7	-67.9	-72.1	0	0	0	113.3
41	V	25.1	Very low	25.4	Very low	146 Å²	146	132.3 Å²	132.3	89%	0.885	74%	0.743	S	S	*	*				-178.9	131	129.2	145.6	0	0	0	0	110.5	N39	N39-V41 PolarHBondContact O-N 3.13Å
42	G	26	Very low	26	Very low	67 Å²	67	128.1 Å²	128.1	69%	0.691	72%	0.718	S	S	*	*			trans	41.4	98.3	153.5	0	0	0	0	0	121.4
43	L	23.6	Very low	26.7	Very low	169 Å²	169	121.9 Å²	121.9	89%	0.885	69%	0.691	S	S	*	*			trans	-153.4	88.7	144.1	-149	79.1	0	0	0	114
44	K	25	Very low	27.7	Very low	161 Å²	161	120.1 Å²	120.1	70%	0.7	67%	0.672	S	S	*	*			trans	170.5	95.7	141.8	-98.6	178.3	-179.9	-171.2	0	112.5	T47	K44-T47 HydrophobicContact CD-CG2 4.49Å
45	P	26.8	Very low	28.8	Very low	98 Å²	98	117.3 Å²	117.3	64%	0.636	65%	0.652	S	S	*	*			trans	-87.5	-4.1	155.6	34.2	-32.4	0	0	0	112.7	T47	P45-T47 VanDerWaalsContact C-N 3.25Å; P45-T47 PolarHBondContact O-N 2.88Å; P45-T47 VanDerWaalsContact O-N 3.12Å
46	Y	26.1	Very low	30	Very low	172 Å²	172	111.8 Å²	111.8	68%	0.675	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	36.6	-177	-73.2	-77.3	0	0	0	114.6
47	T	28.1	Very low	30.9	Very low	83 Å²	83	109.4 Å²	109.4	51%	0.509	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.9	-2.9	171.9	52	0	0	0	0	114.2	K44 P45	K44-T47 HydrophobicContact CD-CG2 4.49Å; P45-T47 VanDerWaalsContact C-N 3.25Å; P45-T47 PolarHBondContact O-N 2.88Å; P45-T47 VanDerWaalsContact O-N 3.12Å
48	D	26.1	Very low	32	Very low	138 Å²	138	109.2 Å²	109.2	74%	0.738	60%	0.604	S	S	*	*	S	Bend	trans	-103.5	0.7	-176.9	-69	-13.4	0	0	0	113.1
49	M	25.3	Very low	33.4	Very low	131 Å²	131	104.2 Å²	104.2	65%	0.645	58%	0.58	S	S	*	*	S	Bend	trans	-100.1	0.3	-171.8	-158.8	172.4	-179.8	0	0	114.9
50	S	25.3	Very low	35.1	Very low	116 Å²	116	101.6 Å²	101.6	81%	0.811	58%	0.575	S	S	*	*	S	Bend	trans	-141.7	28.3	-177.2	71	0	0	0	0	113.6
51	A	26	Very low	36.9	Very low	33 Å²	33	95.1 Å²	95.1	27%	0.273	54%	0.542	S	S	.	.	S	Bend	trans	-131.7	134.4	-178.7	0	0	0	0	0	111.1
52	Y	36.6	Very low	39.1	Very low	83 Å²	83	91.3 Å²	91.3	33%	0.325	52%	0.516	S	S	.	.	S	Bend	trans	74.9	30.1	168	-41.9	-76.3	0	0	0	118.3	E115 N116 P214	Y52-E115 HydrophobicContact CD1-CB 4.4Å; Y52-E115 HydrophobicContact CD1-CG 3.43Å; Y52-E115 VanDerWaalsContact CD1-CG 3.43Å; Y52-E115 HydrophobicContact CE1-CG 3.69Å; Y52-N116 HydrophobicContact CE1-CB 3.71Å; Y52-N116 VanDerWaalsContact CE1-N 3.28Å; Y52-N116 WeakPolarHBondContact CE1-ND2 3.39Å; Y52-P214 HydrophobicContact CG-CB 4.24Å
53	N	41.3	Very low	41	Very low	61 Å²	61	93.6 Å²	93.6	33%	0.326	52%	0.517	S	S	.	.			trans	-133.3	145.7	134	-79.2	-37.6	0	0	0	106	P55	N53-P55 WeakPolarHBondContact O-CD 3.13Å
54	I	44.1	Very low	43	Very low	73 Å²	73	93.7 Å²	93.7	37%	0.374	51%	0.512	S	S	.	.			trans	-90.8	113.1	167.7	-74	161.1	0	0	0	106.2	I56 L111 L114	I54-I56 PolarHBondContact O-N 2.76Å; I54-L111 HydrophobicContact CD1-CD2 3.61Å; I54-L114 HydrophobicContact CD1-CB 3.84Å; I54-L114 HydrophobicContact CD1-CD1 3.61Å; I54-L114 HydrophobicContact CD1-CG 4.33Å
55	P	46.5	Very low	45.4	Very low	63 Å²	63	89.3 Å²	89.3	41%	0.409	50%	0.497	S	S	.	.			trans	-63	128.8	175.8	27	-32.9	0	0	0	108.5	N53 E57 C58	N53-P55 WeakPolarHBondContact O-CD 3.13Å; P55-E57 PolarHBondContact O-N 2.88Å; P55-C58 WeakPolarHBondContact O-CB 3.41Å; P55-C58 PolarHBondContact O-N 3.45Å
56	I	51.3	Low	47.9	Very low	18 Å²	18	86 Å²	86	9%	0.092	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-47.6	-33.4	177.7	-82	171	0	0	0	112	I54 C58 S59 R672 L676	I54-I56 PolarHBondContact O-N 2.76Å; I56-C58 PolarHBondContact O-N 3.14Å; I56-C58 VanDerWaalsContact O-N 3.09Å; I56-S59 PolarHBondContact O-N 2.89Å; I56-S59 PolarHBondContact O-OG 2.99Å; I56-S59 VanDerWaalsContact O-OG 3.04Å; I56-R672 HydrophobicContact CD1-CB 4.21Å; I56-R672 HydrophobicContact CD1-CG 4.36Å; I56-L676 HydrophobicContact CG2-CB 3.51Å; I56-L676 HydrophobicContact CG2-CD1 4.06Å; I56-L676 HydrophobicContact CG2-CG 3.95Å
57	E	45.2	Very low	50.5	Low	113 Å²	113	78.6 Å²	78.6	53%	0.528	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-51.9	-25	174.7	-64.8	132.1	-133.4	0	0	115	P55 S59 K675	P55-E57 PolarHBondContact O-N 2.88Å; E57-S59 PolarHBondContact O-N 3.37Å; E57-K675 WeakPolarHBondContact OE1-CE 3.46Å; E57-K675 IonicContact OE1-NZ 2.67Å; E57-K675 PolarHBondContact OE1-NZ 2.83Å
58	C	46.6	Very low	53.1	Low	108 Å²	108	75.2 Å²	75.2	73%	0.73	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-73.8	-6.8	176.4	-79.1	0	0	0	0	113.9	P55 I56	P55-C58 WeakPolarHBondContact O-CB 3.41Å; P55-C58 PolarHBondContact O-N 3.45Å; I56-C58 PolarHBondContact O-N 3.14Å; I56-C58 VanDerWaalsContact O-N 3.09Å
59	S	54	Low	55.9	Low	35 Å²	35	68.6 Å²	68.6	25%	0.245	39%	0.392	C	S	.	.	S	Bend	trans	-127.6	116.6	176.5	57.5	0	0	0	0	111.4	I56 E57	I56-S59 PolarHBondContact O-N 2.89Å; I56-S59 PolarHBondContact O-OG 2.99Å; I56-S59 VanDerWaalsContact O-OG 3.04Å; E57-S59 PolarHBondContact O-N 3.37Å
60	S	61.2	Low	58.8	Low	105 Å²	105	62.4 Å²	62.4	73%	0.734	36%	0.362	S	S	*	.			trans	-59.9	135.8	167.8	52.9	0	0	0	0	110.3	N62	S60-N62 PolarHBondContact O-N 3.36Å
61	P	65.8	Low	61.8	Low	25 Å²	25	57 Å²	57	16%	0.162	32%	0.323	C	S	.	.			trans	-59.4	137	174.8	25.8	-34.6	0	0	0	110.2	V63 L676 Y677	P61-V63 PolarHBondContact O-N 3.46Å; P61-L676 HydrophobicContact CB-CD2 3.78Å; P61-L676 WeakPolarHBondContact CD-O 3.42Å; P61-L676 WeakPolarHBondContact CG-O 3.3Å; P61-Y677 HydrophobicContact CB-CD1 3.76Å; P61-Y677 HydrophobicContact CB-CE1 3.8Å; P61-Y677 HydrophobicContact CG-CD1 4.12Å
62	N	70.1	Confident	64.6	Low	65 Å²	65	58.4 Å²	58.4	35%	0.348	32%	0.322	S	S	.	.			trans	-80.5	98.4	168.7	-174.9	-12.5	0	0	0	108	S60 E64 N65 N69	S60-N62 PolarHBondContact O-N 3.36Å; N62-E64 PolarHBondContact O-N 3.28Å; N62-E64 WeakPolarHBondContact OD1-CB 3.36Å; N62-E64 PolarHBondContact OD1-N 3.3Å; N62-E64 VanDerWaalsContact OD1-N 3.13Å; N62-N65 HydrophobicContact CB-CB 4.43Å; N62-N65 PolarHBondContact ND2-ND2 3.02Å; N62-N65 CarbonylContact O-C 2.76Å; N62-N65 PolarHBondContact O-N 2.91Å; N62-N69 PolarHBondContact N-ND2 3.27Å; N62-N69 PolarHBondContact N-OD1 3.42Å; N62-N69 PolarHBondContact O-ND2 2.96Å
63	V	65.9	Low	67	Low	116 Å²	116	54.4 Å²	54.4	70%	0.703	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.2	-177.3	-175.2	0	0	0	0	111.6	P61 N65	P61-V63 PolarHBondContact O-N 3.46Å; V63-N65 VanDerWaalsContact C-N 3.27Å; V63-N65 PolarHBondContact O-N 3.09Å
64	E	65.2	Low	69.3	Low	170 Å²	170	51.6 Å²	51.6	79%	0.794	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.6	179.5	-54.8	173.4	172.3	0	0	113.6	N62	N62-E64 PolarHBondContact O-N 3.28Å; N62-E64 WeakPolarHBondContact OD1-CB 3.36Å; N62-E64 PolarHBondContact OD1-N 3.3Å; N62-E64 VanDerWaalsContact OD1-N 3.13Å
65	N	76.1	Confident	71.4	Confident	69 Å²	69	48.1 Å²	48.1	37%	0.369	27%	0.273	S	S	.	.			trans	-134.7	70.9	-168	-76.1	-85.8	0	0	0	112.8	N62 V63 A67 A68 N69	N62-N65 HydrophobicContact CB-CB 4.43Å; N62-N65 PolarHBondContact ND2-ND2 3.02Å; N62-N65 CarbonylContact O-C 2.76Å; N62-N65 PolarHBondContact O-N 2.91Å; V63-N65 VanDerWaalsContact C-N 3.27Å; V63-N65 PolarHBondContact O-N 3.09Å; N65-A67 PolarHBondContact O-N 3.21Å; N65-A67 VanDerWaalsContact O-N 3.15Å; N65-A68 HydrophobicContact CB-CB 3.87Å; N65-A68 WeakPolarHBondContact O-CB 3.22Å; N65-A68 PolarHBondContact O-N 3.24Å; N65-N69 PolarHBondContact O-N 3.36Å
66	H	78.4	Confident	73.2	Confident	30 Å²	30	46.3 Å²	46.3	14%	0.139	26%	0.26	C	S	.	.	H	α-helix	trans	-48	-42.4	176.5	-163.7	-89.9	0	0	0	113.5	A68 N69 T70 Y677	H66-A68 PolarHBondContact O-N 3.17Å; H66-N69 WeakPolarHBondContact O-CB 3.45Å; H66-N69 PolarHBondContact O-N 3.4Å; H66-T70 PolarHBondContact O-N 3.38Å; H66-T70 PolarHBondContact O-OG1 2.96Å; H66-Y677 AromaticContact CD2-CZ 3.74Å; H66-Y677 PolarHBondContact CD2-OH 3.37Å; H66-Y677 AromaticContact NE2-CE2 3.74Å; H66-Y677 AromaticContact NE2-CZ 3.92Å; H66-Y677 PolarHBondContact NE2-OH 2.62Å
67	A	82.5	Confident	74.9	Confident	15 Å²	15	45.5 Å²	45.5	12%	0.124	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-36.7	178	0	0	0	0	0	113.6	N65 T70 I71 Y100 L526	N65-A67 PolarHBondContact O-N 3.21Å; N65-A67 VanDerWaalsContact O-N 3.15Å; A67-T70 WeakPolarHBondContact O-CB 3.48Å; A67-T70 PolarHBondContact O-N 3.48Å; A67-I71 WeakPolarHBondContact O-CD1 3.42Å; A67-I71 VanDerWaalsContact O-CG1 3.32Å; A67-I71 WeakPolarHBondContact O-CG1 3.28Å; A67-I71 PolarHBondContact O-N 2.93Å; A67-Y100 HydrophobicContact CB-CD1 4.26Å; A67-Y100 HydrophobicContact CB-CE1 3.44Å; A67-Y100 VanDerWaalsContact CB-CE1 3.44Å; A67-L526 HydrophobicContact CB-CD1 4.15Å; A67-L526 HydrophobicContact CB-CD2 3.97Å
68	A	82.4	Confident	76.9	Confident	12 Å²	12	40.1 Å²	40.1	10%	0.099	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-37.9	176.3	0	0	0	0	0	111.8	N65 H66 I71 R72	N65-A68 HydrophobicContact CB-CB 3.87Å; N65-A68 WeakPolarHBondContact O-CB 3.22Å; N65-A68 PolarHBondContact O-N 3.24Å; H66-A68 PolarHBondContact O-N 3.17Å; A68-I71 PolarHBondContact O-N 3.25Å; A68-R72 PolarHBondContact O-N 2.93Å; A68-R72 VanDerWaalsContact O-N 3.14Å
69	N	84	Confident	78.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-43.1	172.6	-64.8	-21	0	0	0	111	N62 N65 H66 I71 R72 V73 L676 Y677	N62-N69 PolarHBondContact N-ND2 3.27Å; N62-N69 PolarHBondContact N-OD1 3.42Å; N62-N69 PolarHBondContact O-ND2 2.96Å; N65-N69 PolarHBondContact O-N 3.36Å; H66-N69 WeakPolarHBondContact O-CB 3.45Å; H66-N69 PolarHBondContact O-N 3.4Å; N69-I71 VanDerWaalsContact C-N 3.33Å; N69-I71 PolarHBondContact O-N 3.33Å; N69-R72 WeakPolarHBondContact O-CB 3.25Å; N69-R72 PolarHBondContact O-N 3.22Å; N69-V73 WeakPolarHBondContact O-CG2 3.42Å; N69-V73 PolarHBondContact O-N 3.05Å; N69-L676 HydrophobicContact CB-CD2 3.65Å; N69-Y677 PolarHBondContact ND2-OH 2.77Å
70	T	86.6	Confident	79.9	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-56.7	-45.1	175.3	-53.4	0	0	0	0	112	H66 A67 R72 V73 L74 I524 L526 F669 L786	H66-T70 PolarHBondContact O-N 3.38Å; H66-T70 PolarHBondContact O-OG1 2.96Å; A67-T70 WeakPolarHBondContact O-CB 3.48Å; A67-T70 PolarHBondContact O-N 3.48Å; T70-R72 PolarHBondContact O-N 2.99Å; T70-V73 PolarHBondContact O-N 3.03Å; T70-L74 PolarHBondContact O-N 3.08Å; T70-I524 HydrophobicContact CG2-CG2 4.02Å; T70-L526 HydrophobicContact CG2-CD2 3.96Å; T70-F669 HydrophobicContact CG2-CE2 4.38Å; T70-F669 HydrophobicContact CG2-CZ 3.75Å; T70-L786 HydrophobicContact CG2-CD1 3.43Å; T70-L786 VanDerWaalsContact CG2-CD1 3.43Å; T70-L786 WeakPolarHBondContact OG1-CD1 3.37Å
71	I	88.4	Confident	80.6	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-38.7	177.6	-72.5	160.2	0	0	0	111.8	A67 A68 N69 L74 A75 Y100 Q103 L104	A67-I71 WeakPolarHBondContact O-CD1 3.42Å; A67-I71 VanDerWaalsContact O-CG1 3.32Å; A67-I71 WeakPolarHBondContact O-CG1 3.28Å; A67-I71 PolarHBondContact O-N 2.93Å; A68-I71 PolarHBondContact O-N 3.25Å; N69-I71 VanDerWaalsContact C-N 3.33Å; N69-I71 PolarHBondContact O-N 3.33Å; I71-L74 WeakPolarHBondContact O-CB 3.48Å; I71-L74 PolarHBondContact O-N 2.75Å; I71-A75 WeakPolarHBondContact O-CB 3.25Å; I71-A75 PolarHBondContact O-N 3.03Å; I71-Y100 HydrophobicContact CD1-CD1 3.51Å; I71-Y100 HydrophobicContact CD1-CE1 4.48Å; I71-Y100 HydrophobicContact CD1-CG 3.99Å; I71-Q103 HydrophobicContact CD1-CB 4.31Å; I71-Q103 HydrophobicContact CD1-CG 4.36Å; I71-Q103 HydrophobicContact CG2-CG 4.15Å; I71-L104 HydrophobicContact CG2-CB 3.79Å; I71-L104 HydrophobicContact CG2-CD1 4.02Å
72	R	85.1	Confident	81	Confident	63 Å²	63	35.4 Å²	35.4	24%	0.238	18%	0.182	C	C	.	.	H	α-helix	trans	-64.6	-39.8	175.5	-169.8	169.6	-60.8	112.4	15.5	112.2	A68 N69 T70 A75 D76 E107 L676	A68-R72 PolarHBondContact O-N 2.93Å; A68-R72 VanDerWaalsContact O-N 3.14Å; N69-R72 WeakPolarHBondContact O-CB 3.25Å; N69-R72 PolarHBondContact O-N 3.22Å; T70-R72 PolarHBondContact O-N 2.99Å; R72-A75 PolarHBondContact O-N 3.27Å; R72-D76 PolarHBondContact O-N 3.48Å; R72-E107 IonicContact CZ-OE1 2.61Å; R72-E107 IonicContact NE-OE1 3.1Å; R72-E107 PolarHBondContact NE-OE1 3.32Å; R72-E107 IonicContact NH2-OE1 3.35Å; R72-E107 PolarHBondContact NH2-OE1 2.86Å; R72-L676 HydrophobicContact CG-CD1 4.48Å
73	V	86.9	Confident	81.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-40.5	174.5	172.4	0	0	0	0	111.9	N69 T70 M77 F669 R672 L673 L676	N69-V73 WeakPolarHBondContact O-CG2 3.42Å; N69-V73 PolarHBondContact O-N 3.05Å; T70-V73 PolarHBondContact O-N 3.03Å; V73-M77 VanDerWaalsContact O-CB 3.29Å; V73-M77 WeakPolarHBondContact O-CB 3.3Å; V73-M77 PolarHBondContact O-N 3.33Å; V73-F669 HydrophobicContact CB-CE2 4.39Å; V73-F669 HydrophobicContact CG1-CD2 3.73Å; V73-F669 HydrophobicContact CG1-CE2 3.84Å; V73-R672 HydrophobicContact CG1-CB 3.52Å; V73-L673 HydrophobicContact CG2-CB 4.35Å; V73-L673 HydrophobicContact CG2-CD1 3.9Å; V73-L676 HydrophobicContact CG2-CB 4.22Å; V73-L676 HydrophobicContact CG2-CD1 3.95Å
74	L	89.9	Confident	82	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-58	-47.6	170.8	-95.2	166.4	0	0	0	111.5	T70 I71 M77 F78 V89 I91 L104 I524 F669	T70-L74 PolarHBondContact O-N 3.08Å; I71-L74 WeakPolarHBondContact O-CB 3.48Å; I71-L74 PolarHBondContact O-N 2.75Å; L74-M77 HydrophobicContact CD2-CE 3.77Å; L74-M77 PolarHBondContact O-N 3.3Å; L74-F78 HydrophobicContact CB-CE2 4.18Å; L74-F78 HydrophobicContact CD2-CE2 3.71Å; L74-F78 HydrophobicContact CD2-CZ 3.64Å; L74-F78 WeakPolarHBondContact O-CD2 3.33Å; L74-F78 WeakPolarHBondContact O-CG 3.35Å; L74-F78 PolarHBondContact O-N 3.32Å; L74-V89 HydrophobicContact CD2-CG1 4.08Å; L74-V89 HydrophobicContact CD2-CG2 4.07Å; L74-I91 HydrophobicContact CD1-CD1 3.91Å; L74-I91 HydrophobicContact CD1-CG1 4.41Å; L74-L104 HydrophobicContact CB-CD1 4.1Å; L74-I524 HydrophobicContact CD1-CD1 3.77Å; L74-I524 HydrophobicContact CD2-CD1 4.08Å; L74-I524 HydrophobicContact CG-CD1 4.04Å; L74-F669 HydrophobicContact CG-CE2 4.07Å
75	A	88	Confident	82.9	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-61	-47.9	-179	0	0	0	0	0	112.1	I71 R72 F78 T79 L104 E107 L108 L111	I71-A75 WeakPolarHBondContact O-CB 3.25Å; I71-A75 PolarHBondContact O-N 3.03Å; R72-A75 PolarHBondContact O-N 3.27Å; A75-F78 PolarHBondContact O-N 3.06Å; A75-T79 PolarHBondContact O-N 3.41Å; A75-T79 VanDerWaalsContact O-N 3.15Å; A75-T79 PolarHBondContact O-OG1 2.84Å; A75-T79 VanDerWaalsContact O-OG1 3.09Å; A75-L104 HydrophobicContact CB-CD1 4.14Å; A75-E107 HydrophobicContact CB-CB 4.33Å; A75-L108 HydrophobicContact CB-CD2 3.98Å; A75-L108 HydrophobicContact CB-CG 4.15Å; A75-L111 HydrophobicContact CB-CD1 3.72Å
76	D	84.5	Confident	83.4	Confident	24 Å²	24	21.6 Å²	21.6	13%	0.128	11%	0.11	C	C	.	.	H	α-helix	trans	-57.1	-49.4	173.1	172.7	70.5	0	0	0	111.8	R72 F78 T79 C80 R672	R72-D76 PolarHBondContact O-N 3.48Å; D76-F78 VanDerWaalsContact C-N 3.27Å; D76-F78 PolarHBondContact O-N 3.31Å; D76-T79 WeakPolarHBondContact CA-OG1 3.25Å; D76-T79 CarbonylContact O-C 3.54Å; D76-T79 PolarHBondContact O-N 3.37Å; D76-T79 VanDerWaalsContact O-N 3.09Å; D76-T79 PolarHBondContact O-OG1 2.98Å; D76-C80 WeakPolarHBondContact O-CB 3.43Å; D76-C80 PolarHBondContact O-N 3.04Å; D76-R672 VanDerWaalsContact OD2-CD 3.3Å; D76-R672 WeakPolarHBondContact OD2-CD 3.36Å; D76-R672 IonicContact OD2-CZ 3.83Å; D76-R672 IonicContact OD2-NE 3.42Å; D76-R672 PolarHBondContact OD2-NE 3.17Å; D76-R672 IonicContact OD2-NH2 2.69Å
77	M	85.8	Confident	83.8	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-59.2	-37.1	-178.4	-179.4	173.6	54.9	0	0	112.4	V73 L74 S83 M87 L522 L665 F669	V73-M77 VanDerWaalsContact O-CB 3.29Å; V73-M77 WeakPolarHBondContact O-CB 3.3Å; V73-M77 PolarHBondContact O-N 3.33Å; L74-M77 HydrophobicContact CD2-CE 3.77Å; L74-M77 PolarHBondContact O-N 3.3Å; M77-S83 WeakPolarHBondContact O-CB 3.32Å; M77-S83 PolarHBondContact O-OG 3.2Å; M77-M87 HydrophobicContact CE-CE 3.54Å; M77-M87 HydrophobicContact SD-CE 4.33Å; M77-L522 HydrophobicContact CE-CD2 3.79Å; M77-L665 HydrophobicContact SD-CD1 3.81Å; M77-F669 HydrophobicContact CE-CB 4.25Å; M77-F669 HydrophobicContact CE-CD2 3.67Å; M77-F669 HydrophobicContact CE-CE2 4.49Å; M77-F669 HydrophobicContact CE-CG 4.32Å; M77-F669 HydrophobicContact SD-CB 3.95Å; M77-F669 HydrophobicContact SD-CD2 4.31Å
78	F	87	Confident	84.1	Confident	1 Å²	1	19.6 Å²	19.6	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-72	-35.9	175.4	-64.3	-51.8	0	0	0	113.5	L74 A75 D76 F85 M87 V89 L104 L108 R431 I433 A467 V469	L74-F78 HydrophobicContact CB-CE2 4.18Å; L74-F78 HydrophobicContact CD2-CE2 3.71Å; L74-F78 HydrophobicContact CD2-CZ 3.64Å; L74-F78 WeakPolarHBondContact O-CD2 3.33Å; L74-F78 WeakPolarHBondContact O-CG 3.35Å; L74-F78 PolarHBondContact O-N 3.32Å; A75-F78 PolarHBondContact O-N 3.06Å; D76-F78 VanDerWaalsContact C-N 3.27Å; D76-F78 PolarHBondContact O-N 3.31Å; F78-F85 HydrophobicContact CD1-CZ 4.25Å; F78-M87 HydrophobicContact CD1-SD 4.2Å; F78-M87 HydrophobicContact CE1-CE 3.83Å; F78-M87 HydrophobicContact CE1-SD 3.71Å; F78-M87 HydrophobicContact CZ-CE 4.41Å; F78-V89 HydrophobicContact CE1-CG2 4.24Å; F78-V89 HydrophobicContact CZ-CG2 3.89Å; F78-L104 HydrophobicContact CE2-CD1 4.47Å; F78-L104 HydrophobicContact CE2-CD2 4.35Å; F78-L108 HydrophobicContact CB-CD2 4.36Å; F78-L108 HydrophobicContact CD2-CD2 4.41Å; F78-R431 PolarHBondContact O-NH1 3.14Å; F78-I433 HydrophobicContact CB-CD1 3.46Å; F78-I433 VanDerWaalsContact CB-CD1 3.46Å; F78-I433 HydrophobicContact CB-CG1 4.41Å; F78-I433 HydrophobicContact CD2-CD1 3.86Å; F78-I433 HydrophobicContact CE2-CG2 4.43Å; F78-I433 HydrophobicContact CG-CD1 3.73Å; F78-I433 HydrophobicContact CG-CG1 4.42Å; F78-A467 HydrophobicContact CD1-CB 3.96Å; F78-A467 HydrophobicContact CE1-CB 3.61Å; F78-A467 HydrophobicContact CZ-CB 4.37Å; F78-V469 HydrophobicContact CE2-CG2 3.93Å; F78-V469 HydrophobicContact CZ-CG2 3.56Å
79	T	82.7	Confident	84.5	Confident	26 Å²	26	19.1 Å²	19.1	16%	0.16	9%	0.094	C	C	.	.	H	α-helix	trans	-76	-24.8	175.3	46.8	0	0	0	0	113.5	A75 D76 R81 L111 V215 V217	A75-T79 PolarHBondContact O-N 3.41Å; A75-T79 VanDerWaalsContact O-N 3.15Å; A75-T79 PolarHBondContact O-OG1 2.84Å; A75-T79 VanDerWaalsContact O-OG1 3.09Å; D76-T79 WeakPolarHBondContact CA-OG1 3.25Å; D76-T79 CarbonylContact O-C 3.54Å; D76-T79 PolarHBondContact O-N 3.37Å; D76-T79 VanDerWaalsContact O-N 3.09Å; D76-T79 PolarHBondContact O-OG1 2.98Å; T79-R81 PolarHBondContact O-N 2.95Å; T79-L111 HydrophobicContact CG2-CB 4.29Å; T79-L111 HydrophobicContact CG2-CD1 3.95Å; T79-V215 WeakPolarHBondContact O-CB 3.43Å; T79-V217 HydrophobicContact CG2-CG2 3.87Å
80	C	81.3	Confident	84.8	Confident	13 Å²	13	19.1 Å²	19.1	9%	0.088	9%	0.094	C	C	.	.			trans	-61.1	126.6	-176.5	-176.3	0	0	0	0	112.1	D76 L82 S83 R431 R672	D76-C80 WeakPolarHBondContact O-CB 3.43Å; D76-C80 PolarHBondContact O-N 3.04Å; C80-L82 PolarHBondContact O-N 3.31Å; C80-S83 PolarHBondContact O-N 3.42Å; C80-S83 PolarHBondContact O-OG 2.94Å; C80-R431 PolarHBondContact O-NH1 2.87Å; C80-R431 PolarHBondContact O-NH2 3.37Å; C80-R672 VanDerWaalsContact CB-NH2 3.32Å; C80-R672 PolarHBondContact SG-NH2 3.08Å
81	R	76.5	Confident	84.9	Confident	65 Å²	65	19.1 Å²	19.1	25%	0.245	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-33.3	-178.5	-66.7	178.5	-70	177.1	1	114	T79 K212 V215 R431 E636	T79-R81 PolarHBondContact O-N 2.95Å; R81-K212 PolarHBondContact NH1-O 3.49Å; R81-V215 HydrophobicContact CG-CG2 4.15Å; R81-R431 PolarHBondContact O-NH2 3.48Å; R81-E636 IonicContact CZ-OE1 2.63Å; R81-E636 IonicContact NH2-OE1 3.77Å; R81-E636 PolarHBondContact NH2-OE1 3.3Å; R81-E636 IonicContact NH2-OE2 2.82Å; R81-E636 PolarHBondContact NH2-OE2 3.45Å
82	L	73.6	Confident	84.7	Confident	69 Å²	69	19.2 Å²	19.2	36%	0.361	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-6.5	-172.9	-60.9	172.7	0	0	0	115.2	C80 V639	C80-L82 PolarHBondContact O-N 3.31Å; L82-V639 HydrophobicContact CB-CB 4.42Å; L82-V639 HydrophobicContact CB-CG2 3.82Å; L82-V639 WeakPolarHBondContact O-CG2 3.46Å
83	S	79.5	Confident	84.4	Confident	13 Å²	13	16.6 Å²	16.6	9%	0.091	9%	0.086	C	C	.	.			trans	-70.7	138.7	-180	49.5	0	0	0	0	112.7	M77 C80 F85 R431	M77-S83 WeakPolarHBondContact O-CB 3.32Å; M77-S83 PolarHBondContact O-OG 3.2Å; C80-S83 PolarHBondContact O-N 3.42Å; C80-S83 PolarHBondContact O-OG 2.94Å; S83-F85 WeakPolarHBondContact O-CD2 3.48Å; S83-R431 PolarHBondContact O-NH2 3.13Å; S83-R431 PolarHBondContact OG-NH1 2.99Å
84	N	78.5	Confident	83.5	Confident	80 Å²	80	20.4 Å²	20.4	43%	0.428	10%	0.104	S	C	.	.			trans	-83.8	141.4	-176.8	-77.7	-49	0	0	0	112.1
85	F	83.5	Confident	82.3	Confident	29 Å²	29	26 Å²	26	13%	0.127	13%	0.129	C	C	.	.	S	Bend	trans	-130.2	156.5	178.8	-78.3	-108.5	0	0	0	109.8	F78 S83 R431 A467	F78-F85 HydrophobicContact CD1-CZ 4.25Å; S83-F85 WeakPolarHBondContact O-CD2 3.48Å; F85-R431 HydrophobicContact CE1-CB 4.37Å; F85-R431 HydrophobicContact CZ-CG 4.5Å; F85-A467 HydrophobicContact CD1-CB 4.32Å; F85-A467 HydrophobicContact CE1-CB 3.59Å; F85-A467 HydrophobicContact CZ-CB 4.3Å
86	P	86.7	Confident	80.9	Confident	9 Å²	9	30.3 Å²	30.3	6%	0.058	15%	0.152	C	C	.	.	S	Bend	cis	-69	160.9	-3.4	28.1	-34.3	0	0	0	113.4	L458 I462 A464 V466	P86-L458 HydrophobicContact CB-CB 4.42Å; P86-L458 HydrophobicContact CB-CD2 3.88Å; P86-I462 WeakPolarHBondContact CD-O 3.27Å; P86-A464 WeakPolarHBondContact CA-O 3.34Å; P86-A464 HydrophobicContact CB-CB 4.2Å; P86-V466 WeakPolarHBondContact CA-O 3.39Å
87	M	87.1	Confident	79.6	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	144.6	-175.8	179.6	169.7	172.3	0	0	111.3	M77 F78 V89 V466 A467 I468 L522 L665	M77-M87 HydrophobicContact CE-CE 3.54Å; M77-M87 HydrophobicContact SD-CE 4.33Å; F78-M87 HydrophobicContact CD1-SD 4.2Å; F78-M87 HydrophobicContact CE1-CE 3.83Å; F78-M87 HydrophobicContact CE1-SD 3.71Å; F78-M87 HydrophobicContact CZ-CE 4.41Å; M87-V89 HydrophobicContact CE-CG2 3.29Å; M87-V89 HydrophobicContact CG-CG2 4.22Å; M87-V89 HydrophobicContact SD-CG2 4.43Å; M87-V466 PolarHBondContact N-O 3.5Å; M87-V466 VanDerWaalsContact N-O 3.11Å; M87-A467 HydrophobicContact CB-CB 4.21Å; M87-A467 CarbonylContact O-C 3.39Å; M87-A467 VanDerWaalsContact O-CA 3.31Å; M87-A467 WeakPolarHBondContact O-CA 3.34Å; M87-I468 PolarHBondContact O-N 2.86Å; M87-L522 HydrophobicContact CE-CB 4.32Å; M87-L522 HydrophobicContact CE-CD2 3.87Å; M87-L665 HydrophobicContact CE-CD1 3.81Å; M87-L665 HydrophobicContact CE-CD2 3.7Å; M87-L665 HydrophobicContact CE-CG 4.04Å; M87-L665 HydrophobicContact CG-CD2 3.94Å; M87-L665 HydrophobicContact SD-CD1 3.77Å; M87-L665 HydrophobicContact SD-CD2 3.86Å; M87-L665 HydrophobicContact SD-CG 4.37Å
88	T	89	Confident	78.5	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.6	170.6	45.7	0	0	0	0	109.8	I454 L458 I468 S519 L520 Y521 L522	T88-I454 HydrophobicContact CG2-CG2 4Å; T88-L458 HydrophobicContact CG2-CD1 3.24Å; T88-I468 CarbonylContact C-O 3.58Å; T88-I468 WeakPolarHBondContact CA-O 3.46Å; T88-I468 HydrophobicContact CG2-CB 4.43Å; T88-S519 PolarHBondContact OG1-O 3.16Å; T88-L520 VanDerWaalsContact OG1-CA 3.3Å; T88-L520 WeakPolarHBondContact OG1-CA 3.47Å; T88-Y521 PolarHBondContact O-N 2.98Å; T88-Y521 VanDerWaalsContact OG1-CD2 3.29Å; T88-Y521 WeakPolarHBondContact OG1-CD2 3.42Å; T88-Y521 PolarHBondContact OG1-N 3.33Å; T88-L522 PolarHBondContact O-N 3.19Å
89	V	90.6	Very high	78	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.5	176.9	-177.9	0	0	0	0	108.8	L74 F78 M87 I91 I468 V469 L470 L522 I524	L74-V89 HydrophobicContact CD2-CG1 4.08Å; L74-V89 HydrophobicContact CD2-CG2 4.07Å; F78-V89 HydrophobicContact CE1-CG2 4.24Å; F78-V89 HydrophobicContact CZ-CG2 3.89Å; M87-V89 HydrophobicContact CE-CG2 3.29Å; M87-V89 HydrophobicContact CG-CG2 4.22Å; M87-V89 HydrophobicContact SD-CG2 4.43Å; V89-I91 HydrophobicContact CG1-CG1 4.02Å; V89-I468 PolarHBondContact N-O 2.87Å; V89-V469 HydrophobicContact CB-CB 4.49Å; V89-V469 HydrophobicContact CB-CG1 4.1Å; V89-V469 HydrophobicContact CB-CG2 4.34Å; V89-V469 HydrophobicContact CG1-CG1 4.19Å; V89-L470 PolarHBondContact O-N 2.97Å; V89-L522 VanDerWaalsContact CA-O 3.31Å; V89-L522 WeakPolarHBondContact CA-O 3.44Å; V89-L522 HydrophobicContact CG2-CB 4.42Å; V89-I524 HydrophobicContact CG1-CD1 3.66Å; V89-I524 HydrophobicContact CG1-CG1 4.28Å
90	G	89	Confident	77.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.8	164.9	0	0	0	0	0	109.1	L522 I524	G90-L522 PolarHBondContact N-O 3.2Å; G90-L522 VanDerWaalsContact N-O 3.07Å; G90-I524 PolarHBondContact O-N 2.96Å
91	I	89.3	Confident	78.1	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	103.8	168.4	-58.7	-178.2	0	0	0	106.4	L74 V89 T93 L101 L104 V469 L470 E471 A472 L526	L74-I91 HydrophobicContact CD1-CD1 3.91Å; L74-I91 HydrophobicContact CD1-CG1 4.41Å; V89-I91 HydrophobicContact CG1-CG1 4.02Å; I91-T93 HydrophobicContact CG2-CG2 4.14Å; I91-L101 HydrophobicContact CD1-CD2 4.38Å; I91-L104 HydrophobicContact CD1-CD2 4.48Å; I91-V469 HydrophobicContact CD1-CG1 3.54Å; I91-V469 HydrophobicContact CG1-CG1 3.9Å; I91-L470 PolarHBondContact N-O 3.22Å; I91-E471 WeakPolarHBondContact O-CA 3.09Å; I91-A472 PolarHBondContact O-N 3.07Å; I91-A472 VanDerWaalsContact O-N 3.11Å; I91-L526 HydrophobicContact CG2-CD1 3.5Å; I91-L526 VanDerWaalsContact CG2-CD1 3.5Å; I91-L526 HydrophobicContact CG2-CG 4.17Å
92	F	85.1	Confident	78.4	Confident	3 Å²	3	44.9 Å²	44.9	1%	0.013	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124.8	-178	-68.1	-59.6	0	0	0	110.5	A472 F474 V516 L520 P523 I524 Y525 L526	F92-A472 WeakPolarHBondContact CA-O 3.45Å; F92-A472 HydrophobicContact CE1-CB 4.44Å; F92-F474 HydrophobicContact CB-CB 4.06Å; F92-F474 HydrophobicContact CD1-CB 3.9Å; F92-F474 AromaticContact CD1-CD2 3.82Å; F92-F474 HydrophobicContact CD1-CD2 3.82Å; F92-F474 HydrophobicContact CD1-CG 4.31Å; F92-F474 HydrophobicContact CD2-CD2 4.4Å; F92-F474 AromaticContact CE1-CD2 3.93Å; F92-F474 HydrophobicContact CE1-CD2 3.93Å; F92-F474 HydrophobicContact CE2-CD2 4.49Å; F92-F474 HydrophobicContact CG-CB 4.14Å; F92-F474 HydrophobicContact CG-CD2 4.07Å; F92-F474 HydrophobicContact CG-CG 4.42Å; F92-F474 HydrophobicContact CZ-CD2 4.27Å; F92-V516 HydrophobicContact CE2-CG1 3.93Å; F92-V516 HydrophobicContact CE2-CG2 4.22Å; F92-V516 HydrophobicContact CZ-CG1 4.3Å; F92-V516 HydrophobicContact CZ-CG2 3.81Å; F92-L520 HydrophobicContact CE2-CD1 3.99Å; F92-L520 HydrophobicContact CZ-CD1 3.75Å; F92-P523 HydrophobicContact CD2-CB 4.5Å; F92-P523 HydrophobicContact CE2-CB 4.15Å; F92-I524 PolarHBondContact N-O 2.85Å; F92-Y525 HydrophobicContact CB-CD1 3.7Å; F92-Y525 HydrophobicContact CB-CE1 4.03Å; F92-Y525 HydrophobicContact CB-CG 4.45Å; F92-Y525 HydrophobicContact CD2-CD1 4.03Å; F92-Y525 AromaticContact CD2-CE1 3.66Å; F92-Y525 HydrophobicContact CD2-CE1 3.66Å; F92-Y525 AromaticContact CD2-CZ 3.93Å; F92-Y525 HydrophobicContact CE2-CE1 4.42Å; F92-Y525 HydrophobicContact CG-CD1 4.19Å; F92-Y525 HydrophobicContact CG-CE1 4.02Å; F92-L526 PolarHBondContact O-N 2.95Å
93	T	78	Confident	79	Confident	7 Å²	7	44.3 Å²	44.3	4%	0.043	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	146.2	-173.1	63.7	0	0	0	0	111.3	I91 Y100 A472 N473 L526	I91-T93 HydrophobicContact CG2-CG2 4.14Å; T93-Y100 HydrophobicContact CG2-CD2 3.55Å; T93-Y100 HydrophobicContact CG2-CE2 3.58Å; T93-A472 PolarHBondContact N-O 3.4Å; T93-N473 WeakPolarHBondContact O-CA 3.38Å; T93-N473 VanDerWaalsContact O-CG 3.22Å; T93-N473 PolarHBondContact O-OD1 3.22Å; T93-L526 HydrophobicContact CG2-CB 4.47Å; T93-L526 HydrophobicContact CG2-CD1 4.36Å
94	Q	68.4	Low	79.3	Confident	81 Å²	81	43.7 Å²	43.7	38%	0.379	22%	0.218	S	C	.	.	S	Bend	trans	-95.4	-28.8	175.6	-165.2	-176.2	75.3	0	0	112.1	N473 E527	Q94-N473 PolarHBondContact O-ND2 3.44Å; Q94-E527 PolarHBondContact NE2-OE1 2.9Å
95	Q	65	Low	79.7	Confident	117 Å²	117	40.8 Å²	40.8	55%	0.547	21%	0.206	S	C	.	.			trans	-106.9	119.3	178.5	-66.9	-179.9	-13.5	0	0	111	N97	Q95-N97 PolarHBondContact O-N 2.88Å; Q95-N97 VanDerWaalsContact O-N 3.1Å
96	N	58.1	Low	79.8	Confident	92 Å²	92	42 Å²	42	49%	0.492	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	1.3	-179.3	-65.9	3	0	0	0	114.8	N473	N96-N473 PolarHBondContact OD1-ND2 3.47Å
97	N	57.6	Low	79.5	Confident	154 Å²	154	43.5 Å²	43.5	82%	0.824	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	14	-164.1	-66.8	6.1	0	0	0	114.5	Q95	Q95-N97 PolarHBondContact O-N 2.88Å; Q95-N97 VanDerWaalsContact O-N 3.1Å
98	K	62.9	Low	79.4	Confident	92 Å²	92	43.4 Å²	43.4	40%	0.4	22%	0.223	S	C	.	.			trans	-135.4	113.4	-175.7	-69.5	172	178.8	165.1	0	109.7	Y100	K98-Y100 VanDerWaalsContact C-N 3.28Å; K98-Y100 HydrophobicContact CB-CD1 4.19Å; K98-Y100 HydrophobicContact CB-CD2 4.2Å; K98-Y100 HydrophobicContact CB-CE1 3.8Å; K98-Y100 HydrophobicContact CB-CE2 3.82Å; K98-Y100 HydrophobicContact CB-CG 4.43Å; K98-Y100 HydrophobicContact CD-CE1 3.94Å; K98-Y100 HydrophobicContact CD-CE2 4.38Å; K98-Y100 WeakPolarHBondContact CD-OH 3.24Å; K98-Y100 HydrophobicContact CG-CE1 4.44Å; K98-Y100 PolarHBondContact O-N 3.38Å
99	E	74.6	Confident	79.1	Confident	124 Å²	124	47.5 Å²	47.5	58%	0.579	24%	0.242	S	C	*	.			trans	-76.9	73.2	179.6	-61.9	-173.8	166.9	0	0	111.7	L101 S102 Q103	E99-L101 VanDerWaalsContact C-N 3.28Å; E99-L101 PolarHBondContact O-N 3.25Å; E99-S102 WeakPolarHBondContact CB-OG 3.49Å; E99-S102 PolarHBondContact O-N 3.21Å; E99-S102 VanDerWaalsContact O-N 3.09Å; E99-S102 PolarHBondContact O-OG 3.38Å; E99-S102 VanDerWaalsContact OE2-CB 3.27Å; E99-S102 WeakPolarHBondContact OE2-CB 3.39Å; E99-S102 PolarHBondContact OE2-OG 3.07Å; E99-Q103 PolarHBondContact O-N 3.01Å; E99-Q103 VanDerWaalsContact O-N 3.08Å
100	Y	81.4	Confident	78.5	Confident	22 Å²	22	50.6 Å²	50.6	9%	0.086	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-31.8	-175.4	-64.7	-57.4	0	0	0	112.5	A67 I71 T93 K98 L104 E471 L526	A67-Y100 HydrophobicContact CB-CD1 4.26Å; A67-Y100 HydrophobicContact CB-CE1 3.44Å; A67-Y100 VanDerWaalsContact CB-CE1 3.44Å; I71-Y100 HydrophobicContact CD1-CD1 3.51Å; I71-Y100 HydrophobicContact CD1-CE1 4.48Å; I71-Y100 HydrophobicContact CD1-CG 3.99Å; T93-Y100 HydrophobicContact CG2-CD2 3.55Å; T93-Y100 HydrophobicContact CG2-CE2 3.58Å; K98-Y100 VanDerWaalsContact C-N 3.28Å; K98-Y100 HydrophobicContact CB-CD1 4.19Å; K98-Y100 HydrophobicContact CB-CD2 4.2Å; K98-Y100 HydrophobicContact CB-CE1 3.8Å; K98-Y100 HydrophobicContact CB-CE2 3.82Å; K98-Y100 HydrophobicContact CB-CG 4.43Å; K98-Y100 HydrophobicContact CD-CE1 3.94Å; K98-Y100 HydrophobicContact CD-CE2 4.38Å; K98-Y100 WeakPolarHBondContact CD-OH 3.24Å; K98-Y100 HydrophobicContact CG-CE1 4.44Å; K98-Y100 PolarHBondContact O-N 3.38Å; Y100-L104 WeakPolarHBondContact O-CB 3.3Å; Y100-L104 PolarHBondContact O-N 3.23Å; Y100-E471 WeakPolarHBondContact CD2-OE1 3.5Å; Y100-E471 PolarHBondContact N-OE2 2.93Å; Y100-L526 HydrophobicContact CD1-CD1 4.4Å; Y100-L526 HydrophobicContact CD2-CD1 3.74Å; Y100-L526 HydrophobicContact CE1-CD1 4.41Å; Y100-L526 HydrophobicContact CE2-CD1 3.75Å; Y100-L526 HydrophobicContact CG-CD1 4.03Å
101	L	85	Confident	77.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-68.3	-32.1	171	-75.1	178.7	0	0	0	114.5	I91 E99 L104 A105 Y221 C435 L436 D437 V469 E471	I91-L101 HydrophobicContact CD1-CD2 4.38Å; E99-L101 VanDerWaalsContact C-N 3.28Å; E99-L101 PolarHBondContact O-N 3.25Å; L101-L104 HydrophobicContact CD2-CD2 4.09Å; L101-L104 PolarHBondContact O-N 3.44Å; L101-A105 VanDerWaalsContact O-CB 3.28Å; L101-A105 WeakPolarHBondContact O-CB 3.45Å; L101-A105 PolarHBondContact O-N 3.12Å; L101-Y221 HydrophobicContact CB-CD2 4.48Å; L101-Y221 HydrophobicContact CB-CE2 3.82Å; L101-C435 HydrophobicContact CB-CB 4.38Å; L101-C435 HydrophobicContact CD1-CB 4.22Å; L101-C435 HydrophobicContact CD2-CB 3.88Å; L101-C435 HydrophobicContact CG-CB 4.39Å; L101-L436 VanDerWaalsContact CD1-O 3.31Å; L101-L436 WeakPolarHBondContact CD1-O 3.36Å; L101-D437 HydrophobicContact CD1-CB 4.16Å; L101-V469 HydrophobicContact CD2-CB 3.95Å; L101-V469 HydrophobicContact CD2-CG1 3.55Å; L101-E471 WeakPolarHBondContact CB-OE2 3.34Å; L101-E471 HydrophobicContact CD1-CB 3.46Å; L101-E471 VanDerWaalsContact CD1-CB 3.46Å; L101-E471 HydrophobicContact CG-CB 3.66Å; L101-E471 VanDerWaalsContact CG-OE2 3.28Å; L101-E471 WeakPolarHBondContact CG-OE2 3.47Å; L101-E471 PolarHBondContact N-OE2 3.04Å
102	S	83.4	Confident	77	Confident	44 Å²	44	54.5 Å²	54.5	31%	0.308	28%	0.28	S	S	.	.	H	α-helix	trans	-74.6	-36.8	177.1	85.5	0	0	0	0	110.4	E99 A105 S106	E99-S102 WeakPolarHBondContact CB-OG 3.49Å; E99-S102 PolarHBondContact O-N 3.21Å; E99-S102 VanDerWaalsContact O-N 3.09Å; E99-S102 PolarHBondContact O-OG 3.38Å; E99-S102 VanDerWaalsContact OE2-CB 3.27Å; E99-S102 WeakPolarHBondContact OE2-CB 3.39Å; E99-S102 PolarHBondContact OE2-OG 3.07Å; S102-A105 PolarHBondContact O-N 3.48Å; S102-S106 WeakPolarHBondContact O-CB 3.48Å; S102-S106 PolarHBondContact O-N 3.32Å
103	Q	85.2	Confident	76.2	Confident	58 Å²	58	62.5 Å²	62.5	27%	0.271	31%	0.309	S	S	.	.	H	α-helix	trans	-59.4	-50.5	167.3	-173.5	178.2	1.7	0	0	111.6	I71 E99 A105 S106 E107	I71-Q103 HydrophobicContact CD1-CB 4.31Å; I71-Q103 HydrophobicContact CD1-CG 4.36Å; I71-Q103 HydrophobicContact CG2-CG 4.15Å; E99-Q103 PolarHBondContact O-N 3.01Å; E99-Q103 VanDerWaalsContact O-N 3.08Å; Q103-A105 PolarHBondContact O-N 3.1Å; Q103-S106 PolarHBondContact O-N 3.39Å; Q103-S106 VanDerWaalsContact O-N 3.1Å; Q103-S106 PolarHBondContact O-OG 2.83Å; Q103-E107 PolarHBondContact O-N 3.11Å
104	L	87.9	Confident	75.1	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.4	-44.9	178.1	177	61.9	0	0	0	112.1	I71 L74 A75 F78 I91 Y100 L101 S106 E107 L108 V469	I71-L104 HydrophobicContact CG2-CB 3.79Å; I71-L104 HydrophobicContact CG2-CD1 4.02Å; L74-L104 HydrophobicContact CB-CD1 4.1Å; A75-L104 HydrophobicContact CB-CD1 4.14Å; F78-L104 HydrophobicContact CE2-CD1 4.47Å; F78-L104 HydrophobicContact CE2-CD2 4.35Å; I91-L104 HydrophobicContact CD1-CD2 4.48Å; Y100-L104 WeakPolarHBondContact O-CB 3.3Å; Y100-L104 PolarHBondContact O-N 3.23Å; L101-L104 HydrophobicContact CD2-CD2 4.09Å; L101-L104 PolarHBondContact O-N 3.44Å; L104-S106 VanDerWaalsContact C-N 3.29Å; L104-S106 PolarHBondContact O-N 3.48Å; L104-E107 PolarHBondContact O-N 3.05Å; L104-L108 HydrophobicContact CD1-CD1 3.9Å; L104-L108 HydrophobicContact CD1-CG 4.15Å; L104-L108 HydrophobicContact CG-CD1 3.86Å; L104-L108 WeakPolarHBondContact O-CB 3.05Å; L104-L108 WeakPolarHBondContact O-CD1 3.47Å; L104-L108 VanDerWaalsContact O-CG 3.27Å; L104-L108 WeakPolarHBondContact O-CG 3.38Å; L104-L108 PolarHBondContact O-N 3.01Å; L104-V469 HydrophobicContact CD2-CB 4.45Å; L104-V469 HydrophobicContact CD2-CG1 3.95Å; L104-V469 HydrophobicContact CD2-CG2 4.29Å
105	A	86.3	Confident	74.8	Confident	19 Å²	19	65.4 Å²	65.4	16%	0.157	33%	0.326	C	S	.	.	H	α-helix	trans	-62.9	-35.9	176	0	0	0	0	0	112.2	L101 S102 Q103 H109 V219	L101-A105 VanDerWaalsContact O-CB 3.28Å; L101-A105 WeakPolarHBondContact O-CB 3.45Å; L101-A105 PolarHBondContact O-N 3.12Å; S102-A105 PolarHBondContact O-N 3.48Å; Q103-A105 PolarHBondContact O-N 3.1Å; A105-H109 WeakPolarHBondContact O-CB 3.41Å; A105-H109 PolarHBondContact O-N 3.1Å; A105-V219 HydrophobicContact CB-CG1 3.93Å
106	S	84.7	Confident	74.2	Confident	55 Å²	55	63.6 Å²	63.6	39%	0.385	32%	0.32	S	S	.	.	H	α-helix	trans	-69.3	-45.4	176	80.6	0	0	0	0	112.6	S102 Q103 L104 H109 N110	S102-S106 WeakPolarHBondContact O-CB 3.48Å; S102-S106 PolarHBondContact O-N 3.32Å; Q103-S106 PolarHBondContact O-N 3.39Å; Q103-S106 VanDerWaalsContact O-N 3.1Å; Q103-S106 PolarHBondContact O-OG 2.83Å; L104-S106 VanDerWaalsContact C-N 3.29Å; L104-S106 PolarHBondContact O-N 3.48Å; S106-H109 PolarHBondContact O-N 3.5Å; S106-N110 PolarHBondContact O-N 3.24Å; S106-N110 PolarHBondContact O-ND2 3.43Å
107	E	81.7	Confident	74.2	Confident	40 Å²	40	64 Å²	64	19%	0.187	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-45	177.1	-69.6	-76.9	-133.6	0	0	110.3	R72 A75 Q103 L104 H109 N110 L111	R72-E107 IonicContact CZ-OE1 2.61Å; R72-E107 IonicContact NE-OE1 3.1Å; R72-E107 PolarHBondContact NE-OE1 3.32Å; R72-E107 IonicContact NH2-OE1 3.35Å; R72-E107 PolarHBondContact NH2-OE1 2.86Å; A75-E107 HydrophobicContact CB-CB 4.33Å; Q103-E107 PolarHBondContact O-N 3.11Å; L104-E107 PolarHBondContact O-N 3.05Å; E107-H109 VanDerWaalsContact C-N 3.32Å; E107-H109 PolarHBondContact O-N 3.03Å; E107-N110 WeakPolarHBondContact O-CA 3.32Å; E107-N110 WeakPolarHBondContact O-CB 3.45Å; E107-N110 PolarHBondContact O-N 3.06Å; E107-L111 WeakPolarHBondContact O-CG 3.28Å; E107-L111 PolarHBondContact O-N 3.34Å
108	L	84.6	Confident	74.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-39.3	173.3	-73.8	166.3	0	0	0	112.6	A75 F78 L104 N112 V219 I433	A75-L108 HydrophobicContact CB-CD2 3.98Å; A75-L108 HydrophobicContact CB-CG 4.15Å; F78-L108 HydrophobicContact CB-CD2 4.36Å; F78-L108 HydrophobicContact CD2-CD2 4.41Å; L104-L108 HydrophobicContact CD1-CD1 3.9Å; L104-L108 HydrophobicContact CD1-CG 4.15Å; L104-L108 HydrophobicContact CG-CD1 3.86Å; L104-L108 WeakPolarHBondContact O-CB 3.05Å; L104-L108 WeakPolarHBondContact O-CD1 3.47Å; L104-L108 VanDerWaalsContact O-CG 3.27Å; L104-L108 WeakPolarHBondContact O-CG 3.38Å; L104-L108 PolarHBondContact O-N 3.01Å; L108-N112 WeakPolarHBondContact O-CB 3.46Å; L108-N112 PolarHBondContact O-N 2.96Å; L108-V219 HydrophobicContact CB-CG2 3.7Å; L108-V219 HydrophobicContact CD1-CG2 4.17Å; L108-I433 HydrophobicContact CD1-CB 4.44Å; L108-I433 HydrophobicContact CD1-CD1 3.66Å; L108-I433 HydrophobicContact CD1-CG2 3.96Å; L108-I433 HydrophobicContact CD2-CD1 3.61Å; L108-I433 HydrophobicContact CG-CD1 4.28Å
109	H	81.4	Confident	74.3	Confident	87 Å²	87	58.1 Å²	58.1	40%	0.403	30%	0.304	S	S	.	.	H	α-helix	trans	-69.3	-33.2	174.3	-164.3	-10.8	0	0	0	111.9	A105 S106 E107 R113	A105-H109 WeakPolarHBondContact O-CB 3.41Å; A105-H109 PolarHBondContact O-N 3.1Å; S106-H109 PolarHBondContact O-N 3.5Å; E107-H109 VanDerWaalsContact C-N 3.32Å; E107-H109 PolarHBondContact O-N 3.03Å; H109-R113 PolarHBondContact CE1-NE 3.05Å; H109-R113 VanDerWaalsContact CE1-NE 3.25Å; H109-R113 PolarHBondContact ND1-NE 3.22Å; H109-R113 PolarHBondContact NE2-NH2 3.05Å; H109-R113 WeakPolarHBondContact O-CG 3.31Å; H109-R113 PolarHBondContact O-N 2.95Å
110	N	78.2	Confident	73.9	Confident	65 Å²	65	54.3 Å²	54.3	35%	0.348	29%	0.287	S	S	.	.	H	α-helix	trans	-66	-47.5	173.8	-66.9	-28.2	0	0	0	111.2	S106 E107 N112 R113 L114	S106-N110 PolarHBondContact O-N 3.24Å; S106-N110 PolarHBondContact O-ND2 3.43Å; E107-N110 WeakPolarHBondContact O-CA 3.32Å; E107-N110 WeakPolarHBondContact O-CB 3.45Å; E107-N110 PolarHBondContact O-N 3.06Å; N110-N112 VanDerWaalsContact C-N 3.33Å; N110-N112 PolarHBondContact O-N 3.06Å; N110-R113 WeakPolarHBondContact O-CB 3.4Å; N110-R113 PolarHBondContact O-N 2.75Å; N110-L114 WeakPolarHBondContact O-CG 3.26Å; N110-L114 PolarHBondContact O-N 3.18Å
111	L	75.6	Confident	73.2	Confident	40 Å²	40	61.1 Å²	61.1	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-56.6	-46.4	173.9	-63.5	177.4	0	0	0	111.2	I54 A75 T79 E107 R113 L114 E115	I54-L111 HydrophobicContact CD1-CD2 3.61Å; A75-L111 HydrophobicContact CB-CD1 3.72Å; T79-L111 HydrophobicContact CG2-CB 4.29Å; T79-L111 HydrophobicContact CG2-CD1 3.95Å; E107-L111 WeakPolarHBondContact O-CG 3.28Å; E107-L111 PolarHBondContact O-N 3.34Å; L111-R113 PolarHBondContact O-N 2.83Å; L111-L114 CarbonylContact O-C 3.59Å; L111-L114 PolarHBondContact O-N 3.29Å; L111-E115 PolarHBondContact O-N 3.37Å
112	N	72.9	Confident	72.4	Confident	45 Å²	45	66.8 Å²	66.8	24%	0.241	34%	0.342	C	S	.	.	H	α-helix	trans	-69.4	-9.6	177.6	-158.2	14.4	0	0	0	113.9	L108 N110 V217	L108-N112 WeakPolarHBondContact O-CB 3.46Å; L108-N112 PolarHBondContact O-N 2.96Å; N110-N112 VanDerWaalsContact C-N 3.33Å; N110-N112 PolarHBondContact O-N 3.06Å; N112-V217 PolarHBondContact ND2-O 3.14Å
113	R	67.5	Low	72	Confident	170 Å²	170	67 Å²	67	64%	0.642	34%	0.343	S	S	*	.	H	α-helix	trans	-96.2	-24.1	167.9	-76.5	173.7	-178.2	-178.8	5.3	112.9	H109 N110 L111	H109-R113 PolarHBondContact CE1-NE 3.05Å; H109-R113 VanDerWaalsContact CE1-NE 3.25Å; H109-R113 PolarHBondContact ND1-NE 3.22Å; H109-R113 PolarHBondContact NE2-NH2 3.05Å; H109-R113 WeakPolarHBondContact O-CG 3.31Å; H109-R113 PolarHBondContact O-N 2.95Å; N110-R113 WeakPolarHBondContact O-CB 3.4Å; N110-R113 PolarHBondContact O-N 2.75Å; L111-R113 PolarHBondContact O-N 2.83Å
114	L	55.8	Low	71.8	Confident	112 Å²	112	72.7 Å²	72.7	59%	0.586	37%	0.367	S	S	*	.	H	α-helix	trans	-86	-15.7	175.3	-67.3	164.2	0	0	0	111.7	I54 N110 L111 N116	I54-L114 HydrophobicContact CD1-CB 3.84Å; I54-L114 HydrophobicContact CD1-CD1 3.61Å; I54-L114 HydrophobicContact CD1-CG 4.33Å; N110-L114 WeakPolarHBondContact O-CG 3.26Å; N110-L114 PolarHBondContact O-N 3.18Å; L111-L114 CarbonylContact O-C 3.59Å; L111-L114 PolarHBondContact O-N 3.29Å; L114-N116 PolarHBondContact O-N 3.23Å
115	E	60.9	Low	71.5	Confident	37 Å²	37	74.4 Å²	74.4	17%	0.173	38%	0.376	C	S	.	.	S	Bend	trans	-56.2	103.4	161.6	-148.6	-168.5	177.1	0	0	108.3	Y52 L111 Q428	Y52-E115 HydrophobicContact CD1-CB 4.4Å; Y52-E115 HydrophobicContact CD1-CG 3.43Å; Y52-E115 VanDerWaalsContact CD1-CG 3.43Å; Y52-E115 HydrophobicContact CE1-CG 3.69Å; L111-E115 PolarHBondContact O-N 3.37Å; E115-Q428 VanDerWaalsContact CD-NE2 3.25Å; E115-Q428 PolarHBondContact OE1-NE2 3.01Å; E115-Q428 PolarHBondContact OE2-NE2 3.06Å
116	N	52.6	Low	71.2	Confident	79 Å²	79	73.9 Å²	73.9	42%	0.422	37%	0.371	S	S	.	.			trans	-41.9	134.3	-166.4	-60.9	-75	0	0	0	113.8	Y52 L114 I118	Y52-N116 HydrophobicContact CE1-CB 3.71Å; Y52-N116 VanDerWaalsContact CE1-N 3.28Å; Y52-N116 WeakPolarHBondContact CE1-ND2 3.39Å; L114-N116 PolarHBondContact O-N 3.23Å; N116-I118 PolarHBondContact O-N 2.99Å
117	P	57.2	Low	71	Confident	100 Å²	100	75.7 Å²	75.7	65%	0.649	37%	0.372	S	S	*	.			trans	-57	129.9	-177.4	24.8	-34.9	0	0	0	110.6	P119	P117-P119 VanDerWaalsContact O-CD 3.23Å; P117-P119 WeakPolarHBondContact O-CD 3.21Å
118	I	61.3	Low	71.1	Confident	53 Å²	53	78.1 Å²	78.1	27%	0.272	39%	0.385	S	S	.	.			trans	-46.1	106.2	-172.3	-57.9	165.9	0	0	0	109.7	N116 L120 Y185 A188	N116-I118 PolarHBondContact O-N 2.99Å; I118-L120 PolarHBondContact O-N 2.95Å; I118-Y185 HydrophobicContact CD1-CE2 4.5Å; I118-A188 HydrophobicContact CB-CB 4.45Å; I118-A188 HydrophobicContact CG2-CB 4.11Å
119	P	62.9	Low	71.1	Confident	71 Å²	71	81.1 Å²	81.1	46%	0.461	40%	0.399	S	S	.	.			trans	-68.3	136.1	-175.9	26.2	-33	0	0	0	108.5	P117 K121	P117-P119 VanDerWaalsContact O-CD 3.23Å; P117-P119 WeakPolarHBondContact O-CD 3.21Å; P119-K121 PolarHBondContact O-N 3.45Å
120	L	65.1	Low	71.2	Confident	44 Å²	44	79.4 Å²	79.4	23%	0.23	40%	0.395	C	S	.	.			trans	-70.1	81.6	-179.7	-162.2	163.4	0	0	0	109.5	I118 F122 L126 I187	I118-L120 PolarHBondContact O-N 2.95Å; L120-F122 PolarHBondContact O-N 3.29Å; L120-L126 HydrophobicContact CD2-CD1 4.42Å; L120-L126 HydrophobicContact CD2-CD2 3.8Å; L120-I187 HydrophobicContact CD1-CB 4.4Å; L120-I187 HydrophobicContact CD1-CG2 4.17Å
121	K	68.3	Low	71.6	Confident	164 Å²	164	79.5 Å²	79.5	71%	0.713	40%	0.395	S	S	*	.			trans	-68	126	175.8	-65.8	-173.2	-179.2	-173.1	0	108.4	P119 S123	P119-K121 PolarHBondContact O-N 3.45Å; K121-S123 VanDerWaalsContact C-N 3.27Å; K121-S123 PolarHBondContact O-N 3.26Å
122	F	68.1	Low	72.1	Confident	119 Å²	119	80.8 Å²	80.8	52%	0.522	40%	0.404	S	S	.	.			trans	-66.6	82.6	178.1	-70.1	-77.4	0	0	0	111.5	L120 L126 F127 I169	L120-F122 PolarHBondContact O-N 3.29Å; F122-L126 HydrophobicContact CD1-CD2 3.89Å; F122-L126 HydrophobicContact CE1-CD2 4.28Å; F122-F127 HydrophobicContact CD1-CE2 4.23Å; F122-F127 HydrophobicContact CD1-CZ 4.32Å; F122-I169 HydrophobicContact CE1-CD1 3.71Å; F122-I169 HydrophobicContact CE1-CG1 4.21Å; F122-I169 HydrophobicContact CZ-CD1 3.71Å; F122-I169 HydrophobicContact CZ-CG1 3.89Å
123	S	74.8	Confident	72.8	Confident	49 Å²	49	82.7 Å²	82.7	34%	0.343	41%	0.414	S	S	.	.			trans	-83.9	148.9	170.3	70.1	0	0	0	0	110.4	K121 L125 L126	K121-S123 VanDerWaalsContact C-N 3.27Å; K121-S123 PolarHBondContact O-N 3.26Å; S123-L125 PolarHBondContact O-N 2.98Å; S123-L125 VanDerWaalsContact O-N 3.08Å; S123-L126 WeakPolarHBondContact O-CB 3.38Å; S123-L126 PolarHBondContact O-N 2.96Å; S123-L126 VanDerWaalsContact O-N 3.07Å
124	K	81	Confident	73.8	Confident	177 Å²	177	75.5 Å²	75.5	77%	0.77	39%	0.389	S	S	*	.	H	α-helix	trans	-56.4	-26.7	174.7	-59.8	-176	-179.9	-176.7	0	112.1	L126 F127 I128	K124-L126 VanDerWaalsContact C-N 3.35Å; K124-L126 PolarHBondContact O-N 3.37Å; K124-F127 PolarHBondContact O-N 3.32Å; K124-I128 HydrophobicContact CB-CD1 3.97Å; K124-I128 WeakPolarHBondContact O-CB 3.49Å; K124-I128 VanDerWaalsContact O-CG1 3.28Å; K124-I128 WeakPolarHBondContact O-CG1 3.23Å; K124-I128 PolarHBondContact O-N 3.15Å
125	L	80.2	Confident	75.3	Confident	37 Å²	37	72.7 Å²	72.7	19%	0.194	38%	0.382	C	S	.	.	H	α-helix	trans	-62.2	-34.1	177.2	-167.9	68.3	0	0	0	113.6	S123 F127 I128 F129 L191 I194 K195 L198	S123-L125 PolarHBondContact O-N 2.98Å; S123-L125 VanDerWaalsContact O-N 3.08Å; L125-F127 PolarHBondContact O-N 2.86Å; L125-I128 PolarHBondContact O-N 3.16Å; L125-F129 HydrophobicContact CD1-CB 4.27Å; L125-F129 HydrophobicContact CG-CB 4.5Å; L125-F129 WeakPolarHBondContact O-CB 3.23Å; L125-F129 PolarHBondContact O-N 3.47Å; L125-L191 HydrophobicContact CB-CD2 4.39Å; L125-L191 HydrophobicContact CD2-CD2 4.08Å; L125-L191 HydrophobicContact CG-CD2 3.98Å; L125-I194 HydrophobicContact CD1-CG2 4.28Å; L125-I194 HydrophobicContact CD2-CB 4.24Å; L125-I194 HydrophobicContact CD2-CG2 3.97Å; L125-I194 HydrophobicContact CG-CG2 4.49Å; L125-K195 HydrophobicContact CD2-CB 4.31Å; L125-L198 HydrophobicContact CD1-CD1 3.96Å
126	L	81	Confident	76.6	Confident	7 Å²	7	73.9 Å²	73.9	4%	0.037	39%	0.389	C	S	.	.	H	α-helix	trans	-57.9	-35.1	176.1	179.6	70.6	0	0	0	112.3	L120 F122 S123 K124 P130 Q161 L165 I187 L191	L120-L126 HydrophobicContact CD2-CD1 4.42Å; L120-L126 HydrophobicContact CD2-CD2 3.8Å; F122-L126 HydrophobicContact CD1-CD2 3.89Å; F122-L126 HydrophobicContact CE1-CD2 4.28Å; S123-L126 WeakPolarHBondContact O-CB 3.38Å; S123-L126 PolarHBondContact O-N 2.96Å; S123-L126 VanDerWaalsContact O-N 3.07Å; K124-L126 VanDerWaalsContact C-N 3.35Å; K124-L126 PolarHBondContact O-N 3.37Å; L126-P130 WeakPolarHBondContact O-CD 3.49Å; L126-Q161 PolarHBondContact O-NE2 2.98Å; L126-L165 HydrophobicContact CD1-CD2 3.75Å; L126-L165 HydrophobicContact CD2-CD2 4.05Å; L126-L165 HydrophobicContact CG-CD1 4.31Å; L126-L165 HydrophobicContact CG-CD2 3.96Å; L126-I187 HydrophobicContact CD1-CG2 3.75Å; L126-L191 HydrophobicContact CB-CD1 3.77Å; L126-L191 HydrophobicContact CD1-CD1 3.57Å; L126-L191 HydrophobicContact CG-CD1 4.24Å
127	F	81	Confident	78.3	Confident	93 Å²	93	75.2 Å²	75.2	41%	0.408	40%	0.396	S	S	.	.	H	α-helix	trans	-89.3	-48.4	179	-63.3	-81.6	0	0	0	111.1	F122 K124 L125 L131 Q161 L165	F122-F127 HydrophobicContact CD1-CE2 4.23Å; F122-F127 HydrophobicContact CD1-CZ 4.32Å; K124-F127 PolarHBondContact O-N 3.32Å; L125-F127 PolarHBondContact O-N 2.86Å; F127-L131 WeakPolarHBondContact O-CB 3.38Å; F127-L131 PolarHBondContact O-N 2.93Å; F127-Q161 PolarHBondContact O-NE2 3.48Å; F127-L165 HydrophobicContact CD1-CD1 3.87Å; F127-L165 HydrophobicContact CE1-CD1 3.56Å; F127-L165 HydrophobicContact CZ-CD1 4.26Å
128	I	83.8	Confident	79.9	Confident	92 Å²	92	70.6 Å²	70.6	47%	0.472	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-42.4	-173.8	-66.2	166.6	0	0	0	112.7	K124 L125 L131 V132	K124-I128 HydrophobicContact CB-CD1 3.97Å; K124-I128 WeakPolarHBondContact O-CB 3.49Å; K124-I128 VanDerWaalsContact O-CG1 3.28Å; K124-I128 WeakPolarHBondContact O-CG1 3.23Å; K124-I128 PolarHBondContact O-N 3.15Å; L125-I128 PolarHBondContact O-N 3.16Å; I128-L131 PolarHBondContact O-N 3.38Å; I128-V132 HydrophobicContact CG2-CG2 4.03Å; I128-V132 WeakPolarHBondContact O-CB 3.43Å; I128-V132 VanDerWaalsContact O-CG2 3.28Å; I128-V132 WeakPolarHBondContact O-CG2 3.28Å; I128-V132 PolarHBondContact O-N 2.97Å
129	F	83.9	Confident	81.3	Confident	63 Å²	63	70.4 Å²	70.4	28%	0.276	36%	0.362	S	S	.	.	H	α-helix	trans	-66.5	-50.8	-170.8	176.5	-92	0	0	0	113.7	L125 L131 V132 I133 F190 I194	L125-F129 HydrophobicContact CD1-CB 4.27Å; L125-F129 HydrophobicContact CG-CB 4.5Å; L125-F129 WeakPolarHBondContact O-CB 3.23Å; L125-F129 PolarHBondContact O-N 3.47Å; F129-L131 VanDerWaalsContact C-N 3.33Å; F129-L131 PolarHBondContact O-N 3.47Å; F129-V132 PolarHBondContact O-N 2.89Å; F129-I133 HydrophobicContact CD1-CD1 4.03Å; F129-I133 HydrophobicContact CE1-CD1 3.42Å; F129-I133 VanDerWaalsContact CE1-CD1 3.42Å; F129-I133 HydrophobicContact CE2-CD1 4.23Å; F129-I133 HydrophobicContact CZ-CD1 3.55Å; F129-I133 PolarHBondContact O-N 2.86Å; F129-I133 VanDerWaalsContact O-N 3.14Å; F129-F190 HydrophobicContact CD1-CE1 4.41Å; F129-F190 AromaticContact CE1-CE1 3.75Å; F129-F190 HydrophobicContact CE1-CE1 3.75Å; F129-F190 AromaticContact CE1-CZ 3.91Å; F129-F190 HydrophobicContact CE1-CZ 3.91Å; F129-F190 HydrophobicContact CZ-CE1 4.45Å; F129-F190 HydrophobicContact CZ-CZ 4.2Å; F129-I194 HydrophobicContact CD1-CD1 3.71Å; F129-I194 HydrophobicContact CD2-CD1 4.02Å; F129-I194 HydrophobicContact CD2-CG2 4.12Å; F129-I194 HydrophobicContact CE1-CD1 3.55Å; F129-I194 HydrophobicContact CE2-CD1 3.86Å; F129-I194 HydrophobicContact CE2-CG1 4.32Å; F129-I194 HydrophobicContact CE2-CG2 4.25Å; F129-I194 HydrophobicContact CG-CD1 3.94Å; F129-I194 HydrophobicContact CZ-CD1 3.62Å; F129-I194 HydrophobicContact CZ-CG1 4.3Å
130	P	84.2	Confident	82.5	Confident	51 Å²	51	71.8 Å²	71.8	33%	0.331	36%	0.361	S	S	.	.	H	α-helix	trans	-70.2	-31	177	-13.5	29	0	0	0	112.4	L126 I133 S134 Q161	L126-P130 WeakPolarHBondContact O-CD 3.49Å; P130-I133 PolarHBondContact O-N 2.97Å; P130-S134 WeakPolarHBondContact O-CB 3.49Å; P130-S134 PolarHBondContact O-N 3.02Å; P130-S134 PolarHBondContact O-OG 3.34Å; P130-Q161 HydrophobicContact CB-CG 4.24Å
131	L	85.2	Confident	83.7	Confident	66 Å²	66	71.9 Å²	71.9	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-59.3	-50.7	173.5	-176.1	167	0	0	0	110.2	F127 I128 F129 I133 S134 A135 M158	F127-L131 WeakPolarHBondContact O-CB 3.38Å; F127-L131 PolarHBondContact O-N 2.93Å; I128-L131 PolarHBondContact O-N 3.38Å; F129-L131 VanDerWaalsContact C-N 3.33Å; F129-L131 PolarHBondContact O-N 3.47Å; L131-I133 VanDerWaalsContact C-N 3.33Å; L131-I133 PolarHBondContact O-N 3.4Å; L131-S134 PolarHBondContact O-N 3.42Å; L131-S134 VanDerWaalsContact O-N 3.16Å; L131-S134 PolarHBondContact O-OG 3.46Å; L131-A135 WeakPolarHBondContact O-CB 3.28Å; L131-A135 PolarHBondContact O-N 3.49Å; L131-M158 HydrophobicContact CB-SD 4.31Å; L131-M158 HydrophobicContact CD1-CE 4.2Å; L131-M158 HydrophobicContact CD1-SD 3.51Å; L131-M158 VanDerWaalsContact CD1-SD 3.51Å; L131-M158 HydrophobicContact CG-SD 3.63Å
132	V	86.7	Confident	84.6	Confident	67 Å²	67	64.5 Å²	64.5	41%	0.406	33%	0.334	S	S	.	.	H	α-helix	trans	-59.6	-41.2	176.6	167.6	0	0	0	0	111.6	I128 F129 A135 I136	I128-V132 HydrophobicContact CG2-CG2 4.03Å; I128-V132 WeakPolarHBondContact O-CB 3.43Å; I128-V132 VanDerWaalsContact O-CG2 3.28Å; I128-V132 WeakPolarHBondContact O-CG2 3.28Å; I128-V132 PolarHBondContact O-N 2.97Å; F129-V132 PolarHBondContact O-N 2.89Å; V132-A135 PolarHBondContact O-N 2.73Å; V132-I136 HydrophobicContact CG1-CD1 3.69Å; V132-I136 HydrophobicContact CG1-CG1 4.43Å; V132-I136 WeakPolarHBondContact O-CB 3.41Å; V132-I136 VanDerWaalsContact O-CG1 3.26Å; V132-I136 WeakPolarHBondContact O-CG1 3.34Å; V132-I136 PolarHBondContact O-N 3.27Å
133	I	87.3	Confident	85.4	Confident	86 Å²	86	61 Å²	61	44%	0.441	32%	0.32	S	S	.	.	H	α-helix	trans	-63.1	-45.3	174.7	-69.5	173.9	0	0	0	111.2	F129 P130 L131 A135 I136 L137	F129-I133 HydrophobicContact CD1-CD1 4.03Å; F129-I133 HydrophobicContact CE1-CD1 3.42Å; F129-I133 VanDerWaalsContact CE1-CD1 3.42Å; F129-I133 HydrophobicContact CE2-CD1 4.23Å; F129-I133 HydrophobicContact CZ-CD1 3.55Å; F129-I133 PolarHBondContact O-N 2.86Å; F129-I133 VanDerWaalsContact O-N 3.14Å; P130-I133 PolarHBondContact O-N 2.97Å; L131-I133 VanDerWaalsContact C-N 3.33Å; L131-I133 PolarHBondContact O-N 3.4Å; I133-A135 VanDerWaalsContact C-N 3.33Å; I133-A135 PolarHBondContact O-N 3Å; I133-I136 PolarHBondContact O-N 3.48Å; I133-L137 WeakPolarHBondContact O-CB 3.33Å; I133-L137 PolarHBondContact O-N 2.7Å
134	S	89.6	Confident	85.9	Confident	18 Å²	18	65.3 Å²	65.3	13%	0.126	34%	0.339	C	S	.	.	H	α-helix	trans	-64.6	-36.1	178.9	73.7	0	0	0	0	112.6	P130 L131 G138	P130-S134 WeakPolarHBondContact O-CB 3.49Å; P130-S134 PolarHBondContact O-N 3.02Å; P130-S134 PolarHBondContact O-OG 3.34Å; L131-S134 PolarHBondContact O-N 3.42Å; L131-S134 VanDerWaalsContact O-N 3.16Å; L131-S134 PolarHBondContact O-OG 3.46Å; S134-G138 PolarHBondContact O-N 2.94Å
135	A	87.3	Confident	86.2	Confident	53 Å²	53	59.7 Å²	59.7	44%	0.438	32%	0.319	S	S	.	.	H	α-helix	trans	-68.6	-41.8	174.2	0	0	0	0	0	112.5	L131 V132 I133 Y139	L131-A135 WeakPolarHBondContact O-CB 3.28Å; L131-A135 PolarHBondContact O-N 3.49Å; V132-A135 PolarHBondContact O-N 2.73Å; I133-A135 VanDerWaalsContact C-N 3.33Å; I133-A135 PolarHBondContact O-N 3Å; A135-Y139 VanDerWaalsContact O-CB 3.26Å; A135-Y139 WeakPolarHBondContact O-CB 3.45Å; A135-Y139 PolarHBondContact O-N 3.47Å
136	I	88.2	Confident	86.6	Confident	63 Å²	63	63 Å²	63	32%	0.323	34%	0.337	S	S	.	.	H	α-helix	trans	-65.3	-44	175.2	-70.3	167.1	0	0	0	110.7	V132 I133 Y139 F140	V132-I136 HydrophobicContact CG1-CD1 3.69Å; V132-I136 HydrophobicContact CG1-CG1 4.43Å; V132-I136 WeakPolarHBondContact O-CB 3.41Å; V132-I136 VanDerWaalsContact O-CG1 3.26Å; V132-I136 WeakPolarHBondContact O-CG1 3.34Å; V132-I136 PolarHBondContact O-N 3.27Å; I133-I136 PolarHBondContact O-N 3.48Å; I136-Y139 WeakPolarHBondContact O-CB 3.47Å; I136-Y139 PolarHBondContact O-N 2.91Å; I136-F140 HydrophobicContact CG2-CD2 3.76Å; I136-F140 HydrophobicContact CG2-CE2 3.67Å; I136-F140 VanDerWaalsContact O-CD2 3.27Å; I136-F140 WeakPolarHBondContact O-CD2 3.26Å; I136-F140 PolarHBondContact O-N 3.47Å
137	L	88.2	Confident	86.8	Confident	107 Å²	107	71.4 Å²	71.4	56%	0.56	37%	0.368	S	S	*	.	H	α-helix	trans	-65.8	-45.8	178.4	-170.3	69.9	0	0	0	111.4	I133 Y139 F140 V141	I133-L137 WeakPolarHBondContact O-CB 3.33Å; I133-L137 PolarHBondContact O-N 2.7Å; L137-Y139 VanDerWaalsContact C-N 3.3Å; L137-Y139 PolarHBondContact O-N 2.88Å; L137-F140 PolarHBondContact O-N 3.49Å; L137-V141 WeakPolarHBondContact O-CG2 3.01Å; L137-V141 PolarHBondContact O-N 2.7Å
138	G	90.2	Very high	87.3	Confident	2 Å²	2	72.9 Å²	72.9	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-39.2	172.9	0	0	0	0	0	112.3	S134 G142 G150	S134-G138 PolarHBondContact O-N 2.94Å; G138-G142 PolarHBondContact O-N 3.04Å; G138-G150 WeakPolarHBondContact CA-O 3.35Å; G138-G150 WeakPolarHBondContact O-CA 3.26Å
139	Y	89.7	Confident	87.6	Confident	49 Å²	49	71.4 Å²	71.4	19%	0.192	37%	0.372	C	S	.	.	H	α-helix	trans	-62.1	-50.9	174.2	-176	-100.7	0	0	0	112.2	A135 I136 L137 V141 G142 M143 L290 T293 S294	A135-Y139 VanDerWaalsContact O-CB 3.26Å; A135-Y139 WeakPolarHBondContact O-CB 3.45Å; A135-Y139 PolarHBondContact O-N 3.47Å; I136-Y139 WeakPolarHBondContact O-CB 3.47Å; I136-Y139 PolarHBondContact O-N 2.91Å; L137-Y139 VanDerWaalsContact C-N 3.3Å; L137-Y139 PolarHBondContact O-N 2.88Å; Y139-V141 PolarHBondContact O-N 3.34Å; Y139-G142 PolarHBondContact O-N 3.13Å; Y139-M143 HydrophobicContact CD1-CG 4.05Å; Y139-M143 HydrophobicContact CD2-CG 4.46Å; Y139-M143 HydrophobicContact CE1-CG 3.58Å; Y139-M143 HydrophobicContact CE1-SD 4.39Å; Y139-M143 HydrophobicContact CE2-CG 4.02Å; Y139-M143 HydrophobicContact CE2-SD 4.41Å; Y139-M143 HydrophobicContact CG-CG 4.47Å; Y139-M143 WeakPolarHBondContact O-CB 3.16Å; Y139-M143 WeakPolarHBondContact O-CG 3.49Å; Y139-M143 PolarHBondContact O-N 3.35Å; Y139-L290 HydrophobicContact CD1-CD2 3.44Å; Y139-L290 VanDerWaalsContact CD1-CD2 3.44Å; Y139-L290 HydrophobicContact CD2-CD2 3.9Å; Y139-L290 HydrophobicContact CE1-CD2 3.41Å; Y139-L290 VanDerWaalsContact CE1-CD2 3.41Å; Y139-L290 HydrophobicContact CE2-CD2 3.89Å; Y139-L290 HydrophobicContact CG-CD2 3.69Å; Y139-L290 PolarHBondContact OH-O 3.43Å; Y139-L290 VanDerWaalsContact OH-O 3.04Å; Y139-T293 PolarHBondContact OH-OG1 3.26Å; Y139-S294 PolarHBondContact OH-N 3Å; Y139-S294 PolarHBondContact OH-OG 2.92Å
140	F	89.3	Confident	87.9	Confident	100 Å²	100	68.8 Å²	68.8	44%	0.439	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-41.6	178.4	-81.8	-66.3	0	0	0	112.6	I136 L137 M143 L144	I136-F140 HydrophobicContact CG2-CD2 3.76Å; I136-F140 HydrophobicContact CG2-CE2 3.67Å; I136-F140 VanDerWaalsContact O-CD2 3.27Å; I136-F140 WeakPolarHBondContact O-CD2 3.26Å; I136-F140 PolarHBondContact O-N 3.47Å; L137-F140 PolarHBondContact O-N 3.49Å; F140-M143 PolarHBondContact O-N 3.02Å; F140-L144 WeakPolarHBondContact O-CG 3.45Å; F140-L144 PolarHBondContact O-N 3.16Å
141	V	89.4	Confident	88.1	Confident	46 Å²	46	71 Å²	71	28%	0.279	37%	0.371	S	S	.	.	H	α-helix	trans	-68.9	-38	176.4	179.5	0	0	0	0	111.7	L137 Y139 M143 L144 T145 I153	L137-V141 WeakPolarHBondContact O-CG2 3.01Å; L137-V141 PolarHBondContact O-N 2.7Å; Y139-V141 PolarHBondContact O-N 3.34Å; V141-M143 VanDerWaalsContact C-N 3.33Å; V141-M143 PolarHBondContact O-N 3.23Å; V141-L144 PolarHBondContact O-N 3.33Å; V141-T145 WeakPolarHBondContact O-CB 3.44Å; V141-T145 PolarHBondContact O-N 3.08Å; V141-T145 PolarHBondContact O-OG1 3.07Å; V141-I153 HydrophobicContact CB-CD1 3.98Å; V141-I153 HydrophobicContact CG1-CD1 3.48Å; V141-I153 VanDerWaalsContact CG1-CD1 3.48Å; V141-I153 HydrophobicContact CG2-CD1 4.48Å
142	G	87.2	Confident	88.4	Confident	9 Å²	9	70.3 Å²	70.3	9%	0.093	37%	0.372	C	S	.	.	H	α-helix	trans	-66.5	-32.2	174.4	0	0	0	0	0	113.7	G138 Y139 T145 N146	G138-G142 PolarHBondContact O-N 3.04Å; Y139-G142 PolarHBondContact O-N 3.13Å; G142-T145 CarbonylContact O-C 3.52Å; G142-N146 CarbonylContact O-C 3.57Å; G142-N146 PolarHBondContact O-N 2.97Å
143	M	85.7	Confident	88.6	Confident	45 Å²	45	69.8 Å²	69.8	22%	0.222	37%	0.366	C	S	.	.	H	α-helix	trans	-72	-32.8	173.5	-81.3	-69.6	-67.2	0	0	113.2	Y139 F140 V141 T293 R297	Y139-M143 HydrophobicContact CD1-CG 4.05Å; Y139-M143 HydrophobicContact CD2-CG 4.46Å; Y139-M143 HydrophobicContact CE1-CG 3.58Å; Y139-M143 HydrophobicContact CE1-SD 4.39Å; Y139-M143 HydrophobicContact CE2-CG 4.02Å; Y139-M143 HydrophobicContact CE2-SD 4.41Å; Y139-M143 HydrophobicContact CG-CG 4.47Å; Y139-M143 WeakPolarHBondContact O-CB 3.16Å; Y139-M143 WeakPolarHBondContact O-CG 3.49Å; Y139-M143 PolarHBondContact O-N 3.35Å; F140-M143 PolarHBondContact O-N 3.02Å; V141-M143 VanDerWaalsContact C-N 3.33Å; V141-M143 PolarHBondContact O-N 3.23Å; M143-T293 WeakPolarHBondContact CE-O 3.45Å; M143-R297 HydrophobicContact CE-CB 3.84Å; M143-R297 HydrophobicContact CE-CG 4.43Å; M143-R297 PolarHBondContact O-NE 3.08Å; M143-R297 VanDerWaalsContact O-NE 3.15Å; M143-R297 PolarHBondContact O-NH1 3.03Å; M143-R297 PolarHBondContact O-NH2 3.23Å; M143-R297 HydrophobicContact SD-CB 3.65Å; M143-R297 HydrophobicContact SD-CG 3.95Å
144	L	85.8	Confident	88.6	Confident	141 Å²	141	66.5 Å²	66.5	74%	0.738	35%	0.353	S	S	*	.	H	α-helix	trans	-76.1	-42.2	172.4	-70.3	170.7	0	0	0	111.6	F140 V141 R297	F140-L144 WeakPolarHBondContact O-CG 3.45Å; F140-L144 PolarHBondContact O-N 3.16Å; V141-L144 PolarHBondContact O-N 3.33Å; L144-R297 PolarHBondContact O-NH2 2.8Å
145	T	87.1	Confident	88.7	Confident	59 Å²	59	71.6 Å²	71.6	36%	0.362	37%	0.374	S	S	.	.	S	Bend	trans	-103.6	-117.8	-176.3	65.8	0	0	0	0	111.2	V141 G142 R297	V141-T145 WeakPolarHBondContact O-CB 3.44Å; V141-T145 PolarHBondContact O-N 3.08Å; V141-T145 PolarHBondContact O-OG1 3.07Å; G142-T145 CarbonylContact O-C 3.52Å; T145-R297 PolarHBondContact O-NH2 2.92Å
146	N	87.4	Confident	88.9	Confident	107 Å²	107	73.7 Å²	73.7	57%	0.572	38%	0.378	S	S	*	.			trans	-121.7	145.7	178.8	-68.6	-35.7	0	0	0	109.8	G142 Q148 V149 G150	G142-N146 CarbonylContact O-C 3.57Å; G142-N146 PolarHBondContact O-N 2.97Å; N146-Q148 PolarHBondContact O-N 2.91Å; N146-Q148 VanDerWaalsContact O-N 3.13Å; N146-V149 HydrophobicContact CB-CG2 4.33Å; N146-V149 WeakPolarHBondContact O-CB 3.38Å; N146-V149 PolarHBondContact O-N 3.49Å; N146-G150 PolarHBondContact O-N 3.43Å
147	W	86.1	Confident	88.9	Confident	183 Å²	183	71.7 Å²	71.7	69%	0.693	37%	0.372	S	S	*	.	H	α-helix	trans	-55.8	-34.7	-178.1	67.7	-94.3	0	0	0	113.5	V149 G150 L151	W147-V149 VanDerWaalsContact C-N 3.32Å; W147-V149 PolarHBondContact O-N 3.26Å; W147-G150 PolarHBondContact O-N 3.42Å; W147-L151 WeakPolarHBondContact O-CB 3.46Å; W147-L151 PolarHBondContact O-N 3.43Å
148	Q	90.6	Very high	89	Confident	123 Å²	123	69.8 Å²	69.8	58%	0.575	36%	0.361	S	S	*	.	H	α-helix	trans	-61.7	-36.8	176.1	-64.8	177.8	-19.8	0	0	112.7	N146 S152	N146-Q148 PolarHBondContact O-N 2.91Å; N146-Q148 VanDerWaalsContact O-N 3.13Å; Q148-S152 PolarHBondContact O-N 3.29Å; Q148-S152 PolarHBondContact O-OG 3.38Å
149	V	90.6	Very high	89.1	Confident	62 Å²	62	76.5 Å²	76.5	38%	0.376	39%	0.39	S	S	.	.	H	α-helix	trans	-74.2	-39.5	178.2	-179.7	0	0	0	0	110.4	N146 W147 L151 S152 I153	N146-V149 HydrophobicContact CB-CG2 4.33Å; N146-V149 WeakPolarHBondContact O-CB 3.38Å; N146-V149 PolarHBondContact O-N 3.49Å; W147-V149 VanDerWaalsContact C-N 3.32Å; W147-V149 PolarHBondContact O-N 3.26Å; V149-L151 VanDerWaalsContact C-N 3.33Å; V149-L151 PolarHBondContact O-N 3.25Å; V149-S152 PolarHBondContact O-N 3.21Å; V149-S152 PolarHBondContact O-OG 3.49Å; V149-S152 VanDerWaalsContact O-OG 3.07Å; V149-I153 HydrophobicContact CG1-CD1 3.95Å; V149-I153 WeakPolarHBondContact O-CB 3.24Å; V149-I153 WeakPolarHBondContact O-CD1 3.35Å; V149-I153 VanDerWaalsContact O-CG1 3.24Å; V149-I153 WeakPolarHBondContact O-CG1 3.4Å; V149-I153 PolarHBondContact O-N 2.87Å
150	G	89.7	Confident	89.1	Confident	7 Å²	7	79 Å²	79	7%	0.072	41%	0.405	C	S	.	.	H	α-helix	trans	-61.4	-41.5	172.8	0	0	0	0	0	113	G138 N146 W147 G154	G138-G150 WeakPolarHBondContact CA-O 3.35Å; G138-G150 WeakPolarHBondContact O-CA 3.26Å; N146-G150 PolarHBondContact O-N 3.43Å; W147-G150 PolarHBondContact O-N 3.42Å; G150-G154 PolarHBondContact O-N 2.85Å; G150-G154 VanDerWaalsContact O-N 3.07Å
151	L	88.8	Confident	89	Confident	97 Å²	97	75.2 Å²	75.2	51%	0.508	39%	0.389	S	S	.	.	H	α-helix	trans	-68.8	-42.4	178.4	-171.3	129.4	0	0	0	112.2	W147 V149 G154 H155	W147-L151 WeakPolarHBondContact O-CB 3.46Å; W147-L151 PolarHBondContact O-N 3.43Å; V149-L151 VanDerWaalsContact C-N 3.33Å; V149-L151 PolarHBondContact O-N 3.25Å; L151-G154 PolarHBondContact O-N 2.84Å; L151-H155 PolarHBondContact O-CD2 3.44Å; L151-H155 VanDerWaalsContact O-CD2 3.23Å; L151-H155 PolarHBondContact O-N 3.18Å
152	S	91.7	Very high	89	Confident	53 Å²	53	77.6 Å²	77.6	37%	0.371	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-39.1	176.1	67.6	0	0	0	0	112.2	Q148 V149 G154 H155 I156	Q148-S152 PolarHBondContact O-N 3.29Å; Q148-S152 PolarHBondContact O-OG 3.38Å; V149-S152 PolarHBondContact O-N 3.21Å; V149-S152 PolarHBondContact O-OG 3.49Å; V149-S152 VanDerWaalsContact O-OG 3.07Å; S152-G154 VanDerWaalsContact C-N 3.32Å; S152-G154 PolarHBondContact O-N 3.15Å; S152-H155 PolarHBondContact O-N 3.42Å; S152-I156 WeakPolarHBondContact O-CB 3.44Å; S152-I156 WeakPolarHBondContact O-CD1 3.44Å; S152-I156 VanDerWaalsContact O-CG1 3.24Å; S152-I156 WeakPolarHBondContact O-CG1 3.45Å; S152-I156 PolarHBondContact O-N 2.79Å
153	I	89.9	Confident	89	Confident	56 Å²	56	80 Å²	80	29%	0.287	41%	0.413	S	S	.	.	H	α-helix	trans	-59.7	-41.3	172.1	-71.5	167.1	0	0	0	111.4	V141 V149 I156 G157	V141-I153 HydrophobicContact CB-CD1 3.98Å; V141-I153 HydrophobicContact CG1-CD1 3.48Å; V141-I153 VanDerWaalsContact CG1-CD1 3.48Å; V141-I153 HydrophobicContact CG2-CD1 4.48Å; V149-I153 HydrophobicContact CG1-CD1 3.95Å; V149-I153 WeakPolarHBondContact O-CB 3.24Å; V149-I153 WeakPolarHBondContact O-CD1 3.35Å; V149-I153 VanDerWaalsContact O-CG1 3.24Å; V149-I153 WeakPolarHBondContact O-CG1 3.4Å; V149-I153 PolarHBondContact O-N 2.87Å; I153-I156 PolarHBondContact O-N 3.47Å; I153-G157 PolarHBondContact O-N 3.16Å
154	G	89.2	Confident	89.1	Confident	16 Å²	16	82.6 Å²	82.6	17%	0.165	42%	0.423	C	S	.	.	H	α-helix	trans	-60.6	-46	174.2	0	0	0	0	0	113.1	G150 L151 S152 G157 M158	G150-G154 PolarHBondContact O-N 2.85Å; G150-G154 VanDerWaalsContact O-N 3.07Å; L151-G154 PolarHBondContact O-N 2.84Å; S152-G154 VanDerWaalsContact C-N 3.32Å; S152-G154 PolarHBondContact O-N 3.15Å; G154-G157 PolarHBondContact O-N 2.87Å; G154-M158 PolarHBondContact O-N 2.84Å
155	H	89.8	Confident	89	Confident	125 Å²	125	76.5 Å²	76.5	58%	0.579	39%	0.391	S	S	*	.	H	α-helix	trans	-66.1	-37.7	176.1	-77.1	-71.7	0	0	0	113.1	L151 S152 M158 F159	L151-H155 PolarHBondContact O-CD2 3.44Å; L151-H155 VanDerWaalsContact O-CD2 3.23Å; L151-H155 PolarHBondContact O-N 3.18Å; S152-H155 PolarHBondContact O-N 3.42Å; H155-M158 WeakPolarHBondContact O-CB 3.17Å; H155-M158 PolarHBondContact O-N 2.88Å; H155-F159 PolarHBondContact O-N 3.5Å
156	I	92.2	Very high	88.9	Confident	98 Å²	98	75.9 Å²	75.9	50%	0.503	39%	0.392	S	S	.	.	H	α-helix	trans	-64.9	-43.9	174.5	-69.9	163.1	0	0	0	110.3	S152 I153 M158 F159 I160	S152-I156 WeakPolarHBondContact O-CB 3.44Å; S152-I156 WeakPolarHBondContact O-CD1 3.44Å; S152-I156 VanDerWaalsContact O-CG1 3.24Å; S152-I156 WeakPolarHBondContact O-CG1 3.45Å; S152-I156 PolarHBondContact O-N 2.79Å; I153-I156 PolarHBondContact O-N 3.47Å; I156-M158 PolarHBondContact O-N 3.42Å; I156-F159 PolarHBondContact O-N 2.7Å; I156-I160 HydrophobicContact CG2-CD1 3.72Å; I156-I160 HydrophobicContact CG2-CG1 4.42Å; I156-I160 VanDerWaalsContact O-CG1 3.29Å; I156-I160 WeakPolarHBondContact O-CG1 3.34Å; I156-I160 PolarHBondContact O-N 2.87Å
157	G	89.3	Confident	88.8	Confident	20 Å²	20	76 Å²	76	21%	0.206	39%	0.392	C	S	.	.	H	α-helix	trans	-59.3	-44.6	174.7	0	0	0	0	0	112.9	I153 G154 I160 Q161	I153-G157 PolarHBondContact O-N 3.16Å; G154-G157 PolarHBondContact O-N 2.87Å; G157-I160 PolarHBondContact O-N 3.07Å; G157-Q161 WeakPolarHBondContact O-CB 3.31Å; G157-Q161 PolarHBondContact O-N 3.33Å
158	M	89.5	Confident	88.6	Confident	68 Å²	68	67.7 Å²	67.7	34%	0.335	36%	0.361	S	S	.	.	H	α-helix	trans	-58	-46.2	172.1	-86.3	-81.1	-78.7	0	0	112.7	L131 G154 H155 I156 Q161 I162	L131-M158 HydrophobicContact CB-SD 4.31Å; L131-M158 HydrophobicContact CD1-CE 4.2Å; L131-M158 HydrophobicContact CD1-SD 3.51Å; L131-M158 VanDerWaalsContact CD1-SD 3.51Å; L131-M158 HydrophobicContact CG-SD 3.63Å; G154-M158 PolarHBondContact O-N 2.84Å; H155-M158 WeakPolarHBondContact O-CB 3.17Å; H155-M158 PolarHBondContact O-N 2.88Å; I156-M158 PolarHBondContact O-N 3.42Å; M158-Q161 PolarHBondContact O-N 3.06Å; M158-I162 VanDerWaalsContact O-CG1 3.32Å; M158-I162 WeakPolarHBondContact O-CG1 3.44Å; M158-I162 PolarHBondContact O-N 2.97Å
159	F	91.4	Very high	88.1	Confident	143 Å²	143	64.4 Å²	64.4	63%	0.627	35%	0.347	S	S	*	.	H	α-helix	trans	-65.4	-41.7	178.7	-175.5	-98.2	0	0	0	112.2	H155 I156 I162 T163	H155-F159 PolarHBondContact O-N 3.5Å; I156-F159 PolarHBondContact O-N 2.7Å; F159-I162 PolarHBondContact O-N 3.4Å; F159-T163 HydrophobicContact CD1-CG2 4.2Å; F159-T163 HydrophobicContact CE1-CG2 3.79Å; F159-T163 HydrophobicContact CE2-CG2 4.17Å; F159-T163 HydrophobicContact CZ-CG2 3.77Å; F159-T163 WeakPolarHBondContact O-CB 3.4Å; F159-T163 WeakPolarHBondContact O-CG2 3.14Å; F159-T163 PolarHBondContact O-N 3.33Å; F159-T163 PolarHBondContact O-OG1 2.89Å
160	I	90.4	Very high	87.6	Confident	100 Å²	100	64.9 Å²	64.9	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-42.9	174.2	-68.9	167.6	0	0	0	110.6	I156 G157 T163 F164	I156-I160 HydrophobicContact CG2-CD1 3.72Å; I156-I160 HydrophobicContact CG2-CG1 4.42Å; I156-I160 VanDerWaalsContact O-CG1 3.29Å; I156-I160 WeakPolarHBondContact O-CG1 3.34Å; I156-I160 PolarHBondContact O-N 2.87Å; G157-I160 PolarHBondContact O-N 3.07Å; I160-T163 WeakPolarHBondContact CA-OG1 3.29Å; I160-T163 PolarHBondContact O-OG1 2.98Å; I160-T163 VanDerWaalsContact O-OG1 3.12Å; I160-F164 WeakPolarHBondContact O-CB 3.23Å; I160-F164 PolarHBondContact O-N 3.48Å
161	Q	88	Confident	87	Confident	21 Å²	21	65.1 Å²	65.1	10%	0.098	35%	0.352	C	S	.	.	H	α-helix	trans	-61.9	-47.6	176.5	-175.4	-175.3	-2.1	0	0	111.8	L126 F127 P130 G157 M158 F164 L165	L126-Q161 PolarHBondContact O-NE2 2.98Å; F127-Q161 PolarHBondContact O-NE2 3.48Å; P130-Q161 HydrophobicContact CB-CG 4.24Å; G157-Q161 WeakPolarHBondContact O-CB 3.31Å; G157-Q161 PolarHBondContact O-N 3.33Å; M158-Q161 PolarHBondContact O-N 3.06Å; Q161-F164 PolarHBondContact O-N 2.77Å; Q161-L165 HydrophobicContact CG-CD1 4.16Å; Q161-L165 WeakPolarHBondContact O-CB 3.47Å; Q161-L165 VanDerWaalsContact O-CG 3.26Å; Q161-L165 WeakPolarHBondContact O-CG 3.48Å; Q161-L165 PolarHBondContact O-N 2.85Å
162	I	87.8	Confident	86.2	Confident	96 Å²	96	62.8 Å²	62.8	49%	0.492	34%	0.344	S	S	.	.	H	α-helix	trans	-64.4	-44.9	-179.1	-68.6	165.7	0	0	0	110.8	M158 F159 L165 A166	M158-I162 VanDerWaalsContact O-CG1 3.32Å; M158-I162 WeakPolarHBondContact O-CG1 3.44Å; M158-I162 PolarHBondContact O-N 2.97Å; F159-I162 PolarHBondContact O-N 3.4Å; I162-L165 PolarHBondContact O-N 3.39Å; I162-A166 WeakPolarHBondContact O-CB 3.45Å; I162-A166 PolarHBondContact O-N 3.13Å
163	T	88.3	Confident	85.2	Confident	61 Å²	61	69.2 Å²	69.2	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-67.6	-39	178.4	50.8	0	0	0	0	112.7	F159 I160 A166 L167	F159-T163 HydrophobicContact CD1-CG2 4.2Å; F159-T163 HydrophobicContact CE1-CG2 3.79Å; F159-T163 HydrophobicContact CE2-CG2 4.17Å; F159-T163 HydrophobicContact CZ-CG2 3.77Å; F159-T163 WeakPolarHBondContact O-CB 3.4Å; F159-T163 WeakPolarHBondContact O-CG2 3.14Å; F159-T163 PolarHBondContact O-N 3.33Å; F159-T163 PolarHBondContact O-OG1 2.89Å; I160-T163 WeakPolarHBondContact CA-OG1 3.29Å; I160-T163 PolarHBondContact O-OG1 2.98Å; I160-T163 VanDerWaalsContact O-OG1 3.12Å; T163-A166 PolarHBondContact O-N 3.1Å; T163-L167 VanDerWaalsContact O-CB 3.31Å; T163-L167 WeakPolarHBondContact O-CB 3.45Å; T163-L167 PolarHBondContact O-N 2.92Å
164	F	87.2	Confident	84.1	Confident	98 Å²	98	74.6 Å²	74.6	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-45.1	173.7	178.8	-111.4	0	0	0	112.2	I160 Q161 L167 I168 I187	I160-F164 WeakPolarHBondContact O-CB 3.23Å; I160-F164 PolarHBondContact O-N 3.48Å; Q161-F164 PolarHBondContact O-N 2.77Å; F164-L167 PolarHBondContact O-N 3.21Å; F164-I168 HydrophobicContact CD1-CD1 3.84Å; F164-I168 HydrophobicContact CD2-CD1 4.32Å; F164-I168 HydrophobicContact CE1-CD1 3.51Å; F164-I168 HydrophobicContact CE2-CD1 4.02Å; F164-I168 HydrophobicContact CG-CD1 4.25Å; F164-I168 HydrophobicContact CZ-CD1 3.62Å; F164-I168 WeakPolarHBondContact O-CG1 3.2Å; F164-I168 PolarHBondContact O-N 3.35Å; F164-I187 HydrophobicContact CE1-CD1 3.65Å; F164-I187 HydrophobicContact CZ-CD1 3.91Å
165	L	84.4	Confident	82.9	Confident	13 Å²	13	77.2 Å²	77.2	7%	0.068	40%	0.397	C	S	.	.	H	α-helix	trans	-63.6	-45.7	174.6	-69.1	175.5	0	0	0	111.4	L126 F127 Q161 I162 L167 I168 I169	L126-L165 HydrophobicContact CD1-CD2 3.75Å; L126-L165 HydrophobicContact CD2-CD2 4.05Å; L126-L165 HydrophobicContact CG-CD1 4.31Å; L126-L165 HydrophobicContact CG-CD2 3.96Å; F127-L165 HydrophobicContact CD1-CD1 3.87Å; F127-L165 HydrophobicContact CE1-CD1 3.56Å; F127-L165 HydrophobicContact CZ-CD1 4.26Å; Q161-L165 HydrophobicContact CG-CD1 4.16Å; Q161-L165 WeakPolarHBondContact O-CB 3.47Å; Q161-L165 VanDerWaalsContact O-CG 3.26Å; Q161-L165 WeakPolarHBondContact O-CG 3.48Å; Q161-L165 PolarHBondContact O-N 2.85Å; I162-L165 PolarHBondContact O-N 3.39Å; L165-L167 VanDerWaalsContact C-N 3.28Å; L165-L167 PolarHBondContact O-N 3.37Å; L165-I168 PolarHBondContact O-N 2.87Å; L165-I169 WeakPolarHBondContact O-CD1 3.49Å; L165-I169 WeakPolarHBondContact O-CG1 3.44Å; L165-I169 PolarHBondContact O-N 3.04Å
166	A	83.9	Confident	81.9	Confident	46 Å²	46	78.9 Å²	78.9	38%	0.38	41%	0.405	S	S	.	.	H	α-helix	trans	-58.9	-39	175.6	0	0	0	0	0	112.3	I162 T163 I169 T170	I162-A166 WeakPolarHBondContact O-CB 3.45Å; I162-A166 PolarHBondContact O-N 3.13Å; T163-A166 PolarHBondContact O-N 3.1Å; A166-I169 PolarHBondContact O-N 3.45Å; A166-T170 VanDerWaalsContact O-CB 3.23Å; A166-T170 WeakPolarHBondContact O-CB 3.43Å; A166-T170 PolarHBondContact O-N 2.72Å; A166-T170 PolarHBondContact O-OG1 2.87Å
167	L	85.1	Confident	81	Confident	110 Å²	110	80.7 Å²	80.7	58%	0.576	41%	0.409	S	S	*	.	H	α-helix	trans	-67.7	-38.4	177	-172.7	150.7	0	0	0	112.2	T163 F164 L165 G171	T163-L167 VanDerWaalsContact O-CB 3.31Å; T163-L167 WeakPolarHBondContact O-CB 3.45Å; T163-L167 PolarHBondContact O-N 2.92Å; F164-L167 PolarHBondContact O-N 3.21Å; L165-L167 VanDerWaalsContact C-N 3.28Å; L165-L167 PolarHBondContact O-N 3.37Å; L167-G171 WeakPolarHBondContact O-CA 3.14Å; L167-G171 PolarHBondContact O-N 2.89Å
168	I	82.9	Confident	80.4	Confident	8 Å²	8	84.9 Å²	84.9	4%	0.041	43%	0.432	C	S	.	.	H	α-helix	trans	-68.2	-43.7	174.1	-69	160.1	0	0	0	111.1	F164 L165 S172 I187	F164-I168 HydrophobicContact CD1-CD1 3.84Å; F164-I168 HydrophobicContact CD2-CD1 4.32Å; F164-I168 HydrophobicContact CE1-CD1 3.51Å; F164-I168 HydrophobicContact CE2-CD1 4.02Å; F164-I168 HydrophobicContact CG-CD1 4.25Å; F164-I168 HydrophobicContact CZ-CD1 3.62Å; F164-I168 WeakPolarHBondContact O-CG1 3.2Å; F164-I168 PolarHBondContact O-N 3.35Å; L165-I168 PolarHBondContact O-N 2.87Å; I168-S172 WeakPolarHBondContact O-CB 3.25Å; I168-S172 PolarHBondContact O-N 2.87Å; I168-S172 PolarHBondContact O-OG 2.77Å; I168-I187 HydrophobicContact CD1-CD1 3.4Å
169	I	79.6	Confident	80	Confident	55 Å²	55	89 Å²	89	28%	0.282	45%	0.449	S	S	.	.	H	α-helix	trans	-66.2	-43	-179.9	-62.4	161.4	0	0	0	110.6	F122 L165 A166 S172 R173	F122-I169 HydrophobicContact CE1-CD1 3.71Å; F122-I169 HydrophobicContact CE1-CG1 4.21Å; F122-I169 HydrophobicContact CZ-CD1 3.71Å; F122-I169 HydrophobicContact CZ-CG1 3.89Å; L165-I169 WeakPolarHBondContact O-CD1 3.49Å; L165-I169 WeakPolarHBondContact O-CG1 3.44Å; L165-I169 PolarHBondContact O-N 3.04Å; A166-I169 PolarHBondContact O-N 3.45Å; I169-S172 PolarHBondContact O-OG 3.32Å; I169-S172 VanDerWaalsContact O-OG 3.13Å; I169-R173 WeakPolarHBondContact O-CB 3.35Å; I169-R173 WeakPolarHBondContact O-CG 3.27Å; I169-R173 PolarHBondContact O-N 3.38Å; I169-R173 VanDerWaalsContact O-N 3.1Å
170	T	80.9	Confident	79.5	Confident	72 Å²	72	82.4 Å²	82.4	44%	0.442	42%	0.421	S	S	.	.	H	α-helix	trans	-71.4	-45.1	178.5	-51.9	0	0	0	0	110.7	A166 S172 R173 F174	A166-T170 VanDerWaalsContact O-CB 3.23Å; A166-T170 WeakPolarHBondContact O-CB 3.43Å; A166-T170 PolarHBondContact O-N 2.72Å; A166-T170 PolarHBondContact O-OG1 2.87Å; T170-S172 VanDerWaalsContact C-N 3.33Å; T170-S172 PolarHBondContact O-N 3.12Å; T170-R173 PolarHBondContact O-N 2.94Å; T170-F174 HydrophobicContact CG2-CD2 3.89Å; T170-F174 WeakPolarHBondContact O-CB 3.31Å; T170-F174 PolarHBondContact O-N 2.9Å
171	G	76.3	Confident	78.9	Confident	11 Å²	11	81.9 Å²	81.9	11%	0.113	42%	0.418	C	S	.	.	H	α-helix	trans	-65.8	-32.3	-179.8	0	0	0	0	0	113.9	L167 C175 Q176	L167-G171 WeakPolarHBondContact O-CA 3.14Å; L167-G171 PolarHBondContact O-N 2.89Å; G171-C175 PolarHBondContact O-N 3.44Å; G171-Q176 PolarHBondContact O-N 2.9Å
172	S	72.8	Confident	78.5	Confident	48 Å²	48	90.3 Å²	90.3	34%	0.336	45%	0.449	S	S	.	.	H	α-helix	trans	-77.5	-42.5	174.5	56.6	0	0	0	0	112.4	I168 I169 T170	I168-S172 WeakPolarHBondContact O-CB 3.25Å; I168-S172 PolarHBondContact O-N 2.87Å; I168-S172 PolarHBondContact O-OG 2.77Å; I169-S172 PolarHBondContact O-OG 3.32Å; I169-S172 VanDerWaalsContact O-OG 3.13Å; T170-S172 VanDerWaalsContact C-N 3.33Å; T170-S172 PolarHBondContact O-N 3.12Å
173	R	71.2	Confident	78.2	Confident	189 Å²	189	86.6 Å²	86.6	71%	0.713	43%	0.433	S	S	*	.	H	α-helix	trans	-76.9	-38.6	-179.4	-72.4	-174.5	172.2	-168.1	-2	115.6	I169 T170	I169-R173 WeakPolarHBondContact O-CB 3.35Å; I169-R173 WeakPolarHBondContact O-CG 3.27Å; I169-R173 PolarHBondContact O-N 3.38Å; I169-R173 VanDerWaalsContact O-N 3.1Å; T170-R173 PolarHBondContact O-N 2.94Å
174	F	65.9	Low	77.8	Confident	168 Å²	168	84.9 Å²	84.9	74%	0.737	42%	0.423	S	S	*	.	H	α-helix	trans	-109	-22.3	-169.4	-67.6	-82.7	0	0	0	114.8	T170	T170-F174 HydrophobicContact CG2-CD2 3.89Å; T170-F174 WeakPolarHBondContact O-CB 3.31Å; T170-F174 PolarHBondContact O-N 2.9Å
175	C	64.2	Low	77.5	Confident	72 Å²	72	85.9 Å²	85.9	49%	0.486	43%	0.425	S	S	.	.	S	Bend	trans	-124.5	-8	-167.2	-60.1	0	0	0	0	115.2	G171 K177	G171-C175 PolarHBondContact O-N 3.44Å; C175-K177 HydrophobicContact CB-CG 4.05Å; C175-K177 PolarHBondContact O-N 2.7Å
176	Q	67.6	Low	77.3	Confident	160 Å²	160	88.8 Å²	88.8	75%	0.748	45%	0.447	S	S	*	.			trans	43.7	26.7	-177	-64.5	-170.3	-6.2	0	0	115.4	G171	G171-Q176 PolarHBondContact O-N 2.9Å
177	K	74.4	Confident	77.3	Confident	135 Å²	135	88 Å²	88	59%	0.587	44%	0.436	S	S	*	.			trans	-66.6	129.5	-172.6	-74.1	-171.3	176.9	-175.4	0	110	C175 F179 A180 I181	C175-K177 HydrophobicContact CB-CG 4.05Å; C175-K177 PolarHBondContact O-N 2.7Å; K177-F179 PolarHBondContact O-N 3.14Å; K177-F179 VanDerWaalsContact O-N 3.13Å; K177-A180 HydrophobicContact CB-CB 4.47Å; K177-A180 WeakPolarHBondContact O-CB 3.43Å; K177-A180 PolarHBondContact O-N 3.06Å; K177-I181 PolarHBondContact O-N 3.41Å; K177-I181 VanDerWaalsContact O-N 3.16Å
178	P	77.4	Confident	77.1	Confident	108 Å²	108	83.2 Å²	83.2	70%	0.701	41%	0.412	S	S	*	.	H	α-helix	trans	-61.7	-30	-173	22.9	-33.8	0	0	0	112.8	R182	P178-R182 WeakPolarHBondContact O-CB 3.38Å; P178-R182 PolarHBondContact O-N 3.45Å
179	F	80.7	Confident	76.9	Confident	154 Å²	154	84.8 Å²	84.8	68%	0.675	42%	0.423	S	S	*	.	H	α-helix	trans	-62.3	-45.5	171.4	179.6	-96.2	0	0	0	112.7	K177 I181 R182 A183	K177-F179 PolarHBondContact O-N 3.14Å; K177-F179 VanDerWaalsContact O-N 3.13Å; F179-I181 VanDerWaalsContact C-N 3.34Å; F179-I181 PolarHBondContact O-N 3.08Å; F179-R182 PolarHBondContact O-N 2.61Å; F179-A183 VanDerWaalsContact O-CB 3.26Å; F179-A183 WeakPolarHBondContact O-CB 3.28Å; F179-A183 PolarHBondContact O-N 2.67Å
180	A	81.5	Confident	77.1	Confident	6 Å²	6	87 Å²	87	5%	0.05	43%	0.431	C	S	.	.	H	α-helix	trans	-66.1	-38.2	179.8	0	0	0	0	0	111.5	K177 S184	K177-A180 HydrophobicContact CB-CB 4.47Å; K177-A180 WeakPolarHBondContact O-CB 3.43Å; K177-A180 PolarHBondContact O-N 3.06Å; A180-S184 WeakPolarHBondContact O-CB 3.34Å; A180-S184 PolarHBondContact O-N 2.81Å; A180-S184 PolarHBondContact O-OG 3.44Å
181	I	76.4	Confident	77.2	Confident	89 Å²	89	84.5 Å²	84.5	46%	0.456	42%	0.415	S	S	.	.	H	α-helix	trans	-63.8	-51.7	174.4	-61	170.9	0	0	0	110	K177 F179 A183 S184 Y185	K177-I181 PolarHBondContact O-N 3.41Å; K177-I181 VanDerWaalsContact O-N 3.16Å; F179-I181 VanDerWaalsContact C-N 3.34Å; F179-I181 PolarHBondContact O-N 3.08Å; I181-A183 VanDerWaalsContact C-N 3.35Å; I181-A183 PolarHBondContact O-N 2.95Å; I181-S184 PolarHBondContact O-N 3.27Å; I181-S184 PolarHBondContact O-OG 3.43Å; I181-Y185 PolarHBondContact O-N 2.87Å
182	R	80.3	Confident	77.4	Confident	197 Å²	197	85.9 Å²	85.9	74%	0.743	42%	0.418	S	S	*	.	H	α-helix	trans	-60.2	-40.6	178	-174.7	179	-72	-175.8	-3	112.6	P178 F179 Y185 S186	P178-R182 WeakPolarHBondContact O-CB 3.38Å; P178-R182 PolarHBondContact O-N 3.45Å; F179-R182 PolarHBondContact O-N 2.61Å; R182-Y185 PolarHBondContact O-N 3.47Å; R182-S186 WeakPolarHBondContact O-CB 3.45Å; R182-S186 PolarHBondContact O-N 3.45Å
183	A	81	Confident	78	Confident	18 Å²	18	87.5 Å²	87.5	15%	0.149	42%	0.417	C	S	.	.	H	α-helix	trans	-64.1	-45.4	175.1	0	0	0	0	0	111.6	F179 I181 Y185 S186 I187	F179-A183 VanDerWaalsContact O-CB 3.26Å; F179-A183 WeakPolarHBondContact O-CB 3.28Å; F179-A183 PolarHBondContact O-N 2.67Å; I181-A183 VanDerWaalsContact C-N 3.35Å; I181-A183 PolarHBondContact O-N 2.95Å; A183-Y185 VanDerWaalsContact C-N 3.33Å; A183-Y185 PolarHBondContact O-N 2.87Å; A183-S186 PolarHBondContact O-N 3.21Å; A183-I187 WeakPolarHBondContact O-CD1 3.45Å; A183-I187 VanDerWaalsContact O-CG1 3.3Å; A183-I187 WeakPolarHBondContact O-CG1 3.02Å; A183-I187 PolarHBondContact O-N 3.4Å
184	S	80.9	Confident	78.6	Confident	25 Å²	25	78.8 Å²	78.8	18%	0.175	38%	0.384	C	S	.	.	H	α-helix	trans	-61.4	-40.3	177.6	73.1	0	0	0	0	112.5	A180 I181 I187 A188	A180-S184 WeakPolarHBondContact O-CB 3.34Å; A180-S184 PolarHBondContact O-N 2.81Å; A180-S184 PolarHBondContact O-OG 3.44Å; I181-S184 PolarHBondContact O-N 3.27Å; I181-S184 PolarHBondContact O-OG 3.43Å; S184-I187 PolarHBondContact O-N 3Å; S184-A188 WeakPolarHBondContact O-CB 3.45Å; S184-A188 PolarHBondContact O-N 3.4Å
185	Y	80	Confident	79.6	Confident	119 Å²	119	74.4 Å²	74.4	47%	0.467	37%	0.365	S	S	.	.	H	α-helix	trans	-64.8	-46.2	174.4	179.2	-98.6	0	0	0	111.9	I118 I181 R182 A183 I187 A188 C189	I118-Y185 HydrophobicContact CD1-CE2 4.5Å; I181-Y185 PolarHBondContact O-N 2.87Å; R182-Y185 PolarHBondContact O-N 3.47Å; A183-Y185 VanDerWaalsContact C-N 3.33Å; A183-Y185 PolarHBondContact O-N 2.87Å; Y185-I187 VanDerWaalsContact C-N 3.33Å; Y185-I187 PolarHBondContact O-N 3.11Å; Y185-A188 PolarHBondContact O-N 3.27Å; Y185-C189 VanDerWaalsContact CZ-SG 3.56Å; Y185-C189 WeakPolarHBondContact O-CB 3.22Å; Y185-C189 PolarHBondContact O-N 2.83Å; Y185-C189 PolarHBondContact O-SG 3.49Å; Y185-C189 VanDerWaalsContact O-SG 3.38Å
186	S	80.1	Confident	80.6	Confident	75 Å²	75	71.2 Å²	71.2	52%	0.524	34%	0.343	S	S	.	.	H	α-helix	trans	-57.5	-45	176.7	-172.2	0	0	0	0	111.9	R182 A183 C189 F190	R182-S186 WeakPolarHBondContact O-CB 3.45Å; R182-S186 PolarHBondContact O-N 3.45Å; A183-S186 PolarHBondContact O-N 3.21Å; S186-C189 PolarHBondContact O-N 2.93Å; S186-F190 WeakPolarHBondContact O-CB 3.4Å; S186-F190 PolarHBondContact O-N 2.74Å
187	I	83.6	Confident	81.5	Confident	30 Å²	30	66.9 Å²	66.9	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-67.5	-39.8	178	-66.9	160.7	0	0	0	111.7	L120 L126 F164 I168 A183 S184 Y185 F190 L191	L120-I187 HydrophobicContact CD1-CB 4.4Å; L120-I187 HydrophobicContact CD1-CG2 4.17Å; L126-I187 HydrophobicContact CD1-CG2 3.75Å; F164-I187 HydrophobicContact CE1-CD1 3.65Å; F164-I187 HydrophobicContact CZ-CD1 3.91Å; I168-I187 HydrophobicContact CD1-CD1 3.4Å; A183-I187 WeakPolarHBondContact O-CD1 3.45Å; A183-I187 VanDerWaalsContact O-CG1 3.3Å; A183-I187 WeakPolarHBondContact O-CG1 3.02Å; A183-I187 PolarHBondContact O-N 3.4Å; S184-I187 PolarHBondContact O-N 3Å; Y185-I187 VanDerWaalsContact C-N 3.33Å; Y185-I187 PolarHBondContact O-N 3.11Å; I187-F190 PolarHBondContact O-N 3.18Å; I187-L191 HydrophobicContact CG2-CD1 4.25Å; I187-L191 HydrophobicContact CG2-CG 4.46Å; I187-L191 WeakPolarHBondContact O-CB 3.49Å; I187-L191 WeakPolarHBondContact O-CG 3.17Å; I187-L191 PolarHBondContact O-N 3.04Å
188	A	81.6	Confident	81.8	Confident	8 Å²	8	63.4 Å²	63.4	7%	0.066	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-46.1	175.7	0	0	0	0	0	111.6	I118 S184 Y185 L191 Q192	I118-A188 HydrophobicContact CB-CB 4.45Å; I118-A188 HydrophobicContact CG2-CB 4.11Å; S184-A188 WeakPolarHBondContact O-CB 3.45Å; S184-A188 PolarHBondContact O-N 3.4Å; Y185-A188 PolarHBondContact O-N 3.27Å; A188-L191 PolarHBondContact O-N 2.77Å; A188-Q192 PolarHBondContact O-N 3.46Å
189	C	79.1	Confident	82.1	Confident	42 Å²	42	60.1 Å²	60.1	28%	0.284	29%	0.286	S	S	.	.	H	α-helix	trans	-60.8	-46.4	174.3	-71.5	0	0	0	0	112.2	Y185 S186 L191 Q192 W193	Y185-C189 VanDerWaalsContact CZ-SG 3.56Å; Y185-C189 WeakPolarHBondContact O-CB 3.22Å; Y185-C189 PolarHBondContact O-N 2.83Å; Y185-C189 PolarHBondContact O-SG 3.49Å; Y185-C189 VanDerWaalsContact O-SG 3.38Å; S186-C189 PolarHBondContact O-N 2.93Å; C189-L191 PolarHBondContact O-N 2.96Å; C189-Q192 PolarHBondContact O-N 3.45Å; C189-W193 WeakPolarHBondContact O-CB 3.26Å; C189-W193 PolarHBondContact O-N 2.83Å
190	F	83.5	Confident	82.2	Confident	102 Å²	102	53 Å²	53	45%	0.447	26%	0.255	S	S	.	.	H	α-helix	trans	-63.6	-40.2	178.6	-177.7	-121.7	0	0	0	112.5	F129 S186 I187 W193 I194	F129-F190 HydrophobicContact CD1-CE1 4.41Å; F129-F190 AromaticContact CE1-CE1 3.75Å; F129-F190 HydrophobicContact CE1-CE1 3.75Å; F129-F190 AromaticContact CE1-CZ 3.91Å; F129-F190 HydrophobicContact CE1-CZ 3.91Å; F129-F190 HydrophobicContact CZ-CE1 4.45Å; F129-F190 HydrophobicContact CZ-CZ 4.2Å; S186-F190 WeakPolarHBondContact O-CB 3.4Å; S186-F190 PolarHBondContact O-N 2.74Å; I187-F190 PolarHBondContact O-N 3.18Å; F190-W193 HydrophobicContact CD2-CE3 4.49Å; F190-W193 HydrophobicContact CE2-CE3 4.39Å; F190-W193 WeakPolarHBondContact O-CB 3.41Å; F190-W193 PolarHBondContact O-N 2.87Å; F190-I194 HydrophobicContact CD1-CD1 3.78Å; F190-I194 HydrophobicContact CD2-CD1 4.39Å; F190-I194 HydrophobicContact CE1-CD1 3.49Å; F190-I194 VanDerWaalsContact CE1-CD1 3.49Å; F190-I194 HydrophobicContact CE1-CG1 4.5Å; F190-I194 HydrophobicContact CE2-CD1 4.12Å; F190-I194 HydrophobicContact CE2-CG1 4.3Å; F190-I194 HydrophobicContact CG-CD1 4.24Å; F190-I194 HydrophobicContact CZ-CD1 3.68Å; F190-I194 HydrophobicContact CZ-CG1 4.28Å; F190-I194 WeakPolarHBondContact O-CG1 3.31Å; F190-I194 PolarHBondContact O-N 2.71Å
191	L	82.1	Confident	82.1	Confident	19 Å²	19	54 Å²	54	10%	0.099	26%	0.262	C	S	.	.	H	α-helix	trans	-67.1	-38.1	173.8	-76	179	0	0	0	113.1	L125 L126 I187 A188 C189 W193 I194 K195	L125-L191 HydrophobicContact CB-CD2 4.39Å; L125-L191 HydrophobicContact CD2-CD2 4.08Å; L125-L191 HydrophobicContact CG-CD2 3.98Å; L126-L191 HydrophobicContact CB-CD1 3.77Å; L126-L191 HydrophobicContact CD1-CD1 3.57Å; L126-L191 HydrophobicContact CG-CD1 4.24Å; I187-L191 HydrophobicContact CG2-CD1 4.25Å; I187-L191 HydrophobicContact CG2-CG 4.46Å; I187-L191 WeakPolarHBondContact O-CB 3.49Å; I187-L191 WeakPolarHBondContact O-CG 3.17Å; I187-L191 PolarHBondContact O-N 3.04Å; A188-L191 PolarHBondContact O-N 2.77Å; C189-L191 PolarHBondContact O-N 2.96Å; L191-W193 VanDerWaalsContact C-N 3.3Å; L191-I194 HydrophobicContact CD2-CD1 4.48Å; L191-I194 PolarHBondContact O-N 3.2Å; L191-K195 WeakPolarHBondContact O-CB 3.27Å; L191-K195 PolarHBondContact O-N 2.81Å
192	Q	80.5	Confident	82.3	Confident	40 Å²	40	52.2 Å²	52.2	19%	0.187	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-38.6	173.9	-172.7	168.9	3.4	0	0	110.9	A188 C189 K195 L196 N425	A188-Q192 PolarHBondContact O-N 3.46Å; C189-Q192 PolarHBondContact O-N 3.45Å; Q192-K195 PolarHBondContact O-N 3.35Å; Q192-L196 WeakPolarHBondContact O-CB 3.33Å; Q192-L196 PolarHBondContact O-N 2.92Å; Q192-N425 PolarHBondContact NE2-OD1 3.03Å
193	W	86.1	Confident	82.3	Confident	81 Å²	81	43.9 Å²	43.9	31%	0.307	22%	0.222	S	C	.	.	H	α-helix	trans	-63.3	-46.3	173.8	-173.2	88.8	0	0	0	112.4	C189 F190 L191 L196 F197 I252 L253	C189-W193 WeakPolarHBondContact O-CB 3.26Å; C189-W193 PolarHBondContact O-N 2.83Å; F190-W193 HydrophobicContact CD2-CE3 4.49Å; F190-W193 HydrophobicContact CE2-CE3 4.39Å; F190-W193 WeakPolarHBondContact O-CB 3.41Å; F190-W193 PolarHBondContact O-N 2.87Å; L191-W193 VanDerWaalsContact C-N 3.3Å; W193-L196 PolarHBondContact O-N 3.49Å; W193-F197 HydrophobicContact CH2-CD2 4.45Å; W193-F197 WeakPolarHBondContact O-CB 3.43Å; W193-F197 PolarHBondContact O-N 3.45Å; W193-I252 HydrophobicContact CH2-CD1 4.45Å; W193-I252 HydrophobicContact CZ2-CB 4.13Å; W193-I252 HydrophobicContact CZ2-CD1 4.05Å; W193-I252 HydrophobicContact CZ2-CG2 4.05Å; W193-L253 HydrophobicContact CG-CD1 4.25Å
194	I	84.7	Confident	82.1	Confident	6 Å²	6	46.1 Å²	46.1	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-43.8	174.5	-64.6	160.8	0	0	0	111.1	L125 F129 F190 L191 L196 F197 L198	L125-I194 HydrophobicContact CD1-CG2 4.28Å; L125-I194 HydrophobicContact CD2-CB 4.24Å; L125-I194 HydrophobicContact CD2-CG2 3.97Å; L125-I194 HydrophobicContact CG-CG2 4.49Å; F129-I194 HydrophobicContact CD1-CD1 3.71Å; F129-I194 HydrophobicContact CD2-CD1 4.02Å; F129-I194 HydrophobicContact CD2-CG2 4.12Å; F129-I194 HydrophobicContact CE1-CD1 3.55Å; F129-I194 HydrophobicContact CE2-CD1 3.86Å; F129-I194 HydrophobicContact CE2-CG1 4.32Å; F129-I194 HydrophobicContact CE2-CG2 4.25Å; F129-I194 HydrophobicContact CG-CD1 3.94Å; F129-I194 HydrophobicContact CZ-CD1 3.62Å; F129-I194 HydrophobicContact CZ-CG1 4.3Å; F190-I194 HydrophobicContact CD1-CD1 3.78Å; F190-I194 HydrophobicContact CD2-CD1 4.39Å; F190-I194 HydrophobicContact CE1-CD1 3.49Å; F190-I194 VanDerWaalsContact CE1-CD1 3.49Å; F190-I194 HydrophobicContact CE1-CG1 4.5Å; F190-I194 HydrophobicContact CE2-CD1 4.12Å; F190-I194 HydrophobicContact CE2-CG1 4.3Å; F190-I194 HydrophobicContact CG-CD1 4.24Å; F190-I194 HydrophobicContact CZ-CD1 3.68Å; F190-I194 HydrophobicContact CZ-CG1 4.28Å; F190-I194 WeakPolarHBondContact O-CG1 3.31Å; F190-I194 PolarHBondContact O-N 2.71Å; L191-I194 HydrophobicContact CD2-CD1 4.48Å; L191-I194 PolarHBondContact O-N 3.2Å; I194-L196 VanDerWaalsContact C-N 3.27Å; I194-L196 PolarHBondContact O-N 2.95Å; I194-F197 WeakPolarHBondContact O-CB 3.43Å; I194-F197 PolarHBondContact O-N 3.39Å; I194-L198 HydrophobicContact CG2-CD1 3.83Å; I194-L198 HydrophobicContact CG2-CG 4.18Å; I194-L198 WeakPolarHBondContact O-CB 3.46Å; I194-L198 WeakPolarHBondContact O-CG 3.34Å; I194-L198 PolarHBondContact O-N 2.93Å
195	K	85.4	Confident	81.8	Confident	76 Å²	76	46.1 Å²	46.1	33%	0.33	23%	0.227	S	C	.	.	H	α-helix	trans	-56.8	-44.5	176.3	-175.4	-160.4	171.7	-159.8	0	110.5	L125 L191 Q192 N199 N425	L125-K195 HydrophobicContact CD2-CB 4.31Å; L191-K195 WeakPolarHBondContact O-CB 3.27Å; L191-K195 PolarHBondContact O-N 2.81Å; Q192-K195 PolarHBondContact O-N 3.35Å; K195-N199 WeakPolarHBondContact O-CB 3.37Å; K195-N199 PolarHBondContact O-N 3.49Å; K195-N425 PolarHBondContact NZ-O 3.04Å
196	L	85.3	Confident	81.4	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-69	-40.2	179	-171	53.8	0	0	0	112	Q192 W193 I194 N199 I200 Y249 L253 F421 F424 N425	Q192-L196 WeakPolarHBondContact O-CB 3.33Å; Q192-L196 PolarHBondContact O-N 2.92Å; W193-L196 PolarHBondContact O-N 3.49Å; I194-L196 VanDerWaalsContact C-N 3.27Å; I194-L196 PolarHBondContact O-N 2.95Å; L196-N199 PolarHBondContact O-N 3.35Å; L196-I200 HydrophobicContact CD1-CD1 4.15Å; L196-I200 HydrophobicContact CD1-CG1 4.46Å; L196-I200 HydrophobicContact CG-CD1 4.07Å; L196-I200 WeakPolarHBondContact O-CG1 3.41Å; L196-I200 PolarHBondContact O-N 3.02Å; L196-Y249 HydrophobicContact CD2-CD1 3.57Å; L196-Y249 HydrophobicContact CD2-CE1 4Å; L196-L253 HydrophobicContact CB-CD1 4.08Å; L196-L253 HydrophobicContact CD2-CD1 3.71Å; L196-L253 HydrophobicContact CG-CD1 3.84Å; L196-F421 HydrophobicContact CD1-CD1 4.37Å; L196-F421 HydrophobicContact CD2-CD1 4.16Å; L196-F424 HydrophobicContact CD1-CB 3.52Å; L196-F424 HydrophobicContact CD1-CG 4.38Å; L196-N425 WeakPolarHBondContact CD1-ND2 3.42Å
197	F	86.4	Confident	80.8	Confident	68 Å²	68	48.1 Å²	48.1	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-57.8	-51	172.6	-175.9	-95.4	0	0	0	111.9	W193 I194 N199 I200 C201 I252 L253 L256	W193-F197 HydrophobicContact CH2-CD2 4.45Å; W193-F197 WeakPolarHBondContact O-CB 3.43Å; W193-F197 PolarHBondContact O-N 3.45Å; I194-F197 WeakPolarHBondContact O-CB 3.43Å; I194-F197 PolarHBondContact O-N 3.39Å; F197-N199 VanDerWaalsContact C-N 3.34Å; F197-N199 PolarHBondContact O-N 3.46Å; F197-I200 PolarHBondContact O-N 3.1Å; F197-C201 WeakPolarHBondContact O-CB 3.26Å; F197-C201 PolarHBondContact O-N 3.07Å; F197-C201 PolarHBondContact O-SG 3.41Å; F197-C201 VanDerWaalsContact O-SG 3.39Å; F197-I252 HydrophobicContact CE2-CG2 4.45Å; F197-L253 HydrophobicContact CB-CD2 3.77Å; F197-L253 HydrophobicContact CD2-CD2 3.76Å; F197-L253 HydrophobicContact CG-CD2 4.26Å; F197-L256 HydrophobicContact CD2-CD2 3.98Å; F197-L256 HydrophobicContact CE2-CD2 3.88Å
198	L	81.9	Confident	80	Confident	63 Å²	63	50.7 Å²	50.7	33%	0.33	25%	0.25	S	S	.	.	H	α-helix	trans	-62.1	-40.9	178.1	-69.4	172.4	0	0	0	111.8	L125 I194 C201 F202	L125-L198 HydrophobicContact CD1-CD1 3.96Å; I194-L198 HydrophobicContact CG2-CD1 3.83Å; I194-L198 HydrophobicContact CG2-CG 4.18Å; I194-L198 WeakPolarHBondContact O-CB 3.46Å; I194-L198 WeakPolarHBondContact O-CG 3.34Å; I194-L198 PolarHBondContact O-N 2.93Å; L198-C201 PolarHBondContact O-N 3.34Å; L198-F202 HydrophobicContact CD2-CD2 4.22Å; L198-F202 HydrophobicContact CD2-CE2 3.89Å; L198-F202 WeakPolarHBondContact O-CD2 3.27Å; L198-F202 PolarHBondContact O-N 3.4Å
199	N	83.8	Confident	79.2	Confident	39 Å²	39	52.6 Å²	52.6	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-42.8	174.9	-83.2	0.5	0	0	0	112	K195 L196 F197 C203 F424	K195-N199 WeakPolarHBondContact O-CB 3.37Å; K195-N199 PolarHBondContact O-N 3.49Å; L196-N199 PolarHBondContact O-N 3.35Å; F197-N199 VanDerWaalsContact C-N 3.34Å; F197-N199 PolarHBondContact O-N 3.46Å; N199-C203 WeakPolarHBondContact O-CA 3.42Å; N199-C203 VanDerWaalsContact O-CB 3.22Å; N199-C203 WeakPolarHBondContact O-CB 3.21Å; N199-C203 PolarHBondContact O-N 3.45Å; N199-F424 HydrophobicContact CB-CB 4.49Å; N199-F424 HydrophobicContact CB-CD1 3.97Å; N199-F424 PolarHBondContact ND2-O 2.92Å; N199-F424 WeakPolarHBondContact O-CE1 3.45Å
200	I	82.6	Confident	78.5	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.015	27%	0.267	C	S	.	.	H	α-helix	trans	-70.1	-36.4	177.5	-66.8	165.1	0	0	0	111.2	L196 F197 L253 L256 Q257 K271 F421 F424	L196-I200 HydrophobicContact CD1-CD1 4.15Å; L196-I200 HydrophobicContact CD1-CG1 4.46Å; L196-I200 HydrophobicContact CG-CD1 4.07Å; L196-I200 WeakPolarHBondContact O-CG1 3.41Å; L196-I200 PolarHBondContact O-N 3.02Å; F197-I200 PolarHBondContact O-N 3.1Å; I200-L253 HydrophobicContact CD1-CB 4.33Å; I200-L253 HydrophobicContact CD1-CD2 4.21Å; I200-L256 HydrophobicContact CB-CD2 4.12Å; I200-L256 HydrophobicContact CG2-CB 4.44Å; I200-L256 HydrophobicContact CG2-CD2 3.59Å; I200-L256 HydrophobicContact CG2-CG 3.75Å; I200-Q257 HydrophobicContact CG2-CB 4.41Å; I200-K271 PolarHBondContact O-NZ 3.44Å; I200-F421 HydrophobicContact CD1-CD1 4.03Å; I200-F421 HydrophobicContact CD1-CE1 3.61Å; I200-F424 HydrophobicContact CD1-CD2 4.43Å; I200-F424 HydrophobicContact CG1-CD2 3.73Å; I200-F424 HydrophobicContact CG1-CE1 4.49Å; I200-F424 HydrophobicContact CG1-CE2 3.64Å; I200-F424 HydrophobicContact CG1-CG 4.22Å; I200-F424 HydrophobicContact CG1-CZ 4.04Å
201	C	79.4	Confident	77.6	Confident	28 Å²	28	54.9 Å²	54.9	19%	0.189	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-45.9	176.2	-75.7	0	0	0	0	113	F197 L198 K271	F197-C201 WeakPolarHBondContact O-CB 3.26Å; F197-C201 PolarHBondContact O-N 3.07Å; F197-C201 PolarHBondContact O-SG 3.41Å; F197-C201 VanDerWaalsContact O-SG 3.39Å; L198-C201 PolarHBondContact O-N 3.34Å; C201-K271 WeakPolarHBondContact O-CD 3.49Å
202	F	80.3	Confident	76.8	Confident	52 Å²	52	61.6 Å²	61.6	23%	0.228	31%	0.306	C	S	.	.	H	α-helix	trans	-117	-19	-165.2	-59.3	-63.6	0	0	0	115.9	L198 Y270 K271 A278 F279 M282	L198-F202 HydrophobicContact CD2-CD2 4.22Å; L198-F202 HydrophobicContact CD2-CE2 3.89Å; L198-F202 WeakPolarHBondContact O-CD2 3.27Å; L198-F202 PolarHBondContact O-N 3.4Å; F202-Y270 CarbonylContact O-C 3.6Å; F202-Y270 WeakPolarHBondContact O-CA 3.35Å; F202-K271 PolarHBondContact O-N 3.29Å; F202-A278 HydrophobicContact CD1-CB 4.16Å; F202-F279 HydrophobicContact CB-CB 4.35Å; F202-F279 HydrophobicContact CD1-CB 3.78Å; F202-F279 HydrophobicContact CD2-CB 4.39Å; F202-F279 HydrophobicContact CE1-CB 4.15Å; F202-F279 HydrophobicContact CG-CB 3.92Å; F202-M282 HydrophobicContact CE1-CG 3.92Å; F202-M282 HydrophobicContact CZ-CG 4.22Å
203	C	79.4	Confident	76.3	Confident	21 Å²	21	60.2 Å²	60.2	14%	0.142	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-106.7	164.4	-176.5	-55.4	0	0	0	0	111.9	N199 K269 K271	N199-C203 WeakPolarHBondContact O-CA 3.42Å; N199-C203 VanDerWaalsContact O-CB 3.22Å; N199-C203 WeakPolarHBondContact O-CB 3.21Å; N199-C203 PolarHBondContact O-N 3.45Å; C203-K269 WeakPolarHBondContact CA-O 3.34Å; C203-K271 WeakPolarHBondContact O-CE 3.34Å
204	Y	76.9	Confident	75.7	Confident	65 Å²	65	57.7 Å²	57.7	26%	0.255	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-97	152.5	159.1	-69.1	-76.5	0	0	0	109.7	I268 K269 K271	Y204-I268 HydrophobicContact CD2-CG2 4.15Å; Y204-I268 VanDerWaalsContact CD2-O 3.25Å; Y204-I268 WeakPolarHBondContact CD2-O 3.44Å; Y204-I268 HydrophobicContact CE2-CG2 3.94Å; Y204-K269 PolarHBondContact N-O 3.41Å; Y204-K271 HydrophobicContact CD1-CG 4.38Å; Y204-K271 HydrophobicContact CD2-CG 4.17Å; Y204-K271 HydrophobicContact CE1-CG 3.96Å; Y204-K271 HydrophobicContact CE2-CB 4.3Å; Y204-K271 HydrophobicContact CE2-CG 3.73Å; Y204-K271 HydrophobicContact CG-CG 4.49Å
205	P	75.8	Confident	75.4	Confident	26 Å²	26	58 Å²	58	17%	0.169	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-66.3	147.5	178.9	27.7	-34.2	0	0	0	111.4	Q423 F424	P205-Q423 HydrophobicContact CB-CB 3.76Å; P205-F424 HydrophobicContact CB-CD1 4.24Å; P205-F424 HydrophobicContact CB-CD2 4.38Å; P205-F424 HydrophobicContact CB-CE1 4.1Å; P205-F424 HydrophobicContact CB-CE2 4.22Å; P205-F424 HydrophobicContact CB-CG 4.39Å; P205-F424 HydrophobicContact CB-CZ 4.09Å; P205-F424 HydrophobicContact CG-CZ 4.28Å
206	V	71.7	Confident	75.2	Confident	70 Å²	70	56.2 Å²	56.2	42%	0.424	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-74.5	128.1	179	-176.3	0	0	0	0	109.7	S208 Q423	V206-S208 VanDerWaalsContact C-N 3.34Å; V206-S208 PolarHBondContact O-N 3.2Å; V206-Q423 PolarHBondContact N-O 3.43Å; V206-Q423 VanDerWaalsContact O-CB 3.26Å; V206-Q423 WeakPolarHBondContact O-CB 3.17Å; V206-Q423 VanDerWaalsContact O-CD 3.29Å; V206-Q423 WeakPolarHBondContact O-CG 3.43Å
207	R	66.4	Low	75.2	Confident	165 Å²	165	56 Å²	56	62%	0.623	29%	0.286	S	S	*	.	S	Bend	trans	-60.6	-36.9	-174.2	-77.6	-174.1	166.1	-151.4	-4.7	114.6	Q423	R207-Q423 PolarHBondContact O-NE2 2.96Å
208	S	67.6	Low	75.1	Confident	85 Å²	85	52.9 Å²	52.9	59%	0.594	27%	0.272	S	S	*	.	S	Bend	trans	-111.5	123.6	-179.2	54	0	0	0	0	111.2	V206	V206-S208 VanDerWaalsContact C-N 3.34Å; V206-S208 PolarHBondContact O-N 3.2Å
209	I	64.5	Low	75.2	Confident	47 Å²	47	52 Å²	52	24%	0.241	27%	0.27	C	S	.	.			trans	-80.1	137.8	166.8	-55.9	171.8	0	0	0	107.6	T211 I419 D422 Q423 Q429	I209-T211 PolarHBondContact O-N 3.12Å; I209-I419 HydrophobicContact CD1-CG2 4.49Å; I209-D422 HydrophobicContact CD1-CB 3.92Å; I209-Q423 HydrophobicContact CD1-CG 4.06Å; I209-Q423 HydrophobicContact CG1-CG 3.75Å; I209-Q429 HydrophobicContact CG2-CG 3.88Å
210	N	64.5	Low	75.2	Confident	86 Å²	86	50.6 Å²	50.6	46%	0.46	26%	0.263	S	S	.	.			trans	-70.8	120.7	173.4	-179.1	-6.1	0	0	0	109.7	K212 T213 N426 Q429	N210-K212 PolarHBondContact O-N 2.99Å; N210-K212 VanDerWaalsContact O-N 3.11Å; N210-K212 PolarHBondContact OD1-N 2.89Å; N210-K212 VanDerWaalsContact OD1-N 3.08Å; N210-T213 HydrophobicContact CB-CG2 4.3Å; N210-T213 WeakPolarHBondContact O-CG2 3.47Å; N210-T213 PolarHBondContact O-N 3.48Å; N210-T213 PolarHBondContact O-OG1 2.92Å; N210-N426 PolarHBondContact N-OD1 3.48Å; N210-Q429 PolarHBondContact O-NE2 3.09Å
211	T	64.4	Low	75.2	Confident	107 Å²	107	54.2 Å²	54.2	66%	0.656	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.2	-178	49.9	0	0	0	0	113.6	I209 T213	I209-T211 PolarHBondContact O-N 3.12Å; T211-T213 VanDerWaalsContact C-N 3.31Å; T211-T213 PolarHBondContact O-N 3.29Å
212	K	64.8	Low	75.3	Confident	160 Å²	160	53.9 Å²	53.9	70%	0.696	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-11.3	179.9	-59.5	-162.7	175.4	-160.6	0	114.7	R81 N210	R81-K212 PolarHBondContact NH1-O 3.49Å; N210-K212 PolarHBondContact O-N 2.99Å; N210-K212 VanDerWaalsContact O-N 3.11Å; N210-K212 PolarHBondContact OD1-N 2.89Å; N210-K212 VanDerWaalsContact OD1-N 3.08Å
213	T	70.1	Confident	75.4	Confident	11 Å²	11	57.6 Å²	57.6	7%	0.067	29%	0.285	C	S	.	.	S	Bend	trans	-62.3	140.8	-179.3	54.3	0	0	0	0	112.4	N210 T211 I427 Q429	N210-T213 HydrophobicContact CB-CG2 4.3Å; N210-T213 WeakPolarHBondContact O-CG2 3.47Å; N210-T213 PolarHBondContact O-N 3.48Å; N210-T213 PolarHBondContact O-OG1 2.92Å; T211-T213 VanDerWaalsContact C-N 3.31Å; T211-T213 PolarHBondContact O-N 3.29Å; T213-I427 WeakPolarHBondContact CB-O 3.39Å; T213-Q429 WeakPolarHBondContact OG1-CG 3.3Å; T213-Q429 PolarHBondContact OG1-NE2 3.25Å
214	P	74.4	Confident	75.4	Confident	28 Å²	28	56.7 Å²	56.7	18%	0.182	28%	0.278	C	S	.	.			trans	-60.6	157.1	173	22.9	-32	0	0	0	113.3	Y52 I427 Q428 Q429	Y52-P214 HydrophobicContact CG-CB 4.24Å; P214-I427 WeakPolarHBondContact CD-O 3.28Å; P214-Q428 HydrophobicContact CG-CG 4.28Å; P214-Q428 CarbonylContact O-C 3.55Å; P214-Q428 WeakPolarHBondContact O-CA 3.21Å; P214-Q429 PolarHBondContact O-N 2.86Å
215	V	78.1	Confident	74.7	Confident	12 Å²	12	57.2 Å²	57.2	7%	0.073	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.5	-173.6	167	0	0	0	0	110	T79 R81 V217 Q429 R431	T79-V215 WeakPolarHBondContact O-CB 3.43Å; R81-V215 HydrophobicContact CG-CG2 4.15Å; V215-V217 HydrophobicContact CG1-CG2 4.41Å; V215-Q429 HydrophobicContact CG2-CB 4.49Å; V215-R431 HydrophobicContact CG1-CB 4.49Å; V215-R431 HydrophobicContact CG1-CG 3.94Å
216	R	81	Confident	73.9	Confident	38 Å²	38	60 Å²	60	14%	0.143	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.9	170.5	-173.3	-167.7	-68.3	-165	-8	109.7	Q428 Q429 T430 R431	R216-Q428 VanDerWaalsContact CZ-OE1 3.28Å; R216-Q428 VanDerWaalsContact NE-OE1 3.11Å; R216-Q429 PolarHBondContact N-O 3.05Å; R216-T430 HydrophobicContact CB-CG2 4.44Å; R216-T430 WeakPolarHBondContact O-CA 3.48Å; R216-R431 PolarHBondContact O-N 3.18Å
217	V	84.6	Confident	73.1	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	139	178.3	171.5	0	0	0	0	111.4	T79 N112 V215 V219 R431 I433	T79-V217 HydrophobicContact CG2-CG2 3.87Å; N112-V217 PolarHBondContact ND2-O 3.14Å; V215-V217 HydrophobicContact CG1-CG2 4.41Å; V217-V219 HydrophobicContact CG1-CG2 3.59Å; V217-R431 CarbonylContact C-O 3.56Å; V217-I433 HydrophobicContact CB-CD1 4.42Å; V217-I433 HydrophobicContact CG1-CB 4.42Å; V217-I433 HydrophobicContact CG1-CD1 3.43Å; V217-I433 VanDerWaalsContact CG1-CD1 3.43Å; V217-I433 HydrophobicContact CG1-CG1 3.91Å; V217-I433 HydrophobicContact CG2-CD1 4.06Å
218	I	85	Confident	73.1	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	101.6	165.8	-52.8	-176.6	0	0	0	107.6	L245 H248 R431 F432 I433	I218-L245 HydrophobicContact CD1-CD1 4.49Å; I218-H248 HydrophobicContact CD1-CB 4.45Å; I218-R431 PolarHBondContact N-O 3.29Å; I218-F432 HydrophobicContact CB-CD1 3.96Å; I218-F432 HydrophobicContact CB-CE1 4.3Å; I218-F432 HydrophobicContact CD1-CD1 4.38Å; I218-F432 HydrophobicContact CD1-CE1 3.94Å; I218-F432 HydrophobicContact CD1-CZ 4.18Å; I218-F432 HydrophobicContact CG2-CD1 3.96Å; I218-F432 HydrophobicContact CG2-CE1 4.08Å; I218-F432 WeakPolarHBondContact O-CA 3.48Å; I218-I433 PolarHBondContact O-N 3.37Å
219	V	84.3	Confident	73.5	Confident	45 Å²	45	54.1 Å²	54.1	27%	0.273	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	132.1	176.9	-170.5	0	0	0	0	109.8	A105 L108 V217 I433	A105-V219 HydrophobicContact CB-CG1 3.93Å; L108-V219 HydrophobicContact CB-CG2 3.7Å; L108-V219 HydrophobicContact CD1-CG2 4.17Å; V217-V219 HydrophobicContact CG1-CG2 3.59Å; V219-I433 WeakPolarHBondContact CA-O 3.29Å
220	V	82.9	Confident	74.2	Confident	10 Å²	10	52.7 Å²	52.7	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127.3	172.8	171.7	0	0	0	0	108.5	K240 I433 L434 C435	V220-K240 HydrophobicContact CG1-CB 3.49Å; V220-K240 VanDerWaalsContact CG1-CB 3.49Å; V220-K240 HydrophobicContact CG1-CD 4.28Å; V220-I433 PolarHBondContact N-O 2.7Å; V220-L434 HydrophobicContact CB-CD2 3.65Å; V220-L434 HydrophobicContact CG1-CD2 4.2Å; V220-L434 HydrophobicContact CG2-CD2 3.85Å; V220-C435 PolarHBondContact O-N 3.16Å
221	Y	83.4	Confident	75.2	Confident	79 Å²	79	48.9 Å²	48.9	31%	0.31	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.1	174.2	-171.2	-90.6	0	0	0	110.8	L101 R223 K240 C435	L101-Y221 HydrophobicContact CB-CD2 4.48Å; L101-Y221 HydrophobicContact CB-CE2 3.82Å; Y221-R223 HydrophobicContact CE1-CB 4.28Å; Y221-K240 PolarHBondContact O-NZ 3.04Å; Y221-C435 HydrophobicContact CD2-CB 3.91Å
222	H	82.1	Confident	76	Confident	21 Å²	21	45.6 Å²	45.6	10%	0.097	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	128.8	173.5	179.5	89.4	0	0	0	110.3	S236 K240 C435 L436 D437	H222-S236 WeakPolarHBondContact CE1-CB 3.48Å; H222-S236 PolarHBondContact CE1-OG 3.3Å; H222-S236 PolarHBondContact ND1-OG 3.46Å; H222-K240 HydrophobicContact CB-CD 4.28Å; H222-C435 PolarHBondContact N-O 2.95Å; H222-L436 HydrophobicContact CB-CD2 4.16Å; H222-L436 WeakPolarHBondContact O-CA 3.38Å; H222-D437 PolarHBondContact O-N 3.29Å
223	R	81	Confident	76.8	Confident	129 Å²	129	38.1 Å²	38.1	49%	0.487	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	125.8	175.1	-179.4	171.2	-141.3	-176.5	7.1	109.3	Y221 C225 D437	Y221-R223 HydrophobicContact CE1-CB 4.28Å; R223-C225 PolarHBondContact O-N 3.4Å; R223-D437 HydrophobicContact CB-CB 4.32Å; R223-D437 WeakPolarHBondContact CD-OD2 3.36Å; R223-D437 HydrophobicContact CG-CB 4.25Å; R223-D437 WeakPolarHBondContact CG-OD2 3.4Å; R223-D437 IonicContact CZ-OD2 2.6Å; R223-D437 IonicContact NE-OD2 2.66Å; R223-D437 PolarHBondContact NE-OD2 2.68Å; R223-D437 IonicContact NH2-OD2 2.37Å; R223-D437 PolarHBondContact NH2-OD2 3.42Å
224	I	79	Confident	77.5	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.015	21%	0.21	C	C	.	.			trans	-86.7	111.5	-173.5	-56.2	178.7	0	0	0	109.6	S228 A233 L436 D437 A438 S440 I441 L450	I224-S228 WeakPolarHBondContact CG2-OG 3.42Å; I224-A233 HydrophobicContact CD1-CB 4.2Å; I224-A233 HydrophobicContact CG1-CB 4.3Å; I224-A233 HydrophobicContact CG2-CB 4.22Å; I224-L436 HydrophobicContact CD1-CB 4.45Å; I224-L436 HydrophobicContact CD1-CD2 4.48Å; I224-D437 PolarHBondContact N-O 3.34Å; I224-A438 HydrophobicContact CD1-CB 4.33Å; I224-S440 PolarHBondContact O-OG 3.41Å; I224-I441 HydrophobicContact CB-CD1 4.31Å; I224-I441 HydrophobicContact CG2-CD1 3.89Å; I224-I441 HydrophobicContact CG2-CG1 4.43Å; I224-L450 HydrophobicContact CD1-CD1 4.19Å; I224-L450 HydrophobicContact CD1-CD2 3.44Å; I224-L450 VanDerWaalsContact CD1-CD2 3.44Å; I224-L450 HydrophobicContact CD1-CG 4.46Å
225	C	63.5	Low	78.1	Confident	75 Å²	75	36.6 Å²	36.6	51%	0.507	20%	0.202	S	C	.	.			trans	-63.2	135.3	175.8	-66.2	0	0	0	0	110.7	R223 S227 S228	R223-C225 PolarHBondContact O-N 3.4Å; C225-S227 PolarHBondContact O-N 2.93Å; C225-S228 WeakPolarHBondContact O-CB 3.28Å; C225-S228 PolarHBondContact O-N 3.31Å; C225-S228 PolarHBondContact O-OG 2.97Å
226	P	58.9	Low	78.4	Confident	85 Å²	85	37.4 Å²	37.4	55%	0.552	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.8	-172.9	25.6	-35.2	0	0	0	114.7
227	S	53.8	Low	78.6	Confident	115 Å²	115	35.9 Å²	35.9	80%	0.804	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	1.9	174.9	53.6	0	0	0	0	114.3	C225	C225-S227 PolarHBondContact O-N 2.93Å
228	S	66.6	Low	78.8	Confident	27 Å²	27	36 Å²	36	19%	0.189	20%	0.204	C	C	.	.			trans	-86.1	134.7	-179.1	66.7	0	0	0	0	112.1	I224 C225	I224-S228 WeakPolarHBondContact CG2-OG 3.42Å; C225-S228 WeakPolarHBondContact O-CB 3.28Å; C225-S228 PolarHBondContact O-N 3.31Å; C225-S228 PolarHBondContact O-OG 2.97Å
229	T	77	Confident	78.9	Confident	54 Å²	54	37.1 Å²	37.1	33%	0.331	21%	0.209	S	C	.	.			trans	-71	150.5	170.2	60.5	0	0	0	0	109.7	N231 M232 A233	T229-N231 PolarHBondContact O-N 2.78Å; T229-N231 VanDerWaalsContact O-N 3.16Å; T229-M232 WeakPolarHBondContact O-CA 3.34Å; T229-M232 VanDerWaalsContact O-CB 3.28Å; T229-M232 WeakPolarHBondContact O-CB 3.25Å; T229-M232 PolarHBondContact O-N 2.86Å; T229-M232 WeakPolarHBondContact OG1-CG 3.03Å; T229-A233 PolarHBondContact O-N 2.97Å
230	T	79.1	Confident	79	Confident	17 Å²	17	37.2 Å²	37.2	10%	0.104	21%	0.206	C	C	.	.	H	α-helix	trans	-58.1	-36.6	-172.4	58.8	0	0	0	0	112.8	M232 A233 L234 L446 K449 L450 Q453	T230-M232 VanDerWaalsContact C-N 3.26Å; T230-M232 PolarHBondContact O-N 3.31Å; T230-A233 WeakPolarHBondContact O-CB 3.42Å; T230-A233 PolarHBondContact O-N 3.32Å; T230-A233 VanDerWaalsContact O-N 3.17Å; T230-L234 VanDerWaalsContact O-CD1 3.24Å; T230-L234 WeakPolarHBondContact O-CD1 3.47Å; T230-L234 PolarHBondContact O-N 3.45Å; T230-L446 HydrophobicContact CG2-CD1 3.7Å; T230-L446 HydrophobicContact CG2-CG 4.18Å; T230-K449 HydrophobicContact CG2-CB 4.11Å; T230-L450 HydrophobicContact CG2-CB 4.01Å; T230-Q453 VanDerWaalsContact OG1-CD 3.3Å; T230-Q453 PolarHBondContact OG1-OE1 3.1Å
231	N	84.1	Confident	79.3	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.032	20%	0.203	C	C	.	.	H	α-helix	trans	-57.8	-34.6	173	-71.8	15	0	0	0	113.3	T229 L234 F235 F356 A400 Q453	T229-N231 PolarHBondContact O-N 2.78Å; T229-N231 VanDerWaalsContact O-N 3.16Å; N231-L234 PolarHBondContact O-N 2.73Å; N231-F235 VanDerWaalsContact O-CD2 3.27Å; N231-F235 WeakPolarHBondContact O-CD2 3.48Å; N231-F235 PolarHBondContact O-N 2.89Å; N231-F356 HydrophobicContact CB-CZ 4.12Å; N231-A400 WeakPolarHBondContact ND2-CA 3.49Å; N231-A400 PolarHBondContact ND2-O 2.96Å; N231-Q453 PolarHBondContact OD1-NE2 3.24Å; N231-Q453 PolarHBondContact OD1-OE1 2.94Å
232	M	82.7	Confident	79.6	Confident	38 Å²	38	33.2 Å²	33.2	19%	0.187	19%	0.189	C	C	.	.	H	α-helix	trans	-69.9	-39	177.6	-68.2	-68.3	-60.9	0	0	111.8	T229 T230 F235 S236 L353 F356 L357	T229-M232 WeakPolarHBondContact O-CA 3.34Å; T229-M232 VanDerWaalsContact O-CB 3.28Å; T229-M232 WeakPolarHBondContact O-CB 3.25Å; T229-M232 PolarHBondContact O-N 2.86Å; T229-M232 WeakPolarHBondContact OG1-CG 3.03Å; T230-M232 VanDerWaalsContact C-N 3.26Å; T230-M232 PolarHBondContact O-N 3.31Å; M232-F235 PolarHBondContact O-N 3.4Å; M232-S236 PolarHBondContact O-N 2.88Å; M232-L353 HydrophobicContact CE-CD1 3.45Å; M232-L353 VanDerWaalsContact CE-CD1 3.45Å; M232-L353 HydrophobicContact CE-CG 4.45Å; M232-L353 HydrophobicContact SD-CD1 3.63Å; M232-F356 HydrophobicContact CG-CD1 4.36Å; M232-F356 HydrophobicContact CG-CE1 4.11Å; M232-F356 HydrophobicContact SD-CD1 3.62Å; M232-F356 HydrophobicContact SD-CE1 3.99Å; M232-L357 HydrophobicContact CE-CD1 3.95Å; M232-L357 HydrophobicContact CE-CD2 3.55Å; M232-L357 HydrophobicContact CE-CG 3.71Å; M232-L357 HydrophobicContact SD-CD2 4.06Å; M232-L357 HydrophobicContact SD-CG 4.12Å
233	A	81.5	Confident	79.8	Confident	4 Å²	4	36.6 Å²	36.6	3%	0.033	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-44.5	172.2	0	0	0	0	0	110.7	I224 T229 T230 F235 S236 L237 L450	I224-A233 HydrophobicContact CD1-CB 4.2Å; I224-A233 HydrophobicContact CG1-CB 4.3Å; I224-A233 HydrophobicContact CG2-CB 4.22Å; T229-A233 PolarHBondContact O-N 2.97Å; T230-A233 WeakPolarHBondContact O-CB 3.42Å; T230-A233 PolarHBondContact O-N 3.32Å; T230-A233 VanDerWaalsContact O-N 3.17Å; A233-F235 PolarHBondContact O-N 3.41Å; A233-S236 PolarHBondContact O-N 2.65Å; A233-L237 VanDerWaalsContact O-CB 3.29Å; A233-L237 WeakPolarHBondContact O-CB 3.5Å; A233-L237 PolarHBondContact O-N 3.49Å; A233-L450 HydrophobicContact CB-CD1 4.34Å
234	L	85.2	Confident	80	Confident	1 Å²	1	31 Å²	31	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-37.9	175.1	-88.1	76.5	0	0	0	113.1	T230 N231 L237 V238 I407 L450 Q453 L457	T230-L234 VanDerWaalsContact O-CD1 3.24Å; T230-L234 WeakPolarHBondContact O-CD1 3.47Å; T230-L234 PolarHBondContact O-N 3.45Å; N231-L234 PolarHBondContact O-N 2.73Å; L234-L237 WeakPolarHBondContact O-CB 3.38Å; L234-L237 PolarHBondContact O-N 2.92Å; L234-V238 WeakPolarHBondContact O-CG2 3.37Å; L234-V238 PolarHBondContact O-N 3.02Å; L234-V238 VanDerWaalsContact O-N 3.08Å; L234-I407 HydrophobicContact CB-CD1 4.02Å; L234-I407 HydrophobicContact CB-CG2 4.09Å; L234-I407 HydrophobicContact CD2-CG2 4.29Å; L234-L450 HydrophobicContact CD1-CD1 4.15Å; L234-Q453 HydrophobicContact CD1-CB 4.1Å; L234-Q453 HydrophobicContact CD2-CB 4.09Å; L234-L457 HydrophobicContact CD2-CB 4.39Å; L234-L457 HydrophobicContact CD2-CD2 4.1Å; L234-L457 HydrophobicContact CG-CD2 4.33Å
235	F	86.5	Confident	80.3	Confident	5 Å²	5	30.8 Å²	30.8	2%	0.022	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-48.8	172.8	-89.7	-62.8	0	0	0	112	N231 M232 A233 L237 V238 E239 A352 L353 F356 A403 F406 I407	N231-F235 VanDerWaalsContact O-CD2 3.27Å; N231-F235 WeakPolarHBondContact O-CD2 3.48Å; N231-F235 PolarHBondContact O-N 2.89Å; M232-F235 PolarHBondContact O-N 3.4Å; A233-F235 PolarHBondContact O-N 3.41Å; F235-L237 VanDerWaalsContact C-N 3.26Å; F235-L237 PolarHBondContact O-N 2.81Å; F235-V238 PolarHBondContact O-N 3.01Å; F235-E239 WeakPolarHBondContact O-CB 3.38Å; F235-E239 PolarHBondContact O-N 3.33Å; F235-A352 HydrophobicContact CE1-CB 3.88Å; F235-A352 HydrophobicContact CZ-CB 4.15Å; F235-L353 HydrophobicContact CB-CD1 3.8Å; F235-L353 HydrophobicContact CD2-CD1 4.07Å; F235-L353 HydrophobicContact CG-CD1 3.99Å; F235-F356 HydrophobicContact CE2-CB 4.26Å; F235-F356 HydrophobicContact CE2-CG 4.26Å; F235-A403 HydrophobicContact CE2-CB 3.91Å; F235-A403 HydrophobicContact CZ-CB 4.15Å; F235-F406 AromaticContact CE1-CD1 3.88Å; F235-F406 HydrophobicContact CE1-CD1 3.88Å; F235-F406 HydrophobicContact CE1-CE1 4.24Å; F235-F406 HydrophobicContact CZ-CD1 4.45Å; F235-I407 HydrophobicContact CD1-CD1 4.15Å; F235-I407 HydrophobicContact CD1-CG1 3.72Å; F235-I407 HydrophobicContact CD2-CD1 3.8Å; F235-I407 HydrophobicContact CD2-CG1 4.28Å; F235-I407 HydrophobicContact CE1-CD1 4.22Å; F235-I407 HydrophobicContact CE1-CG1 3.66Å; F235-I407 HydrophobicContact CE2-CD1 3.87Å; F235-I407 HydrophobicContact CE2-CG1 4.23Å; F235-I407 HydrophobicContact CG-CD1 3.93Å; F235-I407 HydrophobicContact CG-CG1 4.03Å; F235-I407 HydrophobicContact CZ-CD1 4.08Å; F235-I407 HydrophobicContact CZ-CG1 3.92Å
236	S	83.5	Confident	81.4	Confident	29 Å²	29	28.4 Å²	28.4	20%	0.203	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-32	179.6	-166.1	0	0	0	0	112	H222 M232 A233 E239 K240	H222-S236 WeakPolarHBondContact CE1-CB 3.48Å; H222-S236 PolarHBondContact CE1-OG 3.3Å; H222-S236 PolarHBondContact ND1-OG 3.46Å; M232-S236 PolarHBondContact O-N 2.88Å; A233-S236 PolarHBondContact O-N 2.65Å; S236-E239 PolarHBondContact O-N 3.19Å; S236-K240 WeakPolarHBondContact O-CB 3.48Å; S236-K240 WeakPolarHBondContact O-CG 3.43Å; S236-K240 PolarHBondContact O-N 2.92Å
237	L	85.5	Confident	82.5	Confident	6 Å²	6	33 Å²	33	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-48.7	172.3	-169.6	62.1	0	0	0	112	A233 L234 F235 K240 M241 L434 L436 I468	A233-L237 VanDerWaalsContact O-CB 3.29Å; A233-L237 WeakPolarHBondContact O-CB 3.5Å; A233-L237 PolarHBondContact O-N 3.49Å; L234-L237 WeakPolarHBondContact O-CB 3.38Å; L234-L237 PolarHBondContact O-N 2.92Å; F235-L237 VanDerWaalsContact C-N 3.26Å; F235-L237 PolarHBondContact O-N 2.81Å; L237-K240 PolarHBondContact O-N 3.15Å; L237-M241 VanDerWaalsContact O-CB 3.27Å; L237-M241 WeakPolarHBondContact O-CB 3.07Å; L237-M241 PolarHBondContact O-N 2.92Å; L237-L434 HydrophobicContact CD1-CB 3.84Å; L237-L434 HydrophobicContact CD1-CD1 3.84Å; L237-L434 HydrophobicContact CD1-CD2 4.33Å; L237-L434 HydrophobicContact CD1-CG 4.21Å; L237-L434 HydrophobicContact CD2-CD1 4.12Å; L237-L434 HydrophobicContact CG-CD1 3.95Å; L237-L436 HydrophobicContact CD1-CD2 3.73Å; L237-L436 HydrophobicContact CD1-CG 4.44Å; L237-L436 HydrophobicContact CD2-CD1 4.37Å; L237-I468 HydrophobicContact CD2-CD1 4.28Å
238	V	88.9	Confident	83.7	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.024	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-37.7	176.5	168.1	0	0	0	0	111.6	L234 F235 W242 I349 I407 E410 F411 L414	L234-V238 WeakPolarHBondContact O-CG2 3.37Å; L234-V238 PolarHBondContact O-N 3.02Å; L234-V238 VanDerWaalsContact O-N 3.08Å; F235-V238 PolarHBondContact O-N 3.01Å; V238-W242 PolarHBondContact O-N 3.18Å; V238-I349 HydrophobicContact CG1-CD1 4.16Å; V238-I407 HydrophobicContact CG2-CG2 4Å; V238-E410 HydrophobicContact CG1-CB 4.25Å; V238-F411 HydrophobicContact CG2-CB 4.26Å; V238-L414 HydrophobicContact CG1-CD1 3.93Å
239	E	88.1	Confident	84.5	Confident	26 Å²	26	30.2 Å²	30.2	12%	0.121	15%	0.145	C	C	.	.	H	α-helix	trans	-63.7	-48.8	174.2	177.2	170.1	-159.6	0	0	112.1	F235 S236 M241 W242 F243 I349 K350	F235-E239 WeakPolarHBondContact O-CB 3.38Å; F235-E239 PolarHBondContact O-N 3.33Å; S236-E239 PolarHBondContact O-N 3.19Å; E239-M241 PolarHBondContact O-N 3.1Å; E239-W242 WeakPolarHBondContact O-CA 3.33Å; E239-W242 WeakPolarHBondContact O-CB 3.4Å; E239-W242 PolarHBondContact O-N 2.93Å; E239-W242 VanDerWaalsContact O-N 3.12Å; E239-F243 HydrophobicContact CG-CD2 3.8Å; E239-F243 HydrophobicContact CG-CE2 3.55Å; E239-F243 VanDerWaalsContact O-CD2 3.29Å; E239-F243 WeakPolarHBondContact O-CD2 3.13Å; E239-F243 PolarHBondContact O-N 3.32Å; E239-F243 WeakPolarHBondContact OE1-CE2 3.13Å; E239-I349 HydrophobicContact CB-CG2 4.43Å; E239-K350 WeakPolarHBondContact OE1-CE 3.46Å; E239-K350 IonicContact OE1-NZ 2.67Å; E239-K350 PolarHBondContact OE1-NZ 2.88Å
240	K	86.4	Confident	84.7	Confident	47 Å²	47	28.9 Å²	28.9	20%	0.204	14%	0.142	C	C	.	.	H	α-helix	trans	-68.3	-33.6	178.1	-72.6	-169.7	162.3	-168.3	0	112.8	V220 Y221 H222 S236 L237 W242 F243 G244 E1117	V220-K240 HydrophobicContact CG1-CB 3.49Å; V220-K240 VanDerWaalsContact CG1-CB 3.49Å; V220-K240 HydrophobicContact CG1-CD 4.28Å; Y221-K240 PolarHBondContact O-NZ 3.04Å; H222-K240 HydrophobicContact CB-CD 4.28Å; S236-K240 WeakPolarHBondContact O-CB 3.48Å; S236-K240 WeakPolarHBondContact O-CG 3.43Å; S236-K240 PolarHBondContact O-N 2.92Å; L237-K240 PolarHBondContact O-N 3.15Å; K240-W242 VanDerWaalsContact C-N 3.31Å; K240-W242 PolarHBondContact O-N 3.08Å; K240-F243 PolarHBondContact O-N 3.38Å; K240-G244 PolarHBondContact O-N 2.95Å; K240-E1117 WeakPolarHBondContact CE-OE1 3.43Å; K240-E1117 IonicContact NZ-OE1 3.78Å; K240-E1117 PolarHBondContact NZ-OE1 3.34Å
241	M	88.8	Confident	84.9	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-59.5	-41.6	168.7	-173.3	-172.5	-176	0	0	111.2	L237 E239 G244 L245 F411 L414 F432 V466	L237-M241 VanDerWaalsContact O-CB 3.27Å; L237-M241 WeakPolarHBondContact O-CB 3.07Å; L237-M241 PolarHBondContact O-N 2.92Å; E239-M241 PolarHBondContact O-N 3.1Å; M241-G244 PolarHBondContact O-N 3.01Å; M241-L245 PolarHBondContact O-N 3.1Å; M241-L245 VanDerWaalsContact O-N 3.12Å; M241-F411 HydrophobicContact CE-CD2 4.37Å; M241-F411 HydrophobicContact CE-CE2 4.08Å; M241-F411 HydrophobicContact SD-CD2 3.8Å; M241-F411 HydrophobicContact SD-CE2 3.88Å; M241-L414 HydrophobicContact CB-CD1 4.27Å; M241-L414 HydrophobicContact CE-CB 3.92Å; M241-L414 HydrophobicContact CG-CD1 4.09Å; M241-L414 HydrophobicContact SD-CB 4.04Å; M241-L414 HydrophobicContact SD-CD1 3.78Å; M241-L414 HydrophobicContact SD-CG 4.48Å; M241-F432 HydrophobicContact CE-CD1 4.31Å; M241-F432 HydrophobicContact CE-CD2 3.51Å; M241-F432 HydrophobicContact CE-CE1 4.27Å; M241-F432 HydrophobicContact CE-CE2 3.46Å; M241-F432 VanDerWaalsContact CE-CE2 3.46Å; M241-F432 HydrophobicContact CE-CG 3.93Å; M241-F432 HydrophobicContact CE-CZ 3.84Å; M241-F432 HydrophobicContact CG-CD1 3.69Å; M241-F432 HydrophobicContact CG-CE1 3.51Å; M241-F432 HydrophobicContact CG-CE2 4.43Å; M241-F432 HydrophobicContact CG-CG 4.21Å; M241-F432 HydrophobicContact CG-CZ 3.9Å; M241-V466 HydrophobicContact CE-CG2 3.86Å
242	W	88.6	Confident	84.9	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.015	17%	0.172	C	C	.	.	H	α-helix	trans	-63.7	-46.6	174.3	-165.8	-70.3	0	0	0	112.1	V238 E239 K240 G244 L245 V246 I254 R258 P345 I346 I349 L414	V238-W242 PolarHBondContact O-N 3.18Å; E239-W242 WeakPolarHBondContact O-CA 3.33Å; E239-W242 WeakPolarHBondContact O-CB 3.4Å; E239-W242 PolarHBondContact O-N 2.93Å; E239-W242 VanDerWaalsContact O-N 3.12Å; K240-W242 VanDerWaalsContact C-N 3.31Å; K240-W242 PolarHBondContact O-N 3.08Å; W242-G244 PolarHBondContact O-N 3.2Å; W242-L245 PolarHBondContact O-N 3.28Å; W242-V246 VanDerWaalsContact CD1-CG2 3.48Å; W242-V246 VanDerWaalsContact NE1-CG2 3.29Å; W242-V246 WeakPolarHBondContact O-CG2 3.4Å; W242-V246 PolarHBondContact O-N 3.2Å; W242-I254 HydrophobicContact CH2-CG2 4.2Å; W242-I254 HydrophobicContact CZ2-CG2 3.41Å; W242-I254 VanDerWaalsContact CZ2-CG2 3.41Å; W242-R258 VanDerWaalsContact CZ3-NH1 3.32Å; W242-P345 HydrophobicContact CH2-CB 4.07Å; W242-P345 HydrophobicContact CZ2-CB 3.45Å; W242-P345 VanDerWaalsContact CZ2-CB 3.45Å; W242-P345 HydrophobicContact CZ2-CG 3.57Å; W242-I346 HydrophobicContact CG-CG1 4.05Å; W242-I349 HydrophobicContact CD2-CD1 4.4Å; W242-I349 HydrophobicContact CE3-CD1 3.92Å; W242-L414 HydrophobicContact CB-CD1 4.47Å; W242-L414 HydrophobicContact CB-CD2 4.35Å; W242-L414 HydrophobicContact CD2-CD2 3.99Å; W242-L414 HydrophobicContact CE3-CD1 4.03Å; W242-L414 HydrophobicContact CE3-CD2 3.44Å; W242-L414 VanDerWaalsContact CE3-CD2 3.44Å; W242-L414 HydrophobicContact CE3-CG 3.73Å; W242-L414 HydrophobicContact CG-CD2 4.45Å; W242-L414 HydrophobicContact CZ3-CD2 3.81Å; W242-L414 HydrophobicContact CZ3-CG 4Å
243	F	87.6	Confident	85	Confident	92 Å²	92	33.5 Å²	33.5	40%	0.404	16%	0.163	S	C	.	.	H	α-helix	trans	-60.6	-42.2	176.7	-80.2	-65.7	0	0	0	112.7	E239 K240 L245 V246 R247 I346	E239-F243 HydrophobicContact CG-CD2 3.8Å; E239-F243 HydrophobicContact CG-CE2 3.55Å; E239-F243 VanDerWaalsContact O-CD2 3.29Å; E239-F243 WeakPolarHBondContact O-CD2 3.13Å; E239-F243 PolarHBondContact O-N 3.32Å; E239-F243 WeakPolarHBondContact OE1-CE2 3.13Å; K240-F243 PolarHBondContact O-N 3.38Å; F243-L245 PolarHBondContact O-N 3.01Å; F243-V246 PolarHBondContact O-N 2.66Å; F243-R247 WeakPolarHBondContact O-CB 3.5Å; F243-R247 PolarHBondContact O-N 3.45Å; F243-I346 HydrophobicContact CD1-CD1 4.18Å; F243-I346 HydrophobicContact CE1-CD1 3.74Å; F243-I346 HydrophobicContact CZ-CD1 4.07Å
244	G	83.7	Confident	85.1	Confident	11 Å²	11	33.3 Å²	33.3	11%	0.113	16%	0.162	C	C	.	.	H	α-helix	trans	-57.7	-46.1	174.1	0	0	0	0	0	112.3	K240 M241 W242 R247 H248	K240-G244 PolarHBondContact O-N 2.95Å; M241-G244 PolarHBondContact O-N 3.01Å; W242-G244 PolarHBondContact O-N 3.2Å; G244-R247 PolarHBondContact O-N 2.99Å; G244-H248 PolarHBondContact O-CD2 3.37Å; G244-H248 VanDerWaalsContact O-CD2 3.31Å; G244-H248 PolarHBondContact O-N 3.24Å
245	L	86.2	Confident	85	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-41.6	178.2	-166.5	61.9	0	0	0	112.1	I218 M241 W242 F243 R247 H248 Y249 I254 L414 L417 F421 F432	I218-L245 HydrophobicContact CD1-CD1 4.49Å; M241-L245 PolarHBondContact O-N 3.1Å; M241-L245 VanDerWaalsContact O-N 3.12Å; W242-L245 PolarHBondContact O-N 3.28Å; F243-L245 PolarHBondContact O-N 3.01Å; L245-R247 VanDerWaalsContact C-N 3.33Å; L245-R247 PolarHBondContact O-N 3.41Å; L245-H248 PolarHBondContact O-N 3.03Å; L245-Y249 HydrophobicContact CD1-CD2 3.54Å; L245-Y249 HydrophobicContact CD1-CE2 3.49Å; L245-Y249 VanDerWaalsContact CD1-CE2 3.49Å; L245-Y249 HydrophobicContact CG-CD2 4.28Å; L245-Y249 PolarHBondContact O-N 3.4Å; L245-Y249 VanDerWaalsContact O-N 3.13Å; L245-I254 HydrophobicContact CB-CD1 4.49Å; L245-I254 HydrophobicContact CG-CD1 4.08Å; L245-I254 WeakPolarHBondContact O-CD1 3.24Å; L245-L414 HydrophobicContact CD2-CD2 3.65Å; L245-L417 HydrophobicContact CD2-CB 4.3Å; L245-L417 HydrophobicContact CD2-CD2 3.85Å; L245-L417 HydrophobicContact CD2-CG 4.47Å; L245-F421 HydrophobicContact CD1-CD2 4.48Å; L245-F432 HydrophobicContact CB-CE1 4.44Å; L245-F432 HydrophobicContact CB-CZ 4.17Å; L245-F432 HydrophobicContact CD1-CZ 4.02Å; L245-F432 HydrophobicContact CD2-CZ 4.48Å; L245-F432 HydrophobicContact CG-CZ 4.46Å
246	V	85.9	Confident	84.7	Confident	25 Å²	25	36 Å²	36	15%	0.152	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-37.6	174.1	170.5	0	0	0	0	112.3	W242 F243 G250 Q251 I254	W242-V246 VanDerWaalsContact CD1-CG2 3.48Å; W242-V246 VanDerWaalsContact NE1-CG2 3.29Å; W242-V246 WeakPolarHBondContact O-CG2 3.4Å; W242-V246 PolarHBondContact O-N 3.2Å; F243-V246 PolarHBondContact O-N 2.66Å; V246-G250 WeakPolarHBondContact O-CA 3.44Å; V246-G250 PolarHBondContact O-N 2.97Å; V246-Q251 HydrophobicContact CG1-CB 4.12Å; V246-Q251 HydrophobicContact CG1-CG 4.45Å; V246-I254 VanDerWaalsContact CA-CD1 3.49Å; V246-I254 HydrophobicContact CB-CD1 4.21Å; V246-I254 HydrophobicContact CG2-CD1 3.68Å
247	R	83.2	Confident	84.6	Confident	181 Å²	181	36 Å²	36	68%	0.683	17%	0.169	S	C	*	.	H	α-helix	trans	-67.9	-31.9	177.5	-175	172	176.1	163.5	-4.1	113	F243 G244 L245	F243-R247 WeakPolarHBondContact O-CB 3.5Å; F243-R247 PolarHBondContact O-N 3.45Å; G244-R247 PolarHBondContact O-N 2.99Å; L245-R247 VanDerWaalsContact C-N 3.33Å; L245-R247 PolarHBondContact O-N 3.41Å
248	H	78.6	Confident	84	Confident	68 Å²	68	39.9 Å²	39.9	32%	0.315	18%	0.184	S	C	.	.	H	α-helix	trans	-88.2	-36.9	-177.7	-82	-73.5	0	0	0	115.3	I218 G244 L245	I218-H248 HydrophobicContact CD1-CB 4.45Å; G244-H248 PolarHBondContact O-CD2 3.37Å; G244-H248 VanDerWaalsContact O-CD2 3.31Å; G244-H248 PolarHBondContact O-N 3.24Å; L245-H248 PolarHBondContact O-N 3.03Å
249	Y	82.7	Confident	82.9	Confident	16 Å²	16	41.5 Å²	41.5	6%	0.063	20%	0.197	C	C	.	.	H	α-helix	trans	-106.4	-12.1	179.3	-62.2	-73.6	0	0	0	114	L196 L245 L253 F421 D422 T430	L196-Y249 HydrophobicContact CD2-CD1 3.57Å; L196-Y249 HydrophobicContact CD2-CE1 4Å; L245-Y249 HydrophobicContact CD1-CD2 3.54Å; L245-Y249 HydrophobicContact CD1-CE2 3.49Å; L245-Y249 VanDerWaalsContact CD1-CE2 3.49Å; L245-Y249 HydrophobicContact CG-CD2 4.28Å; L245-Y249 PolarHBondContact O-N 3.4Å; L245-Y249 VanDerWaalsContact O-N 3.13Å; Y249-L253 WeakPolarHBondContact O-CD1 3.39Å; Y249-F421 HydrophobicContact CD1-CB 4.33Å; Y249-F421 HydrophobicContact CD1-CD1 4.29Å; Y249-F421 HydrophobicContact CD1-CG 4.21Å; Y249-F421 HydrophobicContact CD2-CB 4.46Å; Y249-F421 AromaticContact CD2-CD2 3.73Å; Y249-F421 HydrophobicContact CD2-CD2 3.73Å; Y249-F421 HydrophobicContact CD2-CE2 4.06Å; Y249-F421 HydrophobicContact CD2-CG 4.09Å; Y249-F421 HydrophobicContact CE1-CB 3.73Å; Y249-F421 HydrophobicContact CE1-CD1 4.5Å; Y249-F421 HydrophobicContact CE1-CG 4.11Å; Y249-F421 HydrophobicContact CE2-CB 3.88Å; Y249-F421 AromaticContact CE2-CD2 3.76Å; Y249-F421 HydrophobicContact CE2-CD2 3.76Å; Y249-F421 AromaticContact CE2-CG 3.98Å; Y249-F421 HydrophobicContact CE2-CG 3.98Å; Y249-F421 HydrophobicContact CG-CD1 4.38Å; Y249-F421 HydrophobicContact CG-CD2 4.17Å; Y249-F421 HydrophobicContact CG-CE2 4.37Å; Y249-F421 HydrophobicContact CG-CG 4.18Å; Y249-F421 VanDerWaalsContact CZ-CB 3.46Å; Y249-F421 AromaticContact CZ-CG 3.97Å; Y249-D422 PolarHBondContact OH-OD1 3.21Å; Y249-T430 HydrophobicContact CE2-CG2 4.46Å; Y249-T430 WeakPolarHBondContact OH-CG2 3.25Å
250	G	82.8	Confident	81.8	Confident	25 Å²	25	42 Å²	42	26%	0.258	21%	0.209	S	C	.	.			trans	80.4	147.1	-175.3	0	0	0	0	0	113	V246 I252 L253	V246-G250 WeakPolarHBondContact O-CA 3.44Å; V246-G250 PolarHBondContact O-N 2.97Å; G250-I252 VanDerWaalsContact C-N 3.27Å; G250-I252 PolarHBondContact O-N 3.36Å; G250-L253 PolarHBondContact O-N 3.04Å
251	Q	82.9	Confident	80.4	Confident	79 Å²	79	45.6 Å²	45.6	37%	0.369	23%	0.225	S	C	.	.	H	α-helix	trans	-59.4	-34.7	-172.8	-161	179.9	34.2	0	0	113.4	V246 R255 N344	V246-Q251 HydrophobicContact CG1-CB 4.12Å; V246-Q251 HydrophobicContact CG1-CG 4.45Å; Q251-R255 VanDerWaalsContact CD-NH2 3.33Å; Q251-R255 VanDerWaalsContact NE2-NH2 3.12Å; Q251-R255 WeakPolarHBondContact O-CB 3.38Å; Q251-R255 WeakPolarHBondContact O-CG 3.23Å; Q251-R255 PolarHBondContact O-N 3.38Å; Q251-N344 PolarHBondContact NE2-OD1 2.83Å
252	I	84.2	Confident	78.8	Confident	78 Å²	78	51.5 Å²	51.5	40%	0.4	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-47.9	-177.7	-65.4	167.9	0	0	0	111.9	W193 F197 G250 I254 R255 L256 L341	W193-I252 HydrophobicContact CH2-CD1 4.45Å; W193-I252 HydrophobicContact CZ2-CB 4.13Å; W193-I252 HydrophobicContact CZ2-CD1 4.05Å; W193-I252 HydrophobicContact CZ2-CG2 4.05Å; F197-I252 HydrophobicContact CE2-CG2 4.45Å; G250-I252 VanDerWaalsContact C-N 3.27Å; G250-I252 PolarHBondContact O-N 3.36Å; I252-I254 VanDerWaalsContact C-N 3.32Å; I252-I254 PolarHBondContact O-N 2.97Å; I252-R255 PolarHBondContact O-N 3.42Å; I252-L256 VanDerWaalsContact O-CB 3.3Å; I252-L256 WeakPolarHBondContact O-CB 3.32Å; I252-L256 PolarHBondContact O-N 3.01Å; I252-L341 HydrophobicContact CG2-CD2 4.02Å
253	L	83.9	Confident	77.1	Confident	1 Å²	1	54 Å²	54	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-68.4	-34.1	-176.6	-66	-178.3	0	0	0	112.1	W193 L196 F197 I200 Y249 G250 Q257 F421	W193-L253 HydrophobicContact CG-CD1 4.25Å; L196-L253 HydrophobicContact CB-CD1 4.08Å; L196-L253 HydrophobicContact CD2-CD1 3.71Å; L196-L253 HydrophobicContact CG-CD1 3.84Å; F197-L253 HydrophobicContact CB-CD2 3.77Å; F197-L253 HydrophobicContact CD2-CD2 3.76Å; F197-L253 HydrophobicContact CG-CD2 4.26Å; I200-L253 HydrophobicContact CD1-CB 4.33Å; I200-L253 HydrophobicContact CD1-CD2 4.21Å; Y249-L253 WeakPolarHBondContact O-CD1 3.39Å; G250-L253 PolarHBondContact O-N 3.04Å; L253-Q257 VanDerWaalsContact O-CB 3.31Å; L253-Q257 WeakPolarHBondContact O-CB 3.22Å; L253-Q257 PolarHBondContact O-N 3.47Å; L253-F421 HydrophobicContact CB-CE1 4.13Å; L253-F421 HydrophobicContact CB-CZ 4.47Å
254	I	83.5	Confident	75.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-70	-44.7	175.8	-73.1	162.9	0	0	0	111.6	W242 L245 V246 I252 L256 Q257 R258 P345 L417 F421	W242-I254 HydrophobicContact CH2-CG2 4.2Å; W242-I254 HydrophobicContact CZ2-CG2 3.41Å; W242-I254 VanDerWaalsContact CZ2-CG2 3.41Å; L245-I254 HydrophobicContact CB-CD1 4.49Å; L245-I254 HydrophobicContact CG-CD1 4.08Å; L245-I254 WeakPolarHBondContact O-CD1 3.24Å; V246-I254 VanDerWaalsContact CA-CD1 3.49Å; V246-I254 HydrophobicContact CB-CD1 4.21Å; V246-I254 HydrophobicContact CG2-CD1 3.68Å; I252-I254 VanDerWaalsContact C-N 3.32Å; I252-I254 PolarHBondContact O-N 2.97Å; I254-L256 VanDerWaalsContact C-N 3.33Å; I254-L256 PolarHBondContact O-N 3.26Å; I254-Q257 PolarHBondContact O-N 2.62Å; I254-R258 WeakPolarHBondContact O-CB 3.34Å; I254-R258 PolarHBondContact O-N 3.16Å; I254-P345 HydrophobicContact CG2-CG 4.19Å; I254-L417 HydrophobicContact CG1-CD2 4.18Å; I254-L417 HydrophobicContact CG2-CD2 3.99Å; I254-F421 HydrophobicContact CB-CZ 4.46Å; I254-F421 HydrophobicContact CG1-CE2 3.72Å; I254-F421 HydrophobicContact CG1-CZ 3.6Å
255	R	84.2	Confident	74.3	Confident	50 Å²	50	56.7 Å²	56.7	19%	0.189	31%	0.307	C	S	.	.	H	α-helix	trans	-58.2	-45.2	172.6	-80.8	-167	-164.5	177.2	5.3	111.8	Q251 I252 A259 G340 L341 N344 P345	Q251-R255 VanDerWaalsContact CD-NH2 3.33Å; Q251-R255 VanDerWaalsContact NE2-NH2 3.12Å; Q251-R255 WeakPolarHBondContact O-CB 3.38Å; Q251-R255 WeakPolarHBondContact O-CG 3.23Å; Q251-R255 PolarHBondContact O-N 3.38Å; I252-R255 PolarHBondContact O-N 3.42Å; R255-A259 PolarHBondContact O-N 3.49Å; R255-G340 WeakPolarHBondContact CB-O 3.33Å; R255-L341 WeakPolarHBondContact CD-O 3.42Å; R255-L341 PolarHBondContact NH1-O 3.28Å; R255-N344 VanDerWaalsContact NH2-CG 3.31Å; R255-N344 PolarHBondContact NH2-OD1 2.93Å; R255-P345 HydrophobicContact CG-CG 4.18Å
256	L	79.5	Confident	72.9	Confident	12 Å²	12	59.7 Å²	59.7	6%	0.063	33%	0.326	C	S	.	.	H	α-helix	trans	-63.6	-48.3	178.3	-173.8	68.7	0	0	0	112.4	F197 I200 I252 I254 A259 I337	F197-L256 HydrophobicContact CD2-CD2 3.98Å; F197-L256 HydrophobicContact CE2-CD2 3.88Å; I200-L256 HydrophobicContact CB-CD2 4.12Å; I200-L256 HydrophobicContact CG2-CB 4.44Å; I200-L256 HydrophobicContact CG2-CD2 3.59Å; I200-L256 HydrophobicContact CG2-CG 3.75Å; I252-L256 VanDerWaalsContact O-CB 3.3Å; I252-L256 WeakPolarHBondContact O-CB 3.32Å; I252-L256 PolarHBondContact O-N 3.01Å; I254-L256 VanDerWaalsContact C-N 3.33Å; I254-L256 PolarHBondContact O-N 3.26Å; L256-A259 PolarHBondContact O-N 2.91Å; L256-I337 HydrophobicContact CD1-CB 4.3Å; L256-I337 HydrophobicContact CD1-CG1 3.9Å; L256-I337 HydrophobicContact CD1-CG2 3.93Å
257	Q	81.9	Confident	71.8	Confident	29 Å²	29	65.4 Å²	65.4	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-67.5	-37	-179.2	177.6	64.4	-7.3	0	0	112.3	I200 L253 I254 A259 G260 L417 T420 F421	I200-Q257 HydrophobicContact CG2-CB 4.41Å; L253-Q257 VanDerWaalsContact O-CB 3.31Å; L253-Q257 WeakPolarHBondContact O-CB 3.22Å; L253-Q257 PolarHBondContact O-N 3.47Å; I254-Q257 PolarHBondContact O-N 2.62Å; Q257-A259 PolarHBondContact O-N 2.95Å; Q257-G260 PolarHBondContact O-N 3.38Å; Q257-L417 HydrophobicContact CB-CD1 4.23Å; Q257-L417 HydrophobicContact CG-CD1 3.51Å; Q257-L417 HydrophobicContact CG-CG 4.47Å; Q257-T420 PolarHBondContact NE2-OG1 3.15Å; Q257-F421 HydrophobicContact CB-CE1 4.37Å; Q257-F421 HydrophobicContact CB-CZ 4.25Å
258	R	73.3	Confident	71	Confident	89 Å²	89	59.3 Å²	59.3	34%	0.336	34%	0.337	S	S	.	.	H	α-helix	trans	-65.3	-17.9	176.6	-166	172.6	-176.3	147.7	9.8	113.1	W242 I254 P345 E410	W242-R258 VanDerWaalsContact CZ3-NH1 3.32Å; I254-R258 WeakPolarHBondContact O-CB 3.34Å; I254-R258 PolarHBondContact O-N 3.16Å; R258-P345 PolarHBondContact NH1-O 2.98Å; R258-E410 IonicContact CZ-OE2 3.82Å; R258-E410 IonicContact NH1-OE2 2.69Å; R258-E410 PolarHBondContact NH1-OE2 3.17Å; R258-E410 VanDerWaalsContact NH1-OE2 3.16Å; R258-E410 IonicContact NH2-OE1 2.62Å; R258-E410 PolarHBondContact NH2-OE1 3.26Å; R258-E410 VanDerWaalsContact NH2-OE1 3.12Å; R258-E410 IonicContact NH2-OE2 2.73Å; R258-E410 PolarHBondContact NH2-OE2 3.4Å
259	A	64.8	Low	70.8	Confident	37 Å²	37	63.7 Å²	63.7	31%	0.306	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-5.4	172.7	0	0	0	0	0	114.3	R255 L256 Q257	R255-A259 PolarHBondContact O-N 3.49Å; L256-A259 PolarHBondContact O-N 2.91Å; Q257-A259 PolarHBondContact O-N 2.95Å
260	G	64.5	Low	70.6	Confident	36 Å²	36	68.1 Å²	68.1	37%	0.371	37%	0.372	S	S	.	.	S	Bend	trans	-75.8	134.9	173.6	0	0	0	0	0	112.1	Q257	Q257-G260 PolarHBondContact O-N 3.38Å
261	K	57.1	Low	70.5	Confident	124 Å²	124	69.1 Å²	69.1	54%	0.539	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-65.6	145.6	161.8	-71.4	-166.5	178.7	-171.7	0	109.1
262	P	55.8	Low	70.3	Confident	124 Å²	124	72.8 Å²	72.8	81%	0.805	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-57.8	155.2	172	25	-34	0	0	0	111.6	G264	P262-G264 PolarHBondContact O-N 3.15Å
263	S	53.9	Low	70	Confident	57 Å²	57	70 Å²	70	40%	0.399	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-66.1	120.7	-168.7	56.4	0	0	0	0	113.5
264	G	54.3	Low	69.4	Low	42 Å²	42	75 Å²	75	43%	0.433	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-83.9	131.2	169.7	0	0	0	0	0	112.3	P262	P262-G264 PolarHBondContact O-N 3.15Å
265	N	56.9	Low	69.1	Low	118 Å²	118	80.2 Å²	80.2	63%	0.631	44%	0.436	S	S	*	.			trans	60.6	136.4	174.8	-129.9	-1.9	0	0	0	116.8	N267 I268	N265-N267 VanDerWaalsContact C-N 3.34Å; N265-N267 PolarHBondContact O-N 2.74Å; N265-I268 HydrophobicContact CB-CD1 4.33Å
266	P	57.4	Low	68.9	Low	62 Å²	62	82.2 Å²	82.2	40%	0.403	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.3	-171.4	-13.3	24	0	0	0	114.7	I268	P266-I268 PolarHBondContact O-N 3.29Å
267	N	62.3	Low	69	Low	145 Å²	145	83.1 Å²	83.1	78%	0.775	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-2	-160.1	-60.9	-15.2	0	0	0	113.7	N265	N265-N267 VanDerWaalsContact C-N 3.34Å; N265-N267 PolarHBondContact O-N 2.74Å
268	I	67.7	Low	69	Low	54 Å²	54	82.4 Å²	82.4	28%	0.277	46%	0.455	S	S	.	.			trans	-103.9	106.4	-170.5	-57.8	179.6	0	0	0	109.9	Y204 N265 P266 Y270	Y204-I268 HydrophobicContact CD2-CG2 4.15Å; Y204-I268 VanDerWaalsContact CD2-O 3.25Å; Y204-I268 WeakPolarHBondContact CD2-O 3.44Å; Y204-I268 HydrophobicContact CE2-CG2 3.94Å; N265-I268 HydrophobicContact CB-CD1 4.33Å; P266-I268 PolarHBondContact O-N 3.29Å; I268-Y270 WeakPolarHBondContact CG2-O 3.4Å
269	K	73.4	Confident	69.5	Low	159 Å²	159	81.5 Å²	81.5	69%	0.691	45%	0.454	S	S	*	.			trans	-74.7	-27.8	178.4	-67.1	-178.5	179.8	176.1	0	114	C203 Y204	C203-K269 WeakPolarHBondContact CA-O 3.34Å; Y204-K269 PolarHBondContact N-O 3.41Å
270	Y	79.4	Confident	70.6	Confident	109 Å²	109	83.2 Å²	83.2	43%	0.427	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-123.1	137.9	-171.5	-56.7	-69.9	0	0	0	112.4	F202 I268 F279	F202-Y270 CarbonylContact O-C 3.6Å; F202-Y270 WeakPolarHBondContact O-CA 3.35Å; I268-Y270 WeakPolarHBondContact CG2-O 3.4Å; Y270-F279 HydrophobicContact CD1-CD1 4.33Å; Y270-F279 HydrophobicContact CD1-CE1 4.07Å; Y270-F279 HydrophobicContact CD2-CE1 4.4Å; Y270-F279 HydrophobicContact CE1-CE1 4.34Å; Y270-F279 HydrophobicContact CG-CE1 4.1Å
271	K	80.2	Confident	71.6	Confident	47 Å²	47	82.2 Å²	82.2	20%	0.204	44%	0.444	C	S	.	.			trans	-61.9	137.7	171.3	-70.6	168.3	175.4	175.6	0	109.6	I200 C201 F202 C203 Y204 A278	I200-K271 PolarHBondContact O-NZ 3.44Å; C201-K271 WeakPolarHBondContact O-CD 3.49Å; F202-K271 PolarHBondContact O-N 3.29Å; C203-K271 WeakPolarHBondContact O-CE 3.34Å; Y204-K271 HydrophobicContact CD1-CG 4.38Å; Y204-K271 HydrophobicContact CD2-CG 4.17Å; Y204-K271 HydrophobicContact CE1-CG 3.96Å; Y204-K271 HydrophobicContact CE2-CB 4.3Å; Y204-K271 HydrophobicContact CE2-CG 3.73Å; Y204-K271 HydrophobicContact CG-CG 4.49Å; K271-A278 WeakPolarHBondContact O-CB 3.49Å; K271-A278 PolarHBondContact O-N 2.87Å
272	R	78.9	Confident	72.9	Confident	155 Å²	155	79 Å²	79	59%	0.585	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	151.7	-178.1	-63.2	-174.6	-176.1	-161.5	9.4	112.3	C275 L276	R272-C275 WeakPolarHBondContact CD-O 3.23Å; R272-L276 CarbonylContact C-O 3.42Å; R272-L276 WeakPolarHBondContact CA-O 3.42Å; R272-L276 WeakPolarHBondContact CB-O 3.36Å
273	V	76.9	Confident	74.4	Confident	21 Å²	21	77.7 Å²	77.7	13%	0.127	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	121.3	170.3	171.8	0	0	0	0	106.1	C275 L276 A278 V281 G329	V273-C275 PolarHBondContact O-N 3.23Å; V273-L276 PolarHBondContact N-O 3Å; V273-L276 PolarHBondContact O-N 3.39Å; V273-A278 HydrophobicContact CG2-CB 4.07Å; V273-V281 HydrophobicContact CB-CG2 4.39Å; V273-G329 VanDerWaalsContact CG1-O 3.23Å; V273-G329 WeakPolarHBondContact CG1-O 3.37Å
274	C	71.7	Confident	76	Confident	105 Å²	105	76.7 Å²	76.7	71%	0.709	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.7	66.9	-174.2	-63.8	0	0	0	0	112.9	L276	C274-L276 PolarHBondContact O-N 3.31Å
275	C	76.6	Confident	77.7	Confident	110 Å²	110	76.6 Å²	76.6	74%	0.743	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-26.7	-177.1	-61.1	0	0	0	0	117.3	R272 V273	R272-C275 WeakPolarHBondContact CD-O 3.23Å; V273-C275 PolarHBondContact O-N 3.23Å
276	L	80.5	Confident	79.2	Confident	92 Å²	92	76.1 Å²	76.1	48%	0.482	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	149.6	-179.5	-70.8	170.2	0	0	0	112.8	R272 V273 C274 A278 V281	R272-L276 CarbonylContact C-O 3.42Å; R272-L276 WeakPolarHBondContact CA-O 3.42Å; R272-L276 WeakPolarHBondContact CB-O 3.36Å; V273-L276 PolarHBondContact N-O 3Å; V273-L276 PolarHBondContact O-N 3.39Å; C274-L276 PolarHBondContact O-N 3.31Å; L276-A278 PolarHBondContact O-N 3.23Å; L276-V281 HydrophobicContact CB-CG2 3.91Å; L276-V281 HydrophobicContact CD1-CG2 4.39Å
277	P	82.6	Confident	80.8	Confident	31 Å²	31	77.5 Å²	77.5	20%	0.201	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	132	166.8	-21.5	32.3	0	0	0	111.6	F279 I280 V281	P277-F279 HydrophobicContact CB-CD1 3.76Å; P277-F279 HydrophobicContact CB-CE1 3.48Å; P277-F279 VanDerWaalsContact CB-CE1 3.48Å; P277-F279 HydrophobicContact CB-CZ 4.21Å; P277-F279 HydrophobicContact CG-CE1 4.32Å; P277-F279 PolarHBondContact O-N 2.92Å; P277-F279 VanDerWaalsContact O-N 3.1Å; P277-I280 HydrophobicContact CB-CD1 4.33Å; P277-I280 HydrophobicContact CB-CG1 4.27Å; P277-I280 HydrophobicContact CG-CD1 4.03Å; P277-I280 WeakPolarHBondContact O-CB 3.37Å; P277-I280 PolarHBondContact O-N 2.83Å; P277-V281 PolarHBondContact O-N 3.33Å
278	A	81.1	Confident	82.2	Confident	14 Å²	14	70.7 Å²	70.7	12%	0.116	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-30	-171.6	0	0	0	0	0	113.8	F202 K271 V273 L276 I280 V281 M282	F202-A278 HydrophobicContact CD1-CB 4.16Å; K271-A278 WeakPolarHBondContact O-CB 3.49Å; K271-A278 PolarHBondContact O-N 2.87Å; V273-A278 HydrophobicContact CG2-CB 4.07Å; L276-A278 PolarHBondContact O-N 3.23Å; A278-I280 VanDerWaalsContact C-N 3.32Å; A278-I280 PolarHBondContact O-N 3.17Å; A278-V281 PolarHBondContact O-N 3.01Å; A278-M282 WeakPolarHBondContact O-CG 3.38Å; A278-M282 PolarHBondContact O-N 3.45Å; A278-M282 VanDerWaalsContact O-N 3.07Å
279	F	84.2	Confident	83.3	Confident	70 Å²	70	70.8 Å²	70.8	31%	0.307	35%	0.354	S	S	.	.	H	α-helix	trans	-67	-31.2	175.9	73.7	-94.7	0	0	0	112.7	F202 Y270 P277 I283	F202-F279 HydrophobicContact CB-CB 4.35Å; F202-F279 HydrophobicContact CD1-CB 3.78Å; F202-F279 HydrophobicContact CD2-CB 4.39Å; F202-F279 HydrophobicContact CE1-CB 4.15Å; F202-F279 HydrophobicContact CG-CB 3.92Å; Y270-F279 HydrophobicContact CD1-CD1 4.33Å; Y270-F279 HydrophobicContact CD1-CE1 4.07Å; Y270-F279 HydrophobicContact CD2-CE1 4.4Å; Y270-F279 HydrophobicContact CE1-CE1 4.34Å; Y270-F279 HydrophobicContact CG-CE1 4.1Å; P277-F279 HydrophobicContact CB-CD1 3.76Å; P277-F279 HydrophobicContact CB-CE1 3.48Å; P277-F279 VanDerWaalsContact CB-CE1 3.48Å; P277-F279 HydrophobicContact CB-CZ 4.21Å; P277-F279 HydrophobicContact CG-CE1 4.32Å; P277-F279 PolarHBondContact O-N 2.92Å; P277-F279 VanDerWaalsContact O-N 3.1Å; F279-I283 HydrophobicContact CD2-CD1 4.15Å; F279-I283 WeakPolarHBondContact O-CD1 3.3Å; F279-I283 VanDerWaalsContact O-CG1 3.26Å; F279-I283 WeakPolarHBondContact O-CG1 3.42Å; F279-I283 PolarHBondContact O-N 2.88Å
280	I	86.4	Confident	84.1	Confident	73 Å²	73	66.1 Å²	66.1	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-70.7	-42.7	176.7	-59	-175	0	0	0	109.8	P277 A278 M282 I283 A284	P277-I280 HydrophobicContact CB-CD1 4.33Å; P277-I280 HydrophobicContact CB-CG1 4.27Å; P277-I280 HydrophobicContact CG-CD1 4.03Å; P277-I280 WeakPolarHBondContact O-CB 3.37Å; P277-I280 PolarHBondContact O-N 2.83Å; A278-I280 VanDerWaalsContact C-N 3.32Å; A278-I280 PolarHBondContact O-N 3.17Å; I280-M282 VanDerWaalsContact C-N 3.32Å; I280-M282 PolarHBondContact O-N 2.96Å; I280-I283 PolarHBondContact O-N 2.69Å; I280-A284 WeakPolarHBondContact O-CB 3.49Å; I280-A284 PolarHBondContact O-N 2.95Å
281	V	85.9	Confident	84.6	Confident	15 Å²	15	63.5 Å²	63.5	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-42.3	175.6	-176.9	0	0	0	0	111	V273 L276 P277 A278 A284 F285	V273-V281 HydrophobicContact CB-CG2 4.39Å; L276-V281 HydrophobicContact CB-CG2 3.91Å; L276-V281 HydrophobicContact CD1-CG2 4.39Å; P277-V281 PolarHBondContact O-N 3.33Å; A278-V281 PolarHBondContact O-N 3.01Å; V281-A284 PolarHBondContact O-N 3.45Å; V281-F285 WeakPolarHBondContact O-CB 3.26Å; V281-F285 PolarHBondContact O-N 3.18Å
282	M	84.8	Confident	84.9	Confident	57 Å²	57	61.5 Å²	61.5	28%	0.281	32%	0.321	S	S	.	.	H	α-helix	trans	-64.6	-41.1	174.7	-68.5	-56.1	-57.6	0	0	112.9	F202 A278 I280 F285 W286	F202-M282 HydrophobicContact CE1-CG 3.92Å; F202-M282 HydrophobicContact CZ-CG 4.22Å; A278-M282 WeakPolarHBondContact O-CG 3.38Å; A278-M282 PolarHBondContact O-N 3.45Å; A278-M282 VanDerWaalsContact O-N 3.07Å; I280-M282 VanDerWaalsContact C-N 3.32Å; I280-M282 PolarHBondContact O-N 2.96Å; M282-F285 PolarHBondContact O-N 3.37Å; M282-W286 PolarHBondContact O-N 2.87Å; M282-W286 VanDerWaalsContact O-N 3.09Å
283	I	86.8	Confident	85.3	Confident	95 Å²	95	55.4 Å²	55.4	49%	0.487	30%	0.301	S	S	.	.	H	α-helix	trans	-66	-43.6	177.1	-70.6	165.3	0	0	0	110.8	F279 I280 F285 W286 I287	F279-I283 HydrophobicContact CD2-CD1 4.15Å; F279-I283 WeakPolarHBondContact O-CD1 3.3Å; F279-I283 VanDerWaalsContact O-CG1 3.26Å; F279-I283 WeakPolarHBondContact O-CG1 3.42Å; F279-I283 PolarHBondContact O-N 2.88Å; I280-I283 PolarHBondContact O-N 2.69Å; I283-F285 PolarHBondContact O-N 3.31Å; I283-W286 PolarHBondContact O-N 3.08Å; I283-I287 HydrophobicContact CG2-CD1 3.74Å; I283-I287 HydrophobicContact CG2-CG1 4.44Å; I283-I287 WeakPolarHBondContact O-CG1 3.32Å; I283-I287 PolarHBondContact O-N 2.86Å
284	A	88.3	Confident	85.7	Confident	36 Å²	36	56.5 Å²	56.5	30%	0.298	31%	0.31	S	S	.	.	H	α-helix	trans	-61.1	-42.9	176.6	0	0	0	0	0	111.9	I280 V281 I287 A288	I280-A284 WeakPolarHBondContact O-CB 3.49Å; I280-A284 PolarHBondContact O-N 2.95Å; V281-A284 PolarHBondContact O-N 3.45Å; A284-I287 PolarHBondContact O-N 3.36Å; A284-A288 VanDerWaalsContact O-CB 3.28Å; A284-A288 WeakPolarHBondContact O-CB 3.14Å; A284-A288 PolarHBondContact O-N 2.98Å
285	F	90.4	Very high	86.4	Confident	40 Å²	40	52 Å²	52	18%	0.175	28%	0.278	C	S	.	.	H	α-helix	trans	-56.8	-50	172.9	176	-94.3	0	0	0	112.1	V281 M282 I283 I287 A288 F289 M323 F327	V281-F285 WeakPolarHBondContact O-CB 3.26Å; V281-F285 PolarHBondContact O-N 3.18Å; M282-F285 PolarHBondContact O-N 3.37Å; I283-F285 PolarHBondContact O-N 3.31Å; F285-I287 PolarHBondContact O-N 3.25Å; F285-A288 PolarHBondContact O-N 3.27Å; F285-F289 VanDerWaalsContact O-CB 3.27Å; F285-F289 WeakPolarHBondContact O-CB 3.35Å; F285-F289 PolarHBondContact O-N 2.97Å; F285-M323 HydrophobicContact CD2-CG 3.83Å; F285-M323 HydrophobicContact CE2-CG 3.52Å; F285-M323 HydrophobicContact CZ-CG 4.35Å; F285-F327 HydrophobicContact CD2-CB 4.44Å; F285-F327 HydrophobicContact CE2-CB 4.04Å; F285-F327 HydrophobicContact CE2-CD2 4.36Å
286	W	88.3	Confident	86.7	Confident	109 Å²	109	50.4 Å²	50.4	41%	0.413	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-41.5	179.8	-82.6	109.7	0	0	0	112.7	M282 I283 F289 L290	M282-W286 PolarHBondContact O-N 2.87Å; M282-W286 VanDerWaalsContact O-N 3.09Å; I283-W286 PolarHBondContact O-N 3.08Å; W286-F289 HydrophobicContact CE3-CD1 4.26Å; W286-F289 HydrophobicContact CZ3-CD1 4.28Å; W286-F289 HydrophobicContact CZ3-CE1 4.44Å; W286-F289 PolarHBondContact O-N 3.41Å; W286-L290 WeakPolarHBondContact O-CB 3.47Å; W286-L290 VanDerWaalsContact O-CG 3.23Å; W286-L290 WeakPolarHBondContact O-CG 3.4Å; W286-L290 PolarHBondContact O-N 2.88Å
287	I	90.8	Very high	86.9	Confident	91 Å²	91	51.6 Å²	51.6	47%	0.467	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-46.7	176.8	-67.6	169.1	0	0	0	110.7	I283 A284 F285 F289 L290 I291	I283-I287 HydrophobicContact CG2-CD1 3.74Å; I283-I287 HydrophobicContact CG2-CG1 4.44Å; I283-I287 WeakPolarHBondContact O-CG1 3.32Å; I283-I287 PolarHBondContact O-N 2.86Å; A284-I287 PolarHBondContact O-N 3.36Å; F285-I287 PolarHBondContact O-N 3.25Å; I287-F289 PolarHBondContact O-N 3.37Å; I287-L290 PolarHBondContact O-N 3.17Å; I287-I291 HydrophobicContact CG2-CD1 3.79Å; I287-I291 WeakPolarHBondContact O-CG1 3.22Å; I287-I291 PolarHBondContact O-N 3.07Å
288	A	91.8	Very high	86.8	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-62.7	-40.7	178.2	0	0	0	0	0	112.4	A284 F285 I291 S292 M319 I322 M323	A284-A288 VanDerWaalsContact O-CB 3.28Å; A284-A288 WeakPolarHBondContact O-CB 3.14Å; A284-A288 PolarHBondContact O-N 2.98Å; F285-A288 PolarHBondContact O-N 3.27Å; A288-I291 PolarHBondContact O-N 3.24Å; A288-S292 VanDerWaalsContact O-CB 3.23Å; A288-S292 WeakPolarHBondContact O-CB 3.13Å; A288-S292 PolarHBondContact O-N 3.49Å; A288-M319 HydrophobicContact CB-CB 4.35Å; A288-M319 HydrophobicContact CB-SD 4.19Å; A288-I322 HydrophobicContact CB-CB 4.35Å; A288-I322 HydrophobicContact CB-CG2 4.04Å; A288-M323 HydrophobicContact CB-CB 4.2Å
289	F	90.5	Very high	86.9	Confident	56 Å²	56	58.7 Å²	58.7	25%	0.246	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-47.1	174.7	175.8	-96.7	0	0	0	112.2	F285 W286 I287 S292 T293 M323	F285-F289 VanDerWaalsContact O-CB 3.27Å; F285-F289 WeakPolarHBondContact O-CB 3.35Å; F285-F289 PolarHBondContact O-N 2.97Å; W286-F289 HydrophobicContact CE3-CD1 4.26Å; W286-F289 HydrophobicContact CZ3-CD1 4.28Å; W286-F289 HydrophobicContact CZ3-CE1 4.44Å; W286-F289 PolarHBondContact O-N 3.41Å; I287-F289 PolarHBondContact O-N 3.37Å; F289-S292 PolarHBondContact O-N 3.41Å; F289-T293 HydrophobicContact CD2-CG2 4.19Å; F289-T293 HydrophobicContact CE1-CG2 4.38Å; F289-T293 HydrophobicContact CE2-CG2 3.82Å; F289-T293 HydrophobicContact CZ-CG2 3.93Å; F289-T293 WeakPolarHBondContact O-CB 3.19Å; F289-T293 WeakPolarHBondContact O-CG2 3.48Å; F289-T293 PolarHBondContact O-N 3.44Å; F289-T293 PolarHBondContact O-OG1 2.87Å; F289-M323 HydrophobicContact CB-SD 4.15Å; F289-M323 HydrophobicContact CD2-SD 3.93Å
290	L	89.3	Confident	86.4	Confident	61 Å²	61	59.7 Å²	59.7	32%	0.319	31%	0.305	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.9	-70.7	171.5	0	0	0	111.8	Y139 W286 I287 T293 S294	Y139-L290 HydrophobicContact CD1-CD2 3.44Å; Y139-L290 VanDerWaalsContact CD1-CD2 3.44Å; Y139-L290 HydrophobicContact CD2-CD2 3.9Å; Y139-L290 HydrophobicContact CE1-CD2 3.41Å; Y139-L290 VanDerWaalsContact CE1-CD2 3.41Å; Y139-L290 HydrophobicContact CE2-CD2 3.89Å; Y139-L290 HydrophobicContact CG-CD2 3.69Å; Y139-L290 PolarHBondContact OH-O 3.43Å; Y139-L290 VanDerWaalsContact OH-O 3.04Å; W286-L290 WeakPolarHBondContact O-CB 3.47Å; W286-L290 VanDerWaalsContact O-CG 3.23Å; W286-L290 WeakPolarHBondContact O-CG 3.4Å; W286-L290 PolarHBondContact O-N 2.88Å; I287-L290 PolarHBondContact O-N 3.17Å; L290-T293 PolarHBondContact O-OG1 3.42Å; L290-S294 VanDerWaalsContact O-CB 3.25Å; L290-S294 WeakPolarHBondContact O-CB 3.46Å; L290-S294 PolarHBondContact O-N 3.44Å; L290-S294 PolarHBondContact O-OG 3.19Å
291	I	89.7	Confident	85.7	Confident	55 Å²	55	58.9 Å²	58.9	28%	0.282	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-49.9	177.8	-65.6	167.1	0	0	0	110.7	I287 A288 T293 S294 I295 L315 M319	I287-I291 HydrophobicContact CG2-CD1 3.79Å; I287-I291 WeakPolarHBondContact O-CG1 3.22Å; I287-I291 PolarHBondContact O-N 3.07Å; A288-I291 PolarHBondContact O-N 3.24Å; I291-T293 PolarHBondContact O-N 2.93Å; I291-S294 PolarHBondContact O-N 3.4Å; I291-I295 HydrophobicContact CG2-CD1 3.82Å; I291-I295 WeakPolarHBondContact O-CG1 3.36Å; I291-I295 PolarHBondContact O-N 2.89Å; I291-L315 HydrophobicContact CG2-CD2 4.36Å; I291-M319 HydrophobicContact CB-CG 4.31Å; I291-M319 HydrophobicContact CD1-CE 3.93Å; I291-M319 HydrophobicContact CD1-SD 3.97Å; I291-M319 HydrophobicContact CG2-CG 3.92Å
292	S	87.7	Confident	85.1	Confident	5 Å²	5	62.5 Å²	62.5	4%	0.035	33%	0.331	C	S	.	.	H	α-helix	trans	-59.9	-47.5	-178.8	-178.9	0	0	0	0	112	A288 F289 I295 I296 F316	A288-S292 VanDerWaalsContact O-CB 3.23Å; A288-S292 WeakPolarHBondContact O-CB 3.13Å; A288-S292 PolarHBondContact O-N 3.49Å; F289-S292 PolarHBondContact O-N 3.41Å; S292-I295 PolarHBondContact O-N 3.48Å; S292-I296 WeakPolarHBondContact O-CG1 3.44Å; S292-I296 PolarHBondContact O-N 2.95Å; S292-I296 VanDerWaalsContact O-N 3.13Å; S292-F316 WeakPolarHBondContact OG-CE2 3.2Å
293	T	86.8	Confident	84.4	Confident	27 Å²	27	64.9 Å²	64.9	17%	0.166	34%	0.344	C	S	.	.	H	α-helix	trans	-69.5	-33.7	178.9	52.9	0	0	0	0	113.1	Y139 M143 F289 L290 I291 I296 R297	Y139-T293 PolarHBondContact OH-OG1 3.26Å; M143-T293 WeakPolarHBondContact CE-O 3.45Å; F289-T293 HydrophobicContact CD2-CG2 4.19Å; F289-T293 HydrophobicContact CE1-CG2 4.38Å; F289-T293 HydrophobicContact CE2-CG2 3.82Å; F289-T293 HydrophobicContact CZ-CG2 3.93Å; F289-T293 WeakPolarHBondContact O-CB 3.19Å; F289-T293 WeakPolarHBondContact O-CG2 3.48Å; F289-T293 PolarHBondContact O-N 3.44Å; F289-T293 PolarHBondContact O-OG1 2.87Å; L290-T293 PolarHBondContact O-OG1 3.42Å; I291-T293 PolarHBondContact O-N 2.93Å; T293-I296 PolarHBondContact O-N 3.16Å; T293-R297 PolarHBondContact O-N 3.39Å; T293-R297 VanDerWaalsContact O-N 3.08Å
294	S	85.3	Confident	83.7	Confident	44 Å²	44	65.9 Å²	65.9	31%	0.308	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-42.3	172.9	-65	0	0	0	0	112.2	Y139 L290 I291 R297 L298	Y139-S294 PolarHBondContact OH-N 3Å; Y139-S294 PolarHBondContact OH-OG 2.92Å; L290-S294 VanDerWaalsContact O-CB 3.25Å; L290-S294 WeakPolarHBondContact O-CB 3.46Å; L290-S294 PolarHBondContact O-N 3.44Å; L290-S294 PolarHBondContact O-OG 3.19Å; I291-S294 PolarHBondContact O-N 3.4Å; S294-R297 PolarHBondContact O-N 2.73Å; S294-L298 WeakPolarHBondContact O-CG 3.46Å; S294-L298 PolarHBondContact O-N 3.38Å
295	I	86.1	Confident	82.8	Confident	9 Å²	9	70 Å²	70	5%	0.046	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-43.1	176.6	-68.2	165.8	0	0	0	110.8	I291 S292 R297 L298 Y299 L306 L312 L315 F316	I291-I295 HydrophobicContact CG2-CD1 3.82Å; I291-I295 WeakPolarHBondContact O-CG1 3.36Å; I291-I295 PolarHBondContact O-N 2.89Å; S292-I295 PolarHBondContact O-N 3.48Å; I295-R297 VanDerWaalsContact C-N 3.32Å; I295-R297 PolarHBondContact O-N 3.47Å; I295-L298 PolarHBondContact O-N 2.87Å; I295-Y299 PolarHBondContact O-N 3.45Å; I295-L306 HydrophobicContact CG2-CD1 3.47Å; I295-L306 VanDerWaalsContact CG2-CD1 3.47Å; I295-L306 HydrophobicContact CG2-CD2 4.2Å; I295-L312 HydrophobicContact CD1-CD1 4.42Å; I295-L312 HydrophobicContact CG2-CD2 4.4Å; I295-L315 HydrophobicContact CD1-CD2 4.22Å; I295-F316 HydrophobicContact CB-CD2 4.31Å; I295-F316 HydrophobicContact CD1-CB 4.36Å; I295-F316 HydrophobicContact CG2-CB 4.49Å; I295-F316 HydrophobicContact CG2-CD2 4.03Å
296	I	84.6	Confident	81.7	Confident	78 Å²	78	68.3 Å²	68.3	40%	0.4	36%	0.359	S	S	.	.	H	α-helix	trans	-60.4	-41.2	176.9	-68.2	164.5	0	0	0	111.4	S292 T293 S300 G301 F316	S292-I296 WeakPolarHBondContact O-CG1 3.44Å; S292-I296 PolarHBondContact O-N 2.95Å; S292-I296 VanDerWaalsContact O-N 3.13Å; T293-I296 PolarHBondContact O-N 3.16Å; I296-S300 PolarHBondContact O-N 3.18Å; I296-G301 PolarHBondContact O-N 2.91Å; I296-F316 HydrophobicContact CD1-CE2 3.87Å; I296-F316 HydrophobicContact CD1-CZ 4.19Å; I296-F316 HydrophobicContact CG1-CE2 3.78Å; I296-F316 HydrophobicContact CG1-CZ 4.27Å
297	R	83.3	Confident	80.8	Confident	117 Å²	117	67.9 Å²	67.9	44%	0.442	36%	0.364	S	S	.	.	H	α-helix	trans	-70.2	-39.3	178	-176.1	61.1	173.8	-159.8	-6.1	112.5	M143 L144 T145 T293 S294 I295 Y299 S300	M143-R297 HydrophobicContact CE-CB 3.84Å; M143-R297 HydrophobicContact CE-CG 4.43Å; M143-R297 PolarHBondContact O-NE 3.08Å; M143-R297 VanDerWaalsContact O-NE 3.15Å; M143-R297 PolarHBondContact O-NH1 3.03Å; M143-R297 PolarHBondContact O-NH2 3.23Å; M143-R297 HydrophobicContact SD-CB 3.65Å; M143-R297 HydrophobicContact SD-CG 3.95Å; L144-R297 PolarHBondContact O-NH2 2.8Å; T145-R297 PolarHBondContact O-NH2 2.92Å; T293-R297 PolarHBondContact O-N 3.39Å; T293-R297 VanDerWaalsContact O-N 3.08Å; S294-R297 PolarHBondContact O-N 2.73Å; I295-R297 VanDerWaalsContact C-N 3.32Å; I295-R297 PolarHBondContact O-N 3.47Å; R297-Y299 VanDerWaalsContact C-N 3.27Å; R297-Y299 PolarHBondContact O-N 2.83Å; R297-S300 PolarHBondContact O-N 3.13Å
298	L	81.4	Confident	79.9	Confident	138 Å²	138	66.6 Å²	66.6	72%	0.723	37%	0.373	S	S	*	.	H	α-helix	trans	-57.6	-37.8	177.1	-82.7	165.2	0	0	0	112.9	S294 I295	S294-L298 WeakPolarHBondContact O-CG 3.46Å; S294-L298 PolarHBondContact O-N 3.38Å; I295-L298 PolarHBondContact O-N 2.87Å
299	Y	82.4	Confident	79.4	Confident	56 Å²	56	72 Å²	72	22%	0.22	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	14.6	177.9	-74.6	-92.4	0	0	0	113.7	I295 R297 G301 Q302 K305 L306 L312	I295-Y299 PolarHBondContact O-N 3.45Å; R297-Y299 VanDerWaalsContact C-N 3.27Å; R297-Y299 PolarHBondContact O-N 2.83Å; Y299-G301 PolarHBondContact O-N 3.13Å; Y299-Q302 PolarHBondContact O-N 3.13Å; Y299-K305 HydrophobicContact CD1-CB 3.65Å; Y299-K305 HydrophobicContact CE1-CB 4.09Å; Y299-K305 WeakPolarHBondContact CE1-O 3.26Å; Y299-L306 HydrophobicContact CD2-CD1 3.71Å; Y299-L306 HydrophobicContact CE2-CD1 3.8Å; Y299-L306 HydrophobicContact CG-CB 4.45Å; Y299-L306 HydrophobicContact CG-CD1 4.2Å; Y299-L312 HydrophobicContact CD2-CD2 4.44Å; Y299-L312 HydrophobicContact CE2-CD2 3.45Å; Y299-L312 VanDerWaalsContact CE2-CD2 3.45Å
300	S	74.8	Confident	78.9	Confident	90 Å²	90	71.5 Å²	71.5	63%	0.629	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	35.8	-179.4	71.9	0	0	0	0	114.2	I296 R297 Q302	I296-S300 PolarHBondContact O-N 3.18Å; R297-S300 PolarHBondContact O-N 3.13Å; S300-Q302 PolarHBondContact O-N 2.81Å
301	G	70.5	Confident	78.6	Confident	56 Å²	56	71.6 Å²	71.6	58%	0.577	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	-3.2	-174.7	0	0	0	0	0	116.6	I296 Y299 L303	I296-G301 PolarHBondContact O-N 2.91Å; Y299-G301 PolarHBondContact O-N 3.13Å; G301-L303 PolarHBondContact O-N 3.22Å
302	Q	74.6	Confident	78.3	Confident	91 Å²	91	71.5 Å²	71.5	43%	0.425	42%	0.424	S	S	.	.			trans	-80.2	83.5	179	-71.3	-170.3	-28.2	0	0	111.4	Y299 S300 T304 K305	Y299-Q302 PolarHBondContact O-N 3.13Å; S300-Q302 PolarHBondContact O-N 2.81Å; Q302-T304 PolarHBondContact O-N 3.24Å; Q302-T304 VanDerWaalsContact O-N 3.08Å; Q302-K305 HydrophobicContact CB-CD 4.37Å; Q302-K305 PolarHBondContact O-N 3.29Å; Q302-K305 VanDerWaalsContact OE1-CE 3.31Å
303	L	68.7	Low	78.1	Confident	108 Å²	108	73.8 Å²	73.8	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-51	-33.6	-178.5	-165.7	73.1	0	0	0	113.6	G301 K305 L306 L307	G301-L303 PolarHBondContact O-N 3.22Å; L303-K305 VanDerWaalsContact C-N 3.26Å; L303-K305 PolarHBondContact O-N 3.5Å; L303-L306 HydrophobicContact CD1-CD2 4.09Å; L303-L306 VanDerWaalsContact O-CB 3.3Å; L303-L306 WeakPolarHBondContact O-CB 3.37Å; L303-L306 PolarHBondContact O-N 2.7Å; L303-L307 HydrophobicContact CG-CD1 4.03Å; L303-L307 VanDerWaalsContact O-CD1 3.25Å; L303-L307 WeakPolarHBondContact O-CD1 3.46Å; L303-L307 PolarHBondContact O-N 2.97Å
304	T	72.6	Confident	78.2	Confident	116 Å²	116	75.8 Å²	75.8	71%	0.712	45%	0.45	S	S	*	.	H	α-helix	trans	-58.6	-33.5	178.3	50.6	0	0	0	0	113.7	Q302	Q302-T304 PolarHBondContact O-N 3.24Å; Q302-T304 VanDerWaalsContact O-N 3.08Å
305	K	70.2	Confident	78.3	Confident	121 Å²	121	77 Å²	77	53%	0.526	45%	0.453	S	S	.	.	H	α-helix	trans	-77.9	-24	175.4	-71.2	172.6	176.1	164.9	0	112.7	Y299 Q302 L303	Y299-K305 HydrophobicContact CD1-CB 3.65Å; Y299-K305 HydrophobicContact CE1-CB 4.09Å; Y299-K305 WeakPolarHBondContact CE1-O 3.26Å; Q302-K305 HydrophobicContact CB-CD 4.37Å; Q302-K305 PolarHBondContact O-N 3.29Å; Q302-K305 VanDerWaalsContact OE1-CE 3.31Å; L303-K305 VanDerWaalsContact C-N 3.26Å; L303-K305 PolarHBondContact O-N 3.5Å
306	L	66.3	Low	78.5	Confident	6 Å²	6	78.2 Å²	78.2	3%	0.031	46%	0.458	C	S	.	.	H	α-helix	trans	-71.3	-37.1	175.3	-170.6	70.3	0	0	0	111.5	I295 Y299 L303 G308 H309 L312 F316	I295-L306 HydrophobicContact CG2-CD1 3.47Å; I295-L306 VanDerWaalsContact CG2-CD1 3.47Å; I295-L306 HydrophobicContact CG2-CD2 4.2Å; Y299-L306 HydrophobicContact CD2-CD1 3.71Å; Y299-L306 HydrophobicContact CE2-CD1 3.8Å; Y299-L306 HydrophobicContact CG-CB 4.45Å; Y299-L306 HydrophobicContact CG-CD1 4.2Å; L303-L306 HydrophobicContact CD1-CD2 4.09Å; L303-L306 VanDerWaalsContact O-CB 3.3Å; L303-L306 WeakPolarHBondContact O-CB 3.37Å; L303-L306 PolarHBondContact O-N 2.7Å; L306-G308 PolarHBondContact O-N 3.27Å; L306-H309 PolarHBondContact O-N 3.49Å; L306-L312 HydrophobicContact CD1-CD2 3.83Å; L306-L312 HydrophobicContact CD1-CG 4.25Å; L306-F316 HydrophobicContact CD2-CB 4.4Å; L306-F316 HydrophobicContact CD2-CD1 4.14Å; L306-F316 HydrophobicContact CD2-CD2 4.5Å; L306-F316 HydrophobicContact CD2-CG 4.08Å
307	L	68.7	Low	78.8	Confident	100 Å²	100	78.2 Å²	78.2	52%	0.524	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.8	177.1	-90.5	72.7	0	0	0	113.4	L303 H309 L313	L303-L307 HydrophobicContact CG-CD1 4.03Å; L303-L307 VanDerWaalsContact O-CD1 3.25Å; L303-L307 WeakPolarHBondContact O-CD1 3.46Å; L303-L307 PolarHBondContact O-N 2.97Å; L307-H309 PolarHBondContact O-N 3.33Å; L307-L313 HydrophobicContact CD1-CD1 4.2Å; L307-L313 HydrophobicContact CG-CD1 4.48Å; L307-L313 HydrophobicContact CG-CD2 4.32Å
308	G	72.6	Confident	79.2	Confident	63 Å²	63	77.1 Å²	77.1	65%	0.649	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-17.7	179.6	0	0	0	0	0	115.1	L306	L306-G308 PolarHBondContact O-N 3.27Å
309	H	81.2	Confident	79.7	Confident	116 Å²	116	72.1 Å²	72.1	54%	0.537	44%	0.437	S	S	.	.			trans	-119.7	87	179.2	-68.9	-75.5	0	0	0	111.1	L306 L307 G311 L312 L313	L306-H309 PolarHBondContact O-N 3.49Å; L307-H309 PolarHBondContact O-N 3.33Å; H309-G311 VanDerWaalsContact C-N 3.26Å; H309-G311 PolarHBondContact O-N 2.79Å; H309-G311 VanDerWaalsContact O-N 3.09Å; H309-L312 HydrophobicContact CB-CB 4.26Å; H309-L312 PolarHBondContact O-N 3.29Å; H309-L313 PolarHBondContact O-N 3.26Å
310	G	79.6	Confident	80.2	Confident	45 Å²	45	70.9 Å²	70.9	46%	0.464	44%	0.437	S	S	.	.	H	α-helix	trans	-49.4	-39.6	-174.8	0	0	0	0	0	115	L312 L313 S314	G310-L312 PolarHBondContact O-N 3.15Å; G310-L313 PolarHBondContact O-N 3.35Å; G310-S314 PolarHBondContact O-N 3.37Å; G310-S314 PolarHBondContact O-OG 3.1Å
311	G	83.2	Confident	81.1	Confident	63 Å²	63	69.5 Å²	69.5	65%	0.649	43%	0.427	S	S	*	.	H	α-helix	trans	-64.8	-35.9	176.7	0	0	0	0	0	114.3	H309 L315	H309-G311 VanDerWaalsContact C-N 3.26Å; H309-G311 PolarHBondContact O-N 2.79Å; H309-G311 VanDerWaalsContact O-N 3.09Å; G311-L315 PolarHBondContact O-N 3.41Å; G311-L315 VanDerWaalsContact O-N 3.14Å
312	L	83	Confident	82.1	Confident	52 Å²	52	69.8 Å²	69.8	27%	0.272	41%	0.414	S	S	.	.	H	α-helix	trans	-78.5	-34.3	177.2	-162	71.9	0	0	0	111.4	I295 Y299 L306 H309 G310 L315 F316	I295-L312 HydrophobicContact CD1-CD1 4.42Å; I295-L312 HydrophobicContact CG2-CD2 4.4Å; Y299-L312 HydrophobicContact CD2-CD2 4.44Å; Y299-L312 HydrophobicContact CE2-CD2 3.45Å; Y299-L312 VanDerWaalsContact CE2-CD2 3.45Å; L306-L312 HydrophobicContact CD1-CD2 3.83Å; L306-L312 HydrophobicContact CD1-CG 4.25Å; H309-L312 HydrophobicContact CB-CB 4.26Å; H309-L312 PolarHBondContact O-N 3.29Å; G310-L312 PolarHBondContact O-N 3.15Å; L312-L315 HydrophobicContact CD1-CD2 4.28Å; L312-L315 PolarHBondContact O-N 3.2Å; L312-F316 WeakPolarHBondContact O-CB 3.48Å; L312-F316 PolarHBondContact O-N 3.47Å
313	L	84.5	Confident	82.9	Confident	53 Å²	53	67.9 Å²	67.9	28%	0.277	41%	0.406	S	S	.	.	H	α-helix	trans	-59.9	-46.4	169.6	-175.4	68.9	0	0	0	111	L307 H309 G310 L315 F316 V317	L307-L313 HydrophobicContact CD1-CD1 4.2Å; L307-L313 HydrophobicContact CG-CD1 4.48Å; L307-L313 HydrophobicContact CG-CD2 4.32Å; H309-L313 PolarHBondContact O-N 3.26Å; G310-L313 PolarHBondContact O-N 3.35Å; L313-L315 PolarHBondContact O-N 3.36Å; L313-F316 PolarHBondContact O-N 3.32Å; L313-V317 WeakPolarHBondContact O-CG2 3.41Å; L313-V317 PolarHBondContact O-N 2.72Å
314	S	87.9	Confident	83.9	Confident	69 Å²	69	69.1 Å²	69.1	48%	0.483	41%	0.407	S	S	.	.	H	α-helix	trans	-58.2	-46	174.8	-61.3	0	0	0	0	112.1	G310 F316 V317 I318	G310-S314 PolarHBondContact O-N 3.37Å; G310-S314 PolarHBondContact O-OG 3.1Å; S314-F316 PolarHBondContact O-N 2.67Å; S314-V317 PolarHBondContact O-N 2.8Å; S314-I318 WeakPolarHBondContact O-CB 3.3Å; S314-I318 WeakPolarHBondContact O-CD1 3.48Å; S314-I318 VanDerWaalsContact O-CG1 3.25Å; S314-I318 WeakPolarHBondContact O-CG1 3.36Å; S314-I318 PolarHBondContact O-N 3.18Å
315	L	88.6	Confident	84.8	Confident	69 Å²	69	69.4 Å²	69.4	36%	0.361	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-44.4	176.5	-170.6	75.8	0	0	0	111.8	I291 I295 G311 L312 L313 I318 M319	I291-L315 HydrophobicContact CG2-CD2 4.36Å; I295-L315 HydrophobicContact CD1-CD2 4.22Å; G311-L315 PolarHBondContact O-N 3.41Å; G311-L315 VanDerWaalsContact O-N 3.14Å; L312-L315 HydrophobicContact CD1-CD2 4.28Å; L312-L315 PolarHBondContact O-N 3.2Å; L313-L315 PolarHBondContact O-N 3.36Å; L315-I318 PolarHBondContact O-N 3.25Å; L315-M319 HydrophobicContact CD1-CE 4.04Å; L315-M319 WeakPolarHBondContact O-CB 3.08Å; L315-M319 VanDerWaalsContact O-CG 3.28Å; L315-M319 WeakPolarHBondContact O-CG 3.12Å; L315-M319 PolarHBondContact O-N 3.07Å
316	F	89.6	Confident	85.7	Confident	36 Å²	36	64.3 Å²	64.3	16%	0.158	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-42.5	178.3	177.8	-98.8	0	0	0	112.4	S292 I295 I296 L306 L312 L313 S314 S320	S292-F316 WeakPolarHBondContact OG-CE2 3.2Å; I295-F316 HydrophobicContact CB-CD2 4.31Å; I295-F316 HydrophobicContact CD1-CB 4.36Å; I295-F316 HydrophobicContact CG2-CB 4.49Å; I295-F316 HydrophobicContact CG2-CD2 4.03Å; I296-F316 HydrophobicContact CD1-CE2 3.87Å; I296-F316 HydrophobicContact CD1-CZ 4.19Å; I296-F316 HydrophobicContact CG1-CE2 3.78Å; I296-F316 HydrophobicContact CG1-CZ 4.27Å; L306-F316 HydrophobicContact CD2-CB 4.4Å; L306-F316 HydrophobicContact CD2-CD1 4.14Å; L306-F316 HydrophobicContact CD2-CD2 4.5Å; L306-F316 HydrophobicContact CD2-CG 4.08Å; L312-F316 WeakPolarHBondContact O-CB 3.48Å; L312-F316 PolarHBondContact O-N 3.47Å; L313-F316 PolarHBondContact O-N 3.32Å; S314-F316 PolarHBondContact O-N 2.67Å; F316-S320 VanDerWaalsContact O-CB 3.26Å; F316-S320 WeakPolarHBondContact O-CB 3.42Å; F316-S320 PolarHBondContact O-N 3.2Å; F316-S320 PolarHBondContact O-OG 3.24Å
317	V	90.4	Very high	86.7	Confident	78 Å²	78	68.6 Å²	68.6	47%	0.473	40%	0.402	S	S	.	.	H	α-helix	trans	-63.2	-50.8	175.3	171.4	0	0	0	0	110.5	L313 S314 M319 S320 S321	L313-V317 WeakPolarHBondContact O-CG2 3.41Å; L313-V317 PolarHBondContact O-N 2.72Å; S314-V317 PolarHBondContact O-N 2.8Å; V317-M319 PolarHBondContact O-N 2.96Å; V317-S320 PolarHBondContact O-N 3.39Å; V317-S320 VanDerWaalsContact O-N 3.16Å; V317-S321 PolarHBondContact O-N 2.69Å; V317-S321 PolarHBondContact O-OG 3.29Å
318	I	92.4	Very high	87.7	Confident	93 Å²	93	67.2 Å²	67.2	48%	0.477	40%	0.397	S	S	.	.	H	α-helix	trans	-56.3	-48.6	179.4	-69.9	163.7	0	0	0	111.3	S314 L315 S320 S321 I322	S314-I318 WeakPolarHBondContact O-CB 3.3Å; S314-I318 WeakPolarHBondContact O-CD1 3.48Å; S314-I318 VanDerWaalsContact O-CG1 3.25Å; S314-I318 WeakPolarHBondContact O-CG1 3.36Å; S314-I318 PolarHBondContact O-N 3.18Å; L315-I318 PolarHBondContact O-N 3.25Å; I318-S320 PolarHBondContact O-N 2.78Å; I318-S321 PolarHBondContact O-N 3.3Å; I318-I322 HydrophobicContact CG2-CD1 3.83Å; I318-I322 WeakPolarHBondContact O-CG1 3.38Å; I318-I322 PolarHBondContact O-N 2.67Å
319	M	92.5	Very high	88.2	Confident	34 Å²	34	65.2 Å²	65.2	17%	0.167	38%	0.377	C	S	.	.	H	α-helix	trans	-66	-37.8	179.5	-66.2	-63.8	165.3	0	0	111.9	A288 I291 L315 V317 I322 M323	A288-M319 HydrophobicContact CB-CB 4.35Å; A288-M319 HydrophobicContact CB-SD 4.19Å; I291-M319 HydrophobicContact CB-CG 4.31Å; I291-M319 HydrophobicContact CD1-CE 3.93Å; I291-M319 HydrophobicContact CD1-SD 3.97Å; I291-M319 HydrophobicContact CG2-CG 3.92Å; L315-M319 HydrophobicContact CD1-CE 4.04Å; L315-M319 WeakPolarHBondContact O-CB 3.08Å; L315-M319 VanDerWaalsContact O-CG 3.28Å; L315-M319 WeakPolarHBondContact O-CG 3.12Å; L315-M319 PolarHBondContact O-N 3.07Å; V317-M319 PolarHBondContact O-N 2.96Å; M319-I322 PolarHBondContact O-N 2.88Å; M319-I322 HydrophobicContact SD-CD1 4.35Å; M319-M323 VanDerWaalsContact O-CB 3.31Å; M319-M323 WeakPolarHBondContact O-CB 3.43Å; M319-M323 PolarHBondContact O-N 3.33Å
320	S	92.3	Very high	88.3	Confident	30 Å²	30	60.2 Å²	60.2	21%	0.21	36%	0.355	C	S	.	.	H	α-helix	trans	-67.5	-36.8	176.4	-58.1	0	0	0	0	112.2	F316 V317 I318 M323 F324	F316-S320 VanDerWaalsContact O-CB 3.26Å; F316-S320 WeakPolarHBondContact O-CB 3.42Å; F316-S320 PolarHBondContact O-N 3.2Å; F316-S320 PolarHBondContact O-OG 3.24Å; V317-S320 PolarHBondContact O-N 3.39Å; V317-S320 VanDerWaalsContact O-N 3.16Å; I318-S320 PolarHBondContact O-N 2.78Å; S320-M323 PolarHBondContact O-N 2.85Å; S320-F324 WeakPolarHBondContact O-CB 3.45Å; S320-F324 PolarHBondContact O-N 2.87Å
321	S	93.2	Very high	88.5	Confident	60 Å²	60	61.5 Å²	61.5	42%	0.42	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-43.9	171.8	-60.9	0	0	0	0	112.4	V317 I318 M323 F324 L325	V317-S321 PolarHBondContact O-N 2.69Å; V317-S321 PolarHBondContact O-OG 3.29Å; I318-S321 PolarHBondContact O-N 3.3Å; S321-M323 VanDerWaalsContact C-N 3.34Å; S321-M323 PolarHBondContact O-N 3.39Å; S321-F324 PolarHBondContact O-N 3.27Å; S321-L325 WeakPolarHBondContact O-CB 3.46Å; S321-L325 WeakPolarHBondContact O-CG 3.43Å; S321-L325 PolarHBondContact O-N 3.35Å
322	I	91.6	Very high	88.4	Confident	62 Å²	62	61 Å²	61	32%	0.318	34%	0.336	S	S	.	.	H	α-helix	trans	-61.5	-43.5	175.2	-68.8	165.1	0	0	0	110.6	A288 I318 M319 S326	A288-I322 HydrophobicContact CB-CB 4.35Å; A288-I322 HydrophobicContact CB-CG2 4.04Å; I318-I322 HydrophobicContact CG2-CD1 3.83Å; I318-I322 WeakPolarHBondContact O-CG1 3.38Å; I318-I322 PolarHBondContact O-N 2.67Å; M319-I322 PolarHBondContact O-N 2.88Å; M319-I322 HydrophobicContact SD-CD1 4.35Å; I322-S326 VanDerWaalsContact O-CB 3.22Å; I322-S326 WeakPolarHBondContact O-CB 3.05Å; I322-S326 PolarHBondContact O-N 3.49Å; I322-S326 PolarHBondContact O-OG 3.28Å
323	M	91.3	Very high	88.1	Confident	51 Å²	51	60.8 Å²	60.8	25%	0.251	34%	0.339	S	S	.	.	H	α-helix	trans	-61.8	-46	176.7	-173.9	-179.6	68.8	0	0	111.4	F285 A288 F289 M319 S320 S321 F327	F285-M323 HydrophobicContact CD2-CG 3.83Å; F285-M323 HydrophobicContact CE2-CG 3.52Å; F285-M323 HydrophobicContact CZ-CG 4.35Å; A288-M323 HydrophobicContact CB-CB 4.2Å; F289-M323 HydrophobicContact CB-SD 4.15Å; F289-M323 HydrophobicContact CD2-SD 3.93Å; M319-M323 VanDerWaalsContact O-CB 3.31Å; M319-M323 WeakPolarHBondContact O-CB 3.43Å; M319-M323 PolarHBondContact O-N 3.33Å; S320-M323 PolarHBondContact O-N 2.85Å; S321-M323 VanDerWaalsContact C-N 3.34Å; S321-M323 PolarHBondContact O-N 3.39Å; M323-F327 VanDerWaalsContact O-CB 3.31Å; M323-F327 WeakPolarHBondContact O-CB 3.35Å; M323-F327 PolarHBondContact O-N 3.25Å
324	F	91.4	Very high	87.9	Confident	135 Å²	135	61 Å²	61	59%	0.592	34%	0.34	S	S	*	.	H	α-helix	trans	-62.6	-51.3	177.4	179.1	-100.7	0	0	0	112.3	S320 S321 S326 F327 V328	S320-F324 WeakPolarHBondContact O-CB 3.45Å; S320-F324 PolarHBondContact O-N 2.87Å; S321-F324 PolarHBondContact O-N 3.27Å; F324-S326 VanDerWaalsContact C-N 3.31Å; F324-S326 PolarHBondContact O-N 3.02Å; F324-F327 PolarHBondContact O-N 3.11Å; F324-V328 HydrophobicContact CD1-CG2 4.39Å; F324-V328 HydrophobicContact CD2-CG2 4.29Å; F324-V328 HydrophobicContact CE1-CG2 4.02Å; F324-V328 HydrophobicContact CE2-CG2 3.92Å; F324-V328 HydrophobicContact CZ-CG2 3.78Å; F324-V328 WeakPolarHBondContact O-CG2 3.5Å; F324-V328 PolarHBondContact O-N 3.32Å
325	L	90.2	Very high	87.7	Confident	122 Å²	122	63.2 Å²	63.2	64%	0.639	34%	0.341	S	S	*	.	H	α-helix	trans	-61.3	-40.3	179.1	-70	170.6	0	0	0	111.9	S321 G329	S321-L325 WeakPolarHBondContact O-CB 3.46Å; S321-L325 WeakPolarHBondContact O-CG 3.43Å; S321-L325 PolarHBondContact O-N 3.35Å; L325-G329 PolarHBondContact O-N 3.27Å
326	S	89.5	Confident	87.1	Confident	14 Å²	14	64 Å²	64	10%	0.098	34%	0.339	C	S	.	.	H	α-helix	trans	-68.6	-35.6	176.9	-55.4	0	0	0	0	112.2	I322 F324 S330	I322-S326 VanDerWaalsContact O-CB 3.22Å; I322-S326 WeakPolarHBondContact O-CB 3.05Å; I322-S326 PolarHBondContact O-N 3.49Å; I322-S326 PolarHBondContact O-OG 3.28Å; F324-S326 VanDerWaalsContact C-N 3.31Å; F324-S326 PolarHBondContact O-N 3.02Å; S326-S330 VanDerWaalsContact O-CB 3.24Å; S326-S330 WeakPolarHBondContact O-CB 3.2Å; S326-S330 PolarHBondContact O-N 2.79Å; S326-S330 PolarHBondContact O-OG 3.21Å
327	F	87.9	Confident	86.5	Confident	96 Å²	96	65.2 Å²	65.2	42%	0.421	35%	0.346	S	S	.	.	H	α-helix	trans	-68.2	-49.4	174.6	-176.6	-106.2	0	0	0	111.8	F285 M323 F324 G329 S330 L331	F285-F327 HydrophobicContact CD2-CB 4.44Å; F285-F327 HydrophobicContact CE2-CB 4.04Å; F285-F327 HydrophobicContact CE2-CD2 4.36Å; M323-F327 VanDerWaalsContact O-CB 3.31Å; M323-F327 WeakPolarHBondContact O-CB 3.35Å; M323-F327 PolarHBondContact O-N 3.25Å; F324-F327 PolarHBondContact O-N 3.11Å; F327-G329 PolarHBondContact O-N 3.01Å; F327-S330 PolarHBondContact O-N 2.89Å; F327-S330 PolarHBondContact O-OG 3.13Å; F327-L331 HydrophobicContact CD1-CD1 3.99Å; F327-L331 HydrophobicContact CD1-CG 4.44Å; F327-L331 HydrophobicContact CE1-CD1 3.58Å; F327-L331 HydrophobicContact CE1-CG 4.02Å; F327-L331 HydrophobicContact CZ-CD1 4.17Å; F327-L331 HydrophobicContact CZ-CG 4.14Å; F327-L331 WeakPolarHBondContact O-CB 3.42Å; F327-L331 PolarHBondContact O-N 3.04Å
328	V	88.1	Confident	86.1	Confident	71 Å²	71	65.6 Å²	65.6	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-63.4	-40.4	178.4	175.3	0	0	0	0	111.4	F324 P332	F324-V328 HydrophobicContact CD1-CG2 4.39Å; F324-V328 HydrophobicContact CD2-CG2 4.29Å; F324-V328 HydrophobicContact CE1-CG2 4.02Å; F324-V328 HydrophobicContact CE2-CG2 3.92Å; F324-V328 HydrophobicContact CZ-CG2 3.78Å; F324-V328 WeakPolarHBondContact O-CG2 3.5Å; F324-V328 PolarHBondContact O-N 3.32Å; V328-P332 WeakPolarHBondContact O-CD 3.43Å
329	G	83.2	Confident	85.4	Confident	21 Å²	21	67 Å²	67	22%	0.216	35%	0.348	C	S	.	.	H	α-helix	trans	-67.4	-34.2	174.7	0	0	0	0	0	114	V273 L325 F327	V273-G329 VanDerWaalsContact CG1-O 3.23Å; V273-G329 WeakPolarHBondContact CG1-O 3.37Å; L325-G329 PolarHBondContact O-N 3.27Å; F327-G329 PolarHBondContact O-N 3.01Å
330	S	84	Confident	84.5	Confident	10 Å²	10	65.6 Å²	65.6	7%	0.07	34%	0.341	C	S	.	.	H	α-helix	trans	-85.1	-21.1	178.5	60.3	0	0	0	0	113.9	S326 F327 S333 I334	S326-S330 VanDerWaalsContact O-CB 3.24Å; S326-S330 WeakPolarHBondContact O-CB 3.2Å; S326-S330 PolarHBondContact O-N 2.79Å; S326-S330 PolarHBondContact O-OG 3.21Å; F327-S330 PolarHBondContact O-N 2.89Å; F327-S330 PolarHBondContact O-OG 3.13Å; S330-S333 CarbonylContact O-C 3.48Å; S330-S333 WeakPolarHBondContact O-CA 3.38Å; S330-S333 VanDerWaalsContact O-CB 3.3Å; S330-S333 WeakPolarHBondContact O-CB 3.49Å; S330-S333 PolarHBondContact O-N 3.39Å; S330-I334 WeakPolarHBondContact O-CG1 3.44Å; S330-I334 PolarHBondContact O-N 3Å
331	L	85	Confident	83.9	Confident	73 Å²	73	67.3 Å²	67.3	38%	0.382	35%	0.348	S	S	.	.	H	α-helix	trans	-48.2	-48.1	-179.5	-117.8	169.8	0	0	0	114	F327 S333 I334 F335	F327-L331 HydrophobicContact CD1-CD1 3.99Å; F327-L331 HydrophobicContact CD1-CG 4.44Å; F327-L331 HydrophobicContact CE1-CD1 3.58Å; F327-L331 HydrophobicContact CE1-CG 4.02Å; F327-L331 HydrophobicContact CZ-CD1 4.17Å; F327-L331 HydrophobicContact CZ-CG 4.14Å; F327-L331 WeakPolarHBondContact O-CB 3.42Å; F327-L331 PolarHBondContact O-N 3.04Å; L331-S333 PolarHBondContact O-N 2.84Å; L331-I334 PolarHBondContact O-N 3.42Å; L331-F335 WeakPolarHBondContact O-CB 3.47Å; L331-F335 PolarHBondContact O-N 3.24Å
332	P	80.6	Confident	83.1	Confident	53 Å²	53	70.8 Å²	70.8	34%	0.344	36%	0.361	S	S	.	.	H	α-helix	trans	-64.1	-24.2	176.3	-23.5	35	0	0	0	114.1	V328 R336	V328-P332 WeakPolarHBondContact O-CD 3.43Å; P332-R336 WeakPolarHBondContact O-CD 3.4Å; P332-R336 VanDerWaalsContact O-CG 3.22Å; P332-R336 WeakPolarHBondContact O-CG 3.16Å; P332-R336 PolarHBondContact O-N 2.92Å
333	S	76.7	Confident	82.3	Confident	47 Å²	47	72.1 Å²	72.1	33%	0.329	37%	0.368	S	S	.	.	H	α-helix	trans	-82.3	-43.6	174.6	-59	0	0	0	0	111	S330 L331 F335 R336 I337	S330-S333 CarbonylContact O-C 3.48Å; S330-S333 WeakPolarHBondContact O-CA 3.38Å; S330-S333 VanDerWaalsContact O-CB 3.3Å; S330-S333 WeakPolarHBondContact O-CB 3.49Å; S330-S333 PolarHBondContact O-N 3.39Å; L331-S333 PolarHBondContact O-N 2.84Å; S333-F335 PolarHBondContact O-N 3.2Å; S333-R336 PolarHBondContact O-N 2.96Å; S333-I337 VanDerWaalsContact O-CG1 3.31Å; S333-I337 WeakPolarHBondContact O-CG1 3.35Å; S333-I337 PolarHBondContact O-N 2.69Å
334	I	79.9	Confident	81.3	Confident	58 Å²	58	72.7 Å²	72.7	30%	0.297	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-46.6	175.5	-65.8	166.3	0	0	0	110.4	S330 L331 R336 I337 I338	S330-I334 WeakPolarHBondContact O-CG1 3.44Å; S330-I334 PolarHBondContact O-N 3Å; L331-I334 PolarHBondContact O-N 3.42Å; I334-R336 VanDerWaalsContact C-N 3.33Å; I334-R336 PolarHBondContact O-N 3.27Å; I334-I337 WeakPolarHBondContact O-CB 3.46Å; I334-I337 PolarHBondContact O-N 2.9Å; I334-I337 VanDerWaalsContact O-N 3.14Å; I334-I338 HydrophobicContact CG2-CD1 3.78Å; I334-I338 HydrophobicContact CG2-CG1 4.43Å; I334-I338 WeakPolarHBondContact O-CG1 3.34Å; I334-I338 PolarHBondContact O-N 3.41Å
335	F	82.5	Confident	80.4	Confident	114 Å²	114	66.3 Å²	66.3	50%	0.5	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-37.8	177.5	-173.4	-102.3	0	0	0	112.8	L331 S333 I338 K339	L331-F335 WeakPolarHBondContact O-CB 3.47Å; L331-F335 PolarHBondContact O-N 3.24Å; S333-F335 PolarHBondContact O-N 3.2Å; F335-I338 PolarHBondContact O-N 3.02Å; F335-K339 WeakPolarHBondContact O-CB 3.48Å; F335-K339 PolarHBondContact O-N 3.43Å
336	R	76.1	Confident	79.7	Confident	87 Å²	87	61.3 Å²	61.3	33%	0.328	32%	0.318	S	S	.	.	H	α-helix	trans	-66	-39.2	173.5	-74.1	171	-174.9	164.5	5.6	112.2	P332 S333 I334 G340	P332-R336 WeakPolarHBondContact O-CD 3.4Å; P332-R336 VanDerWaalsContact O-CG 3.22Å; P332-R336 WeakPolarHBondContact O-CG 3.16Å; P332-R336 PolarHBondContact O-N 2.92Å; S333-R336 PolarHBondContact O-N 2.96Å; I334-R336 VanDerWaalsContact C-N 3.33Å; I334-R336 PolarHBondContact O-N 3.27Å; R336-G340 PolarHBondContact O-N 2.85Å
337	I	78.6	Confident	79.1	Confident	61 Å²	61	64.1 Å²	64.1	31%	0.313	34%	0.335	S	S	.	.	H	α-helix	trans	-63.1	-48.9	174.8	-68.2	166.1	0	0	0	110.4	L256 S333 I334 G340 L341	L256-I337 HydrophobicContact CD1-CB 4.3Å; L256-I337 HydrophobicContact CD1-CG1 3.9Å; L256-I337 HydrophobicContact CD1-CG2 3.93Å; S333-I337 VanDerWaalsContact O-CG1 3.31Å; S333-I337 WeakPolarHBondContact O-CG1 3.35Å; S333-I337 PolarHBondContact O-N 2.69Å; I334-I337 WeakPolarHBondContact O-CB 3.46Å; I334-I337 PolarHBondContact O-N 2.9Å; I334-I337 VanDerWaalsContact O-N 3.14Å; I337-G340 PolarHBondContact O-N 3.31Å; I337-L341 HydrophobicContact CG2-CD1 3.9Å; I337-L341 HydrophobicContact CG2-CG 4.47Å; I337-L341 WeakPolarHBondContact O-CG 3.3Å; I337-L341 PolarHBondContact O-N 2.88Å
338	I	81.3	Confident	78.6	Confident	86 Å²	86	61.5 Å²	61.5	44%	0.441	33%	0.327	S	S	.	.	H	α-helix	trans	-59.7	-49.2	177.7	-67.6	168.1	0	0	0	110.7	I334 F335 G340 L341 L342	I334-I338 HydrophobicContact CG2-CD1 3.78Å; I334-I338 HydrophobicContact CG2-CG1 4.43Å; I334-I338 WeakPolarHBondContact O-CG1 3.34Å; I334-I338 PolarHBondContact O-N 3.41Å; F335-I338 PolarHBondContact O-N 3.02Å; I338-G340 VanDerWaalsContact C-N 3.29Å; I338-G340 PolarHBondContact O-N 3.38Å; I338-L341 PolarHBondContact O-N 2.95Å; I338-L341 VanDerWaalsContact O-N 3.16Å; I338-L342 HydrophobicContact CG2-CD1 3.83Å; I338-L342 HydrophobicContact CG2-CG 4.44Å; I338-L342 WeakPolarHBondContact O-CG 3.5Å; I338-L342 PolarHBondContact O-N 2.98Å
339	K	78.3	Confident	78.1	Confident	122 Å²	122	58.2 Å²	58.2	53%	0.53	31%	0.307	S	S	.	.	H	α-helix	trans	-60	-38.2	177.1	-174.4	167.5	-177.3	169.5	0	112.3	F335 I343	F335-K339 WeakPolarHBondContact O-CB 3.48Å; F335-K339 PolarHBondContact O-N 3.43Å; K339-I343 HydrophobicContact CG-CD1 3.94Å; K339-I343 WeakPolarHBondContact O-CD1 3.36Å; K339-I343 VanDerWaalsContact O-CG1 3.32Å; K339-I343 WeakPolarHBondContact O-CG1 3.14Å; K339-I343 PolarHBondContact O-N 2.9Å
340	G	73.7	Confident	78	Confident	4 Å²	4	61.8 Å²	61.8	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-47.1	173	0	0	0	0	0	113	R255 R336 I337 I338 L342 I343	R255-G340 WeakPolarHBondContact CB-O 3.33Å; R336-G340 PolarHBondContact O-N 2.85Å; I337-G340 PolarHBondContact O-N 3.31Å; I338-G340 VanDerWaalsContact C-N 3.29Å; I338-G340 PolarHBondContact O-N 3.38Å; G340-L342 VanDerWaalsContact C-N 3.31Å; G340-L342 PolarHBondContact O-N 2.94Å; G340-I343 PolarHBondContact O-N 3.44Å
341	L	78.5	Confident	77.9	Confident	67 Å²	67	65.2 Å²	65.2	35%	0.351	34%	0.337	S	S	.	.	H	α-helix	trans	-65.1	-30.9	179.3	-69.9	170.8	0	0	0	113.3	I252 R255 I337 I338	I252-L341 HydrophobicContact CG2-CD2 4.02Å; R255-L341 WeakPolarHBondContact CD-O 3.42Å; R255-L341 PolarHBondContact NH1-O 3.28Å; I337-L341 HydrophobicContact CG2-CD1 3.9Å; I337-L341 HydrophobicContact CG2-CG 4.47Å; I337-L341 WeakPolarHBondContact O-CG 3.3Å; I337-L341 PolarHBondContact O-N 2.88Å; I338-L341 PolarHBondContact O-N 2.95Å; I338-L341 VanDerWaalsContact O-N 3.16Å
342	L	77.8	Confident	77.6	Confident	133 Å²	133	62.5 Å²	62.5	70%	0.696	33%	0.325	S	S	*	.	H	α-helix	trans	-74.5	-38.1	176.6	-71.7	167.3	0	0	0	113.1	I338 G340 N344	I338-L342 HydrophobicContact CG2-CD1 3.83Å; I338-L342 HydrophobicContact CG2-CG 4.44Å; I338-L342 WeakPolarHBondContact O-CG 3.5Å; I338-L342 PolarHBondContact O-N 2.98Å; G340-L342 VanDerWaalsContact C-N 3.31Å; G340-L342 PolarHBondContact O-N 2.94Å; L342-N344 PolarHBondContact O-N 3.49Å
343	I	73.7	Confident	77.5	Confident	90 Å²	90	61.2 Å²	61.2	46%	0.462	32%	0.316	S	S	.	.	S	Bend	trans	-74.2	103.2	-176.2	-65.2	167	0	0	0	110.3	K339 G340 P345	K339-I343 HydrophobicContact CG-CD1 3.94Å; K339-I343 WeakPolarHBondContact O-CD1 3.36Å; K339-I343 VanDerWaalsContact O-CG1 3.32Å; K339-I343 WeakPolarHBondContact O-CG1 3.14Å; K339-I343 PolarHBondContact O-N 2.9Å; G340-I343 PolarHBondContact O-N 3.44Å; I343-P345 WeakPolarHBondContact O-CD 3.22Å
344	N	70.7	Confident	77.7	Confident	62 Å²	62	62.4 Å²	62.4	33%	0.332	32%	0.321	S	S	.	.			trans	-72.3	112.6	175.6	-166.6	17.3	0	0	0	110.3	Q251 R255 L342 I346 T347	Q251-N344 PolarHBondContact NE2-OD1 2.83Å; R255-N344 VanDerWaalsContact NH2-CG 3.31Å; R255-N344 PolarHBondContact NH2-OD1 2.93Å; L342-N344 PolarHBondContact O-N 3.49Å; N344-I346 VanDerWaalsContact C-N 3.31Å; N344-I346 PolarHBondContact O-N 2.99Å; N344-T347 HydrophobicContact CB-CG2 4.21Å; N344-T347 PolarHBondContact O-N 3.39Å; N344-T347 PolarHBondContact O-OG1 3.38Å
345	P	71.6	Confident	77.7	Confident	1 Å²	1	64 Å²	64	1%	0.006	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-2	-154.4	34.6	-38.5	0	0	0	114.8	W242 I254 R255 R258 I343	W242-P345 HydrophobicContact CH2-CB 4.07Å; W242-P345 HydrophobicContact CZ2-CB 3.45Å; W242-P345 VanDerWaalsContact CZ2-CB 3.45Å; W242-P345 HydrophobicContact CZ2-CG 3.57Å; I254-P345 HydrophobicContact CG2-CG 4.19Å; R255-P345 HydrophobicContact CG-CG 4.18Å; R258-P345 PolarHBondContact NH1-O 2.98Å; I343-P345 WeakPolarHBondContact O-CD 3.22Å
346	I	75.8	Confident	77.4	Confident	18 Å²	18	59.6 Å²	59.6	9%	0.092	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-24.3	175.5	-65.5	170.6	0	0	0	111.3	W242 F243 N344 P348 I349 K350	W242-I346 HydrophobicContact CG-CG1 4.05Å; F243-I346 HydrophobicContact CD1-CD1 4.18Å; F243-I346 HydrophobicContact CE1-CD1 3.74Å; F243-I346 HydrophobicContact CZ-CD1 4.07Å; N344-I346 VanDerWaalsContact C-N 3.31Å; N344-I346 PolarHBondContact O-N 2.99Å; I346-P348 VanDerWaalsContact C-CD 3.5Å; I346-I349 PolarHBondContact O-N 2.62Å; I346-I349 VanDerWaalsContact O-N 3.11Å; I346-K350 HydrophobicContact CG2-CD 3.95Å; I346-K350 HydrophobicContact CG2-CG 3.92Å; I346-K350 PolarHBondContact O-N 3.37Å; I346-K350 VanDerWaalsContact O-N 3.08Å
347	T	77.2	Confident	77.3	Confident	72 Å²	72	59.3 Å²	59.3	44%	0.442	32%	0.319	S	S	.	.	H	α-helix	trans	-56.2	-41.5	-175.3	59.6	0	0	0	0	114.8	N344 I349 K350 T351	N344-T347 HydrophobicContact CB-CG2 4.21Å; N344-T347 PolarHBondContact O-N 3.39Å; N344-T347 PolarHBondContact O-OG1 3.38Å; T347-I349 VanDerWaalsContact C-N 3.28Å; T347-I349 PolarHBondContact O-N 3.5Å; T347-K350 PolarHBondContact O-N 3.33Å; T347-T351 WeakPolarHBondContact O-CG2 3.31Å; T347-T351 PolarHBondContact O-N 3.03Å; T347-T351 PolarHBondContact O-OG1 3.14Å; T347-T351 VanDerWaalsContact O-OG1 3.08Å
348	P	76.7	Confident	76.8	Confident	41 Å²	41	62.4 Å²	62.4	27%	0.266	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-29.8	178.9	26.2	-36	0	0	0	113.3	I346 T351 A352	I346-P348 VanDerWaalsContact C-CD 3.5Å; P348-T351 WeakPolarHBondContact CA-OG1 3.41Å; P348-T351 PolarHBondContact O-OG1 3.14Å; P348-A352 VanDerWaalsContact O-CB 3.29Å; P348-A352 WeakPolarHBondContact O-CB 3.24Å; P348-A352 PolarHBondContact O-N 3.14Å
349	I	78.7	Confident	75.6	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-72.9	-44.9	175.8	-62.8	165.1	0	0	0	109.4	V238 E239 W242 I346 T347 T351 A352 L353 E410	V238-I349 HydrophobicContact CG1-CD1 4.16Å; E239-I349 HydrophobicContact CB-CG2 4.43Å; W242-I349 HydrophobicContact CD2-CD1 4.4Å; W242-I349 HydrophobicContact CE3-CD1 3.92Å; I346-I349 PolarHBondContact O-N 2.62Å; I346-I349 VanDerWaalsContact O-N 3.11Å; T347-I349 VanDerWaalsContact C-N 3.28Å; T347-I349 PolarHBondContact O-N 3.5Å; I349-T351 PolarHBondContact O-N 2.8Å; I349-A352 PolarHBondContact O-N 2.67Å; I349-L353 WeakPolarHBondContact O-CB 3.38Å; I349-L353 PolarHBondContact O-N 3.37Å; I349-E410 HydrophobicContact CG1-CG 4.21Å
350	K	81.6	Confident	74.6	Confident	97 Å²	97	57.2 Å²	57.2	42%	0.422	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-38.4	176.5	-74.9	-167.7	171.3	-165.3	0	113.1	E239 I346 T347 L353 T354	E239-K350 WeakPolarHBondContact OE1-CE 3.46Å; E239-K350 IonicContact OE1-NZ 2.67Å; E239-K350 PolarHBondContact OE1-NZ 2.88Å; I346-K350 HydrophobicContact CG2-CD 3.95Å; I346-K350 HydrophobicContact CG2-CG 3.92Å; I346-K350 PolarHBondContact O-N 3.37Å; I346-K350 VanDerWaalsContact O-N 3.08Å; T347-K350 PolarHBondContact O-N 3.33Å; K350-L353 PolarHBondContact O-N 2.94Å; K350-T354 WeakPolarHBondContact O-CG2 3.33Å; K350-T354 PolarHBondContact O-N 3.38Å; K350-T354 PolarHBondContact O-OG1 3.24Å
351	T	81.7	Confident	73.5	Confident	81 Å²	81	62.2 Å²	62.2	50%	0.497	34%	0.34	S	S	.	.	H	α-helix	trans	-71.7	-32.9	174.8	54.4	0	0	0	0	112.8	T347 P348 I349 T354 T355	T347-T351 WeakPolarHBondContact O-CG2 3.31Å; T347-T351 PolarHBondContact O-N 3.03Å; T347-T351 PolarHBondContact O-OG1 3.14Å; T347-T351 VanDerWaalsContact O-OG1 3.08Å; P348-T351 WeakPolarHBondContact CA-OG1 3.41Å; P348-T351 PolarHBondContact O-OG1 3.14Å; I349-T351 PolarHBondContact O-N 2.8Å; T351-T354 WeakPolarHBondContact CA-OG1 3.3Å; T351-T354 PolarHBondContact O-OG1 2.9Å; T351-T355 WeakPolarHBondContact O-CB 3.38Å; T351-T355 VanDerWaalsContact O-CG2 3.31Å; T351-T355 WeakPolarHBondContact O-CG2 3.34Å; T351-T355 PolarHBondContact O-N 3.01Å; T351-T355 PolarHBondContact O-OG1 2.89Å
352	A	77.8	Confident	72	Confident	16 Å²	16	61.6 Å²	61.6	13%	0.132	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-41.2	171.1	0	0	0	0	0	111.4	F235 P348 I349 T355 F356 F406	F235-A352 HydrophobicContact CE1-CB 3.88Å; F235-A352 HydrophobicContact CZ-CB 4.15Å; P348-A352 VanDerWaalsContact O-CB 3.29Å; P348-A352 WeakPolarHBondContact O-CB 3.24Å; P348-A352 PolarHBondContact O-N 3.14Å; I349-A352 PolarHBondContact O-N 2.67Å; A352-T355 PolarHBondContact O-OG1 3.49Å; A352-T355 VanDerWaalsContact O-OG1 3.11Å; A352-F356 WeakPolarHBondContact O-CB 3.44Å; A352-F356 PolarHBondContact O-N 2.97Å; A352-F406 HydrophobicContact CB-CD1 3.82Å; A352-F406 HydrophobicContact CB-CE1 3.47Å; A352-F406 VanDerWaalsContact CB-CE1 3.47Å; A352-F406 HydrophobicContact CB-CG 4.47Å; A352-F406 HydrophobicContact CB-CZ 3.85Å
353	L	79.7	Confident	70.7	Confident	27 Å²	27	58 Å²	58	14%	0.141	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-47.9	176.1	-175.2	62	0	0	0	112.3	M232 F235 I349 K350 F356 L357	M232-L353 HydrophobicContact CE-CD1 3.45Å; M232-L353 VanDerWaalsContact CE-CD1 3.45Å; M232-L353 HydrophobicContact CE-CG 4.45Å; M232-L353 HydrophobicContact SD-CD1 3.63Å; F235-L353 HydrophobicContact CB-CD1 3.8Å; F235-L353 HydrophobicContact CD2-CD1 4.07Å; F235-L353 HydrophobicContact CG-CD1 3.99Å; I349-L353 WeakPolarHBondContact O-CB 3.38Å; I349-L353 PolarHBondContact O-N 3.37Å; K350-L353 PolarHBondContact O-N 2.94Å; L353-F356 PolarHBondContact O-N 3Å; L353-L357 HydrophobicContact CG-CD1 4.37Å; L353-L357 WeakPolarHBondContact O-CB 3.31Å; L353-L357 PolarHBondContact O-N 3.23Å
354	T	79.9	Confident	69.3	Low	72 Å²	72	59.3 Å²	59.3	44%	0.442	33%	0.326	S	S	.	.	H	α-helix	trans	-68.4	-37.9	179.4	56	0	0	0	0	112.5	K350 T351 F356 L357 Q358	K350-T354 WeakPolarHBondContact O-CG2 3.33Å; K350-T354 PolarHBondContact O-N 3.38Å; K350-T354 PolarHBondContact O-OG1 3.24Å; T351-T354 WeakPolarHBondContact CA-OG1 3.3Å; T351-T354 PolarHBondContact O-OG1 2.9Å; T354-F356 VanDerWaalsContact C-N 3.35Å; T354-L357 PolarHBondContact O-N 3.35Å; T354-Q358 WeakPolarHBondContact O-CB 3.16Å; T354-Q358 PolarHBondContact O-N 2.99Å
355	T	80.3	Confident	68	Low	92 Å²	92	61.6 Å²	61.6	56%	0.564	33%	0.333	S	S	*	.	H	α-helix	trans	-67	-34.7	174.5	50.7	0	0	0	0	112.5	T351 A352 S359	T351-T355 WeakPolarHBondContact O-CB 3.38Å; T351-T355 VanDerWaalsContact O-CG2 3.31Å; T351-T355 WeakPolarHBondContact O-CG2 3.34Å; T351-T355 PolarHBondContact O-N 3.01Å; T351-T355 PolarHBondContact O-OG1 2.89Å; A352-T355 PolarHBondContact O-OG1 3.49Å; A352-T355 VanDerWaalsContact O-OG1 3.11Å; T355-S359 WeakPolarHBondContact O-CB 3.4Å; T355-S359 PolarHBondContact O-N 3.48Å
356	F	75.5	Confident	66.4	Low	20 Å²	20	68.1 Å²	68.1	9%	0.088	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-47.3	171.8	-172.2	-91.9	0	0	0	111.7	N231 M232 F235 A352 L353 T354 K399 A403	N231-F356 HydrophobicContact CB-CZ 4.12Å; M232-F356 HydrophobicContact CG-CD1 4.36Å; M232-F356 HydrophobicContact CG-CE1 4.11Å; M232-F356 HydrophobicContact SD-CD1 3.62Å; M232-F356 HydrophobicContact SD-CE1 3.99Å; F235-F356 HydrophobicContact CE2-CB 4.26Å; F235-F356 HydrophobicContact CE2-CG 4.26Å; A352-F356 WeakPolarHBondContact O-CB 3.44Å; A352-F356 PolarHBondContact O-N 2.97Å; L353-F356 PolarHBondContact O-N 3Å; T354-F356 VanDerWaalsContact C-N 3.35Å; F356-K399 HydrophobicContact CD2-CD 4.41Å; F356-K399 HydrophobicContact CD2-CG 4.06Å; F356-K399 HydrophobicContact CE2-CD 4.3Å; F356-K399 HydrophobicContact CE2-CG 3.96Å; F356-K399 VanDerWaalsContact O-CE 3.26Å; F356-K399 WeakPolarHBondContact O-CE 3.42Å; F356-K399 PolarHBondContact O-NZ 3.28Å; F356-A403 HydrophobicContact CD2-CB 3.77Å; F356-A403 HydrophobicContact CE2-CB 3.83Å
357	L	74	Confident	64.8	Low	82 Å²	82	72.6 Å²	72.6	43%	0.429	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-54.2	177.3	-82.7	171.8	0	0	0	112.9	M232 L353 T354 S359 N360	M232-L357 HydrophobicContact CE-CD1 3.95Å; M232-L357 HydrophobicContact CE-CD2 3.55Å; M232-L357 HydrophobicContact CE-CG 3.71Å; M232-L357 HydrophobicContact SD-CD2 4.06Å; M232-L357 HydrophobicContact SD-CG 4.12Å; L353-L357 HydrophobicContact CG-CD1 4.37Å; L353-L357 WeakPolarHBondContact O-CB 3.31Å; L353-L357 PolarHBondContact O-N 3.23Å; T354-L357 PolarHBondContact O-N 3.35Å; L357-S359 VanDerWaalsContact C-N 3.29Å; L357-S359 PolarHBondContact O-N 2.93Å; L357-N360 WeakPolarHBondContact O-CB 3.38Å; L357-N360 PolarHBondContact O-N 2.82Å
358	Q	69.3	Low	63	Low	125 Å²	125	76.6 Å²	76.6	58%	0.584	39%	0.394	S	S	*	.	H	α-helix	trans	-62.4	-38.2	-171.7	-174.5	166.5	-15.6	0	0	111.7	T354 N360 N361 D362	T354-Q358 WeakPolarHBondContact O-CB 3.16Å; T354-Q358 PolarHBondContact O-N 2.99Å; Q358-N360 PolarHBondContact O-N 3.44Å; Q358-N361 PolarHBondContact O-N 3.03Å; Q358-D362 PolarHBondContact O-N 3.47Å
359	S	55.9	Low	61.4	Low	44 Å²	44	79.8 Å²	79.8	31%	0.308	41%	0.408	S	S	.	.	H	α-helix	trans	-61.7	-22.6	174.5	157.2	0	0	0	0	114.1	T355 L357 N361 I363 K399	T355-S359 WeakPolarHBondContact O-CB 3.4Å; T355-S359 PolarHBondContact O-N 3.48Å; L357-S359 VanDerWaalsContact C-N 3.29Å; L357-S359 PolarHBondContact O-N 2.93Å; S359-N361 VanDerWaalsContact C-N 3.3Å; S359-I363 WeakPolarHBondContact O-CD1 3.34Å; S359-I363 WeakPolarHBondContact O-CG1 3.45Å; S359-I363 PolarHBondContact O-N 3.27Å; S359-K399 VanDerWaalsContact CB-NZ 3.26Å; S359-K399 WeakPolarHBondContact OG-CE 3.38Å; S359-K399 PolarHBondContact OG-NZ 3.05Å
360	N	55.9	Low	59.5	Low	56 Å²	56	85 Å²	85	30%	0.299	44%	0.439	S	S	.	.	H	α-helix	trans	-67.8	-33.4	171.9	-80.3	20.9	0	0	0	111.5	L357 Q358 K399	L357-N360 WeakPolarHBondContact O-CB 3.38Å; L357-N360 PolarHBondContact O-N 2.82Å; Q358-N360 PolarHBondContact O-N 3.44Å; N360-K399 PolarHBondContact OD1-NZ 3.05Å
361	N	50.6	Low	57.6	Low	108 Å²	108	88.7 Å²	88.7	58%	0.578	46%	0.456	S	S	*	.	H	α-helix	trans	-84.1	-12.6	-176.8	-60.8	-13.3	0	0	0	113.7	Q358 S359 K365	Q358-N361 PolarHBondContact O-N 3.03Å; S359-N361 VanDerWaalsContact C-N 3.3Å; N361-K365 WeakPolarHBondContact O-CE 3.47Å
362	D	48.7	Very low	55.4	Low	54 Å²	54	89.2 Å²	89.2	29%	0.289	46%	0.463	S	S	.	.	H	α-helix	trans	-100.3	-19.5	-178.9	-69	-40	0	0	0	112.9	Q358 D364 K365 E366	Q358-D362 PolarHBondContact O-N 3.47Å; D362-D364 VanDerWaalsContact C-N 3.26Å; D362-D364 PolarHBondContact O-N 3.29Å; D362-K365 WeakPolarHBondContact O-CA 3.17Å; D362-K365 WeakPolarHBondContact O-CB 3.48Å; D362-K365 PolarHBondContact O-N 3.2Å; D362-K365 WeakPolarHBondContact OD1-CD 3.4Å; D362-K365 WeakPolarHBondContact OD1-CE 3.29Å; D362-K365 IonicContact OD1-NZ 2.69Å; D362-K365 PolarHBondContact OD1-NZ 3.06Å; D362-E366 PolarHBondContact O-N 2.83Å
363	I	49.7	Very low	53.2	Low	57 Å²	57	95.7 Å²	95.7	29%	0.292	49%	0.494	S	S	.	.	H	α-helix	trans	-58.4	-41.2	168.1	-70.4	162.8	0	0	0	110.4	S359 K365 E366 F367	S359-I363 WeakPolarHBondContact O-CD1 3.34Å; S359-I363 WeakPolarHBondContact O-CG1 3.45Å; S359-I363 PolarHBondContact O-N 3.27Å; I363-K365 PolarHBondContact O-N 2.92Å; I363-K365 VanDerWaalsContact O-N 3.13Å; I363-E366 PolarHBondContact O-N 3.47Å; I363-F367 PolarHBondContact O-N 2.92Å
364	D	45.2	Very low	51	Low	119 Å²	119	98 Å²	98	64%	0.636	52%	0.524	S	S	*	.	H	α-helix	trans	-63.4	-12.4	172.9	-77.3	-19.5	0	0	0	113.9	D362 F368	D362-D364 VanDerWaalsContact C-N 3.26Å; D362-D364 PolarHBondContact O-N 3.29Å; D364-F368 VanDerWaalsContact O-CD2 3.25Å; D364-F368 WeakPolarHBondContact O-CD2 3.33Å
365	K	42.2	Very low	48.6	Very low	109 Å²	109	104.7 Å²	104.7	47%	0.474	55%	0.547	S	S	.	.	H	α-helix	trans	-102.9	-42	177.7	-60.4	177	-161.1	150.2	0	112.3	N361 D362 I363 F367 F368 I369	N361-K365 WeakPolarHBondContact O-CE 3.47Å; D362-K365 WeakPolarHBondContact O-CA 3.17Å; D362-K365 WeakPolarHBondContact O-CB 3.48Å; D362-K365 PolarHBondContact O-N 3.2Å; D362-K365 WeakPolarHBondContact OD1-CD 3.4Å; D362-K365 WeakPolarHBondContact OD1-CE 3.29Å; D362-K365 IonicContact OD1-NZ 2.69Å; D362-K365 PolarHBondContact OD1-NZ 3.06Å; I363-K365 PolarHBondContact O-N 2.92Å; I363-K365 VanDerWaalsContact O-N 3.13Å; K365-F367 VanDerWaalsContact C-N 3.26Å; K365-F367 PolarHBondContact O-N 2.74Å; K365-F368 PolarHBondContact O-N 3.23Å; K365-I369 HydrophobicContact CB-CD1 4.44Å; K365-I369 WeakPolarHBondContact O-CG1 3.41Å; K365-I369 PolarHBondContact O-N 2.81Å
366	E	38.3	Very low	46.1	Very low	139 Å²	139	107.6 Å²	107.6	65%	0.65	56%	0.558	S	S	*	*	H	α-helix	trans	-61.8	-34.9	176.7	-70.2	-163.8	118	0	0	112	D362 I363 F368 I369 T370	D362-E366 PolarHBondContact O-N 2.83Å; I363-E366 PolarHBondContact O-N 3.47Å; E366-F368 PolarHBondContact O-N 2.98Å; E366-I369 PolarHBondContact O-N 2.99Å; E366-T370 WeakPolarHBondContact O-CG2 3.4Å; E366-T370 PolarHBondContact O-N 3.32Å; E366-T370 PolarHBondContact O-OG1 2.73Å
367	F	41.5	Very low	44.1	Very low	112 Å²	112	113.7 Å²	113.7	49%	0.491	59%	0.592	S	S	.	*	H	α-helix	trans	-65.8	-17	172.2	-105.5	-80.2	0	0	0	114.7	I363 K365 A392	I363-F367 PolarHBondContact O-N 2.92Å; K365-F367 VanDerWaalsContact C-N 3.26Å; K365-F367 PolarHBondContact O-N 2.74Å; F367-A392 HydrophobicContact CE2-CB 4.32Å
368	F	40.5	Very low	42	Very low	156 Å²	156	116.3 Å²	116.3	68%	0.684	61%	0.606	S	S	*	*	H	α-helix	trans	-99.2	-31.2	173.3	-82.5	-101.3	0	0	0	112.8	D364 K365 E366 K371	D364-F368 VanDerWaalsContact O-CD2 3.25Å; D364-F368 WeakPolarHBondContact O-CD2 3.33Å; K365-F368 PolarHBondContact O-N 3.23Å; E366-F368 PolarHBondContact O-N 2.98Å; F368-K371 VanDerWaalsContact O-CB 3.28Å; F368-K371 WeakPolarHBondContact O-CB 3.44Å; F368-K371 PolarHBondContact O-N 2.99Å
369	I	42.1	Very low	40.1	Very low	108 Å²	108	116.7 Å²	116.7	55%	0.554	62%	0.617	S	S	*	*	H	α-helix	trans	-73.6	-36.7	179.3	-67	165.6	0	0	0	111	K365 E366 K371 S372	K365-I369 HydrophobicContact CB-CD1 4.44Å; K365-I369 WeakPolarHBondContact O-CG1 3.41Å; K365-I369 PolarHBondContact O-N 2.81Å; E366-I369 PolarHBondContact O-N 2.99Å; I369-K371 PolarHBondContact O-N 3.42Å; I369-S372 PolarHBondContact O-N 3.38Å; I369-S372 PolarHBondContact O-OG 3.44Å
370	T	38.2	Very low	38.9	Very low	110 Å²	110	122.2 Å²	122.2	68%	0.675	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-7.6	171.5	46.9	0	0	0	0	114.2	E366	E366-T370 WeakPolarHBondContact O-CG2 3.4Å; E366-T370 PolarHBondContact O-N 3.32Å; E366-T370 PolarHBondContact O-OG1 2.73Å
371	K	43.1	Very low	37.6	Very low	176 Å²	176	127.2 Å²	127.2	77%	0.765	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-1.4	179.5	-153.7	171.3	-176.2	172.8	0	114.4	F368 I369	F368-K371 VanDerWaalsContact O-CB 3.28Å; F368-K371 WeakPolarHBondContact O-CB 3.44Å; F368-K371 PolarHBondContact O-N 2.99Å; I369-K371 PolarHBondContact O-N 3.42Å
372	S	34.1	Very low	36.6	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	68%	0.68	S	S	*	*	S	Bend	trans	-119.6	-5.3	-173.3	68.1	0	0	0	0	116.2	I369	I369-S372 PolarHBondContact O-N 3.38Å; I369-S372 PolarHBondContact O-OG 3.44Å
373	I	32.2	Very low	35.7	Very low	152 Å²	152	135.1 Å²	135.1	78%	0.779	70%	0.701	S	S	*	*			trans	-125.5	94.4	-179.3	-55.8	-178.3	0	0	0	110.3
374	G	33.6	Very low	35	Very low	75 Å²	75	135.8 Å²	135.8	77%	0.773	71%	0.711	S	S	*	*			trans	179.3	113	173	0	0	0	0	0	111	L376	G374-L376 PolarHBondContact O-N 3.19Å
375	K	30.3	Very low	35	Very low	213 Å²	213	135 Å²	135	93%	0.926	72%	0.715	S	S	*	*			trans	-69.2	125.3	169.5	-79.7	-174.3	175.2	-178.1	0	108.4	N377	K375-N377 PolarHBondContact O-N 2.7Å
376	L	27.7	Very low	35.3	Very low	152 Å²	152	133.3 Å²	133.3	80%	0.796	71%	0.714	S	S	*	*			trans	-77.2	108.8	176.7	-165.2	166.5	0	0	0	108.8	G374	G374-L376 PolarHBondContact O-N 3.19Å
377	N	32.1	Very low	36.1	Very low	149 Å²	149	130.2 Å²	130.2	80%	0.797	71%	0.708	S	S	*	*			trans	-128.9	154.2	160.2	-100.2	36.3	0	0	0	107.3	K375	K375-N377 PolarHBondContact O-N 2.7Å
378	D	31.3	Very low	36.2	Very low	136 Å²	136	131.7 Å²	131.7	73%	0.727	71%	0.714	S	S	*	*			trans	-76.3	176.1	-156.2	-56.2	-85.3	0	0	0	116.6
379	T	29.9	Very low	36.7	Very low	133 Å²	133	131.2 Å²	131.2	82%	0.816	71%	0.712	S	S	*	*			trans	93.7	50	167.2	-28	0	0	0	0	117.8
380	L	29	Very low	37.1	Very low	160 Å²	160	130.4 Å²	130.4	84%	0.838	71%	0.709	S	S	*	*			trans	-154.4	104.2	132	-143.9	77.1	0	0	0	112.6
381	M	28.5	Very low	38	Very low	162 Å²	162	130.3 Å²	130.3	80%	0.798	70%	0.703	S	S	*	*			trans	-92.9	144.9	168.1	-87.4	-73.2	-157.6	0	0	110.2
382	Y	30.5	Very low	38.7	Very low	221 Å²	221	123.7 Å²	123.7	87%	0.867	68%	0.682	S	S	*	*			trans	58.3	82.4	174	-59.5	-75.8	0	0	0	117.1
383	S	28.7	Very low	40.3	Very low	106 Å²	106	123.5 Å²	123.5	74%	0.741	67%	0.672	S	S	*	*			trans	-128.1	152.4	149.1	-171.6	0	0	0	0	109.6
384	S	35.9	Very low	42.2	Very low	71 Å²	71	119.9 Å²	119.9	50%	0.497	66%	0.658	S	S	.	*			trans	-80.8	152.2	-161.8	52.2	0	0	0	0	114.7	T386	S384-T386 PolarHBondContact O-N 3.22Å; S384-T386 PolarHBondContact OG-OG1 3.26Å
385	S	45.8	Very low	44.1	Very low	103 Å²	103	120.3 Å²	120.3	72%	0.72	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	16.9	177.3	51.6	0	0	0	0	115.3
386	T	48.3	Very low	46.1	Very low	73 Å²	73	115.2 Å²	115.2	45%	0.448	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.1	-52.3	176	46.5	0	0	0	0	111.3	S384 F388 K389 D390	S384-T386 PolarHBondContact O-N 3.22Å; S384-T386 PolarHBondContact OG-OG1 3.26Å; T386-F388 PolarHBondContact O-N 2.61Å; T386-K389 WeakPolarHBondContact O-CA 3.48Å; T386-K389 WeakPolarHBondContact O-CB 3.38Å; T386-K389 PolarHBondContact O-N 2.94Å; T386-D390 VanDerWaalsContact C-OD2 3.27Å; T386-D390 PolarHBondContact O-N 3.03Å; T386-D390 VanDerWaalsContact O-N 3.13Å
387	S	55.3	Low	48.4	Very low	75 Å²	75	110.7 Å²	110.7	52%	0.524	60%	0.599	S	S	.	*	H	α-helix	trans	-54.8	-32.2	-169.5	-176.5	0	0	0	0	115	L391	S387-L391 WeakPolarHBondContact O-CB 3.23Å; S387-L391 PolarHBondContact O-N 3.09Å
388	F	42.3	Very low	50.5	Low	143 Å²	143	109.9 Å²	109.9	63%	0.627	59%	0.589	S	S	*	*	H	α-helix	trans	-75.9	-29.3	177	-76.9	-79.5	0	0	0	113.5	T386 A392	T386-F388 PolarHBondContact O-N 2.61Å; F388-A392 PolarHBondContact O-N 3.2Å
389	K	51.9	Low	52.7	Low	146 Å²	146	105 Å²	105	64%	0.635	56%	0.561	S	S	*	*	H	α-helix	trans	-72.5	-45.8	173	-65.3	-173.7	176.1	-173.1	0	110.3	T386 L391 A392 I393	T386-K389 WeakPolarHBondContact O-CA 3.48Å; T386-K389 WeakPolarHBondContact O-CB 3.38Å; T386-K389 PolarHBondContact O-N 2.94Å; K389-L391 VanDerWaalsContact C-N 3.29Å; K389-L391 PolarHBondContact O-N 3.02Å; K389-A392 PolarHBondContact O-N 2.89Å; K389-A392 VanDerWaalsContact O-N 3.15Å; K389-I393 VanDerWaalsContact O-CG1 3.29Å; K389-I393 WeakPolarHBondContact O-CG1 3.48Å; K389-I393 PolarHBondContact O-N 3.31Å
390	D	49.9	Very low	55.1	Low	91 Å²	91	100.2 Å²	100.2	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-58.6	-43.6	179.9	-52.2	-34.4	0	0	0	110.6	T386 I393 T394	T386-D390 VanDerWaalsContact C-OD2 3.27Å; T386-D390 PolarHBondContact O-N 3.03Å; T386-D390 VanDerWaalsContact O-N 3.13Å; D390-I393 PolarHBondContact O-N 2.96Å; D390-T394 WeakPolarHBondContact O-CG2 3.39Å; D390-T394 PolarHBondContact O-N 3.15Å
391	L	57.2	Low	57.6	Low	107 Å²	107	95.6 Å²	95.6	56%	0.56	52%	0.515	S	S	*	.	H	α-helix	trans	-61.7	-47.1	174.8	-172.8	63.9	0	0	0	112.4	S387 K389 I393 T394 V395	S387-L391 WeakPolarHBondContact O-CB 3.23Å; S387-L391 PolarHBondContact O-N 3.09Å; K389-L391 VanDerWaalsContact C-N 3.29Å; K389-L391 PolarHBondContact O-N 3.02Å; L391-I393 VanDerWaalsContact C-N 3.34Å; L391-I393 PolarHBondContact O-N 3.38Å; L391-T394 PolarHBondContact O-N 3.45Å; L391-T394 PolarHBondContact O-OG1 2.89Å; L391-V395 WeakPolarHBondContact O-CG2 3.32Å; L391-V395 PolarHBondContact O-N 2.96Å; L391-V395 VanDerWaalsContact O-N 3.16Å
392	A	58.6	Low	60.2	Low	38 Å²	38	95.9 Å²	95.9	31%	0.314	51%	0.512	S	S	.	.	H	α-helix	trans	-60.1	-42.6	178.6	0	0	0	0	0	112.3	F367 F388 K389 V395 E396	F367-A392 HydrophobicContact CE2-CB 4.32Å; F388-A392 PolarHBondContact O-N 3.2Å; K389-A392 PolarHBondContact O-N 2.89Å; K389-A392 VanDerWaalsContact O-N 3.15Å; A392-V395 PolarHBondContact O-N 3.21Å; A392-E396 PolarHBondContact O-N 3.07Å; A392-E396 VanDerWaalsContact O-N 3.09Å
393	I	66.7	Low	62.9	Low	87 Å²	87	85.7 Å²	85.7	45%	0.446	47%	0.473	S	S	.	.	H	α-helix	trans	-59.8	-47.6	176.1	-67.4	162.4	0	0	0	110.5	K389 D390 L391 V395 E396 E397	K389-I393 VanDerWaalsContact O-CG1 3.29Å; K389-I393 WeakPolarHBondContact O-CG1 3.48Å; K389-I393 PolarHBondContact O-N 3.31Å; D390-I393 PolarHBondContact O-N 2.96Å; L391-I393 VanDerWaalsContact C-N 3.34Å; L391-I393 PolarHBondContact O-N 3.38Å; I393-V395 VanDerWaalsContact C-N 3.28Å; I393-V395 PolarHBondContact O-N 3.47Å; I393-E396 PolarHBondContact O-N 3.44Å; I393-E397 HydrophobicContact CG2-CG 4.36Å; I393-E397 WeakPolarHBondContact O-CG 3.38Å; I393-E397 PolarHBondContact O-N 3.39Å
394	T	73.2	Confident	65.6	Low	77 Å²	77	81.7 Å²	81.7	47%	0.472	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-30.7	179.2	61.1	0	0	0	0	113.9	D390 L391 K398	D390-T394 WeakPolarHBondContact O-CG2 3.39Å; D390-T394 PolarHBondContact O-N 3.15Å; L391-T394 PolarHBondContact O-N 3.45Å; L391-T394 PolarHBondContact O-OG1 2.89Å; T394-K398 WeakPolarHBondContact O-CB 3.46Å; T394-K398 PolarHBondContact O-N 2.92Å
395	V	73	Confident	68	Low	84 Å²	84	83.4 Å²	83.4	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-70.5	-44.5	175.3	173.1	0	0	0	0	110.9	L391 A392 I393 K398 K399	L391-V395 WeakPolarHBondContact O-CG2 3.32Å; L391-V395 PolarHBondContact O-N 2.96Å; L391-V395 VanDerWaalsContact O-N 3.16Å; A392-V395 PolarHBondContact O-N 3.21Å; I393-V395 VanDerWaalsContact C-N 3.28Å; I393-V395 PolarHBondContact O-N 3.47Å; V395-K398 PolarHBondContact O-N 3.37Å; V395-K399 WeakPolarHBondContact O-CB 3.34Å; V395-K399 PolarHBondContact O-N 3Å
396	E	71.4	Confident	70	Confident	106 Å²	106	81.4 Å²	81.4	50%	0.495	43%	0.425	S	S	.	.	H	α-helix	trans	-66	-39.6	176.4	-169.3	169.8	-161.5	0	0	111.9	A392 I393 K399 A400	A392-E396 PolarHBondContact O-N 3.07Å; A392-E396 VanDerWaalsContact O-N 3.09Å; I393-E396 PolarHBondContact O-N 3.44Å; E396-K399 WeakPolarHBondContact O-CB 3.2Å; E396-K399 PolarHBondContact O-N 3.13Å; E396-A400 WeakPolarHBondContact O-CB 3.39Å; E396-A400 PolarHBondContact O-N 3.41Å
397	E	76.1	Confident	71.9	Confident	57 Å²	57	78 Å²	78	27%	0.266	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-47.4	172.6	-75	-173.3	-167.3	0	0	112.5	I393 K399 A400 C401 T1445	I393-E397 HydrophobicContact CG2-CG 4.36Å; I393-E397 WeakPolarHBondContact O-CG 3.38Å; I393-E397 PolarHBondContact O-N 3.39Å; E397-K399 VanDerWaalsContact C-N 3.29Å; E397-K399 PolarHBondContact O-N 3.25Å; E397-A400 PolarHBondContact O-N 3.16Å; E397-C401 WeakPolarHBondContact O-CB 3.43Å; E397-C401 PolarHBondContact O-N 3.36Å; E397-T1445 HydrophobicContact CG-CG2 4.01Å; E397-T1445 WeakPolarHBondContact OE1-CB 3.41Å; E397-T1445 WeakPolarHBondContact OE1-CG2 3.46Å; E397-T1445 WeakPolarHBondContact OE2-CB 3.4Å
398	K	77.7	Confident	73.6	Confident	132 Å²	132	75.7 Å²	75.7	57%	0.574	39%	0.385	S	S	*	.	H	α-helix	trans	-61.6	-38.3	177.6	-173	176.9	178	-177	0	111.3	T394 V395 K402 E1584	T394-K398 WeakPolarHBondContact O-CB 3.46Å; T394-K398 PolarHBondContact O-N 2.92Å; V395-K398 PolarHBondContact O-N 3.37Å; K398-K402 WeakPolarHBondContact O-CB 3.2Å; K398-K402 PolarHBondContact O-N 3.1Å; K398-E1584 IonicContact NZ-OE1 3.34Å; K398-E1584 PolarHBondContact NZ-OE1 3.03Å
399	K	76.8	Confident	75.8	Confident	33 Å²	33	70.9 Å²	70.9	14%	0.143	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-46.4	173.4	179.2	-175.5	174	178.1	0	112	F356 S359 N360 V395 E396 E397 C401 K402 A403	F356-K399 HydrophobicContact CD2-CD 4.41Å; F356-K399 HydrophobicContact CD2-CG 4.06Å; F356-K399 HydrophobicContact CE2-CD 4.3Å; F356-K399 HydrophobicContact CE2-CG 3.96Å; F356-K399 VanDerWaalsContact O-CE 3.26Å; F356-K399 WeakPolarHBondContact O-CE 3.42Å; F356-K399 PolarHBondContact O-NZ 3.28Å; S359-K399 VanDerWaalsContact CB-NZ 3.26Å; S359-K399 WeakPolarHBondContact OG-CE 3.38Å; S359-K399 PolarHBondContact OG-NZ 3.05Å; N360-K399 PolarHBondContact OD1-NZ 3.05Å; V395-K399 WeakPolarHBondContact O-CB 3.34Å; V395-K399 PolarHBondContact O-N 3Å; E396-K399 WeakPolarHBondContact O-CB 3.2Å; E396-K399 PolarHBondContact O-N 3.13Å; E397-K399 VanDerWaalsContact C-N 3.29Å; E397-K399 PolarHBondContact O-N 3.25Å; K399-C401 PolarHBondContact O-N 3.21Å; K399-K402 PolarHBondContact O-N 3.48Å; K399-A403 PolarHBondContact O-N 2.77Å
400	A	79.6	Confident	77.6	Confident	32 Å²	32	64.3 Å²	64.3	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-40.7	179.3	0	0	0	0	0	112.2	N231 E396 E397 A403 D404	N231-A400 WeakPolarHBondContact ND2-CA 3.49Å; N231-A400 PolarHBondContact ND2-O 2.96Å; E396-A400 WeakPolarHBondContact O-CB 3.39Å; E396-A400 PolarHBondContact O-N 3.41Å; E397-A400 PolarHBondContact O-N 3.16Å; A400-A403 PolarHBondContact O-N 3.48Å; A400-D404 PolarHBondContact O-N 3.33Å
401	C	81.8	Confident	79.5	Confident	64 Å²	64	60 Å²	60	43%	0.432	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-45.1	173.9	-177.8	0	0	0	0	112.1	E397 K399 A403 D404 L405	E397-C401 WeakPolarHBondContact O-CB 3.43Å; E397-C401 PolarHBondContact O-N 3.36Å; K399-C401 PolarHBondContact O-N 3.21Å; C401-A403 VanDerWaalsContact C-N 3.29Å; C401-A403 PolarHBondContact O-N 3.5Å; C401-D404 PolarHBondContact O-N 3.27Å; C401-L405 WeakPolarHBondContact O-CG 3.44Å; C401-L405 PolarHBondContact O-N 3.16Å
402	K	83.9	Confident	81	Confident	167 Å²	167	56 Å²	56	73%	0.726	30%	0.3	S	S	*	.	H	α-helix	trans	-60.9	-37.1	176.3	-173	176.7	179.6	-179.7	0	112.5	K398 K399 F406	K398-K402 WeakPolarHBondContact O-CB 3.2Å; K398-K402 PolarHBondContact O-N 3.1Å; K399-K402 PolarHBondContact O-N 3.48Å; K402-F406 PolarHBondContact O-N 3.13Å
403	A	85.9	Confident	82.3	Confident	7 Å²	7	58.6 Å²	58.6	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-49.5	174.6	0	0	0	0	0	112.2	F235 F356 K399 A400 C401 L405 F406 I407	F235-A403 HydrophobicContact CE2-CB 3.91Å; F235-A403 HydrophobicContact CZ-CB 4.15Å; F356-A403 HydrophobicContact CD2-CB 3.77Å; F356-A403 HydrophobicContact CE2-CB 3.83Å; K399-A403 PolarHBondContact O-N 2.77Å; A400-A403 PolarHBondContact O-N 3.48Å; C401-A403 VanDerWaalsContact C-N 3.29Å; C401-A403 PolarHBondContact O-N 3.5Å; A403-L405 PolarHBondContact O-N 3Å; A403-F406 PolarHBondContact O-N 3.39Å; A403-F406 VanDerWaalsContact O-N 3.13Å; A403-I407 WeakPolarHBondContact O-CB 3.39Å; A403-I407 VanDerWaalsContact O-CG1 3.25Å; A403-I407 WeakPolarHBondContact O-CG1 3.31Å; A403-I407 PolarHBondContact O-N 3.49Å
404	D	85.8	Confident	83.3	Confident	22 Å²	22	54.5 Å²	54.5	12%	0.118	28%	0.283	C	S	.	.	H	α-helix	trans	-56.3	-46.6	177.3	173.9	57.5	0	0	0	112.3	A400 C401 F406 I407 K408	A400-D404 PolarHBondContact O-N 3.33Å; C401-D404 PolarHBondContact O-N 3.27Å; D404-F406 VanDerWaalsContact C-N 3.33Å; D404-F406 PolarHBondContact O-N 3.02Å; D404-I407 PolarHBondContact O-N 3.34Å; D404-K408 VanDerWaalsContact CG-NZ 3.33Å; D404-K408 WeakPolarHBondContact O-CB 3.45Å; D404-K408 VanDerWaalsContact O-CG 3.28Å; D404-K408 WeakPolarHBondContact O-CG 3.37Å; D404-K408 PolarHBondContact O-N 3.4Å; D404-K408 WeakPolarHBondContact OD1-CD 3.41Å; D404-K408 WeakPolarHBondContact OD1-CE 3.21Å; D404-K408 IonicContact OD1-NZ 2.67Å; D404-K408 PolarHBondContact OD1-NZ 2.94Å; D404-K408 WeakPolarHBondContact OD2-CE 3.3Å; D404-K408 IonicContact OD2-NZ 3.12Å; D404-K408 PolarHBondContact OD2-NZ 2.97Å
405	L	86.7	Confident	84	Confident	108 Å²	108	50.8 Å²	50.8	57%	0.565	26%	0.261	S	S	*	.	H	α-helix	trans	-59.5	-40.6	175.2	-71.2	172	0	0	0	112.7	C401 A403 S409	C401-L405 WeakPolarHBondContact O-CG 3.44Å; C401-L405 PolarHBondContact O-N 3.16Å; A403-L405 PolarHBondContact O-N 3Å; L405-S409 WeakPolarHBondContact O-CB 3.39Å; L405-S409 PolarHBondContact O-N 3Å; L405-S409 VanDerWaalsContact O-N 3.11Å
406	F	88.6	Confident	84.7	Confident	61 Å²	61	51.2 Å²	51.2	27%	0.268	26%	0.26	S	S	.	.	H	α-helix	trans	-67.2	-48.4	177	179.6	-90	0	0	0	111.9	F235 A352 K402 A403 D404 K408 S409 E410	F235-F406 AromaticContact CE1-CD1 3.88Å; F235-F406 HydrophobicContact CE1-CD1 3.88Å; F235-F406 HydrophobicContact CE1-CE1 4.24Å; F235-F406 HydrophobicContact CZ-CD1 4.45Å; A352-F406 HydrophobicContact CB-CD1 3.82Å; A352-F406 HydrophobicContact CB-CE1 3.47Å; A352-F406 VanDerWaalsContact CB-CE1 3.47Å; A352-F406 HydrophobicContact CB-CG 4.47Å; A352-F406 HydrophobicContact CB-CZ 3.85Å; K402-F406 PolarHBondContact O-N 3.13Å; A403-F406 PolarHBondContact O-N 3.39Å; A403-F406 VanDerWaalsContact O-N 3.13Å; D404-F406 VanDerWaalsContact C-N 3.33Å; D404-F406 PolarHBondContact O-N 3.02Å; F406-K408 PolarHBondContact O-N 3.4Å; F406-S409 WeakPolarHBondContact O-CA 3.46Å; F406-S409 WeakPolarHBondContact O-CB 3.48Å; F406-S409 PolarHBondContact O-N 3.16Å; F406-S409 PolarHBondContact O-OG 3.26Å; F406-E410 HydrophobicContact CE1-CG 3.92Å; F406-E410 HydrophobicContact CE2-CG 4.45Å; F406-E410 HydrophobicContact CZ-CG 3.87Å; F406-E410 PolarHBondContact O-N 3.22Å
407	I	88.1	Confident	85.4	Confident	1 Å²	1	47 Å²	47	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-53.6	-52.7	177.3	-71.3	164.5	0	0	0	110	L234 F235 V238 A403 D404 S409 E410 F411 L457	L234-I407 HydrophobicContact CB-CD1 4.02Å; L234-I407 HydrophobicContact CB-CG2 4.09Å; L234-I407 HydrophobicContact CD2-CG2 4.29Å; F235-I407 HydrophobicContact CD1-CD1 4.15Å; F235-I407 HydrophobicContact CD1-CG1 3.72Å; F235-I407 HydrophobicContact CD2-CD1 3.8Å; F235-I407 HydrophobicContact CD2-CG1 4.28Å; F235-I407 HydrophobicContact CE1-CD1 4.22Å; F235-I407 HydrophobicContact CE1-CG1 3.66Å; F235-I407 HydrophobicContact CE2-CD1 3.87Å; F235-I407 HydrophobicContact CE2-CG1 4.23Å; F235-I407 HydrophobicContact CG-CD1 3.93Å; F235-I407 HydrophobicContact CG-CG1 4.03Å; F235-I407 HydrophobicContact CZ-CD1 4.08Å; F235-I407 HydrophobicContact CZ-CG1 3.92Å; V238-I407 HydrophobicContact CG2-CG2 4Å; A403-I407 WeakPolarHBondContact O-CB 3.39Å; A403-I407 VanDerWaalsContact O-CG1 3.25Å; A403-I407 WeakPolarHBondContact O-CG1 3.31Å; A403-I407 PolarHBondContact O-N 3.49Å; D404-I407 PolarHBondContact O-N 3.34Å; I407-S409 VanDerWaalsContact C-N 3.26Å; I407-S409 PolarHBondContact O-N 3.34Å; I407-E410 PolarHBondContact O-N 2.86Å; I407-F411 WeakPolarHBondContact O-CB 3.13Å; I407-F411 PolarHBondContact O-N 3.39Å; I407-L457 HydrophobicContact CG2-CD1 4.08Å
408	K	90.7	Very high	85.9	Confident	27 Å²	27	44.3 Å²	44.3	12%	0.117	23%	0.228	C	C	.	.	H	α-helix	trans	-56	-40.3	176.2	-75.2	169.5	167.7	166.6	0	112.2	D404 F406 A412 N456 L457 T460	D404-K408 VanDerWaalsContact CG-NZ 3.33Å; D404-K408 WeakPolarHBondContact O-CB 3.45Å; D404-K408 VanDerWaalsContact O-CG 3.28Å; D404-K408 WeakPolarHBondContact O-CG 3.37Å; D404-K408 PolarHBondContact O-N 3.4Å; D404-K408 WeakPolarHBondContact OD1-CD 3.41Å; D404-K408 WeakPolarHBondContact OD1-CE 3.21Å; D404-K408 IonicContact OD1-NZ 2.67Å; D404-K408 PolarHBondContact OD1-NZ 2.94Å; D404-K408 WeakPolarHBondContact OD2-CE 3.3Å; D404-K408 IonicContact OD2-NZ 3.12Å; D404-K408 PolarHBondContact OD2-NZ 2.97Å; F406-K408 PolarHBondContact O-N 3.4Å; K408-A412 WeakPolarHBondContact O-CB 3.32Å; K408-A412 PolarHBondContact O-N 3.22Å; K408-N456 WeakPolarHBondContact CE-OD1 3.24Å; K408-N456 VanDerWaalsContact NZ-CG 3.27Å; K408-N456 PolarHBondContact NZ-ND2 3.25Å; K408-N456 PolarHBondContact NZ-OD1 3.16Å; K408-L457 HydrophobicContact CG-CD1 3.8Å; K408-T460 HydrophobicContact CB-CG2 4.02Å; K408-T460 HydrophobicContact CD-CG2 3.72Å; K408-T460 HydrophobicContact CG-CG2 3.66Å
409	S	88.4	Confident	86.3	Confident	42 Å²	42	40 Å²	40	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-67.3	-36.3	178.4	91.2	0	0	0	0	113.8	L405 F406 I407 K413	L405-S409 WeakPolarHBondContact O-CB 3.39Å; L405-S409 PolarHBondContact O-N 3Å; L405-S409 VanDerWaalsContact O-N 3.11Å; F406-S409 WeakPolarHBondContact O-CA 3.46Å; F406-S409 WeakPolarHBondContact O-CB 3.48Å; F406-S409 PolarHBondContact O-N 3.16Å; F406-S409 PolarHBondContact O-OG 3.26Å; I407-S409 VanDerWaalsContact C-N 3.26Å; I407-S409 PolarHBondContact O-N 3.34Å; S409-K413 WeakPolarHBondContact O-CD 3.49Å; S409-K413 WeakPolarHBondContact O-CE 3.33Å; S409-K413 WeakPolarHBondContact O-CG 3.49Å; S409-K413 PolarHBondContact O-N 2.96Å; S409-K413 PolarHBondContact O-NZ 2.88Å; S409-K413 PolarHBondContact OG-NZ 2.9Å
410	E	88.3	Confident	86.7	Confident	7 Å²	7	39.7 Å²	39.7	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-81.5	-33	176.5	-68.3	-67	120.9	0	0	111.7	V238 R258 I349 F406 I407 K413 L414	V238-E410 HydrophobicContact CG1-CB 4.25Å; R258-E410 IonicContact CZ-OE2 3.82Å; R258-E410 IonicContact NH1-OE2 2.69Å; R258-E410 PolarHBondContact NH1-OE2 3.17Å; R258-E410 VanDerWaalsContact NH1-OE2 3.16Å; R258-E410 IonicContact NH2-OE1 2.62Å; R258-E410 PolarHBondContact NH2-OE1 3.26Å; R258-E410 VanDerWaalsContact NH2-OE1 3.12Å; R258-E410 IonicContact NH2-OE2 2.73Å; R258-E410 PolarHBondContact NH2-OE2 3.4Å; I349-E410 HydrophobicContact CG1-CG 4.21Å; F406-E410 HydrophobicContact CE1-CG 3.92Å; F406-E410 HydrophobicContact CE2-CG 4.45Å; F406-E410 HydrophobicContact CZ-CG 3.87Å; F406-E410 PolarHBondContact O-N 3.22Å; I407-E410 PolarHBondContact O-N 2.86Å; E410-K413 PolarHBondContact O-N 3.39Å; E410-K413 WeakPolarHBondContact OE1-CD 3.41Å; E410-K413 WeakPolarHBondContact OE1-CE 3.26Å; E410-K413 IonicContact OE1-NZ 3.92Å; E410-K413 PolarHBondContact OE1-NZ 2.67Å; E410-L414 WeakPolarHBondContact O-CB 3.23Å; E410-L414 PolarHBondContact O-N 3.22Å
411	F	90.1	Very high	87	Confident	1 Å²	1	38.2 Å²	38.2	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-45.4	170.5	179.9	-103.8	0	0	0	111.9	V238 M241 I407 K413 L414 C415 L457 L458 A464 V466	V238-F411 HydrophobicContact CG2-CB 4.26Å; M241-F411 HydrophobicContact CE-CD2 4.37Å; M241-F411 HydrophobicContact CE-CE2 4.08Å; M241-F411 HydrophobicContact SD-CD2 3.8Å; M241-F411 HydrophobicContact SD-CE2 3.88Å; I407-F411 WeakPolarHBondContact O-CB 3.13Å; I407-F411 PolarHBondContact O-N 3.39Å; F411-K413 PolarHBondContact O-N 2.98Å; F411-L414 PolarHBondContact O-N 2.98Å; F411-C415 PolarHBondContact O-N 3.21Å; F411-C415 PolarHBondContact O-SG 2.75Å; F411-L457 HydrophobicContact CB-CD1 3.81Å; F411-L457 HydrophobicContact CD1-CD1 3.8Å; F411-L457 HydrophobicContact CD1-CG 4.01Å; F411-L457 HydrophobicContact CD2-CD1 4.45Å; F411-L457 HydrophobicContact CD2-CD2 4.35Å; F411-L457 HydrophobicContact CD2-CG 4.4Å; F411-L457 HydrophobicContact CE1-CG 4.27Å; F411-L457 HydrophobicContact CG-CD1 3.76Å; F411-L457 HydrophobicContact CG-CD2 4.45Å; F411-L457 HydrophobicContact CG-CG 4.09Å; F411-L458 HydrophobicContact CE1-CD2 4.31Å; F411-L458 HydrophobicContact CZ-CD2 3.76Å; F411-A464 HydrophobicContact CE1-CB 4.47Å; F411-A464 HydrophobicContact CZ-CB 4.46Å; F411-V466 HydrophobicContact CE2-CG1 4.32Å; F411-V466 HydrophobicContact CE2-CG2 4.08Å; F411-V466 HydrophobicContact CZ-CB 4.27Å; F411-V466 HydrophobicContact CZ-CG1 4.31Å; F411-V466 HydrophobicContact CZ-CG2 3.91Å
412	A	88.6	Confident	87.1	Confident	24 Å²	24	35.5 Å²	35.5	20%	0.198	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-38.5	175.3	0	0	0	0	0	112.6	K408 N416 V461	K408-A412 WeakPolarHBondContact O-CB 3.32Å; K408-A412 PolarHBondContact O-N 3.22Å; A412-N416 WeakPolarHBondContact O-CB 3.33Å; A412-N416 VanDerWaalsContact O-CG 3.29Å; A412-N416 PolarHBondContact O-N 2.96Å; A412-N416 PolarHBondContact O-ND2 2.73Å; A412-N416 VanDerWaalsContact O-ND2 3.15Å; A412-V461 HydrophobicContact CB-CG2 3.72Å
413	K	86.6	Confident	87.1	Confident	92 Å²	92	29.1 Å²	29.1	40%	0.4	15%	0.154	S	C	.	.	H	α-helix	trans	-63.5	-42.5	173.3	-69.1	158.9	-160.2	144.2	0	111.4	S409 E410 F411 L417	S409-K413 WeakPolarHBondContact O-CD 3.49Å; S409-K413 WeakPolarHBondContact O-CE 3.33Å; S409-K413 WeakPolarHBondContact O-CG 3.49Å; S409-K413 PolarHBondContact O-N 2.96Å; S409-K413 PolarHBondContact O-NZ 2.88Å; S409-K413 PolarHBondContact OG-NZ 2.9Å; E410-K413 PolarHBondContact O-N 3.39Å; E410-K413 WeakPolarHBondContact OE1-CD 3.41Å; E410-K413 WeakPolarHBondContact OE1-CE 3.26Å; E410-K413 IonicContact OE1-NZ 3.92Å; E410-K413 PolarHBondContact OE1-NZ 2.67Å; F411-K413 PolarHBondContact O-N 2.98Å; K413-L417 WeakPolarHBondContact O-CB 3.41Å; K413-L417 PolarHBondContact O-N 2.8Å
414	L	88.4	Confident	87	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.8	-47.5	176.8	-85.9	166.5	0	0	0	112.7	V238 M241 W242 L245 E410 F411 N416 L417 S418	V238-L414 HydrophobicContact CG1-CD1 3.93Å; M241-L414 HydrophobicContact CB-CD1 4.27Å; M241-L414 HydrophobicContact CE-CB 3.92Å; M241-L414 HydrophobicContact CG-CD1 4.09Å; M241-L414 HydrophobicContact SD-CB 4.04Å; M241-L414 HydrophobicContact SD-CD1 3.78Å; M241-L414 HydrophobicContact SD-CG 4.48Å; W242-L414 HydrophobicContact CB-CD1 4.47Å; W242-L414 HydrophobicContact CB-CD2 4.35Å; W242-L414 HydrophobicContact CD2-CD2 3.99Å; W242-L414 HydrophobicContact CE3-CD1 4.03Å; W242-L414 HydrophobicContact CE3-CD2 3.44Å; W242-L414 VanDerWaalsContact CE3-CD2 3.44Å; W242-L414 HydrophobicContact CE3-CG 3.73Å; W242-L414 HydrophobicContact CG-CD2 4.45Å; W242-L414 HydrophobicContact CZ3-CD2 3.81Å; W242-L414 HydrophobicContact CZ3-CG 4Å; L245-L414 HydrophobicContact CD2-CD2 3.65Å; E410-L414 WeakPolarHBondContact O-CB 3.23Å; E410-L414 PolarHBondContact O-N 3.22Å; F411-L414 PolarHBondContact O-N 2.98Å; L414-N416 PolarHBondContact O-N 3.48Å; L414-L417 WeakPolarHBondContact O-CB 3.33Å; L414-L417 PolarHBondContact O-N 2.98Å; L414-L417 VanDerWaalsContact O-N 3.16Å; L414-S418 PolarHBondContact O-N 2.8Å; L414-S418 PolarHBondContact O-OG 3.15Å
415	C	88.4	Confident	86.6	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.5	-50	176.6	-66.5	0	0	0	0	110.9	F411 L417 S418 I419 V461	F411-C415 PolarHBondContact O-N 3.21Å; F411-C415 PolarHBondContact O-SG 2.75Å; C415-L417 VanDerWaalsContact C-N 3.29Å; C415-L417 PolarHBondContact O-N 3.3Å; C415-S418 PolarHBondContact O-N 3.09Å; C415-S418 PolarHBondContact O-OG 3.27Å; C415-I419 WeakPolarHBondContact O-CG1 3.1Å; C415-I419 PolarHBondContact O-N 2.92Å; C415-I419 VanDerWaalsContact O-N 3.13Å; C415-V461 HydrophobicContact CB-CG1 4.28Å
416	N	86.2	Confident	86.1	Confident	92 Å²	92	26.7 Å²	26.7	49%	0.492	14%	0.139	S	C	.	.	H	α-helix	trans	-60.1	-37.8	175.7	-72.4	-29.1	0	0	0	112.2	A412 L414 T420	A412-N416 WeakPolarHBondContact O-CB 3.33Å; A412-N416 VanDerWaalsContact O-CG 3.29Å; A412-N416 PolarHBondContact O-N 2.96Å; A412-N416 PolarHBondContact O-ND2 2.73Å; A412-N416 VanDerWaalsContact O-ND2 3.15Å; L414-N416 PolarHBondContact O-N 3.48Å; N416-T420 WeakPolarHBondContact O-CG2 3.36Å; N416-T420 PolarHBondContact O-N 2.92Å; N416-T420 PolarHBondContact O-OG1 2.81Å
417	L	87	Confident	85.4	Confident	19 Å²	19	27.4 Å²	27.4	10%	0.099	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-48.3	178.8	-154.8	75.4	0	0	0	111.5	L245 I254 Q257 K413 L414 C415 T420 F421	L245-L417 HydrophobicContact CD2-CB 4.3Å; L245-L417 HydrophobicContact CD2-CD2 3.85Å; L245-L417 HydrophobicContact CD2-CG 4.47Å; I254-L417 HydrophobicContact CG1-CD2 4.18Å; I254-L417 HydrophobicContact CG2-CD2 3.99Å; Q257-L417 HydrophobicContact CB-CD1 4.23Å; Q257-L417 HydrophobicContact CG-CD1 3.51Å; Q257-L417 HydrophobicContact CG-CG 4.47Å; K413-L417 WeakPolarHBondContact O-CB 3.41Å; K413-L417 PolarHBondContact O-N 2.8Å; L414-L417 WeakPolarHBondContact O-CB 3.33Å; L414-L417 PolarHBondContact O-N 2.98Å; L414-L417 VanDerWaalsContact O-N 3.16Å; C415-L417 VanDerWaalsContact C-N 3.29Å; C415-L417 PolarHBondContact O-N 3.3Å; L417-T420 PolarHBondContact O-N 2.82Å; L417-T420 PolarHBondContact O-OG1 3.13Å; L417-F421 HydrophobicContact CD2-CE2 3.8Å; L417-F421 HydrophobicContact CD2-CZ 4.44Å; L417-F421 HydrophobicContact CG-CD2 4.22Å; L417-F421 HydrophobicContact CG-CE2 3.65Å; L417-F421 HydrophobicContact CG-CZ 4.38Å; L417-F421 VanDerWaalsContact O-CD2 3.23Å; L417-F421 WeakPolarHBondContact O-CD2 3.43Å; L417-F421 PolarHBondContact O-N 3.3Å
418	S	87.3	Confident	84.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.3	-49.1	176.5	59.8	0	0	0	0	112.4	L414 C415 T420 F421 D422	L414-S418 PolarHBondContact O-N 2.8Å; L414-S418 PolarHBondContact O-OG 3.15Å; C415-S418 PolarHBondContact O-N 3.09Å; C415-S418 PolarHBondContact O-OG 3.27Å; S418-T420 VanDerWaalsContact C-N 3.3Å; S418-T420 PolarHBondContact O-N 3.31Å; S418-F421 PolarHBondContact O-N 3.18Å; S418-D422 PolarHBondContact O-N 2.9Å
419	I	85.1	Confident	84.4	Confident	41 Å²	41	28.8 Å²	28.8	21%	0.21	15%	0.152	C	C	.	.	H	α-helix	trans	-56.1	-44.2	175.6	-64.4	166.8	0	0	0	110.7	I209 C415 F421 D422 Q423 P465	I209-I419 HydrophobicContact CD1-CG2 4.49Å; C415-I419 WeakPolarHBondContact O-CG1 3.1Å; C415-I419 PolarHBondContact O-N 2.92Å; C415-I419 VanDerWaalsContact O-N 3.13Å; I419-F421 PolarHBondContact O-N 3.46Å; I419-D422 PolarHBondContact O-N 3.49Å; I419-Q423 HydrophobicContact CG2-CG 4.34Å; I419-Q423 WeakPolarHBondContact O-CB 3.34Å; I419-Q423 VanDerWaalsContact O-CG 3.24Å; I419-Q423 WeakPolarHBondContact O-CG 3.5Å; I419-Q423 PolarHBondContact O-N 2.95Å; I419-P465 HydrophobicContact CG1-CG 4.26Å
420	T	84.9	Confident	84.3	Confident	27 Å²	27	27 Å²	27	17%	0.166	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-33.8	177.9	60.3	0	0	0	0	113.6	Q257 N416 L417 S418 Q423 F424	Q257-T420 PolarHBondContact NE2-OG1 3.15Å; N416-T420 WeakPolarHBondContact O-CG2 3.36Å; N416-T420 PolarHBondContact O-N 2.92Å; N416-T420 PolarHBondContact O-OG1 2.81Å; L417-T420 PolarHBondContact O-N 2.82Å; L417-T420 PolarHBondContact O-OG1 3.13Å; S418-T420 VanDerWaalsContact C-N 3.3Å; S418-T420 PolarHBondContact O-N 3.31Å; T420-Q423 PolarHBondContact O-N 3.49Å; T420-F424 WeakPolarHBondContact O-CD2 3.39Å; T420-F424 PolarHBondContact O-N 3.39Å
421	F	86.3	Confident	84.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.9	-37.8	173.9	-74.8	-59.4	0	0	0	112.3	L196 I200 L245 Y249 L253 I254 Q257 L417 S418 I419 F424 N425	L196-F421 HydrophobicContact CD1-CD1 4.37Å; L196-F421 HydrophobicContact CD2-CD1 4.16Å; I200-F421 HydrophobicContact CD1-CD1 4.03Å; I200-F421 HydrophobicContact CD1-CE1 3.61Å; L245-F421 HydrophobicContact CD1-CD2 4.48Å; Y249-F421 HydrophobicContact CD1-CB 4.33Å; Y249-F421 HydrophobicContact CD1-CD1 4.29Å; Y249-F421 HydrophobicContact CD1-CG 4.21Å; Y249-F421 HydrophobicContact CD2-CB 4.46Å; Y249-F421 AromaticContact CD2-CD2 3.73Å; Y249-F421 HydrophobicContact CD2-CD2 3.73Å; Y249-F421 HydrophobicContact CD2-CE2 4.06Å; Y249-F421 HydrophobicContact CD2-CG 4.09Å; Y249-F421 HydrophobicContact CE1-CB 3.73Å; Y249-F421 HydrophobicContact CE1-CD1 4.5Å; Y249-F421 HydrophobicContact CE1-CG 4.11Å; Y249-F421 HydrophobicContact CE2-CB 3.88Å; Y249-F421 AromaticContact CE2-CD2 3.76Å; Y249-F421 HydrophobicContact CE2-CD2 3.76Å; Y249-F421 AromaticContact CE2-CG 3.98Å; Y249-F421 HydrophobicContact CE2-CG 3.98Å; Y249-F421 HydrophobicContact CG-CD1 4.38Å; Y249-F421 HydrophobicContact CG-CD2 4.17Å; Y249-F421 HydrophobicContact CG-CE2 4.37Å; Y249-F421 HydrophobicContact CG-CG 4.18Å; Y249-F421 VanDerWaalsContact CZ-CB 3.46Å; Y249-F421 AromaticContact CZ-CG 3.97Å; L253-F421 HydrophobicContact CB-CE1 4.13Å; L253-F421 HydrophobicContact CB-CZ 4.47Å; I254-F421 HydrophobicContact CB-CZ 4.46Å; I254-F421 HydrophobicContact CG1-CE2 3.72Å; I254-F421 HydrophobicContact CG1-CZ 3.6Å; Q257-F421 HydrophobicContact CB-CE1 4.37Å; Q257-F421 HydrophobicContact CB-CZ 4.25Å; L417-F421 HydrophobicContact CD2-CE2 3.8Å; L417-F421 HydrophobicContact CD2-CZ 4.44Å; L417-F421 HydrophobicContact CG-CD2 4.22Å; L417-F421 HydrophobicContact CG-CE2 3.65Å; L417-F421 HydrophobicContact CG-CZ 4.38Å; L417-F421 VanDerWaalsContact O-CD2 3.23Å; L417-F421 WeakPolarHBondContact O-CD2 3.43Å; L417-F421 PolarHBondContact O-N 3.3Å; S418-F421 PolarHBondContact O-N 3.18Å; I419-F421 PolarHBondContact O-N 3.46Å; F421-F424 PolarHBondContact O-N 3.09Å; F421-N425 PolarHBondContact O-N 3.41Å; F421-N425 PolarHBondContact O-ND2 2.89Å
422	D	84.6	Confident	84.4	Confident	7 Å²	7	27.1 Å²	27.1	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-69.4	-40.2	176.3	-64.9	-28.4	0	0	0	111.2	I209 Y249 S418 I419 F424 N425 N426 T430	I209-D422 HydrophobicContact CD1-CB 3.92Å; Y249-D422 PolarHBondContact OH-OD1 3.21Å; S418-D422 PolarHBondContact O-N 2.9Å; I419-D422 PolarHBondContact O-N 3.49Å; D422-F424 VanDerWaalsContact C-N 3.27Å; D422-F424 PolarHBondContact O-N 3.01Å; D422-N425 PolarHBondContact O-N 2.98Å; D422-N425 VanDerWaalsContact O-N 3.13Å; D422-N426 PolarHBondContact O-N 3.41Å; D422-T430 PolarHBondContact OD1-OG1 2.91Å; D422-T430 PolarHBondContact OD2-N 3.48Å; D422-T430 PolarHBondContact OD2-OG1 3.4Å
423	Q	83.9	Confident	84.5	Confident	34 Å²	34	26 Å²	26	16%	0.159	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-29.1	170.3	-71.3	176.8	-22.5	0	0	113.9	P205 V206 R207 I209 I419 T420	P205-Q423 HydrophobicContact CB-CB 3.76Å; V206-Q423 PolarHBondContact N-O 3.43Å; V206-Q423 VanDerWaalsContact O-CB 3.26Å; V206-Q423 WeakPolarHBondContact O-CB 3.17Å; V206-Q423 VanDerWaalsContact O-CD 3.29Å; V206-Q423 WeakPolarHBondContact O-CG 3.43Å; R207-Q423 PolarHBondContact O-NE2 2.96Å; I209-Q423 HydrophobicContact CD1-CG 4.06Å; I209-Q423 HydrophobicContact CG1-CG 3.75Å; I419-Q423 HydrophobicContact CG2-CG 4.34Å; I419-Q423 WeakPolarHBondContact O-CB 3.34Å; I419-Q423 VanDerWaalsContact O-CG 3.24Å; I419-Q423 WeakPolarHBondContact O-CG 3.5Å; I419-Q423 PolarHBondContact O-N 2.95Å; T420-Q423 PolarHBondContact O-N 3.49Å
424	F	82.7	Confident	84.7	Confident	9 Å²	9	21.7 Å²	21.7	4%	0.039	11%	0.112	C	C	.	.	H	α-helix	trans	-81	-27.1	173	-79.6	-59	0	0	0	113.8	L196 N199 I200 P205 T420 F421 D422	L196-F424 HydrophobicContact CD1-CB 3.52Å; L196-F424 HydrophobicContact CD1-CG 4.38Å; N199-F424 HydrophobicContact CB-CB 4.49Å; N199-F424 HydrophobicContact CB-CD1 3.97Å; N199-F424 PolarHBondContact ND2-O 2.92Å; N199-F424 WeakPolarHBondContact O-CE1 3.45Å; I200-F424 HydrophobicContact CD1-CD2 4.43Å; I200-F424 HydrophobicContact CG1-CD2 3.73Å; I200-F424 HydrophobicContact CG1-CE1 4.49Å; I200-F424 HydrophobicContact CG1-CE2 3.64Å; I200-F424 HydrophobicContact CG1-CG 4.22Å; I200-F424 HydrophobicContact CG1-CZ 4.04Å; P205-F424 HydrophobicContact CB-CD1 4.24Å; P205-F424 HydrophobicContact CB-CD2 4.38Å; P205-F424 HydrophobicContact CB-CE1 4.1Å; P205-F424 HydrophobicContact CB-CE2 4.22Å; P205-F424 HydrophobicContact CB-CG 4.39Å; P205-F424 HydrophobicContact CB-CZ 4.09Å; P205-F424 HydrophobicContact CG-CZ 4.28Å; T420-F424 WeakPolarHBondContact O-CD2 3.39Å; T420-F424 PolarHBondContact O-N 3.39Å; F421-F424 PolarHBondContact O-N 3.09Å; D422-F424 VanDerWaalsContact C-N 3.27Å; D422-F424 PolarHBondContact O-N 3.01Å
425	N	76.8	Confident	84.8	Confident	10 Å²	10	21.7 Å²	21.7	5%	0.053	11%	0.112	C	C	.	.	H	α-helix	trans	-85.5	-49.2	178.7	-80.4	-75.9	0	0	0	112	Q192 K195 L196 F421 D422 I427	Q192-N425 PolarHBondContact NE2-OD1 3.03Å; K195-N425 PolarHBondContact NZ-O 3.04Å; L196-N425 WeakPolarHBondContact CD1-ND2 3.42Å; F421-N425 PolarHBondContact O-N 3.41Å; F421-N425 PolarHBondContact O-ND2 2.89Å; D422-N425 PolarHBondContact O-N 2.98Å; D422-N425 VanDerWaalsContact O-N 3.13Å; N425-I427 VanDerWaalsContact C-N 3.27Å; N425-I427 WeakPolarHBondContact O-CG1 3.43Å; N425-I427 PolarHBondContact O-N 2.86Å
426	N	76.5	Confident	84.8	Confident	66 Å²	66	21.9 Å²	21.9	35%	0.353	11%	0.112	S	C	.	.			trans	46.9	44.6	-170	-156.7	18.2	0	0	0	113.2	N210 D422	N210-N426 PolarHBondContact N-OD1 3.48Å; D422-N426 PolarHBondContact O-N 3.41Å
427	I	73.8	Confident	84.9	Confident	76 Å²	76	17.7 Å²	17.7	39%	0.39	9%	0.09	S	C	.	.	S	Bend	trans	-129.6	-37.9	-179.4	-63	157.4	0	0	0	111.2	T213 P214 N425	T213-I427 WeakPolarHBondContact CB-O 3.39Å; P214-I427 WeakPolarHBondContact CD-O 3.28Å; N425-I427 VanDerWaalsContact C-N 3.27Å; N425-I427 WeakPolarHBondContact O-CG1 3.43Å; N425-I427 PolarHBondContact O-N 2.86Å
428	Q	77.6	Confident	84.8	Confident	24 Å²	24	16.9 Å²	16.9	11%	0.112	9%	0.086	C	C	.	.			trans	-137.7	158.7	177.1	-57.3	-174.8	-82.4	0	0	109.4	E115 P214 R216	E115-Q428 VanDerWaalsContact CD-NE2 3.25Å; E115-Q428 PolarHBondContact OE1-NE2 3.01Å; E115-Q428 PolarHBondContact OE2-NE2 3.06Å; P214-Q428 HydrophobicContact CG-CG 4.28Å; P214-Q428 CarbonylContact O-C 3.55Å; P214-Q428 WeakPolarHBondContact O-CA 3.21Å; R216-Q428 VanDerWaalsContact CZ-OE1 3.28Å; R216-Q428 VanDerWaalsContact NE-OE1 3.11Å
429	Q	81.8	Confident	84.5	Confident	34 Å²	34	17.9 Å²	17.9	16%	0.159	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	134.8	164.6	-72.5	161.9	36.1	0	0	109	I209 N210 T213 P214 V215 R216	I209-Q429 HydrophobicContact CG2-CG 3.88Å; N210-Q429 PolarHBondContact O-NE2 3.09Å; T213-Q429 WeakPolarHBondContact OG1-CG 3.3Å; T213-Q429 PolarHBondContact OG1-NE2 3.25Å; P214-Q429 PolarHBondContact O-N 2.86Å; V215-Q429 HydrophobicContact CG2-CB 4.49Å; R216-Q429 PolarHBondContact N-O 3.05Å
430	T	85.8	Confident	84	Confident	3 Å²	3	17.8 Å²	17.8	2%	0.018	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.8	171.6	52.6	0	0	0	0	111.6	R216 Y249 D422 P465	R216-T430 HydrophobicContact CB-CG2 4.44Å; R216-T430 WeakPolarHBondContact O-CA 3.48Å; Y249-T430 HydrophobicContact CE2-CG2 4.46Å; Y249-T430 WeakPolarHBondContact OH-CG2 3.25Å; D422-T430 PolarHBondContact OD1-OG1 2.91Å; D422-T430 PolarHBondContact OD2-N 3.48Å; D422-T430 PolarHBondContact OD2-OG1 3.4Å; T430-P465 WeakPolarHBondContact O-CB 3.45Å
431	R	88.9	Confident	83.8	Confident	12 Å²	12	16.6 Å²	16.6	5%	0.045	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.9	174.6	-60.1	-176.1	-177	172.2	-9.4	110	F78 C80 R81 S83 F85 V215 R216 V217 I218 P465	F78-R431 PolarHBondContact O-NH1 3.14Å; C80-R431 PolarHBondContact O-NH1 2.87Å; C80-R431 PolarHBondContact O-NH2 3.37Å; R81-R431 PolarHBondContact O-NH2 3.48Å; S83-R431 PolarHBondContact O-NH2 3.13Å; S83-R431 PolarHBondContact OG-NH1 2.99Å; F85-R431 HydrophobicContact CE1-CB 4.37Å; F85-R431 HydrophobicContact CZ-CG 4.5Å; V215-R431 HydrophobicContact CG1-CB 4.49Å; V215-R431 HydrophobicContact CG1-CG 3.94Å; R216-R431 PolarHBondContact O-N 3.18Å; V217-R431 CarbonylContact C-O 3.56Å; I218-R431 PolarHBondContact N-O 3.29Å; R431-P465 WeakPolarHBondContact CA-O 3.13Å
432	F	91	Very high	83.3	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.9	171.2	-65.6	-90.3	0	0	0	110.1	I218 M241 L245 L434 P465 V466 A467	I218-F432 HydrophobicContact CB-CD1 3.96Å; I218-F432 HydrophobicContact CB-CE1 4.3Å; I218-F432 HydrophobicContact CD1-CD1 4.38Å; I218-F432 HydrophobicContact CD1-CE1 3.94Å; I218-F432 HydrophobicContact CD1-CZ 4.18Å; I218-F432 HydrophobicContact CG2-CD1 3.96Å; I218-F432 HydrophobicContact CG2-CE1 4.08Å; I218-F432 WeakPolarHBondContact O-CA 3.48Å; M241-F432 HydrophobicContact CE-CD1 4.31Å; M241-F432 HydrophobicContact CE-CD2 3.51Å; M241-F432 HydrophobicContact CE-CE1 4.27Å; M241-F432 HydrophobicContact CE-CE2 3.46Å; M241-F432 VanDerWaalsContact CE-CE2 3.46Å; M241-F432 HydrophobicContact CE-CG 3.93Å; M241-F432 HydrophobicContact CE-CZ 3.84Å; M241-F432 HydrophobicContact CG-CD1 3.69Å; M241-F432 HydrophobicContact CG-CE1 3.51Å; M241-F432 HydrophobicContact CG-CE2 4.43Å; M241-F432 HydrophobicContact CG-CG 4.21Å; M241-F432 HydrophobicContact CG-CZ 3.9Å; L245-F432 HydrophobicContact CB-CE1 4.44Å; L245-F432 HydrophobicContact CB-CZ 4.17Å; L245-F432 HydrophobicContact CD1-CZ 4.02Å; L245-F432 HydrophobicContact CD2-CZ 4.48Å; L245-F432 HydrophobicContact CG-CZ 4.46Å; F432-L434 HydrophobicContact CB-CD2 4.13Å; F432-L434 HydrophobicContact CB-CG 4.41Å; F432-P465 PolarHBondContact N-O 2.91Å; F432-V466 HydrophobicContact CB-CG1 4.34Å; F432-V466 HydrophobicContact CB-CG2 4.24Å; F432-V466 HydrophobicContact CD2-CG2 4.22Å; F432-V466 WeakPolarHBondContact O-CA 3.48Å; F432-A467 PolarHBondContact O-N 2.92Å
433	I	90.9	Very high	83.1	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	113.7	167.8	-57.1	175.5	0	0	0	107	F78 L108 V217 I218 V219 V220 A467 V469	F78-I433 HydrophobicContact CB-CD1 3.46Å; F78-I433 VanDerWaalsContact CB-CD1 3.46Å; F78-I433 HydrophobicContact CB-CG1 4.41Å; F78-I433 HydrophobicContact CD2-CD1 3.86Å; F78-I433 HydrophobicContact CE2-CG2 4.43Å; F78-I433 HydrophobicContact CG-CD1 3.73Å; F78-I433 HydrophobicContact CG-CG1 4.42Å; L108-I433 HydrophobicContact CD1-CB 4.44Å; L108-I433 HydrophobicContact CD1-CD1 3.66Å; L108-I433 HydrophobicContact CD1-CG2 3.96Å; L108-I433 HydrophobicContact CD2-CD1 3.61Å; L108-I433 HydrophobicContact CG-CD1 4.28Å; V217-I433 HydrophobicContact CB-CD1 4.42Å; V217-I433 HydrophobicContact CG1-CB 4.42Å; V217-I433 HydrophobicContact CG1-CD1 3.43Å; V217-I433 VanDerWaalsContact CG1-CD1 3.43Å; V217-I433 HydrophobicContact CG1-CG1 3.91Å; V217-I433 HydrophobicContact CG2-CD1 4.06Å; I218-I433 PolarHBondContact O-N 3.37Å; V219-I433 WeakPolarHBondContact CA-O 3.29Å; V220-I433 PolarHBondContact N-O 2.7Å; I433-A467 WeakPolarHBondContact CA-O 3.49Å; I433-A467 HydrophobicContact CG1-CB 4.48Å; I433-V469 HydrophobicContact CG2-CG2 4.09Å
434	L	90.4	Very high	83.1	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	98.1	-172.6	-52.9	-178	0	0	0	108.7	V220 L237 F432 V466 A467 I468 V469	V220-L434 HydrophobicContact CB-CD2 3.65Å; V220-L434 HydrophobicContact CG1-CD2 4.2Å; V220-L434 HydrophobicContact CG2-CD2 3.85Å; L237-L434 HydrophobicContact CD1-CB 3.84Å; L237-L434 HydrophobicContact CD1-CD1 3.84Å; L237-L434 HydrophobicContact CD1-CD2 4.33Å; L237-L434 HydrophobicContact CD1-CG 4.21Å; L237-L434 HydrophobicContact CD2-CD1 4.12Å; L237-L434 HydrophobicContact CG-CD1 3.95Å; F432-L434 HydrophobicContact CB-CD2 4.13Å; F432-L434 HydrophobicContact CB-CG 4.41Å; L434-V466 HydrophobicContact CD1-CG1 3.55Å; L434-V466 HydrophobicContact CG-CG1 4.01Å; L434-A467 PolarHBondContact N-O 2.96Å; L434-I468 HydrophobicContact CB-CG1 4.15Å; L434-I468 HydrophobicContact CD1-CD1 4.33Å; L434-I468 HydrophobicContact CD1-CG1 4.02Å; L434-I468 HydrophobicContact CG-CG1 4.47Å; L434-V469 PolarHBondContact O-N 3.12Å
435	C	90.1	Very high	83.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	115.3	177.5	-63.3	0	0	0	0	109.8	L101 V220 Y221 H222	L101-C435 HydrophobicContact CB-CB 4.38Å; L101-C435 HydrophobicContact CD1-CB 4.22Å; L101-C435 HydrophobicContact CD2-CB 3.88Å; L101-C435 HydrophobicContact CG-CB 4.39Å; V220-C435 PolarHBondContact O-N 3.16Å; Y221-C435 HydrophobicContact CD2-CB 3.91Å; H222-C435 PolarHBondContact N-O 2.95Å
436	L	88.9	Confident	83.5	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	102.4	-180	-67.9	-179.8	0	0	0	110.1	L101 H222 I224 L237 A438 I454 I468 V469 L470 E471	L101-L436 VanDerWaalsContact CD1-O 3.31Å; L101-L436 WeakPolarHBondContact CD1-O 3.36Å; H222-L436 HydrophobicContact CB-CD2 4.16Å; H222-L436 WeakPolarHBondContact O-CA 3.38Å; I224-L436 HydrophobicContact CD1-CB 4.45Å; I224-L436 HydrophobicContact CD1-CD2 4.48Å; L237-L436 HydrophobicContact CD1-CD2 3.73Å; L237-L436 HydrophobicContact CD1-CG 4.44Å; L237-L436 HydrophobicContact CD2-CD1 4.37Å; L436-A438 PolarHBondContact O-N 2.93Å; L436-I454 HydrophobicContact CD1-CD1 3.54Å; L436-I454 HydrophobicContact CD1-CG1 4.29Å; L436-I468 HydrophobicContact CD1-CG2 3.61Å; L436-I468 HydrophobicContact CG-CG2 4.24Å; L436-V469 PolarHBondContact N-O 3.49Å; L436-L470 HydrophobicContact CB-CD1 3.92Å; L436-L470 WeakPolarHBondContact O-CA 3.3Å; L436-E471 PolarHBondContact O-N 2.93Å
437	D	87.8	Confident	83.9	Confident	5 Å²	5	29.8 Å²	29.8	3%	0.027	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	111.8	169.9	172.2	21.4	0	0	0	109.5	L101 H222 R223 I224 S439	L101-D437 HydrophobicContact CD1-CB 4.16Å; H222-D437 PolarHBondContact O-N 3.29Å; R223-D437 HydrophobicContact CB-CB 4.32Å; R223-D437 WeakPolarHBondContact CD-OD2 3.36Å; R223-D437 HydrophobicContact CG-CB 4.25Å; R223-D437 WeakPolarHBondContact CG-OD2 3.4Å; R223-D437 IonicContact CZ-OD2 2.6Å; R223-D437 IonicContact NE-OD2 2.66Å; R223-D437 PolarHBondContact NE-OD2 2.68Å; R223-D437 IonicContact NH2-OD2 2.37Å; R223-D437 PolarHBondContact NH2-OD2 3.42Å; I224-D437 PolarHBondContact N-O 3.34Å; D437-S439 WeakPolarHBondContact OD1-CB 3.5Å; D437-S439 PolarHBondContact OD1-N 3.2Å; D437-S439 PolarHBondContact OD1-OG 3.27Å
438	A	85	Confident	84.6	Confident	2 Å²	2	27.3 Å²	27.3	2%	0.017	14%	0.144	C	C	.	.			trans	-115.5	13.2	174.1	0	0	0	0	0	112.4	I224 L436 S440 I441 L447 L450 L470 E471 A472	I224-A438 HydrophobicContact CD1-CB 4.33Å; L436-A438 PolarHBondContact O-N 2.93Å; A438-S440 PolarHBondContact O-N 3.49Å; A438-S440 VanDerWaalsContact O-N 3.1Å; A438-I441 HydrophobicContact CB-CD1 3.78Å; A438-I441 HydrophobicContact CB-CG1 4.18Å; A438-I441 WeakPolarHBondContact O-CB 3.46Å; A438-I441 PolarHBondContact O-N 2.98Å; A438-L447 HydrophobicContact CB-CD1 4.32Å; A438-L450 HydrophobicContact CB-CD2 4.4Å; A438-L470 HydrophobicContact CB-CD1 3.65Å; A438-E471 CarbonylContact C-O 3.6Å; A438-E471 WeakPolarHBondContact CA-O 3.46Å; A438-E471 WeakPolarHBondContact CB-O 3.46Å; A438-E471 PolarHBondContact N-O 3.26Å; A438-A472 HydrophobicContact CB-CB 4.41Å
439	S	81.1	Confident	85	Confident	20 Å²	20	30.6 Å²	30.6	14%	0.14	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.7	179.5	62.1	0	0	0	0	113.6	D437 E471	D437-S439 WeakPolarHBondContact OD1-CB 3.5Å; D437-S439 PolarHBondContact OD1-N 3.2Å; D437-S439 PolarHBondContact OD1-OG 3.27Å; S439-E471 PolarHBondContact N-O 3.47Å
440	S	75.8	Confident	85.3	Confident	39 Å²	39	29.1 Å²	29.1	27%	0.273	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.6	177.6	45.7	0	0	0	0	115.4	I224 A438 L442	I224-S440 PolarHBondContact O-OG 3.41Å; A438-S440 PolarHBondContact O-N 3.49Å; A438-S440 VanDerWaalsContact O-N 3.1Å; S440-L442 PolarHBondContact O-N 3.35Å
441	I	79.6	Confident	85.4	Confident	3 Å²	3	29 Å²	29	2%	0.015	15%	0.151	C	C	.	.			trans	-80.9	108.2	179.3	-60.2	-176	0	0	0	110	I224 A438 L446 L447 L450 I476	I224-I441 HydrophobicContact CB-CD1 4.31Å; I224-I441 HydrophobicContact CG2-CD1 3.89Å; I224-I441 HydrophobicContact CG2-CG1 4.43Å; A438-I441 HydrophobicContact CB-CD1 3.78Å; A438-I441 HydrophobicContact CB-CG1 4.18Å; A438-I441 WeakPolarHBondContact O-CB 3.46Å; A438-I441 PolarHBondContact O-N 2.98Å; I441-L446 HydrophobicContact CG2-CB 4.12Å; I441-L446 HydrophobicContact CG2-CD2 3.99Å; I441-L446 HydrophobicContact CG2-CG 4.41Å; I441-L447 HydrophobicContact CG2-CB 4.2Å; I441-L450 HydrophobicContact CD1-CD2 3.98Å; I441-I476 WeakPolarHBondContact O-CD1 3.48Å
442	L	75.4	Confident	85.4	Confident	153 Å²	153	32.4 Å²	32.4	80%	0.801	16%	0.164	S	C	*	.			trans	-86.1	-10.1	179.7	-72.4	162.4	0	0	0	114.9	S440 I476	S440-L442 PolarHBondContact O-N 3.35Å; L442-I476 WeakPolarHBondContact O-CG2 3.44Å
443	Q	81.3	Confident	85.2	Confident	103 Å²	103	34 Å²	34	48%	0.481	17%	0.171	S	C	.	.			trans	-103.4	118.8	-177	-174.2	179.9	0.8	0	0	112.2	D445 L446 L447	Q443-D445 HydrophobicContact CG-CB 4.3Å; Q443-D445 PolarHBondContact NE2-OD2 2.99Å; Q443-D445 PolarHBondContact O-N 2.98Å; Q443-L446 HydrophobicContact CB-CB 4.12Å; Q443-L446 HydrophobicContact CG-CB 4.43Å; Q443-L446 PolarHBondContact O-N 3.15Å; Q443-L446 VanDerWaalsContact O-N 3.15Å; Q443-L447 PolarHBondContact O-N 3.5Å
444	K	83.6	Confident	85.1	Confident	66 Å²	66	34 Å²	34	29%	0.287	17%	0.172	S	C	.	.	H	α-helix	trans	-46.7	-52.8	173.8	177.8	173.1	177.2	144.5	0	112.9	L446 L447 A448 L477 N512	K444-L446 VanDerWaalsContact C-N 3.28Å; K444-L446 PolarHBondContact O-N 3.07Å; K444-L447 PolarHBondContact O-N 3.47Å; K444-A448 WeakPolarHBondContact O-CB 3.34Å; K444-A448 PolarHBondContact O-N 3.31Å; K444-L477 WeakPolarHBondContact CD-O 3.41Å; K444-L477 WeakPolarHBondContact CE-O 3.37Å; K444-L477 PolarHBondContact NZ-O 3.45Å; K444-N512 WeakPolarHBondContact CE-OD1 3.27Å; K444-N512 VanDerWaalsContact NZ-CG 3.35Å; K444-N512 PolarHBondContact NZ-ND2 3.16Å; K444-N512 VanDerWaalsContact NZ-ND2 3.1Å; K444-N512 PolarHBondContact NZ-OD1 3.24Å
445	D	82.9	Confident	85	Confident	49 Å²	49	34.7 Å²	34.7	26%	0.262	17%	0.174	S	C	.	.	H	α-helix	trans	-62.1	-35.5	-175.7	-44.9	-54.7	0	0	0	112.8	Q443 K449	Q443-D445 HydrophobicContact CG-CB 4.3Å; Q443-D445 PolarHBondContact NE2-OD2 2.99Å; Q443-D445 PolarHBondContact O-N 2.98Å; D445-K449 VanDerWaalsContact O-CB 3.24Å; D445-K449 WeakPolarHBondContact O-CB 3.48Å; D445-K449 WeakPolarHBondContact O-CD 3.16Å; D445-K449 WeakPolarHBondContact O-CG 3.45Å; D445-K449 PolarHBondContact O-N 3.25Å
446	L	84.9	Confident	84.8	Confident	30 Å²	30	36.9 Å²	36.9	16%	0.157	19%	0.186	C	C	.	.	H	α-helix	trans	-70.9	-43.8	-178.9	-166.8	74	0	0	0	110.1	T230 I441 Q443 K444 L450	T230-L446 HydrophobicContact CG2-CD1 3.7Å; T230-L446 HydrophobicContact CG2-CG 4.18Å; I441-L446 HydrophobicContact CG2-CB 4.12Å; I441-L446 HydrophobicContact CG2-CD2 3.99Å; I441-L446 HydrophobicContact CG2-CG 4.41Å; Q443-L446 HydrophobicContact CB-CB 4.12Å; Q443-L446 HydrophobicContact CG-CB 4.43Å; Q443-L446 PolarHBondContact O-N 3.15Å; Q443-L446 VanDerWaalsContact O-N 3.15Å; K444-L446 VanDerWaalsContact C-N 3.28Å; K444-L446 PolarHBondContact O-N 3.07Å; L446-L450 VanDerWaalsContact O-CB 3.24Å; L446-L450 WeakPolarHBondContact O-CB 3.39Å; L446-L450 PolarHBondContact O-N 2.88Å
447	L	86.4	Confident	84.8	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-44.4	175.3	-177.8	60.8	0	0	0	111.7	A438 I441 Q443 K444 L450 I451 L470 A472 L477	A438-L447 HydrophobicContact CB-CD1 4.32Å; I441-L447 HydrophobicContact CG2-CB 4.2Å; Q443-L447 PolarHBondContact O-N 3.5Å; K444-L447 PolarHBondContact O-N 3.47Å; L447-L450 WeakPolarHBondContact O-CB 3.38Å; L447-L450 PolarHBondContact O-N 3.19Å; L447-I451 HydrophobicContact CD1-CD1 4.2Å; L447-I451 HydrophobicContact CG-CD1 4.05Å; L447-I451 VanDerWaalsContact O-CG1 3.31Å; L447-I451 WeakPolarHBondContact O-CG1 3.29Å; L447-I451 PolarHBondContact O-N 2.97Å; L447-L470 HydrophobicContact CD1-CD2 4.35Å; L447-A472 HydrophobicContact CD1-CB 3.91Å; L447-A472 HydrophobicContact CD2-CB 4.15Å; L447-L477 HydrophobicContact CD2-CD1 4.26Å; L447-L477 HydrophobicContact CG-CD1 4.43Å
448	A	86.6	Confident	84.7	Confident	23 Å²	23	36.7 Å²	36.7	19%	0.19	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-45.2	176.7	0	0	0	0	0	112.4	K444 L450 I451 Y452 L477 L515	K444-A448 WeakPolarHBondContact O-CB 3.34Å; K444-A448 PolarHBondContact O-N 3.31Å; A448-L450 VanDerWaalsContact C-N 3.34Å; A448-L450 PolarHBondContact O-N 2.97Å; A448-I451 PolarHBondContact O-N 3.03Å; A448-Y452 PolarHBondContact O-N 2.94Å; A448-L477 HydrophobicContact CB-CD1 4.46Å; A448-L515 HydrophobicContact CB-CD2 3.75Å
449	K	86.5	Confident	84.6	Confident	94 Å²	94	41 Å²	41	41%	0.409	21%	0.208	S	C	.	.	H	α-helix	trans	-63.8	-38.4	175.4	-74.5	169.5	-178	178.3	0	111.9	T230 D445 Y452 Q453	T230-K449 HydrophobicContact CG2-CB 4.11Å; D445-K449 VanDerWaalsContact O-CB 3.24Å; D445-K449 WeakPolarHBondContact O-CB 3.48Å; D445-K449 WeakPolarHBondContact O-CD 3.16Å; D445-K449 WeakPolarHBondContact O-CG 3.45Å; D445-K449 PolarHBondContact O-N 3.25Å; K449-Y452 PolarHBondContact O-N 3.4Å; K449-Q453 WeakPolarHBondContact O-CB 3.03Å; K449-Q453 WeakPolarHBondContact O-CG 3.39Å; K449-Q453 PolarHBondContact O-N 2.98Å
450	L	87.9	Confident	84.7	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-49.1	175.3	177.8	68.7	0	0	0	111.3	I224 T230 A233 L234 A438 I441 L446 L447 A448 Y452 Q453 I454 L470	I224-L450 HydrophobicContact CD1-CD1 4.19Å; I224-L450 HydrophobicContact CD1-CD2 3.44Å; I224-L450 VanDerWaalsContact CD1-CD2 3.44Å; I224-L450 HydrophobicContact CD1-CG 4.46Å; T230-L450 HydrophobicContact CG2-CB 4.01Å; A233-L450 HydrophobicContact CB-CD1 4.34Å; L234-L450 HydrophobicContact CD1-CD1 4.15Å; A438-L450 HydrophobicContact CB-CD2 4.4Å; I441-L450 HydrophobicContact CD1-CD2 3.98Å; L446-L450 VanDerWaalsContact O-CB 3.24Å; L446-L450 WeakPolarHBondContact O-CB 3.39Å; L446-L450 PolarHBondContact O-N 2.88Å; L447-L450 WeakPolarHBondContact O-CB 3.38Å; L447-L450 PolarHBondContact O-N 3.19Å; A448-L450 VanDerWaalsContact C-N 3.34Å; A448-L450 PolarHBondContact O-N 2.97Å; L450-Y452 VanDerWaalsContact C-N 3.34Å; L450-Y452 PolarHBondContact O-N 2.69Å; L450-Q453 PolarHBondContact O-N 3.37Å; L450-I454 HydrophobicContact CD1-CD1 3.96Å; L450-I454 HydrophobicContact CD1-CG1 4.34Å; L450-I454 HydrophobicContact CD2-CD1 4.48Å; L450-I454 HydrophobicContact CG-CD1 3.79Å; L450-I454 WeakPolarHBondContact O-CB 3.49Å; L450-I454 VanDerWaalsContact O-CG1 3.29Å; L450-I454 WeakPolarHBondContact O-CG1 3.38Å; L450-I454 PolarHBondContact O-N 3.5Å; L450-L470 HydrophobicContact CD2-CD1 4.07Å
451	I	88.4	Confident	85.1	Confident	1 Å²	1	42 Å²	42	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-57.1	-46.5	177.2	-72.7	165.8	0	0	0	110.9	L447 A448 I454 H455 L470 L520	L447-I451 HydrophobicContact CD1-CD1 4.2Å; L447-I451 HydrophobicContact CG-CD1 4.05Å; L447-I451 VanDerWaalsContact O-CG1 3.31Å; L447-I451 WeakPolarHBondContact O-CG1 3.29Å; L447-I451 PolarHBondContact O-N 2.97Å; A448-I451 PolarHBondContact O-N 3.03Å; I451-I454 PolarHBondContact O-N 2.87Å; I451-H455 PolarHBondContact O-N 3.23Å; I451-L470 HydrophobicContact CD1-CD2 4.15Å; I451-L470 HydrophobicContact CG1-CD2 3.55Å; I451-L520 HydrophobicContact CG2-CD2 4.45Å
452	Y	88.1	Confident	85.1	Confident	82 Å²	82	47.9 Å²	47.9	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-43.8	177	-176.6	-105	0	0	0	112.7	A448 K449 L450 H455 N456 S1451	A448-Y452 PolarHBondContact O-N 2.94Å; K449-Y452 PolarHBondContact O-N 3.4Å; L450-Y452 VanDerWaalsContact C-N 3.34Å; L450-Y452 PolarHBondContact O-N 2.69Å; Y452-H455 PolarHBondContact O-N 3.06Å; Y452-N456 VanDerWaalsContact O-CB 3.26Å; Y452-N456 WeakPolarHBondContact O-CB 3.49Å; Y452-N456 PolarHBondContact O-N 2.95Å; Y452-S1451 PolarHBondContact OH-OG 2.9Å
453	Q	87.9	Confident	85.3	Confident	33 Å²	33	46.5 Å²	46.5	15%	0.154	23%	0.234	C	C	.	.	H	α-helix	trans	-66	-37.6	177.7	-78.3	-169.8	-21.1	0	0	112.7	T230 N231 L234 K449 L450 N456 L457	T230-Q453 VanDerWaalsContact OG1-CD 3.3Å; T230-Q453 PolarHBondContact OG1-OE1 3.1Å; N231-Q453 PolarHBondContact OD1-NE2 3.24Å; N231-Q453 PolarHBondContact OD1-OE1 2.94Å; L234-Q453 HydrophobicContact CD1-CB 4.1Å; L234-Q453 HydrophobicContact CD2-CB 4.09Å; K449-Q453 WeakPolarHBondContact O-CB 3.03Å; K449-Q453 WeakPolarHBondContact O-CG 3.39Å; K449-Q453 PolarHBondContact O-N 2.98Å; L450-Q453 PolarHBondContact O-N 3.37Å; Q453-N456 PolarHBondContact O-N 2.87Å; Q453-L457 VanDerWaalsContact O-CB 3.3Å; Q453-L457 WeakPolarHBondContact O-CB 3.42Å; Q453-L457 PolarHBondContact O-N 3.29Å
454	I	88	Confident	85.5	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-45.9	172.8	-75.2	167.6	0	0	0	110.8	T88 L436 L450 I451 L457 L458 I468 L470	T88-I454 HydrophobicContact CG2-CG2 4Å; L436-I454 HydrophobicContact CD1-CD1 3.54Å; L436-I454 HydrophobicContact CD1-CG1 4.29Å; L450-I454 HydrophobicContact CD1-CD1 3.96Å; L450-I454 HydrophobicContact CD1-CG1 4.34Å; L450-I454 HydrophobicContact CD2-CD1 4.48Å; L450-I454 HydrophobicContact CG-CD1 3.79Å; L450-I454 WeakPolarHBondContact O-CB 3.49Å; L450-I454 VanDerWaalsContact O-CG1 3.29Å; L450-I454 WeakPolarHBondContact O-CG1 3.38Å; L450-I454 PolarHBondContact O-N 3.5Å; I451-I454 PolarHBondContact O-N 2.87Å; I454-L457 PolarHBondContact O-N 3.06Å; I454-L458 PolarHBondContact O-N 3.34Å; I454-I468 HydrophobicContact CD1-CG2 4.42Å; I454-I468 HydrophobicContact CG2-CB 4.28Å; I454-I468 HydrophobicContact CG2-CD1 3.92Å; I454-I468 HydrophobicContact CG2-CG2 3.92Å; I454-L470 HydrophobicContact CD1-CD1 4.49Å
455	H	88	Confident	85.8	Confident	14 Å²	14	39.2 Å²	39.2	7%	0.065	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-48.4	176.9	-165.9	70.6	0	0	0	111.5	I451 Y452 L457 L458 L459 S519 K658	I451-H455 PolarHBondContact O-N 3.23Å; Y452-H455 PolarHBondContact O-N 3.06Å; H455-L457 VanDerWaalsContact C-N 3.32Å; H455-L457 PolarHBondContact O-N 3.11Å; H455-L458 PolarHBondContact O-N 2.85Å; H455-L459 WeakPolarHBondContact O-CG 3.49Å; H455-L459 PolarHBondContact O-N 3.42Å; H455-S519 PolarHBondContact ND1-O 3.29Å; H455-K658 PolarHBondContact CE1-NZ 3.35Å; H455-K658 VanDerWaalsContact CE1-NZ 3.26Å; H455-K658 PolarHBondContact NE2-NZ 3.49Å
456	N	87.8	Confident	86.2	Confident	46 Å²	46	36.9 Å²	36.9	25%	0.246	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-35.1	-179.9	-165.9	-19.6	0	0	0	112.4	K408 Y452 Q453 T460	K408-N456 WeakPolarHBondContact CE-OD1 3.24Å; K408-N456 VanDerWaalsContact NZ-CG 3.27Å; K408-N456 PolarHBondContact NZ-ND2 3.25Å; K408-N456 PolarHBondContact NZ-OD1 3.16Å; Y452-N456 VanDerWaalsContact O-CB 3.26Å; Y452-N456 WeakPolarHBondContact O-CB 3.49Å; Y452-N456 PolarHBondContact O-N 2.95Å; Q453-N456 PolarHBondContact O-N 2.87Å; N456-T460 WeakPolarHBondContact O-CG2 3.49Å
457	L	87.9	Confident	86.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-48	173.7	-178.2	62.6	0	0	0	111.8	L234 I407 K408 F411 Q453 I454 H455 T460	L234-L457 HydrophobicContact CD2-CB 4.39Å; L234-L457 HydrophobicContact CD2-CD2 4.1Å; L234-L457 HydrophobicContact CG-CD2 4.33Å; I407-L457 HydrophobicContact CG2-CD1 4.08Å; K408-L457 HydrophobicContact CG-CD1 3.8Å; F411-L457 HydrophobicContact CB-CD1 3.81Å; F411-L457 HydrophobicContact CD1-CD1 3.8Å; F411-L457 HydrophobicContact CD1-CG 4.01Å; F411-L457 HydrophobicContact CD2-CD1 4.45Å; F411-L457 HydrophobicContact CD2-CD2 4.35Å; F411-L457 HydrophobicContact CD2-CG 4.4Å; F411-L457 HydrophobicContact CE1-CG 4.27Å; F411-L457 HydrophobicContact CG-CD1 3.76Å; F411-L457 HydrophobicContact CG-CD2 4.45Å; F411-L457 HydrophobicContact CG-CG 4.09Å; Q453-L457 VanDerWaalsContact O-CB 3.3Å; Q453-L457 WeakPolarHBondContact O-CB 3.42Å; Q453-L457 PolarHBondContact O-N 3.29Å; I454-L457 PolarHBondContact O-N 3.06Å; H455-L457 VanDerWaalsContact C-N 3.32Å; H455-L457 PolarHBondContact O-N 3.11Å; L457-T460 WeakPolarHBondContact O-CB 3.48Å; L457-T460 PolarHBondContact O-N 3.36Å; L457-T460 PolarHBondContact O-OG1 3.05Å
458	L	85.2	Confident	86.7	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-70.9	-31.2	-179.7	-73.3	167.9	0	0	0	113.1	P86 T88 F411 I454 H455 T460 V461 V466 I468	P86-L458 HydrophobicContact CB-CB 4.42Å; P86-L458 HydrophobicContact CB-CD2 3.88Å; T88-L458 HydrophobicContact CG2-CD1 3.24Å; F411-L458 HydrophobicContact CE1-CD2 4.31Å; F411-L458 HydrophobicContact CZ-CD2 3.76Å; I454-L458 PolarHBondContact O-N 3.34Å; H455-L458 PolarHBondContact O-N 2.85Å; L458-T460 PolarHBondContact O-N 3.11Å; L458-T460 VanDerWaalsContact O-N 3.16Å; L458-V461 PolarHBondContact O-N 2.97Å; L458-V466 HydrophobicContact CD2-CB 3.95Å; L458-V466 HydrophobicContact CD2-CG1 3.99Å; L458-I468 HydrophobicContact CD1-CB 4.38Å; L458-I468 HydrophobicContact CD1-CD1 3.71Å; L458-I468 HydrophobicContact CD1-CG1 3.97Å; L458-I468 HydrophobicContact CD2-CD1 4.22Å; L458-I468 HydrophobicContact CG-CD1 3.94Å
459	L	83.7	Confident	87	Confident	94 Å²	94	34.4 Å²	34.4	49%	0.492	17%	0.174	S	C	.	.	H	α-helix	trans	-60.9	-19.6	172.6	-75.2	178.7	0	0	0	113.5	H455 V461	H455-L459 WeakPolarHBondContact O-CG 3.49Å; H455-L459 PolarHBondContact O-N 3.42Å; L459-V461 PolarHBondContact O-N 2.91Å
460	T	83.9	Confident	87.1	Confident	59 Å²	59	30 Å²	30	36%	0.362	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.4	178	66.5	0	0	0	0	114.4	K408 N456 L457 L458	K408-T460 HydrophobicContact CB-CG2 4.02Å; K408-T460 HydrophobicContact CD-CG2 3.72Å; K408-T460 HydrophobicContact CG-CG2 3.66Å; N456-T460 WeakPolarHBondContact O-CG2 3.49Å; L457-T460 WeakPolarHBondContact O-CB 3.48Å; L457-T460 PolarHBondContact O-N 3.36Å; L457-T460 PolarHBondContact O-OG1 3.05Å; L458-T460 PolarHBondContact O-N 3.11Å; L458-T460 VanDerWaalsContact O-N 3.16Å
461	V	84.2	Confident	87.2	Confident	19 Å²	19	30.3 Å²	30.3	12%	0.115	16%	0.157	C	C	.	.			trans	-138.7	96.7	-179.5	-178.5	0	0	0	0	109.4	A412 C415 L458 L459 N463 A464	A412-V461 HydrophobicContact CB-CG2 3.72Å; C415-V461 HydrophobicContact CB-CG1 4.28Å; L458-V461 PolarHBondContact O-N 2.97Å; L459-V461 PolarHBondContact O-N 2.91Å; V461-N463 PolarHBondContact O-N 3.31Å; V461-A464 HydrophobicContact CB-CB 3.97Å; V461-A464 HydrophobicContact CG1-CB 3.93Å; V461-A464 WeakPolarHBondContact O-CB 3.48Å; V461-A464 PolarHBondContact O-N 3.39Å
462	I	78.8	Confident	87.1	Confident	128 Å²	128	30.3 Å²	30.3	66%	0.656	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-28.9	-174.7	-57.2	171.7	0	0	0	113.2	P86	P86-I462 WeakPolarHBondContact CD-O 3.27Å
463	N	80.5	Confident	86.9	Confident	123 Å²	123	27.1 Å²	27.1	66%	0.658	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.2	29.1	-178.5	-61.6	-4.7	0	0	0	112.7	V461	V461-N463 PolarHBondContact O-N 3.31Å
464	A	85.2	Confident	86.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.			trans	-65.4	127.1	179.2	0	0	0	0	0	111.5	P86 F411 V461 V466	P86-A464 WeakPolarHBondContact CA-O 3.34Å; P86-A464 HydrophobicContact CB-CB 4.2Å; F411-A464 HydrophobicContact CE1-CB 4.47Å; F411-A464 HydrophobicContact CZ-CB 4.46Å; V461-A464 HydrophobicContact CB-CB 3.97Å; V461-A464 HydrophobicContact CG1-CB 3.93Å; V461-A464 WeakPolarHBondContact O-CB 3.48Å; V461-A464 PolarHBondContact O-N 3.39Å; A464-V466 HydrophobicContact CB-CB 4.43Å; A464-V466 HydrophobicContact CB-CG2 4.18Å; A464-V466 PolarHBondContact O-N 3.27Å
465	P	88.6	Confident	86.2	Confident	17 Å²	17	29.4 Å²	29.4	11%	0.11	16%	0.155	C	C	.	.			trans	-80.2	54.9	177	35.5	-36.6	0	0	0	110.8	I419 T430 R431 F432	I419-P465 HydrophobicContact CG1-CG 4.26Å; T430-P465 WeakPolarHBondContact O-CB 3.45Å; R431-P465 WeakPolarHBondContact CA-O 3.13Å; F432-P465 PolarHBondContact N-O 2.91Å
466	V	91.5	Very high	85.8	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	123.5	-171.5	-175	0	0	0	0	110.4	P86 M87 M241 F411 F432 L434 L458 A464 I468	P86-V466 WeakPolarHBondContact CA-O 3.39Å; M87-V466 PolarHBondContact N-O 3.5Å; M87-V466 VanDerWaalsContact N-O 3.11Å; M241-V466 HydrophobicContact CE-CG2 3.86Å; F411-V466 HydrophobicContact CE2-CG1 4.32Å; F411-V466 HydrophobicContact CE2-CG2 4.08Å; F411-V466 HydrophobicContact CZ-CB 4.27Å; F411-V466 HydrophobicContact CZ-CG1 4.31Å; F411-V466 HydrophobicContact CZ-CG2 3.91Å; F432-V466 HydrophobicContact CB-CG1 4.34Å; F432-V466 HydrophobicContact CB-CG2 4.24Å; F432-V466 HydrophobicContact CD2-CG2 4.22Å; F432-V466 WeakPolarHBondContact O-CA 3.48Å; L434-V466 HydrophobicContact CD1-CG1 3.55Å; L434-V466 HydrophobicContact CG-CG1 4.01Å; L458-V466 HydrophobicContact CD2-CB 3.95Å; L458-V466 HydrophobicContact CD2-CG1 3.99Å; A464-V466 HydrophobicContact CB-CB 4.43Å; A464-V466 HydrophobicContact CB-CG2 4.18Å; A464-V466 PolarHBondContact O-N 3.27Å; V466-I468 HydrophobicContact CG1-CG1 4.14Å
467	A	90.9	Very high	85.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.4	162.3	0	0	0	0	0	109.4	F78 F85 M87 F432 I433 L434	F78-A467 HydrophobicContact CD1-CB 3.96Å; F78-A467 HydrophobicContact CE1-CB 3.61Å; F78-A467 HydrophobicContact CZ-CB 4.37Å; F85-A467 HydrophobicContact CD1-CB 4.32Å; F85-A467 HydrophobicContact CE1-CB 3.59Å; F85-A467 HydrophobicContact CZ-CB 4.3Å; M87-A467 HydrophobicContact CB-CB 4.21Å; M87-A467 CarbonylContact O-C 3.39Å; M87-A467 VanDerWaalsContact O-CA 3.31Å; M87-A467 WeakPolarHBondContact O-CA 3.34Å; F432-A467 PolarHBondContact O-N 2.92Å; I433-A467 WeakPolarHBondContact CA-O 3.49Å; I433-A467 HydrophobicContact CG1-CB 4.48Å; L434-A467 PolarHBondContact N-O 2.96Å
468	I	91.5	Very high	84.7	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.5	169.9	-60.6	-178	0	0	0	108	M87 T88 V89 L237 L434 L436 I454 L458 V466	M87-I468 PolarHBondContact O-N 2.86Å; T88-I468 CarbonylContact C-O 3.58Å; T88-I468 WeakPolarHBondContact CA-O 3.46Å; T88-I468 HydrophobicContact CG2-CB 4.43Å; V89-I468 PolarHBondContact N-O 2.87Å; L237-I468 HydrophobicContact CD2-CD1 4.28Å; L434-I468 HydrophobicContact CB-CG1 4.15Å; L434-I468 HydrophobicContact CD1-CD1 4.33Å; L434-I468 HydrophobicContact CD1-CG1 4.02Å; L434-I468 HydrophobicContact CG-CG1 4.47Å; L436-I468 HydrophobicContact CD1-CG2 3.61Å; L436-I468 HydrophobicContact CG-CG2 4.24Å; I454-I468 HydrophobicContact CD1-CG2 4.42Å; I454-I468 HydrophobicContact CG2-CB 4.28Å; I454-I468 HydrophobicContact CG2-CD1 3.92Å; I454-I468 HydrophobicContact CG2-CG2 3.92Å; L458-I468 HydrophobicContact CD1-CB 4.38Å; L458-I468 HydrophobicContact CD1-CD1 3.71Å; L458-I468 HydrophobicContact CD1-CG1 3.97Å; L458-I468 HydrophobicContact CD2-CD1 4.22Å; L458-I468 HydrophobicContact CG-CD1 3.94Å; V466-I468 HydrophobicContact CG1-CG1 4.14Å
469	V	92	Very high	84.2	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110.7	178.8	-168.6	0	0	0	0	107.8	F78 V89 I91 L101 L104 I433 L434 L436	F78-V469 HydrophobicContact CE2-CG2 3.93Å; F78-V469 HydrophobicContact CZ-CG2 3.56Å; V89-V469 HydrophobicContact CB-CB 4.49Å; V89-V469 HydrophobicContact CB-CG1 4.1Å; V89-V469 HydrophobicContact CB-CG2 4.34Å; V89-V469 HydrophobicContact CG1-CG1 4.19Å; I91-V469 HydrophobicContact CD1-CG1 3.54Å; I91-V469 HydrophobicContact CG1-CG1 3.9Å; L101-V469 HydrophobicContact CD2-CB 3.95Å; L101-V469 HydrophobicContact CD2-CG1 3.55Å; L104-V469 HydrophobicContact CD2-CB 4.45Å; L104-V469 HydrophobicContact CD2-CG1 3.95Å; L104-V469 HydrophobicContact CD2-CG2 4.29Å; I433-V469 HydrophobicContact CG2-CG2 4.09Å; L434-V469 PolarHBondContact O-N 3.12Å; L436-V469 PolarHBondContact N-O 3.49Å
470	L	90.2	Very high	83.6	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.016	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.2	-179.3	-178.9	69.6	0	0	0	109.3	V89 I91 L436 A438 L447 L450 I451 I454	V89-L470 PolarHBondContact O-N 2.97Å; I91-L470 PolarHBondContact N-O 3.22Å; L436-L470 HydrophobicContact CB-CD1 3.92Å; L436-L470 WeakPolarHBondContact O-CA 3.3Å; A438-L470 HydrophobicContact CB-CD1 3.65Å; L447-L470 HydrophobicContact CD1-CD2 4.35Å; L450-L470 HydrophobicContact CD2-CD1 4.07Å; I451-L470 HydrophobicContact CD1-CD2 4.15Å; I451-L470 HydrophobicContact CG1-CD2 3.55Å; I454-L470 HydrophobicContact CD1-CD1 4.49Å
471	E	90.1	Very high	82.7	Confident	9 Å²	9	33 Å²	33	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	121.9	169.4	178.3	166.1	-165	0	0	109.5	I91 Y100 L101 L436 A438 S439	I91-E471 WeakPolarHBondContact O-CA 3.09Å; Y100-E471 WeakPolarHBondContact CD2-OE1 3.5Å; Y100-E471 PolarHBondContact N-OE2 2.93Å; L101-E471 WeakPolarHBondContact CB-OE2 3.34Å; L101-E471 HydrophobicContact CD1-CB 3.46Å; L101-E471 VanDerWaalsContact CD1-CB 3.46Å; L101-E471 HydrophobicContact CG-CB 3.66Å; L101-E471 VanDerWaalsContact CG-OE2 3.28Å; L101-E471 WeakPolarHBondContact CG-OE2 3.47Å; L101-E471 PolarHBondContact N-OE2 3.04Å; L436-E471 PolarHBondContact O-N 2.93Å; A438-E471 CarbonylContact C-O 3.6Å; A438-E471 WeakPolarHBondContact CA-O 3.46Å; A438-E471 WeakPolarHBondContact CB-O 3.46Å; A438-E471 PolarHBondContact N-O 3.26Å; S439-E471 PolarHBondContact N-O 3.47Å
472	A	86.3	Confident	81.9	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	148.5	-176.3	0	0	0	0	0	111.7	I91 F92 T93 A438 L447 F474	I91-A472 PolarHBondContact O-N 3.07Å; I91-A472 VanDerWaalsContact O-N 3.11Å; F92-A472 WeakPolarHBondContact CA-O 3.45Å; F92-A472 HydrophobicContact CE1-CB 4.44Å; T93-A472 PolarHBondContact N-O 3.4Å; A438-A472 HydrophobicContact CB-CB 4.41Å; L447-A472 HydrophobicContact CD1-CB 3.91Å; L447-A472 HydrophobicContact CD2-CB 4.15Å; A472-F474 PolarHBondContact O-N 3.08Å
473	N	83.8	Confident	81.3	Confident	14 Å²	14	26.4 Å²	26.4	8%	0.075	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	113.5	173.5	-171	-37.5	0	0	0	110.2	T93 Q94 N96 K475 I476	T93-N473 WeakPolarHBondContact O-CA 3.38Å; T93-N473 VanDerWaalsContact O-CG 3.22Å; T93-N473 PolarHBondContact O-OD1 3.22Å; Q94-N473 PolarHBondContact O-ND2 3.44Å; N96-N473 PolarHBondContact OD1-ND2 3.47Å; N473-K475 PolarHBondContact O-N 2.91Å; N473-K475 WeakPolarHBondContact OD1-CB 3.45Å; N473-K475 PolarHBondContact OD1-N 3.35Å; N473-I476 HydrophobicContact CB-CD1 4.01Å; N473-I476 HydrophobicContact CB-CG1 4.22Å; N473-I476 WeakPolarHBondContact O-CB 3.45Å; N473-I476 PolarHBondContact O-N 3.2Å
474	F	81.1	Confident	80.6	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.018	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.8	-175.8	-168.1	-110.7	0	0	0	112.8	F92 A472 I476 L477 L478 V516 Y525 N789 F791	F92-F474 HydrophobicContact CB-CB 4.06Å; F92-F474 HydrophobicContact CD1-CB 3.9Å; F92-F474 AromaticContact CD1-CD2 3.82Å; F92-F474 HydrophobicContact CD1-CD2 3.82Å; F92-F474 HydrophobicContact CD1-CG 4.31Å; F92-F474 HydrophobicContact CD2-CD2 4.4Å; F92-F474 AromaticContact CE1-CD2 3.93Å; F92-F474 HydrophobicContact CE1-CD2 3.93Å; F92-F474 HydrophobicContact CE2-CD2 4.49Å; F92-F474 HydrophobicContact CG-CB 4.14Å; F92-F474 HydrophobicContact CG-CD2 4.07Å; F92-F474 HydrophobicContact CG-CG 4.42Å; F92-F474 HydrophobicContact CZ-CD2 4.27Å; A472-F474 PolarHBondContact O-N 3.08Å; F474-I476 PolarHBondContact O-N 3.02Å; F474-I476 VanDerWaalsContact O-N 3.14Å; F474-L477 HydrophobicContact CD2-CB 4.35Å; F474-L477 HydrophobicContact CD2-CD2 3.97Å; F474-L477 HydrophobicContact CE2-CD2 3.71Å; F474-L477 WeakPolarHBondContact O-CA 3.42Å; F474-L477 WeakPolarHBondContact O-CB 3.43Å; F474-L477 PolarHBondContact O-N 2.91Å; F474-L478 HydrophobicContact CD1-CD1 3.39Å; F474-L478 HydrophobicContact CE1-CD1 3.45Å; F474-L478 VanDerWaalsContact CE1-CD1 3.45Å; F474-L478 HydrophobicContact CG-CD1 4.15Å; F474-L478 HydrophobicContact CZ-CD1 4.2Å; F474-L478 WeakPolarHBondContact O-CD1 3.42Å; F474-L478 PolarHBondContact O-N 3.27Å; F474-V516 HydrophobicContact CE2-CG2 4.13Å; F474-Y525 AromaticContact CD1-CE1 3.96Å; F474-Y525 HydrophobicContact CD1-CE1 3.96Å; F474-Y525 AromaticContact CD2-CE1 3.95Å; F474-Y525 HydrophobicContact CD2-CE1 3.95Å; F474-Y525 AromaticContact CE1-CE1 3.93Å; F474-Y525 HydrophobicContact CE1-CE1 3.93Å; F474-Y525 AromaticContact CE2-CE1 3.95Å; F474-Y525 HydrophobicContact CE2-CE1 3.95Å; F474-Y525 AromaticContact CG-CE1 3.96Å; F474-Y525 HydrophobicContact CG-CE1 3.96Å; F474-Y525 AromaticContact CZ-CE1 3.94Å; F474-Y525 HydrophobicContact CZ-CE1 3.94Å; F474-N789 WeakPolarHBondContact CE1-OD1 3.15Å; F474-F791 AromaticContact CD1-CD2 3.5Å; F474-F791 HydrophobicContact CD1-CD2 3.5Å; F474-F791 AromaticContact CD1-CE2 3.58Å; F474-F791 HydrophobicContact CD1-CE2 3.58Å; F474-F791 HydrophobicContact CD1-CG 4.21Å; F474-F791 HydrophobicContact CD1-CZ 4.3Å; F474-F791 HydrophobicContact CE1-CB 4.44Å; F474-F791 AromaticContact CE1-CD2 3.7Å; F474-F791 HydrophobicContact CE1-CD2 3.7Å; F474-F791 HydrophobicContact CE1-CE2 4.26Å; F474-F791 HydrophobicContact CE1-CG 4.14Å
475	K	79	Confident	79.3	Confident	81 Å²	81	25.9 Å²	25.9	35%	0.352	15%	0.147	S	C	.	.	H	α-helix	trans	-52	-37.4	172.9	-163.1	-158.7	-174.5	-158.2	0	111.9	N473 L477 L478 G479 D480 C483	N473-K475 PolarHBondContact O-N 2.91Å; N473-K475 WeakPolarHBondContact OD1-CB 3.45Å; N473-K475 PolarHBondContact OD1-N 3.35Å; K475-L477 VanDerWaalsContact C-N 3.29Å; K475-L477 PolarHBondContact O-N 2.81Å; K475-L478 PolarHBondContact O-N 2.88Å; K475-G479 PolarHBondContact O-N 3.31Å; K475-D480 VanDerWaalsContact CE-OD1 3.22Å; K475-D480 WeakPolarHBondContact CE-OD1 3.19Å; K475-D480 IonicContact NZ-OD1 2.64Å; K475-D480 PolarHBondContact NZ-OD1 3.01Å; K475-C483 HydrophobicContact CD-CB 4.24Å; K475-C483 HydrophobicContact CG-CB 3.52Å; K475-C483 WeakPolarHBondContact CG-SG 3.49Å
476	I	79.5	Confident	78.2	Confident	25 Å²	25	25.6 Å²	25.6	13%	0.128	14%	0.144	C	C	.	.	H	α-helix	trans	-72.6	-25.4	-178.2	-52.5	178	0	0	0	111.2	I441 L442 N473 F474	I441-I476 WeakPolarHBondContact O-CD1 3.48Å; L442-I476 WeakPolarHBondContact O-CG2 3.44Å; N473-I476 HydrophobicContact CB-CD1 4.01Å; N473-I476 HydrophobicContact CB-CG1 4.22Å; N473-I476 WeakPolarHBondContact O-CB 3.45Å; N473-I476 PolarHBondContact O-N 3.2Å; F474-I476 PolarHBondContact O-N 3.02Å; F474-I476 VanDerWaalsContact O-N 3.14Å
477	L	78.9	Confident	76.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-75.8	-37.1	175.6	-160.1	71.1	0	0	0	111.6	K444 L447 A448 F474 K475 N512 L515 V516	K444-L477 WeakPolarHBondContact CD-O 3.41Å; K444-L477 WeakPolarHBondContact CE-O 3.37Å; K444-L477 PolarHBondContact NZ-O 3.45Å; L447-L477 HydrophobicContact CD2-CD1 4.26Å; L447-L477 HydrophobicContact CG-CD1 4.43Å; A448-L477 HydrophobicContact CB-CD1 4.46Å; F474-L477 HydrophobicContact CD2-CB 4.35Å; F474-L477 HydrophobicContact CD2-CD2 3.97Å; F474-L477 HydrophobicContact CE2-CD2 3.71Å; F474-L477 WeakPolarHBondContact O-CA 3.42Å; F474-L477 WeakPolarHBondContact O-CB 3.43Å; F474-L477 PolarHBondContact O-N 2.91Å; K475-L477 VanDerWaalsContact C-N 3.29Å; K475-L477 PolarHBondContact O-N 2.81Å; L477-N512 HydrophobicContact CD2-CB 3.87Å; L477-N512 HydrophobicContact CG-CB 4Å; L477-N512 PolarHBondContact O-ND2 2.66Å; L477-N512 VanDerWaalsContact O-ND2 3.09Å; L477-N512 PolarHBondContact O-OD1 2.97Å; L477-L515 HydrophobicContact CD1-CD2 4.44Å; L477-V516 HydrophobicContact CD2-CG2 3.91Å
478	L	75	Confident	74.7	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.037	18%	0.184	C	C	.	.	H	α-helix	trans	-73.2	-42.3	170.8	-69	82	0	0	0	111.8	F474 K475 V482 I486 V509 F791	F474-L478 HydrophobicContact CD1-CD1 3.39Å; F474-L478 HydrophobicContact CE1-CD1 3.45Å; F474-L478 VanDerWaalsContact CE1-CD1 3.45Å; F474-L478 HydrophobicContact CG-CD1 4.15Å; F474-L478 HydrophobicContact CZ-CD1 4.2Å; F474-L478 WeakPolarHBondContact O-CD1 3.42Å; F474-L478 PolarHBondContact O-N 3.27Å; K475-L478 PolarHBondContact O-N 2.88Å; L478-V482 HydrophobicContact CB-CB 4.22Å; L478-V482 HydrophobicContact CB-CG1 4.15Å; L478-V482 HydrophobicContact CD2-CG1 3.84Å; L478-I486 HydrophobicContact CD2-CD1 4.03Å; L478-V509 HydrophobicContact CD2-CG2 3.84Å; L478-F791 HydrophobicContact CD1-CD1 4.27Å; L478-F791 HydrophobicContact CD1-CE1 4.44Å; L478-F791 HydrophobicContact CD1-CG 4.43Å; L478-F791 HydrophobicContact CD2-CB 4.33Å; L478-F791 HydrophobicContact CD2-CD1 3.6Å; L478-F791 HydrophobicContact CD2-CE1 4.23Å; L478-F791 HydrophobicContact CD2-CG 4.13Å
479	G	74.1	Confident	72.6	Confident	24 Å²	24	36.9 Å²	36.9	25%	0.247	21%	0.214	C	C	.	.			trans	98.4	150	-169.3	0	0	0	0	0	112.3	K475 L481 V482 C483	K475-G479 PolarHBondContact O-N 3.31Å; G479-L481 PolarHBondContact O-N 3.46Å; G479-V482 PolarHBondContact O-N 3.46Å; G479-C483 PolarHBondContact O-N 3.24Å; G479-C483 PolarHBondContact O-SG 3.34Å; G479-C483 VanDerWaalsContact O-SG 3.35Å
480	D	70.5	Confident	70	Confident	105 Å²	105	43.5 Å²	43.5	56%	0.561	25%	0.249	S	C	*	.	H	α-helix	trans	-59.3	-40.7	-170.7	-76.4	-63.4	0	0	0	113.9	K475 V482 C483 S484	K475-D480 VanDerWaalsContact CE-OD1 3.22Å; K475-D480 WeakPolarHBondContact CE-OD1 3.19Å; K475-D480 IonicContact NZ-OD1 2.64Å; K475-D480 PolarHBondContact NZ-OD1 3.01Å; D480-V482 PolarHBondContact O-N 3.15Å; D480-C483 CarbonylContact O-C 3.59Å; D480-C483 PolarHBondContact O-N 3.12Å; D480-C483 VanDerWaalsContact O-N 3.15Å; D480-S484 PolarHBondContact O-N 3.05Å; D480-S484 PolarHBondContact O-OG 2.92Å; D480-S484 VanDerWaalsContact O-OG 3.09Å
481	L	64.3	Low	67.3	Low	131 Å²	131	48.8 Å²	48.8	69%	0.686	28%	0.278	S	S	*	.	H	α-helix	trans	-59.5	-43.5	-179.1	-179	65.4	0	0	0	112.7	G479 C483 S484 T485	G479-L481 PolarHBondContact O-N 3.46Å; L481-C483 VanDerWaalsContact C-N 3.33Å; L481-S484 WeakPolarHBondContact CA-OG 3.44Å; L481-S484 PolarHBondContact O-OG 3.3Å; L481-T485 PolarHBondContact O-N 3.01Å; L481-T485 PolarHBondContact O-OG1 3.17Å
482	V	68.9	Low	64.7	Low	8 Å²	8	54 Å²	54	5%	0.048	31%	0.31	C	S	.	.	H	α-helix	trans	-69.8	-35.1	178.2	179.6	0	0	0	0	110.3	L478 G479 D480 T485 I486 I505 I508 V509	L478-V482 HydrophobicContact CB-CB 4.22Å; L478-V482 HydrophobicContact CB-CG1 4.15Å; L478-V482 HydrophobicContact CD2-CG1 3.84Å; G479-V482 PolarHBondContact O-N 3.46Å; D480-V482 PolarHBondContact O-N 3.15Å; V482-T485 WeakPolarHBondContact CA-OG1 3.44Å; V482-T485 PolarHBondContact O-OG1 3.49Å; V482-I486 HydrophobicContact CG1-CD1 3.83Å; V482-I486 WeakPolarHBondContact O-CB 3.39Å; V482-I486 WeakPolarHBondContact O-CD1 3.43Å; V482-I486 VanDerWaalsContact O-CG1 3.25Å; V482-I486 WeakPolarHBondContact O-CG1 3.2Å; V482-I486 PolarHBondContact O-N 3.14Å; V482-I486 VanDerWaalsContact O-N 3.11Å; V482-I505 HydrophobicContact CG1-CG1 4.32Å; V482-I505 HydrophobicContact CG1-CG2 4.04Å; V482-I505 HydrophobicContact CG2-CG1 4.44Å; V482-I508 HydrophobicContact CG2-CB 4.48Å; V482-I508 HydrophobicContact CG2-CD1 3.9Å; V482-I508 HydrophobicContact CG2-CG2 4.15Å; V482-V509 HydrophobicContact CG1-CG2 4.42Å
483	C	66.4	Low	62.3	Low	1 Å²	1	60 Å²	60	1%	0.007	35%	0.347	C	S	.	.	H	α-helix	trans	-75.8	-34.5	177.2	-61.6	0	0	0	0	112.8	K475 G479 D480 L481 T485 I486 L487	K475-C483 HydrophobicContact CD-CB 4.24Å; K475-C483 HydrophobicContact CG-CB 3.52Å; K475-C483 WeakPolarHBondContact CG-SG 3.49Å; G479-C483 PolarHBondContact O-N 3.24Å; G479-C483 PolarHBondContact O-SG 3.34Å; G479-C483 VanDerWaalsContact O-SG 3.35Å; D480-C483 CarbonylContact O-C 3.59Å; D480-C483 PolarHBondContact O-N 3.12Å; D480-C483 VanDerWaalsContact O-N 3.15Å; L481-C483 VanDerWaalsContact C-N 3.33Å; C483-T485 VanDerWaalsContact C-N 3.3Å; C483-T485 PolarHBondContact O-N 3.3Å; C483-I486 PolarHBondContact O-N 3.41Å; C483-L487 HydrophobicContact CB-CD1 4.24Å; C483-L487 WeakPolarHBondContact O-CB 3.43Å; C483-L487 WeakPolarHBondContact O-CD1 3.48Å; C483-L487 PolarHBondContact O-N 2.98Å
484	S	64	Low	59.9	Low	68 Å²	68	66.7 Å²	66.7	48%	0.476	38%	0.376	S	S	.	.	H	α-helix	trans	-69.2	-27.1	175.5	50.6	0	0	0	0	113.3	D480 L481 S488	D480-S484 PolarHBondContact O-N 3.05Å; D480-S484 PolarHBondContact O-OG 2.92Å; D480-S484 VanDerWaalsContact O-OG 3.09Å; L481-S484 WeakPolarHBondContact CA-OG 3.44Å; L481-S484 PolarHBondContact O-OG 3.3Å; S484-S488 VanDerWaalsContact O-CB 3.27Å; S484-S488 WeakPolarHBondContact O-CB 3.17Å
485	T	59.6	Low	57.7	Low	43 Å²	43	69.2 Å²	69.2	26%	0.264	39%	0.393	S	S	.	.	H	α-helix	trans	-80	-39.8	174.3	39.9	0	0	0	0	111.7	L481 V482 C483 F498 I505	L481-T485 PolarHBondContact O-N 3.01Å; L481-T485 PolarHBondContact O-OG1 3.17Å; V482-T485 WeakPolarHBondContact CA-OG1 3.44Å; V482-T485 PolarHBondContact O-OG1 3.49Å; C483-T485 VanDerWaalsContact C-N 3.3Å; C483-T485 PolarHBondContact O-N 3.3Å; T485-F498 HydrophobicContact CG2-CE1 4.21Å; T485-F498 HydrophobicContact CG2-CZ 4.12Å; T485-I505 HydrophobicContact CG2-CD1 4.27Å; T485-I505 WeakPolarHBondContact OG1-CD1 3.36Å
486	I	63.7	Low	55.8	Low	11 Å²	11	73.7 Å²	73.7	6%	0.056	42%	0.421	C	S	.	.	H	α-helix	trans	-71	-43.2	177.3	-67.5	170.2	0	0	0	112.8	L478 V482 C483 S488 I505 V509 Y794	L478-I486 HydrophobicContact CD2-CD1 4.03Å; V482-I486 HydrophobicContact CG1-CD1 3.83Å; V482-I486 WeakPolarHBondContact O-CB 3.39Å; V482-I486 WeakPolarHBondContact O-CD1 3.43Å; V482-I486 VanDerWaalsContact O-CG1 3.25Å; V482-I486 WeakPolarHBondContact O-CG1 3.2Å; V482-I486 PolarHBondContact O-N 3.14Å; V482-I486 VanDerWaalsContact O-N 3.11Å; C483-I486 PolarHBondContact O-N 3.41Å; I486-S488 PolarHBondContact O-N 2.93Å; I486-I505 HydrophobicContact CD1-CG2 4.06Å; I486-I505 HydrophobicContact CG1-CG2 4.16Å; I486-V509 HydrophobicContact CD1-CG2 4.04Å; I486-Y794 HydrophobicContact CG2-CG 4.38Å
487	L	60.1	Low	53.8	Low	85 Å²	85	76 Å²	76	45%	0.445	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	9	-174.5	-77.3	93.1	0	0	0	115	C483 P489 F791	C483-L487 HydrophobicContact CB-CD1 4.24Å; C483-L487 WeakPolarHBondContact O-CB 3.43Å; C483-L487 WeakPolarHBondContact O-CD1 3.48Å; C483-L487 PolarHBondContact O-N 2.98Å; L487-P489 VanDerWaalsContact C-CD 3.49Å; L487-P489 WeakPolarHBondContact O-CD 3.16Å; L487-F791 HydrophobicContact CD1-CE1 4.02Å
488	S	50.8	Low	52	Low	55 Å²	55	78 Å²	78	39%	0.385	45%	0.448	S	S	.	.			trans	-126.8	66.6	-176.3	-152.6	0	0	0	0	113.6	S484 I486 N490	S484-S488 VanDerWaalsContact O-CB 3.27Å; S484-S488 WeakPolarHBondContact O-CB 3.17Å; I486-S488 PolarHBondContact O-N 2.93Å; S488-N490 PolarHBondContact O-N 3.26Å; S488-N490 VanDerWaalsContact O-N 3.13Å
489	P	47	Very low	50.9	Low	100 Å²	100	83.5 Å²	83.5	65%	0.649	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.4	-174.3	28	-36.3	0	0	0	115.2	L487	L487-P489 VanDerWaalsContact C-CD 3.49Å; L487-P489 WeakPolarHBondContact O-CD 3.16Å
490	N	37.9	Very low	49.7	Very low	138 Å²	138	90.2 Å²	90.2	74%	0.738	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-4.1	-167.7	-69	-0.7	0	0	0	115.2	S488 T492	S488-N490 PolarHBondContact O-N 3.26Å; S488-N490 VanDerWaalsContact O-N 3.13Å; N490-T492 PolarHBondContact O-N 2.85Å; N490-T492 VanDerWaalsContact O-N 3.11Å
491	N	32.5	Very low	49.3	Very low	114 Å²	114	89.7 Å²	89.7	61%	0.61	50%	0.501	S	S	*	.			trans	-86.7	77.3	-180	-82.2	-16.5	0	0	0	111.9	T493	N491-T493 PolarHBondContact O-N 3.36Å
492	T	35.4	Very low	49.2	Very low	119 Å²	119	84.6 Å²	84.6	73%	0.73	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-61.7	-11.5	-176.9	52.9	0	0	0	0	115.5	N490	N490-T492 PolarHBondContact O-N 2.85Å; N490-T492 VanDerWaalsContact O-N 3.11Å
493	T	36.8	Very low	49.1	Very low	128 Å²	128	88.3 Å²	88.3	79%	0.785	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-87.3	1.2	-171.4	34.7	0	0	0	0	116.5	N491	N491-T493 PolarHBondContact O-N 3.36Å
494	F	32.4	Very low	49.2	Very low	153 Å²	153	94.1 Å²	94.1	67%	0.671	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-117	-1.7	179.3	-117.3	-89.8	0	0	0	115.7	N496 F498	F494-N496 VanDerWaalsContact C-N 3.26Å; F494-N496 PolarHBondContact O-N 3.21Å; F494-F498 HydrophobicContact CB-CE2 4.36Å; F494-F498 HydrophobicContact CD1-CE2 4.44Å; F494-F498 WeakPolarHBondContact O-CD2 3.49Å
495	C	35.2	Very low	49.5	Very low	57 Å²	57	92 Å²	92	39%	0.385	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-70.1	-3.3	-165.4	-71.6	0	0	0	0	117.1	S497	C495-S497 PolarHBondContact O-N 2.98Å
496	N	39.2	Very low	50	Low	176 Å²	176	90 Å²	90	94%	0.941	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-88.7	2	-170.2	-73.7	-7	0	0	0	115.6	F494	F494-N496 VanDerWaalsContact C-N 3.26Å; F494-N496 PolarHBondContact O-N 3.21Å
497	S	37.7	Very low	50.5	Low	72 Å²	72	94.5 Å²	94.5	50%	0.503	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-121.7	8.6	176.7	55.6	0	0	0	0	114.4	C495 T499	C495-S497 PolarHBondContact O-N 2.98Å; S497-T499 PolarHBondContact O-N 3.44Å
498	F	40.9	Very low	51.2	Low	42 Å²	42	91.8 Å²	91.8	18%	0.184	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.6	-155.3	-107.2	-97.3	0	0	0	117.9	T485 F494 Q500 E501 S502	T485-F498 HydrophobicContact CG2-CE1 4.21Å; T485-F498 HydrophobicContact CG2-CZ 4.12Å; F494-F498 HydrophobicContact CB-CE2 4.36Å; F494-F498 HydrophobicContact CD1-CE2 4.44Å; F494-F498 WeakPolarHBondContact O-CD2 3.49Å; F498-Q500 VanDerWaalsContact C-N 3.27Å; F498-Q500 PolarHBondContact O-N 2.77Å; F498-E501 HydrophobicContact CD1-CB 4.23Å; F498-E501 HydrophobicContact CE1-CB 4.34Å; F498-E501 WeakPolarHBondContact CZ-OE2 3.49Å; F498-E501 PolarHBondContact O-N 2.92Å; F498-S502 PolarHBondContact O-N 3.26Å; F498-S502 VanDerWaalsContact O-N 3.11Å; F498-S502 PolarHBondContact O-OG 3.46Å
499	T	51	Low	52.4	Low	124 Å²	124	89.2 Å²	89.2	76%	0.761	48%	0.477	S	S	*	.	H	α-helix	trans	-66.5	-23.7	-171.8	49.4	0	0	0	0	114.7	S497 S502	S497-T499 PolarHBondContact O-N 3.44Å; T499-S502 PolarHBondContact O-OG 3.17Å
500	Q	50.3	Low	53.8	Low	164 Å²	164	84.8 Å²	84.8	77%	0.766	45%	0.449	S	S	*	.	H	α-helix	trans	-96.8	-27.8	177.4	-165.7	165.4	2.3	0	0	112.7	F498 F504	F498-Q500 VanDerWaalsContact C-N 3.27Å; F498-Q500 PolarHBondContact O-N 2.77Å; Q500-F504 PolarHBondContact O-N 2.67Å
501	E	60.6	Low	55.6	Low	94 Å²	94	82.7 Å²	82.7	44%	0.439	44%	0.438	S	S	.	.	H	α-helix	trans	-72.8	-36.4	176.6	-63.9	-168.5	156.6	0	0	111.9	F498 K503 F504 I505	F498-E501 HydrophobicContact CD1-CB 4.23Å; F498-E501 HydrophobicContact CE1-CB 4.34Å; F498-E501 WeakPolarHBondContact CZ-OE2 3.49Å; F498-E501 PolarHBondContact O-N 2.92Å; E501-K503 PolarHBondContact O-N 3.24Å; E501-F504 PolarHBondContact O-N 3.36Å; E501-I505 WeakPolarHBondContact O-CB 3.46Å; E501-I505 WeakPolarHBondContact O-CG1 3.44Å; E501-I505 PolarHBondContact O-N 2.89Å
502	S	62.6	Low	57.9	Low	24 Å²	24	77.6 Å²	77.6	17%	0.168	41%	0.411	C	S	.	.	H	α-helix	trans	-61.5	-43	176.9	57.1	0	0	0	0	113.1	F498 T499 F504 I505 A506 I747	F498-S502 PolarHBondContact O-N 3.26Å; F498-S502 VanDerWaalsContact O-N 3.11Å; F498-S502 PolarHBondContact O-OG 3.46Å; T499-S502 PolarHBondContact O-OG 3.17Å; S502-F504 PolarHBondContact O-N 3.2Å; S502-I505 PolarHBondContact O-N 2.9Å; S502-A506 WeakPolarHBondContact O-CB 3.29Å; S502-A506 PolarHBondContact O-N 3.44Å; S502-I747 WeakPolarHBondContact OG-CG2 3.33Å
503	K	66.4	Low	59.9	Low	86 Å²	86	72.5 Å²	72.5	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-41.4	173.6	-72.2	-151.2	171.5	-152.4	0	112.2	E501 A506 Q507 E746 E749	E501-K503 PolarHBondContact O-N 3.24Å; K503-A506 PolarHBondContact O-N 2.79Å; K503-Q507 WeakPolarHBondContact O-CB 3.41Å; K503-Q507 PolarHBondContact O-N 2.87Å; K503-E746 WeakPolarHBondContact CE-O 3.33Å; K503-E746 PolarHBondContact NZ-O 2.88Å; K503-E749 IonicContact NZ-OE2 2.66Å; K503-E749 PolarHBondContact NZ-OE2 3.38Å
504	F	69.6	Low	62	Low	123 Å²	123	72.6 Å²	72.6	54%	0.539	37%	0.37	S	S	.	.	H	α-helix	trans	-67.2	-40	178.5	-175.5	-113.8	0	0	0	112.2	Q500 E501 S502 Q507 I508	Q500-F504 PolarHBondContact O-N 2.67Å; E501-F504 PolarHBondContact O-N 3.36Å; S502-F504 PolarHBondContact O-N 3.2Å; F504-Q507 PolarHBondContact O-N 3.43Å; F504-I508 HydrophobicContact CD1-CD1 3.88Å; F504-I508 HydrophobicContact CE1-CD1 3.49Å; F504-I508 VanDerWaalsContact CE1-CD1 3.49Å; F504-I508 HydrophobicContact CE2-CD1 4.16Å; F504-I508 HydrophobicContact CG-CD1 4.39Å; F504-I508 HydrophobicContact CZ-CD1 3.66Å; F504-I508 WeakPolarHBondContact O-CG1 3.37Å; F504-I508 PolarHBondContact O-N 2.78Å
505	I	70.5	Confident	64.4	Low	23 Å²	23	67.3 Å²	67.3	12%	0.118	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-50.9	171.8	-75.2	162.5	0	0	0	110.7	V482 T485 I486 E501 S502 Q507 I508 V509	V482-I505 HydrophobicContact CG1-CG1 4.32Å; V482-I505 HydrophobicContact CG1-CG2 4.04Å; V482-I505 HydrophobicContact CG2-CG1 4.44Å; T485-I505 HydrophobicContact CG2-CD1 4.27Å; T485-I505 WeakPolarHBondContact OG1-CD1 3.36Å; I486-I505 HydrophobicContact CD1-CG2 4.06Å; I486-I505 HydrophobicContact CG1-CG2 4.16Å; E501-I505 WeakPolarHBondContact O-CB 3.46Å; E501-I505 WeakPolarHBondContact O-CG1 3.44Å; E501-I505 PolarHBondContact O-N 2.89Å; S502-I505 PolarHBondContact O-N 2.9Å; I505-Q507 VanDerWaalsContact C-N 3.33Å; I505-Q507 PolarHBondContact O-N 3.24Å; I505-I508 PolarHBondContact O-N 2.94Å; I505-V509 WeakPolarHBondContact O-CG2 3.38Å; I505-V509 PolarHBondContact O-N 3.31Å
506	A	70.2	Confident	66.7	Low	1 Å²	1	64.6 Å²	64.6	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-57.5	-44.4	178.6	0	0	0	0	0	112	S502 K503 V509 G510 L748 A750 L751	S502-A506 WeakPolarHBondContact O-CB 3.29Å; S502-A506 PolarHBondContact O-N 3.44Å; K503-A506 PolarHBondContact O-N 2.79Å; A506-V509 PolarHBondContact O-N 3.31Å; A506-G510 PolarHBondContact O-N 3.27Å; A506-L748 HydrophobicContact CB-CD2 4.18Å; A506-A750 HydrophobicContact CB-CB 4.27Å; A506-L751 HydrophobicContact CB-CD1 4.46Å; A506-L751 HydrophobicContact CB-CG 4.13Å
507	Q	74.2	Confident	68.7	Low	106 Å²	106	57 Å²	57	50%	0.495	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-45.1	176.3	-173.8	176.3	1.9	0	0	112.3	K503 F504 I505 V509 G510 D511 A750	K503-Q507 WeakPolarHBondContact O-CB 3.41Å; K503-Q507 PolarHBondContact O-N 2.87Å; F504-Q507 PolarHBondContact O-N 3.43Å; I505-Q507 VanDerWaalsContact C-N 3.33Å; I505-Q507 PolarHBondContact O-N 3.24Å; Q507-V509 VanDerWaalsContact C-N 3.33Å; Q507-V509 PolarHBondContact O-N 2.89Å; Q507-G510 PolarHBondContact O-N 3.21Å; Q507-D511 PolarHBondContact O-N 2.98Å; Q507-A750 HydrophobicContact CB-CB 4.08Å
508	I	75.1	Confident	70.8	Confident	29 Å²	29	55.3 Å²	55.3	15%	0.149	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-41.3	176.9	-71.8	170.9	0	0	0	111	V482 F504 I505 N512	V482-I508 HydrophobicContact CG2-CB 4.48Å; V482-I508 HydrophobicContact CG2-CD1 3.9Å; V482-I508 HydrophobicContact CG2-CG2 4.15Å; F504-I508 HydrophobicContact CD1-CD1 3.88Å; F504-I508 HydrophobicContact CE1-CD1 3.49Å; F504-I508 VanDerWaalsContact CE1-CD1 3.49Å; F504-I508 HydrophobicContact CE2-CD1 4.16Å; F504-I508 HydrophobicContact CG-CD1 4.39Å; F504-I508 HydrophobicContact CZ-CD1 3.66Å; F504-I508 WeakPolarHBondContact O-CG1 3.37Å; F504-I508 PolarHBondContact O-N 2.78Å; I505-I508 PolarHBondContact O-N 2.94Å; I508-N512 WeakPolarHBondContact CG2-ND2 3.31Å; I508-N512 PolarHBondContact O-N 3.27Å; I508-N512 PolarHBondContact O-ND2 2.95Å
509	V	75.6	Confident	72.8	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-60.3	-49.2	176.9	173.1	0	0	0	0	110.4	L478 V482 I486 I505 A506 Q507 N512 F513 L751 I792	L478-V509 HydrophobicContact CD2-CG2 3.84Å; V482-V509 HydrophobicContact CG1-CG2 4.42Å; I486-V509 HydrophobicContact CD1-CG2 4.04Å; I505-V509 WeakPolarHBondContact O-CG2 3.38Å; I505-V509 PolarHBondContact O-N 3.31Å; A506-V509 PolarHBondContact O-N 3.31Å; Q507-V509 VanDerWaalsContact C-N 3.33Å; Q507-V509 PolarHBondContact O-N 2.89Å; V509-N512 PolarHBondContact O-N 2.89Å; V509-F513 PolarHBondContact O-N 2.86Å; V509-L751 HydrophobicContact CB-CD2 4.02Å; V509-L751 HydrophobicContact CG1-CD2 3.75Å; V509-I792 HydrophobicContact CG1-CG1 4.47Å
510	G	75.2	Confident	74.4	Confident	6 Å²	6	47.8 Å²	47.8	6%	0.062	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-48.5	-179.5	0	0	0	0	0	113.8	A506 Q507 N512 F513 H514 E754	A506-G510 PolarHBondContact O-N 3.27Å; Q507-G510 PolarHBondContact O-N 3.21Å; G510-N512 PolarHBondContact O-N 2.93Å; G510-N512 VanDerWaalsContact O-N 3.09Å; G510-F513 PolarHBondContact O-N 2.94Å; G510-H514 WeakPolarHBondContact O-CB 3.29Å; G510-H514 PolarHBondContact O-N 3.35Å; G510-E754 VanDerWaalsContact CA-OE1 3.22Å; G510-E754 WeakPolarHBondContact CA-OE1 3.29Å; G510-E754 VanDerWaalsContact O-OE1 3.11Å
511	D	77.3	Confident	76.1	Confident	95 Å²	95	41 Å²	41	51%	0.508	20%	0.204	S	C	.	.	H	α-helix	trans	-53.5	-37.6	177.5	-80.2	-26.1	0	0	0	112.3	Q507 L515	Q507-D511 PolarHBondContact O-N 2.98Å; D511-L515 WeakPolarHBondContact O-CB 3.49Å; D511-L515 PolarHBondContact O-N 3.17Å; D511-L515 VanDerWaalsContact O-N 3.13Å
512	N	79.6	Confident	77.5	Confident	7 Å²	7	36.6 Å²	36.6	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-80.6	-34.5	179	-58.6	-40.1	0	0	0	113	K444 L477 I508 V509 G510 L515 V516	K444-N512 WeakPolarHBondContact CE-OD1 3.27Å; K444-N512 VanDerWaalsContact NZ-CG 3.35Å; K444-N512 PolarHBondContact NZ-ND2 3.16Å; K444-N512 VanDerWaalsContact NZ-ND2 3.1Å; K444-N512 PolarHBondContact NZ-OD1 3.24Å; L477-N512 HydrophobicContact CD2-CB 3.87Å; L477-N512 HydrophobicContact CG-CB 4Å; L477-N512 PolarHBondContact O-ND2 2.66Å; L477-N512 VanDerWaalsContact O-ND2 3.09Å; L477-N512 PolarHBondContact O-OD1 2.97Å; I508-N512 WeakPolarHBondContact CG2-ND2 3.31Å; I508-N512 PolarHBondContact O-N 3.27Å; I508-N512 PolarHBondContact O-ND2 2.95Å; V509-N512 PolarHBondContact O-N 2.89Å; G510-N512 PolarHBondContact O-N 2.93Å; G510-N512 VanDerWaalsContact O-N 3.09Å; N512-L515 PolarHBondContact O-N 2.79Å; N512-V516 WeakPolarHBondContact O-CG2 3.45Å; N512-V516 PolarHBondContact O-N 2.78Å
513	F	77.3	Confident	78.6	Confident	12 Å²	12	35.6 Å²	35.6	5%	0.053	18%	0.176	C	C	.	.	H	α-helix	trans	-68.1	-46.1	174.7	179.8	-97.6	0	0	0	110.9	V509 G510 L515 V516 H517 P697 E754 N789 I792	V509-F513 PolarHBondContact O-N 2.86Å; G510-F513 PolarHBondContact O-N 2.94Å; F513-L515 PolarHBondContact O-N 3.12Å; F513-V516 PolarHBondContact O-N 3.08Å; F513-V516 VanDerWaalsContact O-N 3.09Å; F513-H517 AromaticContact CD2-CD2 3.77Å; F513-H517 AromaticContact CE1-CD2 3.72Å; F513-H517 AromaticContact CE2-CD2 3.33Å; F513-H517 WeakPolarHBondContact CE2-CD2 3.3Å; F513-H517 AromaticContact CE2-NE2 3.21Å; F513-H517 WeakPolarHBondContact CE2-NE2 3.48Å; F513-H517 AromaticContact CZ-CD2 3.33Å; F513-H517 WeakPolarHBondContact CZ-CD2 3.28Å; F513-H517 AromaticContact CZ-CE1 3.88Å; F513-H517 AromaticContact CZ-NE2 3.23Å; F513-H517 WeakPolarHBondContact CZ-NE2 3.47Å; F513-H517 PolarHBondContact O-N 3.22Å; F513-P697 HydrophobicContact CE1-CG 4.12Å; F513-P697 HydrophobicContact CZ-CB 4.26Å; F513-P697 HydrophobicContact CZ-CG 4.27Å; F513-E754 VanDerWaalsContact CD1-CD 3.5Å; F513-E754 VanDerWaalsContact CD1-OE1 3.24Å; F513-E754 WeakPolarHBondContact CD1-OE1 3.42Å; F513-E754 WeakPolarHBondContact CD1-OE2 3.34Å; F513-N789 HydrophobicContact CD2-CB 3.6Å; F513-N789 WeakPolarHBondContact CD2-ND2 3.49Å; F513-N789 HydrophobicContact CE2-CB 3.58Å; F513-I792 HydrophobicContact CD2-CD1 4.38Å; F513-I792 HydrophobicContact CE2-CD1 4.29Å; F513-I792 HydrophobicContact CZ-CD1 4.48Å
514	H	80.6	Confident	79.6	Confident	130 Å²	130	31.5 Å²	31.5	60%	0.602	16%	0.159	S	C	*	.	H	α-helix	trans	-57.4	-44.9	171.4	178.3	-106.4	0	0	0	111.9	G510 V516 H517 A518	G510-H514 WeakPolarHBondContact O-CB 3.29Å; G510-H514 PolarHBondContact O-N 3.35Å; H514-V516 VanDerWaalsContact C-N 3.29Å; H514-V516 PolarHBondContact O-N 2.67Å; H514-H517 PolarHBondContact O-N 3.05Å; H514-A518 WeakPolarHBondContact O-CB 3.37Å; H514-A518 PolarHBondContact O-N 3.22Å
515	L	84	Confident	80.2	Confident	41 Å²	41	26.2 Å²	26.2	22%	0.215	14%	0.135	C	C	.	.	H	α-helix	trans	-56	-42.9	173.5	175.1	65.6	0	0	0	112.2	A448 L477 D511 N512 F513 S519	A448-L515 HydrophobicContact CB-CD2 3.75Å; L477-L515 HydrophobicContact CD1-CD2 4.44Å; D511-L515 WeakPolarHBondContact O-CB 3.49Å; D511-L515 PolarHBondContact O-N 3.17Å; D511-L515 VanDerWaalsContact O-N 3.13Å; N512-L515 PolarHBondContact O-N 2.79Å; F513-L515 PolarHBondContact O-N 3.12Å; L515-S519 WeakPolarHBondContact O-CB 3.38Å; L515-S519 PolarHBondContact O-N 3.22Å; L515-S519 VanDerWaalsContact O-N 3.13Å; L515-S519 PolarHBondContact O-OG 2.98Å
516	V	83.8	Confident	80.5	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.6	-52.1	179.2	160	0	0	0	0	111.8	F92 F474 L477 N512 F513 H514 A518 S519 L520 P523	F92-V516 HydrophobicContact CE2-CG1 3.93Å; F92-V516 HydrophobicContact CE2-CG2 4.22Å; F92-V516 HydrophobicContact CZ-CG1 4.3Å; F92-V516 HydrophobicContact CZ-CG2 3.81Å; F474-V516 HydrophobicContact CE2-CG2 4.13Å; L477-V516 HydrophobicContact CD2-CG2 3.91Å; N512-V516 WeakPolarHBondContact O-CG2 3.45Å; N512-V516 PolarHBondContact O-N 2.78Å; F513-V516 PolarHBondContact O-N 3.08Å; F513-V516 VanDerWaalsContact O-N 3.09Å; H514-V516 VanDerWaalsContact C-N 3.29Å; H514-V516 PolarHBondContact O-N 2.67Å; V516-A518 VanDerWaalsContact C-N 3.26Å; V516-A518 PolarHBondContact O-N 3.48Å; V516-S519 PolarHBondContact O-N 3.4Å; V516-L520 HydrophobicContact CG1-CD1 4.22Å; V516-L520 WeakPolarHBondContact O-CB 3.26Å; V516-L520 PolarHBondContact O-N 2.82Å; V516-P523 HydrophobicContact CG1-CB 3.83Å; V516-P523 HydrophobicContact CG1-CG 4.38Å
517	H	81.1	Confident	80.3	Confident	18 Å²	18	27.4 Å²	27.4	8%	0.083	14%	0.14	C	C	.	.	H	α-helix	trans	-66.7	-26.2	177.9	-86.6	-100.4	0	0	0	113	F513 H514 Q662 H694	F513-H517 AromaticContact CD2-CD2 3.77Å; F513-H517 AromaticContact CE1-CD2 3.72Å; F513-H517 AromaticContact CE2-CD2 3.33Å; F513-H517 WeakPolarHBondContact CE2-CD2 3.3Å; F513-H517 AromaticContact CE2-NE2 3.21Å; F513-H517 WeakPolarHBondContact CE2-NE2 3.48Å; F513-H517 AromaticContact CZ-CD2 3.33Å; F513-H517 WeakPolarHBondContact CZ-CD2 3.28Å; F513-H517 AromaticContact CZ-CE1 3.88Å; F513-H517 AromaticContact CZ-NE2 3.23Å; F513-H517 WeakPolarHBondContact CZ-NE2 3.47Å; F513-H517 PolarHBondContact O-N 3.22Å; H514-H517 PolarHBondContact O-N 3.05Å; H517-Q662 PolarHBondContact O-NE2 3.03Å; H517-H694 AromaticContact ND1-NE2 3.86Å
518	A	80.7	Confident	79.6	Confident	35 Å²	35	27.3 Å²	27.3	29%	0.289	15%	0.149	S	C	.	.	H	α-helix	trans	-76.3	-21.1	172	0	0	0	0	0	113.3	H514 V516 K658	H514-A518 WeakPolarHBondContact O-CB 3.37Å; H514-A518 PolarHBondContact O-N 3.22Å; V516-A518 VanDerWaalsContact C-N 3.26Å; V516-A518 PolarHBondContact O-N 3.48Å; A518-K658 PolarHBondContact O-NZ 3.15Å
519	S	82.2	Confident	78.7	Confident	5 Å²	5	28.2 Å²	28.2	4%	0.035	16%	0.157	C	C	.	.	H	α-helix	trans	-113.9	-27.5	-172.5	-53.1	0	0	0	0	114.6	T88 H455 L515 V516	T88-S519 PolarHBondContact OG1-O 3.16Å; H455-S519 PolarHBondContact ND1-O 3.29Å; L515-S519 WeakPolarHBondContact O-CB 3.38Å; L515-S519 PolarHBondContact O-N 3.22Å; L515-S519 VanDerWaalsContact O-N 3.13Å; L515-S519 PolarHBondContact O-OG 2.98Å; V516-S519 PolarHBondContact O-N 3.4Å
520	L	85.7	Confident	77.7	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.016	18%	0.177	C	C	.	.			trans	-110.1	136	-174.3	-56	-175.3	0	0	0	111.3	T88 F92 I451 V516 Q662	T88-L520 VanDerWaalsContact OG1-CA 3.3Å; T88-L520 WeakPolarHBondContact OG1-CA 3.47Å; F92-L520 HydrophobicContact CE2-CD1 3.99Å; F92-L520 HydrophobicContact CZ-CD1 3.75Å; I451-L520 HydrophobicContact CG2-CD2 4.45Å; V516-L520 HydrophobicContact CG1-CD1 4.22Å; V516-L520 WeakPolarHBondContact O-CB 3.26Å; V516-L520 PolarHBondContact O-N 2.82Å; L520-Q662 PolarHBondContact O-NE2 3.22Å
521	Y	86.1	Confident	76.6	Confident	23 Å²	23	33.2 Å²	33.2	9%	0.09	18%	0.18	C	C	.	.	S	Bend	trans	-78.8	-26.8	176.7	-77.9	-76.4	0	0	0	112.4	T88 K658 K661 Q662	T88-Y521 PolarHBondContact O-N 2.98Å; T88-Y521 VanDerWaalsContact OG1-CD2 3.29Å; T88-Y521 WeakPolarHBondContact OG1-CD2 3.42Å; T88-Y521 PolarHBondContact OG1-N 3.33Å; Y521-K658 HydrophobicContact CE1-CG 4.09Å; Y521-K661 HydrophobicContact CD1-CB 4.45Å; Y521-K661 HydrophobicContact CE1-CB 4.26Å; Y521-Q662 HydrophobicContact CD1-CG 3.95Å
522	L	89	Confident	75.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	96.9	176.1	-175.9	64.6	0	0	0	110.6	M77 M87 T88 V89 G90 I524 L665 F669 I787	M77-L522 HydrophobicContact CE-CD2 3.79Å; M87-L522 HydrophobicContact CE-CB 4.32Å; M87-L522 HydrophobicContact CE-CD2 3.87Å; T88-L522 PolarHBondContact O-N 3.19Å; V89-L522 VanDerWaalsContact CA-O 3.31Å; V89-L522 WeakPolarHBondContact CA-O 3.44Å; V89-L522 HydrophobicContact CG2-CB 4.42Å; G90-L522 PolarHBondContact N-O 3.2Å; G90-L522 VanDerWaalsContact N-O 3.07Å; L522-I524 HydrophobicContact CD2-CD1 3.96Å; L522-I524 HydrophobicContact CD2-CG1 4.28Å; L522-I524 HydrophobicContact CG-CD1 4.17Å; L522-I524 HydrophobicContact CG-CG1 3.95Å; L522-L665 HydrophobicContact CB-CD2 4.04Å; L522-F669 HydrophobicContact CD1-CD1 4.25Å; L522-F669 HydrophobicContact CD2-CB 4.11Å; L522-F669 HydrophobicContact CD2-CD1 4.23Å; L522-F669 HydrophobicContact CD2-CD2 4.14Å; L522-F669 HydrophobicContact CD2-CG 3.9Å; L522-I787 HydrophobicContact CD1-CD1 3.68Å; L522-I787 HydrophobicContact CD1-CG1 4.09Å
523	P	87.2	Confident	73.2	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.019	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	140.2	164.3	31.1	-31.5	0	0	0	110	F92 V516 Y525 I787	F92-P523 HydrophobicContact CD2-CB 4.5Å; F92-P523 HydrophobicContact CE2-CB 4.15Å; V516-P523 HydrophobicContact CG1-CB 3.83Å; V516-P523 HydrophobicContact CG1-CG 4.38Å; P523-Y525 HydrophobicContact CB-CE2 4Å; P523-I787 HydrophobicContact CG-CG2 4.34Å
524	I	85.7	Confident	71.5	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	112.4	178.6	-58.1	174.5	0	0	0	107.6	T70 L74 V89 G90 F92 L522 L526 F669 L786	T70-I524 HydrophobicContact CG2-CG2 4.02Å; L74-I524 HydrophobicContact CD1-CD1 3.77Å; L74-I524 HydrophobicContact CD2-CD1 4.08Å; L74-I524 HydrophobicContact CG-CD1 4.04Å; V89-I524 HydrophobicContact CG1-CD1 3.66Å; V89-I524 HydrophobicContact CG1-CG1 4.28Å; G90-I524 PolarHBondContact O-N 2.96Å; F92-I524 PolarHBondContact N-O 2.85Å; L522-I524 HydrophobicContact CD2-CD1 3.96Å; L522-I524 HydrophobicContact CD2-CG1 4.28Å; L522-I524 HydrophobicContact CG-CD1 4.17Å; L522-I524 HydrophobicContact CG-CG1 3.95Å; I524-L526 HydrophobicContact CG2-CD2 4.22Å; I524-L526 HydrophobicContact CG2-CG 4.37Å; I524-F669 HydrophobicContact CD1-CE1 4.1Å; I524-F669 HydrophobicContact CD1-CE2 4.03Å; I524-F669 HydrophobicContact CD1-CZ 3.6Å; I524-F669 HydrophobicContact CG1-CE1 4.17Å; I524-F669 HydrophobicContact CG1-CZ 4.13Å; I524-F669 HydrophobicContact CG2-CZ 4.45Å; I524-L786 CarbonylContact C-O 3.59Å; I524-L786 WeakPolarHBondContact CA-O 3.41Å; I524-L786 HydrophobicContact CG2-CB 4.03Å; I524-L786 HydrophobicContact CG2-CD1 4.21Å
525	Y	83.1	Confident	69.4	Low	11 Å²	11	39.6 Å²	39.6	4%	0.043	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	110.4	177.1	-62.6	-85.5	0	0	0	109.3	F92 F474 P523 E527 L786 H788 N789 P790	F92-Y525 HydrophobicContact CB-CD1 3.7Å; F92-Y525 HydrophobicContact CB-CE1 4.03Å; F92-Y525 HydrophobicContact CB-CG 4.45Å; F92-Y525 HydrophobicContact CD2-CD1 4.03Å; F92-Y525 AromaticContact CD2-CE1 3.66Å; F92-Y525 HydrophobicContact CD2-CE1 3.66Å; F92-Y525 AromaticContact CD2-CZ 3.93Å; F92-Y525 HydrophobicContact CE2-CE1 4.42Å; F92-Y525 HydrophobicContact CG-CD1 4.19Å; F92-Y525 HydrophobicContact CG-CE1 4.02Å; F474-Y525 AromaticContact CD1-CE1 3.96Å; F474-Y525 HydrophobicContact CD1-CE1 3.96Å; F474-Y525 AromaticContact CD2-CE1 3.95Å; F474-Y525 HydrophobicContact CD2-CE1 3.95Å; F474-Y525 AromaticContact CE1-CE1 3.93Å; F474-Y525 HydrophobicContact CE1-CE1 3.93Å; F474-Y525 AromaticContact CE2-CE1 3.95Å; F474-Y525 HydrophobicContact CE2-CE1 3.95Å; F474-Y525 AromaticContact CG-CE1 3.96Å; F474-Y525 HydrophobicContact CG-CE1 3.96Å; F474-Y525 AromaticContact CZ-CE1 3.94Å; F474-Y525 HydrophobicContact CZ-CE1 3.94Å; P523-Y525 HydrophobicContact CB-CE2 4Å; Y525-E527 PolarHBondContact O-N 2.86Å; Y525-L786 PolarHBondContact N-O 3.38Å; Y525-L786 VanDerWaalsContact O-CD2 3.29Å; Y525-L786 WeakPolarHBondContact O-CD2 3.18Å; Y525-H788 VanDerWaalsContact CD2-O 3.29Å; Y525-H788 WeakPolarHBondContact CD2-O 3.41Å; Y525-N789 HydrophobicContact CE1-CB 4.49Å; Y525-N789 HydrophobicContact CE2-CB 3.9Å; Y525-P790 HydrophobicContact CD1-CG 4.39Å; Y525-P790 HydrophobicContact CG-CG 4.39Å
526	L	76.7	Confident	67	Low	19 Å²	19	45.7 Å²	45.7	10%	0.099	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	86.2	-179.2	-73.4	-178	0	0	0	111.3	A67 T70 I91 F92 T93 Y100 I524	A67-L526 HydrophobicContact CB-CD1 4.15Å; A67-L526 HydrophobicContact CB-CD2 3.97Å; T70-L526 HydrophobicContact CG2-CD2 3.96Å; I91-L526 HydrophobicContact CG2-CD1 3.5Å; I91-L526 VanDerWaalsContact CG2-CD1 3.5Å; I91-L526 HydrophobicContact CG2-CG 4.17Å; F92-L526 PolarHBondContact O-N 2.95Å; T93-L526 HydrophobicContact CG2-CB 4.47Å; T93-L526 HydrophobicContact CG2-CD1 4.36Å; Y100-L526 HydrophobicContact CD1-CD1 4.4Å; Y100-L526 HydrophobicContact CD2-CD1 3.74Å; Y100-L526 HydrophobicContact CE1-CD1 4.41Å; Y100-L526 HydrophobicContact CE2-CD1 3.75Å; Y100-L526 HydrophobicContact CG-CD1 4.03Å; I524-L526 HydrophobicContact CG2-CD2 4.22Å; I524-L526 HydrophobicContact CG2-CG 4.37Å
527	E	66.4	Low	64.5	Low	30 Å²	30	51 Å²	51	14%	0.14	28%	0.282	C	S	.	.			trans	-121.9	157.3	174.2	-151	154.1	-138.9	0	0	109.6	Q94 Y525 P790 Y794	Q94-E527 PolarHBondContact NE2-OE1 2.9Å; Y525-E527 PolarHBondContact O-N 2.86Å; E527-P790 WeakPolarHBondContact OE2-CB 3.28Å; E527-P790 WeakPolarHBondContact OE2-CG 3.09Å; E527-Y794 PolarHBondContact OE1-OH 2.9Å
528	P	58.2	Low	62	Low	105 Å²	105	59 Å²	59	68%	0.682	32%	0.316	S	S	*	.			trans	-52	139.9	167.7	19.3	-34.7	0	0	0	112.1	I530	P528-I530 PolarHBondContact O-N 3.49Å
529	P	56.2	Low	59.4	Low	48 Å²	48	66.3 Å²	66.3	31%	0.312	34%	0.342	S	S	.	.			trans	-65.2	134.2	177.7	28.1	-34.3	0	0	0	110.5	F531 A783	P529-F531 PolarHBondContact O-N 3.46Å; P529-A783 HydrophobicContact CB-CB 4.32Å
530	I	55.5	Low	56.7	Low	82 Å²	82	70.5 Å²	70.5	42%	0.421	37%	0.371	S	S	.	.	S	Bend	trans	-60.7	-36.3	-175.6	-54.1	171.4	0	0	0	111.5	P528 I704 E708	P528-I530 PolarHBondContact O-N 3.49Å; I530-I704 HydrophobicContact CD1-CG2 4.32Å; I530-E708 WeakPolarHBondContact CG2-OE1 3.36Å
531	F	51.1	Low	53.9	Low	29 Å²	29	77.2 Å²	77.2	13%	0.127	41%	0.407	C	S	.	.			trans	-97.5	109.8	170.2	-58.7	-57.6	0	0	0	110.1	P529 D533 E708 N711 K779 I782	P529-F531 PolarHBondContact O-N 3.46Å; F531-D533 PolarHBondContact O-N 3.12Å; F531-E708 HydrophobicContact CE1-CG 3.82Å; F531-E708 HydrophobicContact CZ-CG 3.7Å; F531-N711 VanDerWaalsContact CE1-ND2 3.32Å; F531-N711 WeakPolarHBondContact CE1-ND2 3.27Å; F531-K779 HydrophobicContact CD2-CB 4.28Å; F531-K779 HydrophobicContact CD2-CG 4.33Å; F531-K779 HydrophobicContact CE2-CG 4.37Å; F531-I782 HydrophobicContact CD2-CB 4.29Å; F531-I782 HydrophobicContact CD2-CG2 4.04Å; F531-I782 HydrophobicContact CE2-CB 4.11Å; F531-I782 HydrophobicContact CE2-CD1 3.97Å; F531-I782 HydrophobicContact CE2-CG2 3.8Å
532	T	45.8	Very low	51	Low	115 Å²	115	83.2 Å²	83.2	71%	0.706	44%	0.44	S	S	*	.			trans	-67.7	-23.5	170.5	44.1	0	0	0	0	112.9	L534	T532-L534 PolarHBondContact O-N 2.97Å
533	D	41.1	Very low	48.3	Very low	136 Å²	136	92.3 Å²	92.3	73%	0.727	48%	0.483	S	S	*	.			trans	-82.3	49.8	-168.7	-54.9	-1.7	0	0	0	112	F531	F531-D533 PolarHBondContact O-N 3.12Å
534	L	40.7	Very low	45.2	Very low	52 Å²	52	101.2 Å²	101.2	27%	0.272	52%	0.524	S	S	.	.			trans	-62.9	123	155.4	-124.7	75.2	0	0	0	106.4	T532 E536 Y677 A783	T532-L534 PolarHBondContact O-N 2.97Å; L534-E536 PolarHBondContact O-N 3.48Å; L534-Y677 HydrophobicContact CD2-CD1 3.79Å; L534-Y677 HydrophobicContact CD2-CE1 4.18Å; L534-Y677 HydrophobicContact CD2-CG 4.15Å; L534-A783 HydrophobicContact CD1-CB 4Å
535	P	36.2	Very low	42.4	Very low	75 Å²	75	108.9 Å²	108.9	49%	0.487	56%	0.562	S	S	.	*			trans	-60.7	129.1	-173.4	24	-33.8	0	0	0	110.1	I537	P535-I537 WeakPolarHBondContact O-CG1 3.1Å; P535-I537 PolarHBondContact O-N 2.95Å
536	E	33.4	Very low	39.8	Very low	169 Å²	169	116.1 Å²	116.1	79%	0.79	59%	0.594	S	S	*	*			trans	-56.6	106.8	176.9	-73.5	-160.2	124	0	0	109.7	L534 K538	L534-E536 PolarHBondContact O-N 3.48Å; E536-K538 VanDerWaalsContact C-N 3.28Å; E536-K538 PolarHBondContact O-N 2.87Å
537	I	31.8	Very low	37.5	Very low	111 Å²	111	123.4 Å²	123.4	57%	0.569	63%	0.627	S	S	*	*			trans	-73.4	87.4	-175.3	-55	-174.2	0	0	0	109.5	P535	P535-I537 WeakPolarHBondContact O-CG1 3.1Å; P535-I537 PolarHBondContact O-N 2.95Å
538	K	27.9	Very low	35.4	Very low	186 Å²	186	128.8 Å²	128.8	81%	0.809	66%	0.657	S	S	*	*	S	Bend	trans	64	75.6	168.2	-60.3	179.9	179	176.8	0	115.7	E536	E536-K538 VanDerWaalsContact C-N 3.28Å; E536-K538 PolarHBondContact O-N 2.87Å
539	K	27.1	Very low	33.9	Very low	190 Å²	190	131.8 Å²	131.8	83%	0.826	66%	0.662	S	S	*	*			trans	-110.6	114	132.7	-77.8	180	-178.2	168.2	0	108.8
540	S	25.7	Very low	32.4	Very low	92 Å²	92	136 Å²	136	64%	0.643	68%	0.681	S	S	*	*			trans	-149.7	142.8	171.5	58.9	0	0	0	0	110.3
541	N	26.3	Very low	30.8	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	69%	0.694	S	S	*	*			trans	73.8	117.8	176.2	-49.8	-4.1	0	0	0	113
542	N	25.5	Very low	29.7	Very low	149 Å²	149	144.2 Å²	144.2	80%	0.797	72%	0.721	S	S	*	*			cis	-131.7	175.2	3.3	-63.8	-46.9	0	0	0	109
543	E	32	Very low	28.9	Very low	192 Å²	192	143.8 Å²	143.8	90%	0.897	72%	0.723	S	S	*	*			cis	-141.4	159.8	22.9	-64.1	176.3	148.2	0	0	112.9
544	Q	23.5	Very low	28	Very low	189 Å²	189	142.2 Å²	142.2	88%	0.883	72%	0.722	S	S	*	*			trans	-99.4	133.5	166.5	-64.6	175.7	-47.5	0	0	110.2
545	M	26.2	Very low	27.3	Very low	163 Å²	163	146.2 Å²	146.2	80%	0.803	74%	0.743	S	S	*	*			trans	-164.7	125	145.3	-116.4	-156.9	-172	0	0	114.2
546	K	28	Very low	26.8	Very low	163 Å²	163	149.8 Å²	149.8	71%	0.709	76%	0.758	S	S	*	*			trans	65.4	148.3	160.2	-58.8	172.9	-176.9	173.9	0	116.1
547	H	28.5	Very low	26.5	Very low	171 Å²	171	144.7 Å²	144.7	79%	0.792	75%	0.751	S	S	*	*			cis	-146.5	166.3	-11.9	-118.5	-50.2	0	0	0	107.7
548	N	22.8	Very low	26.3	Very low	144 Å²	144	150.8 Å²	150.8	77%	0.77	77%	0.769	S	S	*	*			trans	-138.5	152.4	171.1	-153.4	-5.3	0	0	0	109.6
549	Q	26	Very low	26	Very low	168 Å²	168	146.8 Å²	146.8	79%	0.785	76%	0.764	S	S	*	*			trans	68.5	152.6	-175.2	-51.3	177.1	-6.6	0	0	114.1
550	L	25	Very low	25.9	Very low	137 Å²	137	143.3 Å²	143.3	72%	0.717	76%	0.764	S	S	*	*			cis	-156.4	133.4	19.3	-168.7	74.8	0	0	0	113.2
551	L	22.6	Very low	26	Very low	133 Å²	133	143.7 Å²	143.7	70%	0.696	77%	0.773	S	S	*	*			trans	61.9	166.3	158	-72.4	166.2	0	0	0	118.7
552	H	28.2	Very low	25.9	Very low	149 Å²	149	145 Å²	145	69%	0.69	78%	0.779	S	S	*	*			cis	-154.4	142.6	15.4	-139.4	-67	0	0	0	114.4
553	S	27.5	Very low	26	Very low	106 Å²	106	142.5 Å²	142.5	74%	0.741	78%	0.779	S	S	*	*			trans	63.9	149.2	151.2	37.1	0	0	0	0	125
554	S	23.6	Very low	25.7	Very low	103 Å²	103	139 Å²	139	72%	0.72	77%	0.771	S	S	*	*			trans	-90.3	-176.6	173.4	52.9	0	0	0	0	113
555	L	25.5	Very low	25.8	Very low	136 Å²	136	138.7 Å²	138.7	71%	0.712	77%	0.767	S	S	*	*				174.5	150.8	61.7	-169.7	72.7	0	0	0	112.7
556	N	25.7	Very low	25.7	Very low	151 Å²	151	138.3 Å²	138.3	81%	0.807	76%	0.764	S	S	*	*			trans	61.2	155	166.4	-65.4	-18.8	0	0	0	118.6
557	G	26.3	Very low	25.4	Very low	62 Å²	62	135.2 Å²	135.2	64%	0.639	76%	0.763	S	S	*	*			cis	177.4	141.2	-7.1	0	0	0	0	0	108.1
558	Y	28.4	Very low	25.2	Very low	239 Å²	239	131.7 Å²	131.7	94%	0.937	76%	0.757	S	S	*	*				178.7	-176.7	84.2	-100.5	-83.9	0	0	0	109.9
559	S	22.3	Very low	25.3	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	76%	0.757	S	S	*	*			trans	-112.2	160	-163	58.1	0	0	0	0	117.9
560	S	25.2	Very low	25.2	Very low	117 Å²	117	131.3 Å²	131.3	82%	0.818	76%	0.757	S	S	*	*			trans	115.6	154.9	134.7	79.9	0	0	0	0	120.3
561	A	27.6	Very low	25.1	Very low	100 Å²	100	129 Å²	129	83%	0.826	75%	0.752	S	S	*	*			trans	72.8	124	167.4	0	0	0	0	0	120.2
562	N	23.1	Very low	25.2	Very low	171 Å²	171	128.3 Å²	128.3	91%	0.914	75%	0.754	S	S	*	*			trans	-104.4	137.1	168.3	-80.9	-27.1	0	0	0	110.7
563	A	27.7	Very low	25	Very low	96 Å²	96	125.7 Å²	125.7	79%	0.793	75%	0.752	S	S	*	*			trans	-164.3	76.9	156.9	0	0	0	0	0	113.7
564	T	25.4	Very low	25	Very low	119 Å²	119	128.3 Å²	128.3	73%	0.73	75%	0.753	S	S	*	*			trans	19.7	134	143	44.6	0	0	0	0	123.5
565	F	26.2	Very low	25.1	Very low	182 Å²	182	129.4 Å²	129.4	80%	0.798	75%	0.75	S	S	*	*			trans	71.8	142.4	143	-72	-51	0	0	0	119.6
566	Q	24.4	Very low	25.1	Very low	156 Å²	156	127.9 Å²	127.9	73%	0.729	75%	0.75	S	S	*	*			cis	-162.4	144.5	-7.3	-172.9	172.4	-14.7	0	0	111.3
567	S	22.5	Very low	25	Very low	98 Å²	98	126.2 Å²	126.2	69%	0.685	75%	0.745	S	S	*	*			trans	41.3	128.5	161	64.9	0	0	0	0	120.2
568	S	23.1	Very low	25.1	Very low	97 Å²	97	130.8 Å²	130.8	68%	0.678	75%	0.754	S	S	*	*				-177.7	136.9	63.7	46.1	0	0	0	0	110.9
569	I	24.6	Very low	25.1	Very low	148 Å²	148	124 Å²	124	76%	0.759	74%	0.741	S	S	*	*				79.7	133.2	108.6	-64.1	174.7	0	0	0	116
570	I	25	Very low	25.1	Very low	156 Å²	156	126 Å²	126	80%	0.8	75%	0.748	S	S	*	*			trans	71.6	135.5	166.4	-79.6	164.9	0	0	0	116.4
571	S	22.9	Very low	25.2	Very low	87 Å²	87	126.1 Å²	126.1	61%	0.608	75%	0.75	S	S	*	*			cis	-165.4	169.4	-17.3	62.1	0	0	0	0	112.2
572	T	23.6	Very low	25.1	Very low	120 Å²	120	126.8 Å²	126.8	74%	0.736	75%	0.748	S	S	*	*			trans	17.2	141.9	139.2	63.4	0	0	0	0	119.6
573	S	25.1	Very low	25.3	Very low	93 Å²	93	128.5 Å²	128.5	65%	0.65	75%	0.747	S	S	*	*			cis	173.5	-170.6	5.5	42.4	0	0	0	0	109
574	E	26.7	Very low	25.1	Very low	161 Å²	161	133.2 Å²	133.2	75%	0.752	75%	0.75	S	S	*	*			trans	99.8	146.3	151.5	-52.9	-150.1	148.8	0	0	118.2
575	I	25.6	Very low	25.1	Very low	127 Å²	127	133.5 Å²	133.5	65%	0.651	75%	0.751	S	S	*	*			cis	-156.3	163.5	-18.2	-113.9	171.9	0	0	0	109.1
576	S	27.1	Very low	25.1	Very low	104 Å²	104	129.7 Å²	129.7	73%	0.727	75%	0.747	S	S	*	*			trans	120.7	154.7	151.4	72.9	0	0	0	0	117.1
577	T	23.3	Very low	25.2	Very low	115 Å²	115	127.7 Å²	127.7	71%	0.706	75%	0.75	S	S	*	*				-173.9	178.8	-71.7	33.9	0	0	0	0	108.8
578	I	28.5	Very low	25.1	Very low	159 Å²	159	128.2 Å²	128.2	82%	0.815	75%	0.754	S	S	*	*			trans	76.4	135.2	172.6	-49.8	168.7	0	0	0	113.6
579	S	26.6	Very low	25.8	Very low	96 Å²	96	128 Å²	128	67%	0.671	75%	0.751	S	S	*	*			cis	-156.2	147.7	-22.2	52.5	0	0	0	0	106.4
580	V	23.9	Very low	25.8	Very low	143 Å²	143	127.7 Å²	127.7	87%	0.867	75%	0.751	S	S	*	*				69.7	102.9	51.9	-175.6	0	0	0	0	115.3
581	S	26.9	Very low	25.7	Very low	121 Å²	121	125.3 Å²	125.3	85%	0.846	75%	0.746	S	S	*	*			trans	-158.1	162.1	136	78.8	0	0	0	0	111.2
582	S	25	Very low	25.8	Very low	113 Å²	113	127.4 Å²	127.4	79%	0.79	76%	0.755	S	S	*	*			trans	-151.6	146.2	-177	60.2	0	0	0	0	112.8
583	K	27.4	Very low	25.8	Very low	207 Å²	207	126 Å²	126	90%	0.9	75%	0.751	S	S	*	*			trans	-158.5	84.2	174.5	-117.7	170.9	-173.8	176	0	115.2
584	K	24.5	Very low	25.7	Very low	196 Å²	196	126 Å²	126	85%	0.852	75%	0.751	S	S	*	*				14.5	127.1	126.9	-160.9	-178	-168.6	175.8	0	117.8
585	V	25.3	Very low	25.6	Very low	125 Å²	125	127.2 Å²	127.2	76%	0.758	76%	0.756	S	S	*	*				172.6	148.6	120.9	151.4	0	0	0	0	114.2
586	S	24.4	Very low	25.7	Very low	101 Å²	101	127.5 Å²	127.5	71%	0.706	76%	0.763	S	S	*	*			trans	74.7	118.1	158.1	60.8	0	0	0	0	124.6
587	S	26.7	Very low	25.9	Very low	114 Å²	114	128.1 Å²	128.1	80%	0.797	76%	0.764	S	S	*	*			trans	72.5	102.6	132.5	60.6	0	0	0	0	123.3
588	S	21.3	Very low	25.9	Very low	109 Å²	109	128.5 Å²	128.5	76%	0.762	75%	0.753	S	S	*	*			trans	-81.5	-159.6	135	64.3	0	0	0	0	109.7
589	P	38	Very low	25.7	Very low	94 Å²	94	124.1 Å²	124.1	61%	0.61	74%	0.74	S	S	*	*			cis	-135.7	174.9	-13.3	32.9	-12.2	0	0	0	114.9
590	N	24.6	Very low	25.5	Very low	141 Å²	141	125 Å²	125	75%	0.754	74%	0.735	S	S	*	*				162.6	141.4	112.7	-90.1	-34.1	0	0	0	118.1
591	C	23.1	Very low	25.6	Very low	105 Å²	105	126 Å²	126	71%	0.709	73%	0.728	S	S	*	*			trans	72.3	112.8	138.2	-69.3	0	0	0	0	125.2
592	V	23.6	Very low	25.5	Very low	131 Å²	131	125.4 Å²	125.4	79%	0.794	72%	0.716	S	S	*	*				89.4	131.9	116.3	171	0	0	0	0	121.2
593	S	23.5	Very low	25.5	Very low	92 Å²	92	125.5 Å²	125.5	64%	0.643	71%	0.707	S	S	*	*			trans	63.5	113.9	159.4	-160.8	0	0	0	0	117.5
594	S	23.3	Very low	25.3	Very low	93 Å²	93	123.7 Å²	123.7	65%	0.65	70%	0.7	S	S	*	*			cis	74.7	105.7	49	86.3	0	0	0	0	115.8
595	H	24.7	Very low	25.4	Very low	186 Å²	186	122.3 Å²	122.3	86%	0.861	70%	0.696	S	S	*	*			trans	-176.3	160.5	131.2	-101.3	-63.3	0	0	0	113.6
596	V	29	Very low	25.4	Very low	133 Å²	133	119.3 Å²	119.3	81%	0.806	69%	0.691	S	S	*	*			trans	-127.4	134.5	174.8	166	0	0	0	0	106.8
597	P	30.3	Very low	25.5	Very low	116 Å²	116	119.8 Å²	119.8	75%	0.753	69%	0.689	S	S	*	*				-153.1	-171.1	115.3	36.7	-15.5	0	0	0	116
598	R	22.6	Very low	25.5	Very low	124 Å²	124	121.3 Å²	121.3	47%	0.468	69%	0.688	S	S	.	*			trans	-102.5	165.8	-164.9	-161.2	-129.2	-172	154.2	1.2	114	P1071 W1072	R598-P1071 HydrophobicContact CB-CB 4.22Å; R598-P1071 PolarHBondContact N-O 3.08Å; R598-P1071 WeakPolarHBondContact O-CD 3.29Å; R598-W1072 HydrophobicContact CB-CB 3.97Å; R598-W1072 HydrophobicContact CB-CG 4.48Å
599	A	24.4	Very low	25.9	Very low	66 Å²	66	120.9 Å²	120.9	55%	0.545	69%	0.686	S	S	.	*			trans	-121	167.3	-173.5	0	0	0	0	0	115.7
600	M	22.7	Very low	25.4	Very low	115 Å²	115	123.1 Å²	123.1	57%	0.567	69%	0.693	S	S	*	*			trans	-163.9	136.9	169.9	-104.6	-178.2	160.7	0	0	107.5	Q1069	M600-Q1069 WeakPolarHBondContact O-CG 3.43Å; M600-Q1069 PolarHBondContact O-NE2 3.34Å
601	F	26.1	Very low	25.7	Very low	163 Å²	163	123.1 Å²	123.1	72%	0.715	69%	0.693	S	S	*	*			trans	25.2	134.6	161.8	-59.4	-85.9	0	0	0	120.6	Q1069	F601-Q1069 VanDerWaalsContact C-NE2 3.32Å; F601-Q1069 PolarHBondContact O-NE2 3.29Å
602	D	24.4	Very low	25.9	Very low	110 Å²	110	127.5 Å²	127.5	59%	0.588	69%	0.694	S	S	*	*			cis	-161.6	163.3	26.9	-136.7	-19.2	0	0	0	116
603	N	25	Very low	26.2	Very low	115 Å²	115	128.6 Å²	128.6	62%	0.615	69%	0.69	S	S	*	*			trans	58.4	122.4	150.4	-70.2	-40.5	0	0	0	125.6
604	F	24.6	Very low	26.3	Very low	168 Å²	168	130 Å²	130	74%	0.737	70%	0.699	S	S	*	*			trans	81.2	106.8	131.4	-85.6	-111.6	0	0	0	124.6
605	H	25	Very low	26.4	Very low	167 Å²	167	130.3 Å²	130.3	77%	0.773	70%	0.701	S	S	*	*				70.2	141.3	124	-87.4	-102.2	0	0	0	123.7
606	G	25.2	Very low	26.5	Very low	63 Å²	63	131.6 Å²	131.6	65%	0.649	70%	0.704	S	S	*	*			trans	149.5	73.3	170.7	0	0	0	0	0	112.8
607	T	26.8	Very low	26.2	Very low	110 Å²	110	131.7 Å²	131.7	68%	0.675	70%	0.699	S	S	*	*				60.1	142.4	86.8	67.4	0	0	0	0	115.4
608	N	26.9	Very low	26.1	Very low	146 Å²	146	134.6 Å²	134.6	78%	0.781	71%	0.706	S	S	*	*			cis	-170.1	159.7	-6.9	-105.8	-4.3	0	0	0	109.5
609	S	29.2	Very low	26.1	Very low	101 Å²	101	133 Å²	133	71%	0.706	71%	0.714	S	S	*	*			trans	-165.7	117	135.1	51	0	0	0	0	109.6
610	N	29.2	Very low	26.2	Very low	141 Å²	141	136.5 Å²	136.5	75%	0.754	72%	0.722	S	S	*	*				73.6	127.8	103.1	-58.7	-16.7	0	0	0	113.1
611	N	29.6	Very low	26.3	Very low	141 Å²	141	137.1 Å²	137.1	75%	0.754	73%	0.728	S	S	*	*			cis	-160.4	-165.2	3.5	-131.5	-38.4	0	0	0	107.5
612	R	28.5	Very low	26.2	Very low	196 Å²	196	135.8 Å²	135.8	74%	0.74	73%	0.728	S	S	*	*			cis	-162.3	135.8	11.2	-144	-170.3	171.8	148.4	0.7	110.9
613	H	28.9	Very low	26.2	Very low	155 Å²	155	137.4 Å²	137.4	72%	0.718	73%	0.732	S	S	*	*			trans	61.1	155.5	168.5	-62.2	-68.1	0	0	0	117.8
614	C	26.9	Very low	26.2	Very low	122 Å²	122	139.2 Å²	139.2	82%	0.824	73%	0.734	S	S	*	*			cis	-132	161.4	3.2	-133.7	0	0	0	0	111.4
615	S	24	Very low	26.2	Very low	98 Å²	98	139.6 Å²	139.6	69%	0.685	74%	0.738	S	S	*	*			trans	-139	160	-173.6	60.1	0	0	0	0	112.9
616	K	27.1	Very low	26.4	Very low	213 Å²	213	140.3 Å²	140.3	93%	0.926	74%	0.742	S	S	*	*			trans	-149.1	137.8	146.7	-130	170	-174.5	175.9	0	110.5
617	I	23.8	Very low	26.3	Very low	136 Å²	136	145.5 Å²	145.5	70%	0.697	76%	0.755	S	S	*	*			trans	-130.1	135.7	-173	-62.2	168	0	0	0	107.6
618	I	26.8	Very low	26.3	Very low	176 Å²	176	149.8 Å²	149.8	90%	0.903	76%	0.764	S	S	*	*			trans	-138.4	139.7	145.8	-58.3	-176	0	0	0	107
619	S	22.9	Very low	26.4	Very low	91 Å²	91	149.2 Å²	149.2	64%	0.636	76%	0.76	S	S	*	*			trans	-149.1	177	174.9	56.8	0	0	0	0	109.1
620	I	26.7	Very low	26.2	Very low	140 Å²	140	152.8 Å²	152.8	72%	0.718	77%	0.765	S	S	*	*			trans	128	106.4	159.1	-69.6	165.6	0	0	0	114.4
621	N	25.7	Very low	26.1	Very low	128 Å²	128	149.9 Å²	149.9	68%	0.684	75%	0.752	S	S	*	*			trans	62.3	152.4	136	-59.7	11.1	0	0	0	121.3
622	N	23	Very low	25.9	Very low	135 Å²	135	148.7 Å²	148.7	72%	0.722	75%	0.75	S	S	*	*			cis	-165.2	173.1	-14.2	-109.6	-4.2	0	0	0	112.3
623	E	24.4	Very low	25.8	Very low	144 Å²	144	146.8 Å²	146.8	67%	0.673	75%	0.75	S	S	*	*			trans	101.2	114.1	151.1	-63.1	-137.5	119.9	0	0	121.5
624	K	24.6	Very low	25.7	Very low	152 Å²	152	147.7 Å²	147.7	66%	0.661	76%	0.755	S	S	*	*			trans	87	120.3	136.9	-72.6	165	-177.4	150	0	121.4
625	E	24.7	Very low	25.9	Very low	177 Å²	177	148.8 Å²	148.8	83%	0.827	75%	0.752	S	S	*	*			trans	60.9	124.6	143.8	-58.5	-172	131.9	0	0	117.9
626	Q	30.1	Very low	26.5	Very low	182 Å²	182	150.2 Å²	150.2	85%	0.85	75%	0.748	S	S	*	*			cis	-145.5	151.9	30.3	-67.6	177.6	-13.8	0	0	113.2	K628	Q626-K628 PolarHBondContact O-N 2.93Å
627	N	23.2	Very low	27.4	Very low	171 Å²	171	144 Å²	144	91%	0.914	72%	0.721	S	S	*	*			trans	-72.8	109.1	175.8	-70.6	-37.3	0	0	0	112
628	K	26.9	Very low	28.6	Very low	200 Å²	200	138.7 Å²	138.7	87%	0.87	70%	0.696	S	S	*	*			trans	-109.3	105	154.7	-165.7	177.4	-177	-175.6	0	107.7	Q626 E630	Q626-K628 PolarHBondContact O-N 2.93Å; K628-E630 PolarHBondContact O-N 3.07Å; K628-E630 VanDerWaalsContact O-N 3.08Å
629	I	29.1	Very low	29.7	Very low	135 Å²	135	131 Å²	131	69%	0.692	66%	0.658	S	S	*	*			trans	-65.9	111.4	-177	-63.6	173.3	0	0	0	108.6	V631	I629-V631 HydrophobicContact CG2-CG2 4.31Å; I629-V631 PolarHBondContact O-N 3.47Å; I629-V631 VanDerWaalsContact O-N 3.16Å
630	E	24.8	Very low	31.1	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.822	66%	0.657	S	S	*	*			trans	-71.4	101.8	168.4	-173.7	165	-137.9	0	0	108.3	K628 T632	K628-E630 PolarHBondContact O-N 3.07Å; K628-E630 VanDerWaalsContact O-N 3.08Å; E630-T632 PolarHBondContact O-N 2.86Å
631	V	26.9	Very low	32.6	Very low	79 Å²	79	129.2 Å²	129.2	48%	0.479	64%	0.642	S	S	.	*			trans	-78.4	107.3	167.9	177.6	0	0	0	0	106.6	I629 E633	I629-V631 HydrophobicContact CG2-CG2 4.31Å; I629-V631 PolarHBondContact O-N 3.47Å; I629-V631 VanDerWaalsContact O-N 3.16Å; V631-E633 VanDerWaalsContact C-N 3.27Å; V631-E633 HydrophobicContact CG1-CG 4.17Å; V631-E633 PolarHBondContact O-N 3.12Å
632	T	25.4	Very low	34.5	Very low	117 Å²	117	123.6 Å²	123.6	72%	0.718	61%	0.612	S	S	*	*			trans	-64.7	89.2	165.1	24.9	0	0	0	0	109.3	E630 E634	E630-T632 PolarHBondContact O-N 2.86Å; T632-E634 PolarHBondContact O-N 3.27Å; T632-E634 VanDerWaalsContact O-N 3.07Å
633	E	26.4	Very low	36.4	Very low	155 Å²	155	118.2 Å²	118.2	72%	0.724	59%	0.586	S	S	*	*			trans	-67.7	100.9	165.3	-68.4	-167.3	146.4	0	0	108.5	V631 N635	V631-E633 VanDerWaalsContact C-N 3.27Å; V631-E633 HydrophobicContact CG1-CG 4.17Å; V631-E633 PolarHBondContact O-N 3.12Å; E633-N635 PolarHBondContact O-N 3.09Å; E633-N635 VanDerWaalsContact O-N 3.17Å
634	E	26.5	Very low	38.2	Very low	175 Å²	175	113.4 Å²	113.4	82%	0.818	57%	0.569	S	S	*	*			trans	-61.1	115.6	167.4	-64.8	-175.5	152.5	0	0	108.5	T632 E636	T632-E634 PolarHBondContact O-N 3.27Å; T632-E634 VanDerWaalsContact O-N 3.07Å; E634-E636 PolarHBondContact O-N 3.44Å
635	N	31.5	Very low	40.2	Very low	145 Å²	145	108.2 Å²	108.2	78%	0.775	55%	0.547	S	S	*	.			trans	-55.4	107.8	-167.6	-67.9	-55.4	0	0	0	113.2	E633 F637	E633-N635 PolarHBondContact O-N 3.09Å; E633-N635 VanDerWaalsContact O-N 3.17Å; N635-F637 PolarHBondContact O-N 3.18Å
636	E	35.5	Very low	42.2	Very low	128 Å²	128	99.9 Å²	99.9	60%	0.598	51%	0.508	S	S	*	.			trans	-66.4	83.8	160.2	-84.1	-155	118.6	0	0	108.6	R81 E634 S638	R81-E636 IonicContact CZ-OE1 2.63Å; R81-E636 IonicContact NH2-OE1 3.77Å; R81-E636 PolarHBondContact NH2-OE1 3.3Å; R81-E636 IonicContact NH2-OE2 2.82Å; R81-E636 PolarHBondContact NH2-OE2 3.45Å; E634-E636 PolarHBondContact O-N 3.44Å; E636-S638 PolarHBondContact O-N 2.95Å
637	F	46.5	Very low	43.7	Very low	81 Å²	81	96 Å²	96	36%	0.355	49%	0.493	S	S	.	.			trans	-57.9	119.1	-171.8	-151.1	-83.6	0	0	0	112	N635 D641 I642 I683	N635-F637 PolarHBondContact O-N 3.18Å; F637-D641 HydrophobicContact CE1-CB 4.24Å; F637-I642 HydrophobicContact CD1-CD1 4.33Å; F637-I642 HydrophobicContact CD1-CG1 4.05Å; F637-I642 HydrophobicContact CE1-CD1 4.44Å; F637-I642 HydrophobicContact CE1-CG1 3.76Å; F637-I683 HydrophobicContact CD1-CD1 4.3Å; F637-I683 HydrophobicContact CD2-CD1 3.99Å; F637-I683 HydrophobicContact CE1-CD1 3.81Å; F637-I683 HydrophobicContact CE2-CD1 3.46Å; F637-I683 VanDerWaalsContact CE2-CD1 3.46Å; F637-I683 HydrophobicContact CG-CD1 4.38Å; F637-I683 HydrophobicContact CZ-CD1 3.37Å
638	S	48.8	Very low	45.5	Very low	26 Å²	26	95.2 Å²	95.2	18%	0.182	48%	0.483	C	S	.	.			trans	-80.4	137.8	-170.8	-168.1	0	0	0	0	112	E636 N640 D641 I642	E636-S638 PolarHBondContact O-N 2.95Å; S638-N640 PolarHBondContact O-N 2.95Å; S638-N640 PolarHBondContact OG-N 3.25Å; S638-D641 VanDerWaalsContact CB-CG 3.48Å; S638-D641 WeakPolarHBondContact CB-OD2 3.48Å; S638-D641 PolarHBondContact N-OD2 3.08Å; S638-D641 WeakPolarHBondContact O-CB 3.43Å; S638-D641 PolarHBondContact O-N 2.95Å; S638-I642 PolarHBondContact O-N 3.39Å
639	V	50	Low	47	Very low	15 Å²	15	87.8 Å²	87.8	9%	0.091	45%	0.453	C	S	.	.	H	α-helix	trans	-62.9	-23.6	169.7	173.4	0	0	0	0	111.2	L82 A643 V664	L82-V639 HydrophobicContact CB-CB 4.42Å; L82-V639 HydrophobicContact CB-CG2 3.82Å; L82-V639 WeakPolarHBondContact O-CG2 3.46Å; V639-A643 PolarHBondContact O-N 3.1Å; V639-A643 VanDerWaalsContact O-N 3.13Å; V639-V664 HydrophobicContact CG1-CG1 3.54Å
640	N	51.6	Low	48	Very low	117 Å²	117	88.9 Å²	88.9	63%	0.626	46%	0.455	S	S	*	.	H	α-helix	trans	-72.6	-30.4	172.6	-63.9	-12.5	0	0	0	112.4	S638 A643 S644	S638-N640 PolarHBondContact O-N 2.95Å; S638-N640 PolarHBondContact OG-N 3.25Å; N640-A643 PolarHBondContact O-N 3.23Å; N640-S644 PolarHBondContact O-N 3.3Å
641	D	59.5	Low	49.5	Very low	75 Å²	75	84.5 Å²	84.5	40%	0.401	44%	0.435	S	S	.	.	H	α-helix	trans	-69.2	-44.7	177.9	-56.4	-25.4	0	0	0	109.3	F637 S638 A643 S644 M645	F637-D641 HydrophobicContact CE1-CB 4.24Å; S638-D641 VanDerWaalsContact CB-CG 3.48Å; S638-D641 WeakPolarHBondContact CB-OD2 3.48Å; S638-D641 PolarHBondContact N-OD2 3.08Å; S638-D641 WeakPolarHBondContact O-CB 3.43Å; S638-D641 PolarHBondContact O-N 2.95Å; D641-A643 VanDerWaalsContact C-N 3.33Å; D641-A643 PolarHBondContact O-N 2.82Å; D641-S644 CarbonylContact O-C 3.6Å; D641-S644 WeakPolarHBondContact O-CA 3.32Å; D641-S644 WeakPolarHBondContact O-CB 3.34Å; D641-S644 PolarHBondContact O-N 2.87Å; D641-S644 PolarHBondContact O-OG 3.11Å; D641-M645 WeakPolarHBondContact O-CG 3.43Å; D641-M645 PolarHBondContact O-N 3.43Å
642	I	65.9	Low	51.1	Low	10 Å²	10	81.2 Å²	81.2	5%	0.051	41%	0.414	C	S	.	.	H	α-helix	trans	-57	-45.9	172.3	-58.2	177	0	0	0	110.7	F637 S638 S644 M645 F646 V664 T667 A668	F637-I642 HydrophobicContact CD1-CD1 4.33Å; F637-I642 HydrophobicContact CD1-CG1 4.05Å; F637-I642 HydrophobicContact CE1-CD1 4.44Å; F637-I642 HydrophobicContact CE1-CG1 3.76Å; S638-I642 PolarHBondContact O-N 3.39Å; I642-S644 VanDerWaalsContact C-N 3.27Å; I642-S644 PolarHBondContact O-N 3.32Å; I642-M645 WeakPolarHBondContact O-CB 3.32Å; I642-M645 PolarHBondContact O-N 2.86Å; I642-M645 VanDerWaalsContact O-N 3.16Å; I642-F646 HydrophobicContact CG2-CD2 4.24Å; I642-F646 HydrophobicContact CG2-CE2 3.86Å; I642-F646 VanDerWaalsContact O-CD2 3.26Å; I642-F646 WeakPolarHBondContact O-CD2 3.28Å; I642-F646 PolarHBondContact O-N 3.16Å; I642-V664 HydrophobicContact CG2-CG1 4.26Å; I642-V664 HydrophobicContact CG2-CG2 4.35Å; I642-T667 VanDerWaalsContact CG2-OG1 3.29Å; I642-T667 WeakPolarHBondContact CG2-OG1 3.34Å; I642-A668 HydrophobicContact CD1-CB 4.39Å
643	A	62.2	Low	52.6	Low	22 Å²	22	78.6 Å²	78.6	18%	0.182	41%	0.405	C	S	.	.	H	α-helix	trans	-60.9	-36.7	174.7	0	0	0	0	0	112.3	V639 N640 D641 F646 L647 V664	V639-A643 PolarHBondContact O-N 3.1Å; V639-A643 VanDerWaalsContact O-N 3.13Å; N640-A643 PolarHBondContact O-N 3.23Å; D641-A643 VanDerWaalsContact C-N 3.33Å; D641-A643 PolarHBondContact O-N 2.82Å; A643-F646 PolarHBondContact O-N 2.91Å; A643-L647 WeakPolarHBondContact O-CG 3.49Å; A643-L647 PolarHBondContact O-N 2.74Å; A643-L647 VanDerWaalsContact O-N 3.07Å; A643-V664 HydrophobicContact CB-CG2 3.93Å
644	S	63	Low	54.3	Low	44 Å²	44	75.8 Å²	75.8	31%	0.308	40%	0.395	S	S	.	.	H	α-helix	trans	-66.9	-35.5	174.8	88	0	0	0	0	112.6	N640 D641 I642 F646 L647 H648	N640-S644 PolarHBondContact O-N 3.3Å; D641-S644 CarbonylContact O-C 3.6Å; D641-S644 WeakPolarHBondContact O-CA 3.32Å; D641-S644 WeakPolarHBondContact O-CB 3.34Å; D641-S644 PolarHBondContact O-N 2.87Å; D641-S644 PolarHBondContact O-OG 3.11Å; I642-S644 VanDerWaalsContact C-N 3.27Å; I642-S644 PolarHBondContact O-N 3.32Å; S644-F646 VanDerWaalsContact C-N 3.3Å; S644-F646 PolarHBondContact O-N 3.38Å; S644-L647 PolarHBondContact O-N 3.44Å; S644-H648 PolarHBondContact O-N 2.98Å; S644-H648 PolarHBondContact O-ND1 2.89Å
645	M	65.3	Low	56.2	Low	43 Å²	43	68.9 Å²	68.9	21%	0.212	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-35.7	176.2	-65.2	173	77.4	0	0	111.7	D641 I642 N649 I683 E684 V687	D641-M645 WeakPolarHBondContact O-CG 3.43Å; D641-M645 PolarHBondContact O-N 3.43Å; I642-M645 WeakPolarHBondContact O-CB 3.32Å; I642-M645 PolarHBondContact O-N 2.86Å; I642-M645 VanDerWaalsContact O-N 3.16Å; M645-N649 PolarHBondContact O-ND2 3.35Å; M645-I683 HydrophobicContact CE-CB 4.36Å; M645-I683 HydrophobicContact CE-CG2 3.92Å; M645-I683 HydrophobicContact SD-CG2 3.88Å; M645-E684 HydrophobicContact CE-CB 4.34Å; M645-E684 HydrophobicContact CE-CG 3.49Å; M645-E684 VanDerWaalsContact CE-CG 3.49Å; M645-V687 HydrophobicContact CE-CG2 4.28Å
646	F	66.5	Low	58.2	Low	2 Å²	2	65.9 Å²	65.9	1%	0.009	35%	0.345	C	S	.	.	H	α-helix	trans	-68.8	-45.2	171.1	-74	-67.6	0	0	0	112.1	I642 A643 S644 H648 N649 W655 L663 V664 T667 V687	I642-F646 HydrophobicContact CG2-CD2 4.24Å; I642-F646 HydrophobicContact CG2-CE2 3.86Å; I642-F646 VanDerWaalsContact O-CD2 3.26Å; I642-F646 WeakPolarHBondContact O-CD2 3.28Å; I642-F646 PolarHBondContact O-N 3.16Å; A643-F646 PolarHBondContact O-N 2.91Å; S644-F646 VanDerWaalsContact C-N 3.3Å; S644-F646 PolarHBondContact O-N 3.38Å; F646-H648 PolarHBondContact O-N 3.29Å; F646-N649 PolarHBondContact O-N 3.42Å; F646-W655 HydrophobicContact CB-CZ3 4.03Å; F646-W655 AromaticContact CD1-CH2 3.87Å; F646-W655 HydrophobicContact CD1-CH2 3.87Å; F646-W655 AromaticContact CD1-CZ3 3.51Å; F646-W655 HydrophobicContact CD1-CZ3 3.51Å; F646-W655 HydrophobicContact CE1-CH2 4.36Å; F646-W655 HydrophobicContact CE1-CZ3 4.26Å; F646-W655 HydrophobicContact CG-CZ3 4.06Å; F646-L663 HydrophobicContact CD1-CD1 4.48Å; F646-L663 HydrophobicContact CE1-CB 3.95Å; F646-L663 HydrophobicContact CE1-CD1 4.26Å; F646-L663 HydrophobicContact CE1-CD2 4.49Å; F646-L663 HydrophobicContact CE1-CG 4.49Å; F646-L663 HydrophobicContact CE2-CB 4.08Å; F646-L663 HydrophobicContact CZ-CB 3.69Å; F646-V664 HydrophobicContact CD2-CG2 3.69Å; F646-V664 HydrophobicContact CE2-CG2 3.92Å; F646-T667 HydrophobicContact CE2-CG2 4.1Å; F646-T667 HydrophobicContact CZ-CG2 3.67Å; F646-V687 HydrophobicContact CD1-CG1 4.07Å; F646-V687 HydrophobicContact CE1-CG1 3.74Å; F646-V687 HydrophobicContact CZ-CG1 4.06Å; F646-V687 HydrophobicContact CZ-CG2 4.36Å
647	L	62	Low	59.9	Low	100 Å²	100	61.8 Å²	61.8	52%	0.524	34%	0.337	S	S	.	.	H	α-helix	trans	-70.7	-23.5	-177.5	-71.3	167.2	0	0	0	114.6	A643 S644 N649 I660	A643-L647 WeakPolarHBondContact O-CG 3.49Å; A643-L647 PolarHBondContact O-N 2.74Å; A643-L647 VanDerWaalsContact O-N 3.07Å; S644-L647 PolarHBondContact O-N 3.44Å; L647-N649 VanDerWaalsContact C-N 3.28Å; L647-N649 PolarHBondContact O-N 3.47Å; L647-I660 HydrophobicContact CD2-CD1 4.18Å
648	H	60.7	Low	61.4	Low	154 Å²	154	59.6 Å²	59.6	71%	0.713	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.8	175.7	-86.4	82.7	0	0	0	113.3	S644 F646 H650	S644-H648 PolarHBondContact O-N 2.98Å; S644-H648 PolarHBondContact O-ND1 2.89Å; F646-H648 PolarHBondContact O-N 3.29Å; H648-H650 PolarHBondContact O-N 2.95Å; H648-H650 VanDerWaalsContact O-N 3.15Å
649	N	59.7	Low	62.8	Low	45 Å²	45	59.1 Å²	59.1	24%	0.241	32%	0.323	C	S	.	.	S	Bend	trans	-78.7	100.6	176.9	-61.2	-52.5	0	0	0	109	M645 F646 L647 E651 L652	M645-N649 PolarHBondContact O-ND2 3.35Å; F646-N649 PolarHBondContact O-N 3.42Å; L647-N649 VanDerWaalsContact C-N 3.28Å; L647-N649 PolarHBondContact O-N 3.47Å; N649-E651 PolarHBondContact O-N 3.42Å; N649-L652 HydrophobicContact CB-CB 4.26Å; N649-L652 HydrophobicContact CB-CD1 3.46Å; N649-L652 VanDerWaalsContact CB-CD1 3.46Å; N649-L652 HydrophobicContact CB-CG 3.65Å; N649-L652 WeakPolarHBondContact O-CB 3.44Å; N649-L652 PolarHBondContact O-N 2.93Å
650	H	50.1	Low	64.3	Low	157 Å²	157	60 Å²	60	73%	0.727	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-17	-168.7	-156.2	-49.9	0	0	0	114.6	H648 L652	H648-H650 PolarHBondContact O-N 2.95Å; H648-H650 VanDerWaalsContact O-N 3.15Å; H650-L652 VanDerWaalsContact C-N 3.33Å
651	E	56.4	Low	65.6	Low	85 Å²	85	57.9 Å²	57.9	40%	0.397	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.8	173.9	-54.7	-164.1	136.3	0	0	113.8	N649 K763 F764	N649-E651 PolarHBondContact O-N 3.42Å; E651-K763 WeakPolarHBondContact OE1-CB 3.48Å; E651-F764 PolarHBondContact OE2-N 2.84Å
652	L	60.4	Low	66.8	Low	10 Å²	10	54.6 Å²	54.6	5%	0.052	29%	0.294	C	S	.	.	S	Bend	trans	-107.1	2.5	-171.1	-47.3	-173.6	0	0	0	112.6	N649 H650 D654 W655 F764	N649-L652 HydrophobicContact CB-CB 4.26Å; N649-L652 HydrophobicContact CB-CD1 3.46Å; N649-L652 VanDerWaalsContact CB-CD1 3.46Å; N649-L652 HydrophobicContact CB-CG 3.65Å; N649-L652 WeakPolarHBondContact O-CB 3.44Å; N649-L652 PolarHBondContact O-N 2.93Å; H650-L652 VanDerWaalsContact C-N 3.33Å; L652-D654 PolarHBondContact O-N 3.04Å; L652-W655 HydrophobicContact CB-CD2 4Å; L652-W655 HydrophobicContact CB-CE3 4.14Å; L652-W655 HydrophobicContact CB-CH2 3.85Å; L652-W655 HydrophobicContact CB-CZ2 3.65Å; L652-W655 HydrophobicContact CB-CZ3 4.06Å; L652-W655 HydrophobicContact CD1-CH2 3.44Å; L652-W655 VanDerWaalsContact CD1-CH2 3.44Å; L652-W655 HydrophobicContact CD1-CZ2 3.67Å; L652-W655 HydrophobicContact CD1-CZ3 4.17Å; L652-W655 HydrophobicContact CD2-CH2 4.3Å; L652-W655 HydrophobicContact CD2-CZ2 3.63Å; L652-W655 HydrophobicContact CG-CH2 4.03Å; L652-W655 HydrophobicContact CG-CZ2 3.81Å; L652-W655 WeakPolarHBondContact O-CB 3.42Å; L652-W655 VanDerWaalsContact O-CD2 3.27Å; L652-W655 PolarHBondContact O-N 3.42Å; L652-F764 HydrophobicContact CD1-CE2 4.02Å; L652-F764 HydrophobicContact CD2-CD2 4.29Å; L652-F764 HydrophobicContact CD2-CE2 4.47Å
653	A	56.8	Low	67.6	Low	62 Å²	62	54.1 Å²	54.1	51%	0.512	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-21.1	-178.8	0	0	0	0	0	114.1	W655	A653-W655 PolarHBondContact O-N 3.5Å; A653-W655 VanDerWaalsContact O-N 3.14Å
654	D	62.3	Low	68.7	Low	96 Å²	96	53.4 Å²	53.4	51%	0.513	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-6.9	177.1	-71.9	10.4	0	0	0	113.9	L652 N656 R760	L652-D654 PolarHBondContact O-N 3.04Å; D654-N656 PolarHBondContact O-N 2.86Å; D654-R760 IonicContact OD2-CZ 3.32Å; D654-R760 IonicContact OD2-NH2 3.75Å; D654-R760 PolarHBondContact OD2-NH2 2.91Å
655	W	66.2	Low	69.7	Low	30 Å²	30	52.1 Å²	52.1	11%	0.114	28%	0.275	C	S	.	.			trans	-73.9	121.8	-170.6	-66.9	-7.2	0	0	0	113.3	F646 L652 A653 G657 V659 I660 L663 T691 H695	F646-W655 HydrophobicContact CB-CZ3 4.03Å; F646-W655 AromaticContact CD1-CH2 3.87Å; F646-W655 HydrophobicContact CD1-CH2 3.87Å; F646-W655 AromaticContact CD1-CZ3 3.51Å; F646-W655 HydrophobicContact CD1-CZ3 3.51Å; F646-W655 HydrophobicContact CE1-CH2 4.36Å; F646-W655 HydrophobicContact CE1-CZ3 4.26Å; F646-W655 HydrophobicContact CG-CZ3 4.06Å; L652-W655 HydrophobicContact CB-CD2 4Å; L652-W655 HydrophobicContact CB-CE3 4.14Å; L652-W655 HydrophobicContact CB-CH2 3.85Å; L652-W655 HydrophobicContact CB-CZ2 3.65Å; L652-W655 HydrophobicContact CB-CZ3 4.06Å; L652-W655 HydrophobicContact CD1-CH2 3.44Å; L652-W655 VanDerWaalsContact CD1-CH2 3.44Å; L652-W655 HydrophobicContact CD1-CZ2 3.67Å; L652-W655 HydrophobicContact CD1-CZ3 4.17Å; L652-W655 HydrophobicContact CD2-CH2 4.3Å; L652-W655 HydrophobicContact CD2-CZ2 3.63Å; L652-W655 HydrophobicContact CG-CH2 4.03Å; L652-W655 HydrophobicContact CG-CZ2 3.81Å; L652-W655 WeakPolarHBondContact O-CB 3.42Å; L652-W655 VanDerWaalsContact O-CD2 3.27Å; L652-W655 PolarHBondContact O-N 3.42Å; A653-W655 PolarHBondContact O-N 3.5Å; A653-W655 VanDerWaalsContact O-N 3.14Å; W655-G657 PolarHBondContact O-N 2.92Å; W655-V659 HydrophobicContact CG-CG1 4.47Å; W655-I660 HydrophobicContact CB-CD1 4.29Å; W655-I660 HydrophobicContact CB-CG1 3.84Å; W655-I660 HydrophobicContact CE3-CG1 4.18Å; W655-I660 WeakPolarHBondContact O-CD1 3.45Å; W655-L663 HydrophobicContact CD2-CD1 4.21Å; W655-L663 HydrophobicContact CE3-CD1 3.62Å; W655-L663 HydrophobicContact CH2-CD1 3.32Å; W655-L663 HydrophobicContact CZ2-CD1 3.98Å; W655-L663 HydrophobicContact CZ3-CD1 3.15Å; W655-T691 HydrophobicContact CH2-CG2 3.98Å; W655-T691 HydrophobicContact CZ2-CG2 4.08Å; W655-H695 AromaticContact CE2-CD2 3.8Å; W655-H695 AromaticContact CE2-NE2 3.26Å; W655-H695 VanDerWaalsContact CE2-NE2 3.26Å; W655-H695 AromaticContact CH2-NE2 3.98Å; W655-H695 AromaticContact CZ2-CD2 3.44Å; W655-H695 VanDerWaalsContact CZ2-CD2 3.44Å; W655-H695 WeakPolarHBondContact CZ2-CD2 3.43Å; W655-H695 AromaticContact CZ2-NE2 3.19Å; W655-H695 WeakPolarHBondContact CZ2-NE2 3.42Å; W655-H695 AromaticContact NE1-CD2 3.91Å; W655-H695 AromaticContact NE1-NE2 3.5Å
656	N	72	Confident	70.7	Confident	82 Å²	82	50.1 Å²	50.1	44%	0.439	27%	0.265	S	S	.	.			trans	-48.8	133.4	164.5	177.8	-26.1	0	0	0	110.3	D654 K658 V659 I660	D654-N656 PolarHBondContact O-N 2.86Å; N656-K658 PolarHBondContact O-N 2.98Å; N656-K658 WeakPolarHBondContact OD1-CB 3.35Å; N656-K658 PolarHBondContact OD1-N 3.48Å; N656-V659 HydrophobicContact CB-CG2 4.41Å; N656-V659 WeakPolarHBondContact O-CA 3.43Å; N656-V659 WeakPolarHBondContact O-CB 3.4Å; N656-V659 PolarHBondContact O-N 2.96Å; N656-I660 PolarHBondContact O-N 2.83Å
657	G	72.8	Confident	71.6	Confident	41 Å²	41	50.2 Å²	50.2	42%	0.423	27%	0.266	S	S	.	.	H	α-helix	trans	-54.4	-20.4	-179.5	0	0	0	0	0	115.4	W655 K661	W655-G657 PolarHBondContact O-N 2.92Å; G657-K661 WeakPolarHBondContact O-CB 3.17Å; G657-K661 WeakPolarHBondContact O-CG 3.43Å; G657-K661 PolarHBondContact O-N 3.08Å
658	K	77.2	Confident	72.7	Confident	36 Å²	36	45.9 Å²	45.9	16%	0.157	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-43.7	168	178.5	173.1	172.2	176	0	112.7	H455 A518 Y521 N656 K661 Q662	H455-K658 PolarHBondContact CE1-NZ 3.35Å; H455-K658 VanDerWaalsContact CE1-NZ 3.26Å; H455-K658 PolarHBondContact NE2-NZ 3.49Å; A518-K658 PolarHBondContact O-NZ 3.15Å; Y521-K658 HydrophobicContact CE1-CG 4.09Å; N656-K658 PolarHBondContact O-N 2.98Å; N656-K658 WeakPolarHBondContact OD1-CB 3.35Å; N656-K658 PolarHBondContact OD1-N 3.48Å; K658-K661 PolarHBondContact O-N 2.8Å; K658-Q662 WeakPolarHBondContact O-CG 3.36Å; K658-Q662 PolarHBondContact O-N 3.26Å
659	V	79.2	Confident	73.9	Confident	15 Å²	15	38.5 Å²	38.5	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-69.1	-41.2	177.9	-178.3	0	0	0	0	110.3	W655 N656 K661 Q662 L663	W655-V659 HydrophobicContact CG-CG1 4.47Å; N656-V659 HydrophobicContact CB-CG2 4.41Å; N656-V659 WeakPolarHBondContact O-CA 3.43Å; N656-V659 WeakPolarHBondContact O-CB 3.4Å; N656-V659 PolarHBondContact O-N 2.96Å; V659-K661 VanDerWaalsContact C-N 3.33Å; V659-K661 PolarHBondContact O-N 2.9Å; V659-Q662 WeakPolarHBondContact O-CB 3.23Å; V659-Q662 PolarHBondContact O-N 3.21Å; V659-L663 HydrophobicContact CG1-CD1 3.97Å; V659-L663 HydrophobicContact CG1-CG 4.44Å; V659-L663 WeakPolarHBondContact O-CB 3.21Å; V659-L663 WeakPolarHBondContact O-CG 3.35Å; V659-L663 PolarHBondContact O-N 2.96Å
660	I	81	Confident	75.2	Confident	33 Å²	33	36.6 Å²	36.6	17%	0.169	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-45.4	172.7	-58.1	175.7	0	0	0	110.2	L647 W655 N656 Q662 L663 V664	L647-I660 HydrophobicContact CD2-CD1 4.18Å; W655-I660 HydrophobicContact CB-CD1 4.29Å; W655-I660 HydrophobicContact CB-CG1 3.84Å; W655-I660 HydrophobicContact CE3-CG1 4.18Å; W655-I660 WeakPolarHBondContact O-CD1 3.45Å; N656-I660 PolarHBondContact O-N 2.83Å; I660-Q662 PolarHBondContact O-N 2.72Å; I660-L663 PolarHBondContact O-N 3.1Å; I660-V664 HydrophobicContact CG2-CG2 4.13Å; I660-V664 WeakPolarHBondContact O-CB 3.34Å; I660-V664 VanDerWaalsContact O-CG2 3.23Å; I660-V664 WeakPolarHBondContact O-CG2 3.47Å; I660-V664 PolarHBondContact O-N 2.95Å
661	K	79.3	Confident	76.9	Confident	74 Å²	74	32.6 Å²	32.6	32%	0.322	18%	0.179	S	C	.	.	H	α-helix	trans	-60.4	-43.1	174.7	-79.2	-178.7	177.6	-168.6	0	112.6	Y521 G657 K658 V659 L665	Y521-K661 HydrophobicContact CD1-CB 4.45Å; Y521-K661 HydrophobicContact CE1-CB 4.26Å; G657-K661 WeakPolarHBondContact O-CB 3.17Å; G657-K661 WeakPolarHBondContact O-CG 3.43Å; G657-K661 PolarHBondContact O-N 3.08Å; K658-K661 PolarHBondContact O-N 2.8Å; V659-K661 VanDerWaalsContact C-N 3.33Å; V659-K661 PolarHBondContact O-N 2.9Å; K661-L665 WeakPolarHBondContact O-CB 3.3Å; K661-L665 PolarHBondContact O-N 3.47Å; K661-L665 VanDerWaalsContact O-N 3.1Å
662	Q	83.6	Confident	78.2	Confident	6 Å²	6	30.1 Å²	30.1	3%	0.028	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-54.5	175	-76.9	172.2	-51.4	0	0	111	H517 L520 Y521 K658 V659 I660 V664 L665 S666 H694	H517-Q662 PolarHBondContact O-NE2 3.03Å; L520-Q662 PolarHBondContact O-NE2 3.22Å; Y521-Q662 HydrophobicContact CD1-CG 3.95Å; K658-Q662 WeakPolarHBondContact O-CG 3.36Å; K658-Q662 PolarHBondContact O-N 3.26Å; V659-Q662 WeakPolarHBondContact O-CB 3.23Å; V659-Q662 PolarHBondContact O-N 3.21Å; I660-Q662 PolarHBondContact O-N 2.72Å; Q662-V664 PolarHBondContact O-N 3.04Å; Q662-L665 WeakPolarHBondContact O-CB 3.5Å; Q662-L665 PolarHBondContact O-N 3.28Å; Q662-S666 WeakPolarHBondContact O-CB 3.37Å; Q662-S666 PolarHBondContact O-N 3.33Å; Q662-S666 PolarHBondContact O-OG 3.13Å; Q662-H694 PolarHBondContact OE1-NE2 3.43Å
663	L	84	Confident	79.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-47.9	-177.6	-73.5	169.3	0	0	0	113.2	F646 W655 V659 I660 L665 S666 T667 V690 H694	F646-L663 HydrophobicContact CD1-CD1 4.48Å; F646-L663 HydrophobicContact CE1-CB 3.95Å; F646-L663 HydrophobicContact CE1-CD1 4.26Å; F646-L663 HydrophobicContact CE1-CD2 4.49Å; F646-L663 HydrophobicContact CE1-CG 4.49Å; F646-L663 HydrophobicContact CE2-CB 4.08Å; F646-L663 HydrophobicContact CZ-CB 3.69Å; W655-L663 HydrophobicContact CD2-CD1 4.21Å; W655-L663 HydrophobicContact CE3-CD1 3.62Å; W655-L663 HydrophobicContact CH2-CD1 3.32Å; W655-L663 HydrophobicContact CZ2-CD1 3.98Å; W655-L663 HydrophobicContact CZ3-CD1 3.15Å; V659-L663 HydrophobicContact CG1-CD1 3.97Å; V659-L663 HydrophobicContact CG1-CG 4.44Å; V659-L663 WeakPolarHBondContact O-CB 3.21Å; V659-L663 WeakPolarHBondContact O-CG 3.35Å; V659-L663 PolarHBondContact O-N 2.96Å; I660-L663 PolarHBondContact O-N 3.1Å; L663-L665 VanDerWaalsContact C-N 3.28Å; L663-L665 PolarHBondContact O-N 3.16Å; L663-S666 WeakPolarHBondContact O-CB 3.43Å; L663-S666 PolarHBondContact O-N 3.03Å; L663-T667 PolarHBondContact O-N 3.45Å; L663-T667 PolarHBondContact O-OG1 2.87Å; L663-V690 HydrophobicContact CD2-CG1 4.03Å; L663-H694 HydrophobicContact CD2-CB 3.67Å
664	V	83.6	Confident	80.7	Confident	6 Å²	6	26.8 Å²	26.8	4%	0.036	14%	0.139	C	C	.	.	H	α-helix	trans	-58.4	-42.1	176.8	169.6	0	0	0	0	111	V639 I642 A643 F646 I660 Q662 T667 A668	V639-V664 HydrophobicContact CG1-CG1 3.54Å; I642-V664 HydrophobicContact CG2-CG1 4.26Å; I642-V664 HydrophobicContact CG2-CG2 4.35Å; A643-V664 HydrophobicContact CB-CG2 3.93Å; F646-V664 HydrophobicContact CD2-CG2 3.69Å; F646-V664 HydrophobicContact CE2-CG2 3.92Å; I660-V664 HydrophobicContact CG2-CG2 4.13Å; I660-V664 WeakPolarHBondContact O-CB 3.34Å; I660-V664 VanDerWaalsContact O-CG2 3.23Å; I660-V664 WeakPolarHBondContact O-CG2 3.47Å; I660-V664 PolarHBondContact O-N 2.95Å; Q662-V664 PolarHBondContact O-N 3.04Å; V664-T667 WeakPolarHBondContact CA-OG1 3.07Å; V664-T667 PolarHBondContact O-OG1 3Å; V664-A668 WeakPolarHBondContact O-CB 3.33Å; V664-A668 PolarHBondContact O-N 2.7Å
665	L	84	Confident	81.6	Confident	18 Å²	18	26.6 Å²	26.6	9%	0.094	13%	0.134	C	C	.	.	H	α-helix	trans	-67.7	-44.3	177.3	-173.8	65.5	0	0	0	112	M77 M87 L522 K661 Q662 L663 A668 F669	M77-L665 HydrophobicContact SD-CD1 3.81Å; M87-L665 HydrophobicContact CE-CD1 3.81Å; M87-L665 HydrophobicContact CE-CD2 3.7Å; M87-L665 HydrophobicContact CE-CG 4.04Å; M87-L665 HydrophobicContact CG-CD2 3.94Å; M87-L665 HydrophobicContact SD-CD1 3.77Å; M87-L665 HydrophobicContact SD-CD2 3.86Å; M87-L665 HydrophobicContact SD-CG 4.37Å; L522-L665 HydrophobicContact CB-CD2 4.04Å; K661-L665 WeakPolarHBondContact O-CB 3.3Å; K661-L665 PolarHBondContact O-N 3.47Å; K661-L665 VanDerWaalsContact O-N 3.1Å; Q662-L665 WeakPolarHBondContact O-CB 3.5Å; Q662-L665 PolarHBondContact O-N 3.28Å; L663-L665 VanDerWaalsContact C-N 3.28Å; L663-L665 PolarHBondContact O-N 3.16Å; L665-A668 PolarHBondContact O-N 3.39Å; L665-F669 WeakPolarHBondContact O-CB 3.39Å; L665-F669 PolarHBondContact O-N 3.48Å
666	S	86.5	Confident	82.3	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.007	13%	0.129	C	C	.	.	H	α-helix	trans	-58.8	-45.7	175.2	-67	0	0	0	0	112.1	Q662 L663 F669 T670 V690 I787	Q662-S666 WeakPolarHBondContact O-CB 3.37Å; Q662-S666 PolarHBondContact O-N 3.33Å; Q662-S666 PolarHBondContact O-OG 3.13Å; L663-S666 WeakPolarHBondContact O-CB 3.43Å; L663-S666 PolarHBondContact O-N 3.03Å; S666-F669 PolarHBondContact O-N 3.17Å; S666-T670 PolarHBondContact O-N 3.31Å; S666-T670 PolarHBondContact O-OG1 3.5Å; S666-T670 VanDerWaalsContact O-OG1 3.05Å; S666-V690 VanDerWaalsContact CB-CG1 3.45Å; S666-I787 VanDerWaalsContact CB-CD1 3.43Å
667	T	85.3	Confident	82.6	Confident	3 Å²	3	21.8 Å²	21.8	2%	0.018	11%	0.11	C	C	.	.	H	α-helix	trans	-66.7	-40.8	173.9	44.3	0	0	0	0	113	I642 F646 L663 V664 F669 T670 Y671 V686 V687 V690	I642-T667 VanDerWaalsContact CG2-OG1 3.29Å; I642-T667 WeakPolarHBondContact CG2-OG1 3.34Å; F646-T667 HydrophobicContact CE2-CG2 4.1Å; F646-T667 HydrophobicContact CZ-CG2 3.67Å; L663-T667 PolarHBondContact O-N 3.45Å; L663-T667 PolarHBondContact O-OG1 2.87Å; V664-T667 WeakPolarHBondContact CA-OG1 3.07Å; V664-T667 PolarHBondContact O-OG1 3Å; T667-F669 PolarHBondContact O-N 2.94Å; T667-T670 PolarHBondContact O-N 3.16Å; T667-T670 PolarHBondContact O-OG1 3.32Å; T667-Y671 WeakPolarHBondContact O-CB 3.3Å; T667-Y671 PolarHBondContact O-N 3Å; T667-V686 HydrophobicContact CG2-CG1 4.48Å; T667-V687 HydrophobicContact CG2-CG2 4Å; T667-V690 HydrophobicContact CG2-CB 3.71Å; T667-V690 HydrophobicContact CG2-CG1 3.89Å; T667-V690 HydrophobicContact CG2-CG2 3.85Å
668	A	85	Confident	82.8	Confident	9 Å²	9	24.5 Å²	24.5	7%	0.074	12%	0.115	C	C	.	.	H	α-helix	trans	-69	-21.8	179	0	0	0	0	0	112.4	I642 V664 L665 R672	I642-A668 HydrophobicContact CD1-CB 4.39Å; V664-A668 WeakPolarHBondContact O-CB 3.33Å; V664-A668 PolarHBondContact O-N 2.7Å; L665-A668 PolarHBondContact O-N 3.39Å; A668-R672 WeakPolarHBondContact O-CD 3.38Å; A668-R672 VanDerWaalsContact O-CG 3.31Å; A668-R672 WeakPolarHBondContact O-CG 3.28Å; A668-R672 PolarHBondContact O-NH1 3.11Å
669	F	87.5	Confident	82.8	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-81.5	-53.9	171.9	175.6	-109.2	0	0	0	112	T70 V73 L74 M77 L522 I524 L665 S666 T667 Y671 R672 L673 L786 I787	T70-F669 HydrophobicContact CG2-CE2 4.38Å; T70-F669 HydrophobicContact CG2-CZ 3.75Å; V73-F669 HydrophobicContact CB-CE2 4.39Å; V73-F669 HydrophobicContact CG1-CD2 3.73Å; V73-F669 HydrophobicContact CG1-CE2 3.84Å; L74-F669 HydrophobicContact CG-CE2 4.07Å; M77-F669 HydrophobicContact CE-CB 4.25Å; M77-F669 HydrophobicContact CE-CD2 3.67Å; M77-F669 HydrophobicContact CE-CE2 4.49Å; M77-F669 HydrophobicContact CE-CG 4.32Å; M77-F669 HydrophobicContact SD-CB 3.95Å; M77-F669 HydrophobicContact SD-CD2 4.31Å; L522-F669 HydrophobicContact CD1-CD1 4.25Å; L522-F669 HydrophobicContact CD2-CB 4.11Å; L522-F669 HydrophobicContact CD2-CD1 4.23Å; L522-F669 HydrophobicContact CD2-CD2 4.14Å; L522-F669 HydrophobicContact CD2-CG 3.9Å; I524-F669 HydrophobicContact CD1-CE1 4.1Å; I524-F669 HydrophobicContact CD1-CE2 4.03Å; I524-F669 HydrophobicContact CD1-CZ 3.6Å; I524-F669 HydrophobicContact CG1-CE1 4.17Å; I524-F669 HydrophobicContact CG1-CZ 4.13Å; I524-F669 HydrophobicContact CG2-CZ 4.45Å; L665-F669 WeakPolarHBondContact O-CB 3.39Å; L665-F669 PolarHBondContact O-N 3.48Å; S666-F669 PolarHBondContact O-N 3.17Å; T667-F669 PolarHBondContact O-N 2.94Å; F669-Y671 VanDerWaalsContact C-N 3.34Å; F669-Y671 PolarHBondContact O-N 3.34Å; F669-R672 PolarHBondContact O-N 2.91Å; F669-L673 PolarHBondContact O-N 2.81Å; F669-L673 VanDerWaalsContact O-N 3.08Å; F669-L786 HydrophobicContact CE1-CD1 4.45Å; F669-L786 HydrophobicContact CZ-CD1 4.41Å; F669-I787 HydrophobicContact CD1-CD1 4.23Å; F669-I787 HydrophobicContact CD1-CG1 4.47Å
670	T	86.5	Confident	82.4	Confident	4 Å²	4	31.1 Å²	31.1	3%	0.025	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-38.4	-179.4	51.7	0	0	0	0	112.4	S666 T667 R672 L673 L674 V686 V690 I787	S666-T670 PolarHBondContact O-N 3.31Å; S666-T670 PolarHBondContact O-OG1 3.5Å; S666-T670 VanDerWaalsContact O-OG1 3.05Å; T667-T670 PolarHBondContact O-N 3.16Å; T667-T670 PolarHBondContact O-OG1 3.32Å; T670-R672 PolarHBondContact O-N 3.35Å; T670-L673 PolarHBondContact O-N 2.91Å; T670-L674 WeakPolarHBondContact O-CG 3.46Å; T670-L674 PolarHBondContact O-N 3.44Å; T670-V686 WeakPolarHBondContact OG1-CG1 3.49Å; T670-V690 HydrophobicContact CG2-CG2 4.27Å; T670-I787 HydrophobicContact CG2-CD1 3.89Å
671	Y	85.1	Confident	82.3	Confident	73 Å²	73	30.3 Å²	30.3	29%	0.286	15%	0.147	S	C	.	.	H	α-helix	trans	-63.4	-39.2	175.7	-177.6	-112.4	0	0	0	112.9	T667 F669 L674 K675 I683 V686	T667-Y671 WeakPolarHBondContact O-CB 3.3Å; T667-Y671 PolarHBondContact O-N 3Å; F669-Y671 VanDerWaalsContact C-N 3.34Å; F669-Y671 PolarHBondContact O-N 3.34Å; Y671-L674 PolarHBondContact O-N 3.36Å; Y671-K675 PolarHBondContact O-N 2.74Å; Y671-I683 HydrophobicContact CD2-CG1 3.92Å; Y671-I683 HydrophobicContact CE1-CD1 4.19Å; Y671-I683 HydrophobicContact CE2-CD1 3.97Å; Y671-I683 HydrophobicContact CE2-CG1 3.54Å; Y671-V686 HydrophobicContact CD2-CG2 4.45Å
672	R	83.6	Confident	82.4	Confident	34 Å²	34	34.1 Å²	34.1	13%	0.128	17%	0.166	C	C	.	.	H	α-helix	trans	-65.2	-38.2	173	-78.1	175.8	172.8	84.6	0.9	112.3	I56 V73 D76 C80 A668 F669 T670 K675 L676	I56-R672 HydrophobicContact CD1-CB 4.21Å; I56-R672 HydrophobicContact CD1-CG 4.36Å; V73-R672 HydrophobicContact CG1-CB 3.52Å; D76-R672 VanDerWaalsContact OD2-CD 3.3Å; D76-R672 WeakPolarHBondContact OD2-CD 3.36Å; D76-R672 IonicContact OD2-CZ 3.83Å; D76-R672 IonicContact OD2-NE 3.42Å; D76-R672 PolarHBondContact OD2-NE 3.17Å; D76-R672 IonicContact OD2-NH2 2.69Å; C80-R672 VanDerWaalsContact CB-NH2 3.32Å; C80-R672 PolarHBondContact SG-NH2 3.08Å; A668-R672 WeakPolarHBondContact O-CD 3.38Å; A668-R672 VanDerWaalsContact O-CG 3.31Å; A668-R672 WeakPolarHBondContact O-CG 3.28Å; A668-R672 PolarHBondContact O-NH1 3.11Å; F669-R672 PolarHBondContact O-N 2.91Å; T670-R672 PolarHBondContact O-N 3.35Å; R672-K675 PolarHBondContact O-N 3.03Å; R672-L676 WeakPolarHBondContact O-CB 3.5Å; R672-L676 PolarHBondContact O-N 2.7Å
673	L	84.9	Confident	82.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.1	-44.5	177.4	-170.5	62.8	0	0	0	111.1	V73 F669 T670 K675 L676 Y677 C784 L786	V73-L673 HydrophobicContact CG2-CB 4.35Å; V73-L673 HydrophobicContact CG2-CD1 3.9Å; F669-L673 PolarHBondContact O-N 2.81Å; F669-L673 VanDerWaalsContact O-N 3.08Å; T670-L673 PolarHBondContact O-N 2.91Å; L673-K675 PolarHBondContact O-N 3.32Å; L673-L676 PolarHBondContact O-N 2.9Å; L673-Y677 HydrophobicContact CD1-CD2 4.35Å; L673-Y677 HydrophobicContact CD1-CE2 3.74Å; L673-Y677 HydrophobicContact CG-CD2 4.26Å; L673-Y677 HydrophobicContact CG-CE2 3.94Å; L673-Y677 VanDerWaalsContact O-CD2 3.24Å; L673-Y677 WeakPolarHBondContact O-CD2 3.5Å; L673-Y677 PolarHBondContact O-N 2.78Å; L673-Y677 VanDerWaalsContact O-N 3.12Å; L673-C784 HydrophobicContact CD2-CB 4.06Å; L673-C784 HydrophobicContact CG-CB 4.43Å; L673-L786 HydrophobicContact CD2-CD1 3.86Å; L673-L786 HydrophobicContact CD2-CG 4.49Å
674	L	84.4	Confident	82	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-45.4	171.8	-71.4	167.5	0	0	0	111.8	T670 Y671 L676 Y677 N678 M679 I681 V686 L781 C784	T670-L674 WeakPolarHBondContact O-CG 3.46Å; T670-L674 PolarHBondContact O-N 3.44Å; Y671-L674 PolarHBondContact O-N 3.36Å; L674-L676 VanDerWaalsContact C-N 3.32Å; L674-L676 PolarHBondContact O-N 3.26Å; L674-Y677 CarbonylContact O-C 3.38Å; L674-Y677 PolarHBondContact O-N 3.11Å; L674-Y677 VanDerWaalsContact O-N 3.15Å; L674-N678 PolarHBondContact O-N 2.91Å; L674-M679 HydrophobicContact CB-CB 4.33Å; L674-M679 HydrophobicContact CD2-CB 4.06Å; L674-M679 HydrophobicContact CD2-CG 4.43Å; L674-M679 WeakPolarHBondContact O-CB 3.5Å; L674-M679 PolarHBondContact O-N 2.93Å; L674-I681 HydrophobicContact CD1-CB 4.46Å; L674-I681 HydrophobicContact CD1-CD1 4.25Å; L674-I681 HydrophobicContact CD2-CD1 3.78Å; L674-V686 HydrophobicContact CD1-CG2 3.75Å; L674-L781 HydrophobicContact CD1-CD2 3.91Å; L674-C784 HydrophobicContact CD2-CB 3.99Å; L674-C784 HydrophobicContact CG-CB 4.3Å
675	K	81.9	Confident	82	Confident	93 Å²	93	41.3 Å²	41.3	40%	0.404	20%	0.2	S	C	.	.	H	α-helix	trans	-62.5	-37.3	175.7	-163.4	-178.7	-170.1	-168	0	112.3	E57 Y671 R672 L673 Y677 N678	E57-K675 WeakPolarHBondContact OE1-CE 3.46Å; E57-K675 IonicContact OE1-NZ 2.67Å; E57-K675 PolarHBondContact OE1-NZ 2.83Å; Y671-K675 PolarHBondContact O-N 2.74Å; R672-K675 PolarHBondContact O-N 3.03Å; L673-K675 PolarHBondContact O-N 3.32Å; K675-Y677 VanDerWaalsContact C-N 3.27Å; K675-Y677 PolarHBondContact O-N 3.07Å; K675-N678 WeakPolarHBondContact O-CA 3.27Å; K675-N678 PolarHBondContact O-N 3.37Å
676	L	81	Confident	82	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-66.1	-27.7	175.9	-180	141.9	0	0	0	113.1	I56 P61 N69 R72 V73 R672 L673 L674 N678	I56-L676 HydrophobicContact CG2-CB 3.51Å; I56-L676 HydrophobicContact CG2-CD1 4.06Å; I56-L676 HydrophobicContact CG2-CG 3.95Å; P61-L676 HydrophobicContact CB-CD2 3.78Å; P61-L676 WeakPolarHBondContact CD-O 3.42Å; P61-L676 WeakPolarHBondContact CG-O 3.3Å; N69-L676 HydrophobicContact CB-CD2 3.65Å; R72-L676 HydrophobicContact CG-CD1 4.48Å; V73-L676 HydrophobicContact CG2-CB 4.22Å; V73-L676 HydrophobicContact CG2-CD1 3.95Å; R672-L676 WeakPolarHBondContact O-CB 3.5Å; R672-L676 PolarHBondContact O-N 2.7Å; L673-L676 PolarHBondContact O-N 2.9Å; L674-L676 VanDerWaalsContact C-N 3.32Å; L674-L676 PolarHBondContact O-N 3.26Å; L676-N678 VanDerWaalsContact C-N 3.3Å
677	Y	78.8	Confident	81.9	Confident	8 Å²	8	40.8 Å²	40.8	3%	0.031	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	4.1	169.1	-70.5	-64.5	0	0	0	113.8	P61 H66 N69 L534 L673 L674 K675 M679	P61-Y677 HydrophobicContact CB-CD1 3.76Å; P61-Y677 HydrophobicContact CB-CE1 3.8Å; P61-Y677 HydrophobicContact CG-CD1 4.12Å; H66-Y677 AromaticContact CD2-CZ 3.74Å; H66-Y677 PolarHBondContact CD2-OH 3.37Å; H66-Y677 AromaticContact NE2-CE2 3.74Å; H66-Y677 AromaticContact NE2-CZ 3.92Å; H66-Y677 PolarHBondContact NE2-OH 2.62Å; N69-Y677 PolarHBondContact ND2-OH 2.77Å; L534-Y677 HydrophobicContact CD2-CD1 3.79Å; L534-Y677 HydrophobicContact CD2-CE1 4.18Å; L534-Y677 HydrophobicContact CD2-CG 4.15Å; L673-Y677 HydrophobicContact CD1-CD2 4.35Å; L673-Y677 HydrophobicContact CD1-CE2 3.74Å; L673-Y677 HydrophobicContact CG-CD2 4.26Å; L673-Y677 HydrophobicContact CG-CE2 3.94Å; L673-Y677 VanDerWaalsContact O-CD2 3.24Å; L673-Y677 WeakPolarHBondContact O-CD2 3.5Å; L673-Y677 PolarHBondContact O-N 2.78Å; L673-Y677 VanDerWaalsContact O-N 3.12Å; L674-Y677 CarbonylContact O-C 3.38Å; L674-Y677 PolarHBondContact O-N 3.11Å; L674-Y677 VanDerWaalsContact O-N 3.15Å; K675-Y677 VanDerWaalsContact C-N 3.27Å; K675-Y677 PolarHBondContact O-N 3.07Å; Y677-M679 VanDerWaalsContact C-N 3.3Å; Y677-M679 PolarHBondContact O-N 3.41Å
678	N	76.9	Confident	81.8	Confident	99 Å²	99	41 Å²	41	53%	0.529	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	32.7	-173	-62.9	-40.2	0	0	0	114.3	L674 K675 L676	L674-N678 PolarHBondContact O-N 2.91Å; K675-N678 WeakPolarHBondContact O-CA 3.27Å; K675-N678 PolarHBondContact O-N 3.37Å; L676-N678 VanDerWaalsContact C-N 3.3Å
679	M	76.5	Confident	81.8	Confident	23 Å²	23	40.8 Å²	40.8	11%	0.113	20%	0.196	C	C	.	.			trans	-93.2	104.2	-177.3	-47.7	-50.5	-72	0	0	110.9	L674 Y677 I681 Q780	L674-M679 HydrophobicContact CB-CB 4.33Å; L674-M679 HydrophobicContact CD2-CB 4.06Å; L674-M679 HydrophobicContact CD2-CG 4.43Å; L674-M679 WeakPolarHBondContact O-CB 3.5Å; L674-M679 PolarHBondContact O-N 2.93Å; Y677-M679 VanDerWaalsContact C-N 3.3Å; Y677-M679 PolarHBondContact O-N 3.41Å; M679-I681 VanDerWaalsContact C-N 3.33Å; M679-I681 HydrophobicContact CB-CG1 4.39Å; M679-I681 PolarHBondContact O-N 3.25Å; M679-Q780 HydrophobicContact CE-CB 4.35Å; M679-Q780 HydrophobicContact CE-CG 3.63Å
680	N	71.5	Confident	81.7	Confident	167 Å²	167	41 Å²	41	89%	0.893	20%	0.198	S	C	*	.			trans	-78.4	77.6	179.6	-69.2	-11.9	0	0	0	111.3
681	I	79.3	Confident	81.6	Confident	15 Å²	15	40.9 Å²	40.9	8%	0.077	20%	0.197	C	C	.	.			trans	-102.5	136.9	175.7	-55.8	-172.2	0	0	0	110	L674 M679 L685 V686 Q780 L781	L674-I681 HydrophobicContact CD1-CB 4.46Å; L674-I681 HydrophobicContact CD1-CD1 4.25Å; L674-I681 HydrophobicContact CD2-CD1 3.78Å; M679-I681 VanDerWaalsContact C-N 3.33Å; M679-I681 HydrophobicContact CB-CG1 4.39Å; M679-I681 PolarHBondContact O-N 3.25Å; I681-L685 HydrophobicContact CG2-CB 4.25Å; I681-L685 HydrophobicContact CG2-CD2 3.98Å; I681-L685 HydrophobicContact CG2-CG 4.45Å; I681-V686 HydrophobicContact CG2-CG2 4.15Å; I681-Q780 HydrophobicContact CD1-CB 4.01Å; I681-L781 HydrophobicContact CD1-CG 4Å; I681-L781 HydrophobicContact CG2-CD1 4.31Å
682	E	80.4	Confident	81.5	Confident	155 Å²	155	37.7 Å²	37.7	72%	0.724	19%	0.185	S	C	*	.			trans	-61.2	134.3	177.1	-65.5	-177.6	166.6	0	0	112.1	E684 L685 V686	E682-E684 PolarHBondContact O-N 3.05Å; E682-L685 WeakPolarHBondContact O-CB 3.46Å; E682-L685 PolarHBondContact O-N 3.39Å; E682-V686 PolarHBondContact O-N 3.21Å
683	I	80.6	Confident	81.5	Confident	27 Å²	27	36.4 Å²	36.4	14%	0.138	18%	0.181	C	C	.	.	H	α-helix	trans	-63.1	-30.5	-175.2	-62.7	171.6	0	0	0	111.4	F637 M645 Y671 L685 V686 V687	F637-I683 HydrophobicContact CD1-CD1 4.3Å; F637-I683 HydrophobicContact CD2-CD1 3.99Å; F637-I683 HydrophobicContact CE1-CD1 3.81Å; F637-I683 HydrophobicContact CE2-CD1 3.46Å; F637-I683 VanDerWaalsContact CE2-CD1 3.46Å; F637-I683 HydrophobicContact CG-CD1 4.38Å; F637-I683 HydrophobicContact CZ-CD1 3.37Å; M645-I683 HydrophobicContact CE-CB 4.36Å; M645-I683 HydrophobicContact CE-CG2 3.92Å; M645-I683 HydrophobicContact SD-CG2 3.88Å; Y671-I683 HydrophobicContact CD2-CG1 3.92Å; Y671-I683 HydrophobicContact CE1-CD1 4.19Å; Y671-I683 HydrophobicContact CE2-CD1 3.97Å; Y671-I683 HydrophobicContact CE2-CG1 3.54Å; I683-L685 VanDerWaalsContact C-N 3.29Å; I683-L685 PolarHBondContact O-N 2.84Å; I683-V686 PolarHBondContact O-N 3.44Å; I683-V687 HydrophobicContact CG2-CG2 4.28Å; I683-V687 WeakPolarHBondContact O-CB 3.31Å; I683-V687 VanDerWaalsContact O-CG2 3.28Å; I683-V687 WeakPolarHBondContact O-CG2 3.47Å; I683-V687 PolarHBondContact O-N 3.31Å
684	E	79.3	Confident	81.4	Confident	110 Å²	110	37.6 Å²	37.6	51%	0.514	19%	0.186	S	C	.	.	H	α-helix	trans	-61.1	-35	172.5	-77.5	-158.5	-139.3	0	0	113.6	M645 E682 L688 K768	M645-E684 HydrophobicContact CE-CB 4.34Å; M645-E684 HydrophobicContact CE-CG 3.49Å; M645-E684 VanDerWaalsContact CE-CG 3.49Å; E682-E684 PolarHBondContact O-N 3.05Å; E684-L688 WeakPolarHBondContact O-CB 3.44Å; E684-L688 PolarHBondContact O-N 3.12Å; E684-K768 IonicContact OE2-NZ 2.68Å; E684-K768 PolarHBondContact OE2-NZ 2.93Å; E684-K768 VanDerWaalsContact OE2-NZ 3.1Å
685	L	82.4	Confident	81.2	Confident	25 Å²	25	37.7 Å²	37.7	13%	0.131	19%	0.186	C	C	.	.	H	α-helix	trans	-75.6	-35.6	177	-172.6	64	0	0	0	111.2	I681 E682 I683 L688 W689 V773 L781	I681-L685 HydrophobicContact CG2-CB 4.25Å; I681-L685 HydrophobicContact CG2-CD2 3.98Å; I681-L685 HydrophobicContact CG2-CG 4.45Å; E682-L685 WeakPolarHBondContact O-CB 3.46Å; E682-L685 PolarHBondContact O-N 3.39Å; I683-L685 VanDerWaalsContact C-N 3.29Å; I683-L685 PolarHBondContact O-N 2.84Å; L685-L688 HydrophobicContact CD1-CD2 4.23Å; L685-L688 PolarHBondContact O-N 3.01Å; L685-W689 WeakPolarHBondContact O-CB 3.41Å; L685-W689 PolarHBondContact O-N 3.46Å; L685-V773 HydrophobicContact CD1-CB 4.5Å; L685-V773 HydrophobicContact CD1-CG1 3.91Å; L685-V773 HydrophobicContact CD1-CG2 3.7Å; L685-V773 HydrophobicContact CD2-CG1 3.86Å; L685-L781 HydrophobicContact CD2-CD1 3.77Å; L685-L781 HydrophobicContact CG-CD1 3.71Å
686	V	84.8	Confident	81.3	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-43.9	171.7	-174.1	0	0	0	0	110.8	T667 T670 Y671 L674 I681 E682 I683 W689 V690 L781	T667-V686 HydrophobicContact CG2-CG1 4.48Å; T670-V686 WeakPolarHBondContact OG1-CG1 3.49Å; Y671-V686 HydrophobicContact CD2-CG2 4.45Å; L674-V686 HydrophobicContact CD1-CG2 3.75Å; I681-V686 HydrophobicContact CG2-CG2 4.15Å; E682-V686 PolarHBondContact O-N 3.21Å; I683-V686 PolarHBondContact O-N 3.44Å; V686-W689 PolarHBondContact O-N 3.34Å; V686-V690 HydrophobicContact CG1-CG2 4.47Å; V686-V690 WeakPolarHBondContact O-CB 3.29Å; V686-V690 WeakPolarHBondContact O-CG2 3.41Å; V686-V690 PolarHBondContact O-N 3.38Å; V686-L781 HydrophobicContact CG2-CD2 4.2Å
687	V	83.7	Confident	81.3	Confident	7 Å²	7	33.6 Å²	33.6	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-61.4	-44.8	174.9	165.6	0	0	0	0	111.1	M645 F646 T667 I683 T691	M645-V687 HydrophobicContact CE-CG2 4.28Å; F646-V687 HydrophobicContact CD1-CG1 4.07Å; F646-V687 HydrophobicContact CE1-CG1 3.74Å; F646-V687 HydrophobicContact CZ-CG1 4.06Å; F646-V687 HydrophobicContact CZ-CG2 4.36Å; T667-V687 HydrophobicContact CG2-CG2 4Å; I683-V687 HydrophobicContact CG2-CG2 4.28Å; I683-V687 WeakPolarHBondContact O-CB 3.31Å; I683-V687 VanDerWaalsContact O-CG2 3.28Å; I683-V687 WeakPolarHBondContact O-CG2 3.47Å; I683-V687 PolarHBondContact O-N 3.31Å; V687-T691 WeakPolarHBondContact O-CB 3.29Å; V687-T691 PolarHBondContact O-N 2.91Å; V687-T691 PolarHBondContact O-OG1 3.13Å
688	L	83.7	Confident	81.5	Confident	8 Å²	8	33.3 Å²	33.3	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-51.6	175	177.7	58.1	0	0	0	111.4	E684 L685 V690 T691 L692 F764 K768	E684-L688 WeakPolarHBondContact O-CB 3.44Å; E684-L688 PolarHBondContact O-N 3.12Å; L685-L688 HydrophobicContact CD1-CD2 4.23Å; L685-L688 PolarHBondContact O-N 3.01Å; L688-V690 PolarHBondContact O-N 3.19Å; L688-T691 WeakPolarHBondContact O-CB 3.43Å; L688-T691 PolarHBondContact O-N 3.4Å; L688-L692 HydrophobicContact CD1-CD1 4.36Å; L688-L692 HydrophobicContact CD1-CG 4.43Å; L688-L692 HydrophobicContact CG-CD1 4.35Å; L688-L692 WeakPolarHBondContact O-CG 3.39Å; L688-L692 PolarHBondContact O-N 3.19Å; L688-F764 HydrophobicContact CD1-CD1 4.5Å; L688-F764 HydrophobicContact CD1-CE1 3.48Å; L688-F764 VanDerWaalsContact CD1-CE1 3.48Å; L688-F764 HydrophobicContact CD1-CZ 3.55Å; L688-K768 HydrophobicContact CD1-CG 4.28Å
689	W	85.5	Confident	81.7	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.015	15%	0.146	C	C	.	.	H	α-helix	trans	-61	-46.2	-178.3	-174.3	-113.5	0	0	0	112.8	L685 V686 T691 L692 V693 T700 L703 I704 L778 L781 I782 S785	L685-W689 WeakPolarHBondContact O-CB 3.41Å; L685-W689 PolarHBondContact O-N 3.46Å; V686-W689 PolarHBondContact O-N 3.34Å; W689-T691 VanDerWaalsContact C-N 3.3Å; W689-T691 PolarHBondContact O-N 3.3Å; W689-L692 HydrophobicContact CE3-CD1 4.41Å; W689-L692 PolarHBondContact O-N 2.68Å; W689-V693 HydrophobicContact CD2-CG2 4.4Å; W689-V693 HydrophobicContact CZ2-CG2 4.15Å; W689-V693 WeakPolarHBondContact O-CG2 3.49Å; W689-V693 PolarHBondContact O-N 3.18Å; W689-T700 HydrophobicContact CH2-CG2 3.75Å; W689-T700 HydrophobicContact CZ2-CG2 4.18Å; W689-T700 HydrophobicContact CZ3-CG2 4.13Å; W689-L703 HydrophobicContact CZ3-CD2 4.07Å; W689-I704 HydrophobicContact CH2-CD1 4.27Å; W689-I704 HydrophobicContact CH2-CG1 3.93Å; W689-I704 HydrophobicContact CZ2-CD1 4.19Å; W689-I704 HydrophobicContact CZ2-CG1 4.25Å; W689-L778 HydrophobicContact CD2-CD1 4.46Å; W689-L778 HydrophobicContact CE3-CD1 3.71Å; W689-L778 HydrophobicContact CZ3-CD1 3.79Å; W689-L781 HydrophobicContact CB-CD1 4.34Å; W689-L781 HydrophobicContact CB-CD2 4.18Å; W689-L781 HydrophobicContact CD2-CB 4.39Å; W689-L781 HydrophobicContact CG-CB 4.11Å; W689-L781 HydrophobicContact CG-CD2 4.23Å; W689-I782 HydrophobicContact CH2-CD1 4.16Å; W689-I782 HydrophobicContact CH2-CG1 3.66Å; W689-I782 HydrophobicContact CZ2-CB 4.46Å; W689-I782 HydrophobicContact CZ2-CD1 4.4Å; W689-I782 HydrophobicContact CZ2-CG1 3.42Å; W689-I782 VanDerWaalsContact CZ2-CG1 3.42Å; W689-S785 VanDerWaalsContact NE1-CB 3.26Å; W689-S785 PolarHBondContact NE1-OG 2.98Å
690	V	85.3	Confident	82	Confident	6 Å²	6	28.5 Å²	28.5	4%	0.036	14%	0.142	C	C	.	.	H	α-helix	trans	-65.9	-32.9	178.2	171.4	0	0	0	0	111.9	L663 S666 T667 T670 V686 L688 H694	L663-V690 HydrophobicContact CD2-CG1 4.03Å; S666-V690 VanDerWaalsContact CB-CG1 3.45Å; T667-V690 HydrophobicContact CG2-CB 3.71Å; T667-V690 HydrophobicContact CG2-CG1 3.89Å; T667-V690 HydrophobicContact CG2-CG2 3.85Å; T670-V690 HydrophobicContact CG2-CG2 4.27Å; V686-V690 HydrophobicContact CG1-CG2 4.47Å; V686-V690 WeakPolarHBondContact O-CB 3.29Å; V686-V690 WeakPolarHBondContact O-CG2 3.41Å; V686-V690 PolarHBondContact O-N 3.38Å; L688-V690 PolarHBondContact O-N 3.19Å; V690-H694 WeakPolarHBondContact O-CB 3.45Å; V690-H694 PolarHBondContact O-N 2.88Å; V690-H694 VanDerWaalsContact O-N 3.16Å
691	T	83.6	Confident	82.4	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-65.4	-43.6	173.5	-52.1	0	0	0	0	111.2	W655 V687 L688 W689 H694 H695 W696 F764	W655-T691 HydrophobicContact CH2-CG2 3.98Å; W655-T691 HydrophobicContact CZ2-CG2 4.08Å; V687-T691 WeakPolarHBondContact O-CB 3.29Å; V687-T691 PolarHBondContact O-N 2.91Å; V687-T691 PolarHBondContact O-OG1 3.13Å; L688-T691 WeakPolarHBondContact O-CB 3.43Å; L688-T691 PolarHBondContact O-N 3.4Å; W689-T691 VanDerWaalsContact C-N 3.3Å; W689-T691 PolarHBondContact O-N 3.3Å; T691-H694 PolarHBondContact O-N 3.1Å; T691-H695 WeakPolarHBondContact O-CB 3.5Å; T691-H695 PolarHBondContact O-N 2.92Å; T691-H695 VanDerWaalsContact O-N 3.07Å; T691-W696 HydrophobicContact CG2-CZ3 4.15Å; T691-F764 HydrophobicContact CG2-CE1 4.09Å; T691-F764 HydrophobicContact CG2-CE2 4.4Å; T691-F764 HydrophobicContact CG2-CZ 3.74Å
692	L	83.4	Confident	82.5	Confident	6 Å²	6	20.4 Å²	20.4	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-59.4	-54.3	176.1	-68.3	172.1	0	0	0	111.3	L688 W689 H694 H695 W696 T700 L730 L761 F764 L765	L688-L692 HydrophobicContact CD1-CD1 4.36Å; L688-L692 HydrophobicContact CD1-CG 4.43Å; L688-L692 HydrophobicContact CG-CD1 4.35Å; L688-L692 WeakPolarHBondContact O-CG 3.39Å; L688-L692 PolarHBondContact O-N 3.19Å; W689-L692 HydrophobicContact CE3-CD1 4.41Å; W689-L692 PolarHBondContact O-N 2.68Å; L692-H694 VanDerWaalsContact C-N 3.25Å; L692-H694 PolarHBondContact O-N 3Å; L692-H695 PolarHBondContact O-N 3.03Å; L692-W696 HydrophobicContact CD2-CE3 3.99Å; L692-W696 HydrophobicContact CD2-CZ3 4.43Å; L692-W696 CarbonylContact O-C 3.51Å; L692-W696 WeakPolarHBondContact O-CA 2.72Å; L692-W696 PolarHBondContact O-N 2.81Å; L692-T700 VanDerWaalsContact C-OG1 3.29Å; L692-T700 HydrophobicContact CB-CG2 4.45Å; L692-T700 PolarHBondContact O-OG1 3.22Å; L692-L730 HydrophobicContact CD1-CD1 4.32Å; L692-L730 HydrophobicContact CD1-CD2 4.08Å; L692-L761 HydrophobicContact CD2-CD1 3.83Å; L692-F764 HydrophobicContact CD2-CD1 4.4Å; L692-F764 HydrophobicContact CD2-CE1 4.13Å; L692-F764 HydrophobicContact CG-CE1 4.49Å; L692-L765 HydrophobicContact CD2-CD2 4.17Å
693	V	83.5	Confident	82.5	Confident	7 Å²	7	13.5 Å²	13.5	4%	0.042	7%	0.066	C	C	.	.	H	α-helix	trans	-57	-33.7	-179.9	171.9	0	0	0	0	113.2	W689 T700 H788	W689-V693 HydrophobicContact CD2-CG2 4.4Å; W689-V693 HydrophobicContact CZ2-CG2 4.15Å; W689-V693 WeakPolarHBondContact O-CG2 3.49Å; W689-V693 PolarHBondContact O-N 3.18Å; V693-T700 HydrophobicContact CG2-CG2 3.87Å; V693-H788 HydrophobicContact CG1-CB 3.83Å
694	H	82.7	Confident	82.5	Confident	24 Å²	24	12.4 Å²	12.4	11%	0.111	6%	0.06	C	C	.	.	H	α-helix	trans	-91.9	-21.5	-176	-164.4	-47.3	0	0	0	114.1	H517 Q662 L663 V690 T691 L692	H517-H694 AromaticContact ND1-NE2 3.86Å; Q662-H694 PolarHBondContact OE1-NE2 3.43Å; L663-H694 HydrophobicContact CD2-CB 3.67Å; V690-H694 WeakPolarHBondContact O-CB 3.45Å; V690-H694 PolarHBondContact O-N 2.88Å; V690-H694 VanDerWaalsContact O-N 3.16Å; T691-H694 PolarHBondContact O-N 3.1Å; L692-H694 VanDerWaalsContact C-N 3.25Å; L692-H694 PolarHBondContact O-N 3Å
695	H	80.5	Confident	82.4	Confident	3 Å²	3	7.5 Å²	7.5	1%	0.014	4%	0.037	C	C	.	.	H	α-helix	trans	-116.2	-20.5	-174.9	-70	-1.3	0	0	0	114.5	W655 T691 L692 P697 R756	W655-H695 AromaticContact CE2-CD2 3.8Å; W655-H695 AromaticContact CE2-NE2 3.26Å; W655-H695 VanDerWaalsContact CE2-NE2 3.26Å; W655-H695 AromaticContact CH2-NE2 3.98Å; W655-H695 AromaticContact CZ2-CD2 3.44Å; W655-H695 VanDerWaalsContact CZ2-CD2 3.44Å; W655-H695 WeakPolarHBondContact CZ2-CD2 3.43Å; W655-H695 AromaticContact CZ2-NE2 3.19Å; W655-H695 WeakPolarHBondContact CZ2-NE2 3.42Å; W655-H695 AromaticContact NE1-CD2 3.91Å; W655-H695 AromaticContact NE1-NE2 3.5Å; T691-H695 WeakPolarHBondContact O-CB 3.5Å; T691-H695 PolarHBondContact O-N 2.92Å; T691-H695 VanDerWaalsContact O-N 3.07Å; L692-H695 PolarHBondContact O-N 3.03Å; H695-P697 VanDerWaalsContact C-CD 3.47Å; H695-R756 PolarHBondContact CE1-NH1 3.49Å; H695-R756 PolarHBondContact NE2-NH1 3.36Å; H695-R756 VanDerWaalsContact NE2-NH1 3.11Å; H695-R756 PolarHBondContact O-N 2.91Å
696	W	83.9	Confident	82.2	Confident	8 Å²	8	8.3 Å²	8.3	3%	0.03	4%	0.039	C	C	.	.			trans	-136.7	53.3	177.8	-57.2	-71	0	0	0	110.5	T691 L692 Y698 H699 T700 D755 R756 R760 L761 F764	T691-W696 HydrophobicContact CG2-CZ3 4.15Å; L692-W696 HydrophobicContact CD2-CE3 3.99Å; L692-W696 HydrophobicContact CD2-CZ3 4.43Å; L692-W696 CarbonylContact O-C 3.51Å; L692-W696 WeakPolarHBondContact O-CA 2.72Å; L692-W696 PolarHBondContact O-N 2.81Å; W696-Y698 VanDerWaalsContact C-N 3.29Å; W696-Y698 PolarHBondContact O-N 3.47Å; W696-H699 PolarHBondContact O-N 3.49Å; W696-T700 VanDerWaalsContact O-CB 3.24Å; W696-T700 WeakPolarHBondContact O-CB 2.8Å; W696-T700 PolarHBondContact O-N 3.2Å; W696-T700 PolarHBondContact O-OG1 3.23Å; W696-D755 VanDerWaalsContact CA-OD1 3.31Å; W696-D755 WeakPolarHBondContact CA-OD1 3.24Å; W696-D755 WeakPolarHBondContact CA-OD2 3.31Å; W696-R756 PolarHBondContact NE1-O 2.9Å; W696-R760 HydrophobicContact CZ2-CB 4.22Å; W696-L761 HydrophobicContact CB-CD1 4.4Å; W696-L761 HydrophobicContact CB-CD2 4.06Å; W696-L761 HydrophobicContact CD2-CB 4.03Å; W696-L761 HydrophobicContact CD2-CD1 3.62Å; W696-L761 HydrophobicContact CD2-CD2 4.38Å; W696-L761 HydrophobicContact CD2-CG 4.2Å; W696-L761 HydrophobicContact CE3-CD1 3.71Å; W696-L761 HydrophobicContact CG-CB 4.14Å; W696-L761 HydrophobicContact CG-CD1 3.91Å; W696-L761 HydrophobicContact CG-CD2 3.83Å; W696-L761 HydrophobicContact CG-CG 4.17Å; W696-L761 HydrophobicContact CZ2-CB 4.1Å; W696-L761 HydrophobicContact CZ3-CD1 4.2Å; W696-F764 HydrophobicContact CE3-CD1 4.49Å; W696-F764 HydrophobicContact CH2-CB 4.11Å; W696-F764 AromaticContact CH2-CD1 3.86Å; W696-F764 HydrophobicContact CH2-CD1 3.86Å; W696-F764 HydrophobicContact CH2-CE1 4.49Å; W696-F764 HydrophobicContact CH2-CG 4.06Å; W696-F764 AromaticContact CZ3-CD1 3.52Å; W696-F764 HydrophobicContact CZ3-CD1 3.52Å; W696-F764 AromaticContact CZ3-CE1 3.81Å; W696-F764 HydrophobicContact CZ3-CE1 3.81Å; W696-F764 HydrophobicContact CZ3-CG 4.18Å
697	P	81.7	Confident	81.8	Confident	2 Å²	2	8.4 Å²	8.4	1%	0.013	4%	0.04	C	C	.	.	H	α-helix	trans	-52.4	-45.3	-178.5	22.6	-34.4	0	0	0	112.2	F513 H695 T700 T701 E754 D755 H788 I792	F513-P697 HydrophobicContact CE1-CG 4.12Å; F513-P697 HydrophobicContact CZ-CB 4.26Å; F513-P697 HydrophobicContact CZ-CG 4.27Å; H695-P697 VanDerWaalsContact C-CD 3.47Å; P697-T700 PolarHBondContact O-N 3.08Å; P697-T701 PolarHBondContact O-N 3.29Å; P697-T701 PolarHBondContact O-OG1 3.06Å; P697-E754 HydrophobicContact CG-CB 4.32Å; P697-D755 WeakPolarHBondContact CD-OD1 3.47Å; P697-D755 WeakPolarHBondContact CG-OD1 3.27Å; P697-H788 PolarHBondContact O-CE1 3.08Å; P697-I792 HydrophobicContact CB-CD1 4.05Å
698	Y	81.2	Confident	81.4	Confident	2 Å²	2	9.6 Å²	9.6	1%	0.008	5%	0.045	C	C	.	.	H	α-helix	trans	-64.8	-49.5	-176.9	174	-88.4	0	0	0	112.2	W696 T700 T701 W702 V741 S744 L748 L751 A752 D755 I796	W696-Y698 VanDerWaalsContact C-N 3.29Å; W696-Y698 PolarHBondContact O-N 3.47Å; Y698-T700 VanDerWaalsContact C-N 3.27Å; Y698-T700 PolarHBondContact O-N 2.86Å; Y698-T701 WeakPolarHBondContact O-CB 3.26Å; Y698-T701 PolarHBondContact O-N 2.91Å; Y698-W702 AromaticContact CE1-CD1 3.63Å; Y698-W702 AromaticContact CE1-NE1 3.55Å; Y698-W702 AromaticContact CE2-NE1 3.82Å; Y698-W702 AromaticContact CZ-CD1 3.78Å; Y698-W702 AromaticContact CZ-NE1 3.25Å; Y698-W702 PolarHBondContact O-N 3.29Å; Y698-W702 PolarHBondContact OH-NE1 2.9Å; Y698-W702 VanDerWaalsContact OH-NE1 3.16Å; Y698-V741 HydrophobicContact CE1-CG1 3.98Å; Y698-V741 HydrophobicContact CE1-CG2 4.5Å; Y698-S744 PolarHBondContact OH-OG 2.89Å; Y698-L748 HydrophobicContact CE2-CB 4.03Å; Y698-L748 HydrophobicContact CE2-CD1 4.18Å; Y698-L751 HydrophobicContact CD2-CB 3.84Å; Y698-L751 HydrophobicContact CE2-CB 4.38Å; Y698-A752 HydrophobicContact CE1-CB 4.5Å; Y698-D755 WeakPolarHBondContact CB-OD1 3.38Å; Y698-D755 PolarHBondContact N-OD1 3.4Å; Y698-I796 HydrophobicContact CD2-CD1 3.63Å; Y698-I796 HydrophobicContact CD2-CG1 4.45Å; Y698-I796 HydrophobicContact CE2-CD1 3.72Å; Y698-I796 HydrophobicContact CE2-CG1 4.17Å; Y698-I796 HydrophobicContact CG-CD1 4.4Å
699	H	82.2	Confident	81.1	Confident	16 Å²	16	12.5 Å²	12.5	7%	0.074	6%	0.06	C	C	.	.	H	α-helix	trans	-68.3	-26.8	175.4	-71.6	87.1	0	0	0	112.6	W696 W702 L703 F734 D755 L758 L761	W696-H699 PolarHBondContact O-N 3.49Å; H699-W702 PolarHBondContact O-N 3.11Å; H699-L703 PolarHBondContact O-N 3.31Å; H699-F734 HydrophobicContact CB-CE2 4.26Å; H699-F734 AromaticContact CD2-CE2 3.66Å; H699-D755 IonicContact CE1-OD2 2.78Å; H699-D755 IonicContact CG-OD2 3.29Å; H699-D755 PolarHBondContact N-OD2 2.94Å; H699-D755 IonicContact ND1-OD2 2.7Å; H699-D755 PolarHBondContact ND1-OD2 3.05Å; H699-L758 VanDerWaalsContact CE1-CD1 3.46Å; H699-L758 WeakPolarHBondContact CE1-CD1 3.49Å; H699-L761 HydrophobicContact CB-CD2 3.94Å
700	T	82.5	Confident	80.4	Confident	4 Å²	4	13.9 Å²	13.9	3%	0.025	7%	0.068	C	C	.	.	H	α-helix	trans	-71.2	-36.7	173.7	-55	0	0	0	0	111.6	W689 L692 V693 W696 P697 Y698 L703 I704	W689-T700 HydrophobicContact CH2-CG2 3.75Å; W689-T700 HydrophobicContact CZ2-CG2 4.18Å; W689-T700 HydrophobicContact CZ3-CG2 4.13Å; L692-T700 VanDerWaalsContact C-OG1 3.29Å; L692-T700 HydrophobicContact CB-CG2 4.45Å; L692-T700 PolarHBondContact O-OG1 3.22Å; V693-T700 HydrophobicContact CG2-CG2 3.87Å; W696-T700 VanDerWaalsContact O-CB 3.24Å; W696-T700 WeakPolarHBondContact O-CB 2.8Å; W696-T700 PolarHBondContact O-N 3.2Å; W696-T700 PolarHBondContact O-OG1 3.23Å; P697-T700 PolarHBondContact O-N 3.08Å; Y698-T700 VanDerWaalsContact C-N 3.27Å; Y698-T700 PolarHBondContact O-N 2.86Å; T700-L703 WeakPolarHBondContact O-CB 3.16Å; T700-L703 PolarHBondContact O-N 3.38Å; T700-I704 HydrophobicContact CG2-CD1 4.41Å; T700-I704 WeakPolarHBondContact O-CG1 3.32Å; T700-I704 PolarHBondContact O-N 3.06Å
701	T	80.3	Confident	79.5	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.3	-44.7	171.5	-50.8	0	0	0	0	111.6	P697 Y698 L703 I704 I705 H788 I792 H793 I796	P697-T701 PolarHBondContact O-N 3.29Å; P697-T701 PolarHBondContact O-OG1 3.06Å; Y698-T701 WeakPolarHBondContact O-CB 3.26Å; Y698-T701 PolarHBondContact O-N 2.91Å; T701-L703 VanDerWaalsContact C-N 3.26Å; T701-L703 PolarHBondContact O-N 3.44Å; T701-I704 WeakPolarHBondContact O-CB 3.29Å; T701-I704 PolarHBondContact O-N 2.87Å; T701-I704 VanDerWaalsContact O-N 3.11Å; T701-I705 HydrophobicContact CG2-CD1 4.17Å; T701-I705 WeakPolarHBondContact O-CG1 3.28Å; T701-I705 PolarHBondContact O-N 3.07Å; T701-H788 PolarHBondContact OG1-CE1 2.89Å; T701-H788 PolarHBondContact OG1-NE2 2.89Å; T701-I792 HydrophobicContact CG2-CG2 4.34Å; T701-I792 VanDerWaalsContact OG1-CG2 3.31Å; T701-I792 WeakPolarHBondContact OG1-CG2 3.44Å; T701-H793 HydrophobicContact CG2-CB 3.89Å; T701-I796 HydrophobicContact CG2-CB 4.49Å; T701-I796 HydrophobicContact CG2-CD1 3.8Å
702	W	80.2	Confident	78.7	Confident	12 Å²	12	17.8 Å²	17.8	5%	0.045	10%	0.097	C	C	.	.	H	α-helix	trans	-62.9	-32.2	174.4	-82.2	106.6	0	0	0	113.1	Y698 H699 Y706 I737 R740 V741 S744 I796 V800	Y698-W702 AromaticContact CE1-CD1 3.63Å; Y698-W702 AromaticContact CE1-NE1 3.55Å; Y698-W702 AromaticContact CE2-NE1 3.82Å; Y698-W702 AromaticContact CZ-CD1 3.78Å; Y698-W702 AromaticContact CZ-NE1 3.25Å; Y698-W702 PolarHBondContact O-N 3.29Å; Y698-W702 PolarHBondContact OH-NE1 2.9Å; Y698-W702 VanDerWaalsContact OH-NE1 3.16Å; H699-W702 PolarHBondContact O-N 3.11Å; W702-Y706 VanDerWaalsContact O-CB 3.29Å; W702-Y706 WeakPolarHBondContact O-CB 3.48Å; W702-Y706 PolarHBondContact O-N 3.24Å; W702-I737 HydrophobicContact CB-CG2 3.59Å; W702-I737 HydrophobicContact CG-CG2 4.32Å; W702-R740 HydrophobicContact CZ3-CB 4.38Å; W702-V741 HydrophobicContact CB-CG2 4.35Å; W702-V741 HydrophobicContact CD2-CG2 3.88Å; W702-V741 HydrophobicContact CG-CG2 3.72Å; W702-S744 WeakPolarHBondContact CZ2-OG 3.21Å; W702-I796 HydrophobicContact CD2-CG2 3.91Å; W702-I796 HydrophobicContact CE3-CG2 4.32Å; W702-I796 HydrophobicContact CG-CG2 4.5Å; W702-I796 HydrophobicContact CH2-CG2 4.11Å; W702-I796 HydrophobicContact CZ2-CG2 3.64Å; W702-I796 HydrophobicContact CZ3-CG2 4.41Å; W702-V800 HydrophobicContact CH2-CG2 3.45Å; W702-V800 VanDerWaalsContact CH2-CG2 3.45Å; W702-V800 HydrophobicContact CZ2-CG2 4.38Å; W702-V800 HydrophobicContact CZ3-CG2 3.64Å
703	L	80.9	Confident	77.6	Confident	10 Å²	10	20 Å²	20	5%	0.052	11%	0.113	C	C	.	.	H	α-helix	trans	-66.9	-39.8	171.5	-179.3	61.5	0	0	0	112	W689 H699 T700 T701 Y706 L707 L730 A733 I737	W689-L703 HydrophobicContact CZ3-CD2 4.07Å; H699-L703 PolarHBondContact O-N 3.31Å; T700-L703 WeakPolarHBondContact O-CB 3.16Å; T700-L703 PolarHBondContact O-N 3.38Å; T701-L703 VanDerWaalsContact C-N 3.26Å; T701-L703 PolarHBondContact O-N 3.44Å; L703-Y706 PolarHBondContact O-N 2.9Å; L703-L707 HydrophobicContact CD1-CD1 4.25Å; L703-L707 HydrophobicContact CD1-CG 4.47Å; L703-L707 HydrophobicContact CG-CD1 4.09Å; L703-L707 VanDerWaalsContact O-CD1 3.3Å; L703-L707 WeakPolarHBondContact O-CD1 3.08Å; L703-L707 WeakPolarHBondContact O-CG 3.27Å; L703-L707 PolarHBondContact O-N 3.19Å; L703-L730 HydrophobicContact CD2-CD1 4.25Å; L703-L730 HydrophobicContact CD2-CD2 4.34Å; L703-L730 HydrophobicContact CD2-CG 4.27Å; L703-A733 HydrophobicContact CD1-CB 3.93Å; L703-I737 VanDerWaalsContact CA-CD1 3.45Å; L703-I737 HydrophobicContact CB-CD1 3.72Å; L703-I737 HydrophobicContact CD1-CD1 3.69Å; L703-I737 HydrophobicContact CG-CD1 4.3Å
704	I	80.7	Confident	76.2	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-61.5	-50.3	174.2	-69.2	165.2	0	0	0	110.5	I530 W689 T700 T701 Y706 L707 E708 I782	I530-I704 HydrophobicContact CD1-CG2 4.32Å; W689-I704 HydrophobicContact CH2-CD1 4.27Å; W689-I704 HydrophobicContact CH2-CG1 3.93Å; W689-I704 HydrophobicContact CZ2-CD1 4.19Å; W689-I704 HydrophobicContact CZ2-CG1 4.25Å; T700-I704 HydrophobicContact CG2-CD1 4.41Å; T700-I704 WeakPolarHBondContact O-CG1 3.32Å; T700-I704 PolarHBondContact O-N 3.06Å; T701-I704 WeakPolarHBondContact O-CB 3.29Å; T701-I704 PolarHBondContact O-N 2.87Å; T701-I704 VanDerWaalsContact O-N 3.11Å; I704-Y706 PolarHBondContact O-N 2.8Å; I704-L707 WeakPolarHBondContact O-CB 3.49Å; I704-L707 PolarHBondContact O-N 2.82Å; I704-L707 VanDerWaalsContact O-N 3.08Å; I704-E708 WeakPolarHBondContact CG2-OE1 3.47Å; I704-E708 PolarHBondContact O-N 3.32Å; I704-I782 HydrophobicContact CG1-CD1 4.08Å; I704-I782 HydrophobicContact CG1-CG1 4.1Å; I704-I782 HydrophobicContact CG1-CG2 4.4Å; I704-I782 HydrophobicContact CG2-CG2 4.29Å
705	I	78.1	Confident	74.8	Confident	8 Å²	8	26.4 Å²	26.4	4%	0.041	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-41.1	177.6	-65.6	167.9	0	0	0	111.7	T701 L707 E708 D709 H793 I796	T701-I705 HydrophobicContact CG2-CD1 4.17Å; T701-I705 WeakPolarHBondContact O-CG1 3.28Å; T701-I705 PolarHBondContact O-N 3.07Å; I705-L707 VanDerWaalsContact C-N 3.28Å; I705-L707 PolarHBondContact O-N 2.95Å; I705-E708 WeakPolarHBondContact O-CB 3.33Å; I705-E708 PolarHBondContact O-N 2.83Å; I705-D709 PolarHBondContact O-N 2.83Å; I705-H793 WeakPolarHBondContact CG1-CE1 3.4Å; I705-I796 HydrophobicContact CD1-CB 4.04Å; I705-I796 HydrophobicContact CD1-CG2 3.55Å
706	Y	78.7	Confident	73.4	Confident	41 Å²	41	33.6 Å²	33.6	16%	0.161	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-34.3	175.1	176.8	-105.5	0	0	0	112.6	W702 L703 I704 L710 A733 E736 I737	W702-Y706 VanDerWaalsContact O-CB 3.29Å; W702-Y706 WeakPolarHBondContact O-CB 3.48Å; W702-Y706 PolarHBondContact O-N 3.24Å; L703-Y706 PolarHBondContact O-N 2.9Å; I704-Y706 PolarHBondContact O-N 2.8Å; Y706-L710 HydrophobicContact CD1-CD1 4.06Å; Y706-L710 HydrophobicContact CE1-CD1 3.54Å; Y706-L710 HydrophobicContact CE1-CG 4.35Å; Y706-L710 WeakPolarHBondContact O-CG 3.39Å; Y706-L710 PolarHBondContact O-N 2.81Å; Y706-L710 VanDerWaalsContact O-N 3.17Å; Y706-A733 HydrophobicContact CD1-CB 4.05Å; Y706-A733 HydrophobicContact CE1-CB 3.72Å; Y706-E736 HydrophobicContact CE2-CB 4.33Å; Y706-E736 HydrophobicContact CE2-CG 4.17Å; Y706-I737 HydrophobicContact CG-CG1 4.32Å
707	L	76.1	Confident	71.8	Confident	4 Å²	4	39 Å²	39	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-73.3	-32.3	174.4	-67.5	161.3	0	0	0	112	L703 I704 I705 L710 N711 I728 L778 I782	L703-L707 HydrophobicContact CD1-CD1 4.25Å; L703-L707 HydrophobicContact CD1-CG 4.47Å; L703-L707 HydrophobicContact CG-CD1 4.09Å; L703-L707 VanDerWaalsContact O-CD1 3.3Å; L703-L707 WeakPolarHBondContact O-CD1 3.08Å; L703-L707 WeakPolarHBondContact O-CG 3.27Å; L703-L707 PolarHBondContact O-N 3.19Å; I704-L707 WeakPolarHBondContact O-CB 3.49Å; I704-L707 PolarHBondContact O-N 2.82Å; I704-L707 VanDerWaalsContact O-N 3.08Å; I705-L707 VanDerWaalsContact C-N 3.28Å; I705-L707 PolarHBondContact O-N 2.95Å; L707-L710 PolarHBondContact O-N 2.86Å; L707-N711 PolarHBondContact O-N 2.89Å; L707-N711 VanDerWaalsContact O-N 3.1Å; L707-N711 PolarHBondContact O-ND2 3.02Å; L707-I728 HydrophobicContact CD2-CD1 3.58Å; L707-L778 HydrophobicContact CD1-CD2 3.52Å; L707-L778 HydrophobicContact CD1-CG 3.92Å; L707-L778 HydrophobicContact CD2-CD2 4Å; L707-L778 HydrophobicContact CG-CD2 4.43Å; L707-I782 HydrophobicContact CD1-CD1 3.64Å
708	E	75.3	Confident	69.9	Low	32 Å²	32	43.8 Å²	43.8	15%	0.15	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-48	170.9	-71.6	164.2	-151.7	0	0	111.7	I530 F531 I704 I705 L710 N711 A712 H793	I530-E708 WeakPolarHBondContact CG2-OE1 3.36Å; F531-E708 HydrophobicContact CE1-CG 3.82Å; F531-E708 HydrophobicContact CZ-CG 3.7Å; I704-E708 WeakPolarHBondContact CG2-OE1 3.47Å; I704-E708 PolarHBondContact O-N 3.32Å; I705-E708 WeakPolarHBondContact O-CB 3.33Å; I705-E708 PolarHBondContact O-N 2.83Å; E708-L710 VanDerWaalsContact C-N 3.3Å; E708-L710 PolarHBondContact O-N 2.86Å; E708-N711 WeakPolarHBondContact O-CA 3.38Å; E708-N711 WeakPolarHBondContact O-CB 3.43Å; E708-N711 PolarHBondContact O-N 2.94Å; E708-A712 PolarHBondContact O-N 2.67Å; E708-H793 IonicContact OE1-CE1 3.19Å; E708-H793 PolarHBondContact OE1-CE1 3.46Å; E708-H793 IonicContact OE1-NE2 2.96Å; E708-H793 IonicContact OE2-CE1 2.67Å; E708-H793 PolarHBondContact OE2-CE1 2.84Å; E708-H793 IonicContact OE2-NE2 2.85Å; E708-H793 PolarHBondContact OE2-NE2 2.76Å
709	D	76.3	Confident	68	Low	68 Å²	68	51.6 Å²	51.6	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-54.3	-45.4	173.3	-80.9	-3.2	0	0	0	111.9	I705 N711 A712 S713 R740	I705-D709 PolarHBondContact O-N 2.83Å; D709-N711 PolarHBondContact O-N 3.32Å; D709-A712 PolarHBondContact O-N 3.46Å; D709-S713 WeakPolarHBondContact O-CB 3.46Å; D709-S713 PolarHBondContact O-N 2.67Å; D709-S713 PolarHBondContact O-OG 3.09Å; D709-R740 IonicContact OD2-CZ 2.81Å; D709-R740 VanDerWaalsContact OD2-CZ 3.29Å; D709-R740 IonicContact OD2-NH1 3.32Å; D709-R740 PolarHBondContact OD2-NH1 3.11Å; D709-R740 IonicContact OD2-NH2 3.71Å; D709-R740 PolarHBondContact OD2-NH2 2.73Å
710	L	72.2	Confident	65.9	Low	33 Å²	33	60.2 Å²	60.2	17%	0.173	33%	0.334	C	S	.	.	H	α-helix	trans	-65	-26.3	176.8	-72.8	177.6	0	0	0	112.6	Y706 L707 E708 S713 N714 M726 I728	Y706-L710 HydrophobicContact CD1-CD1 4.06Å; Y706-L710 HydrophobicContact CE1-CD1 3.54Å; Y706-L710 HydrophobicContact CE1-CG 4.35Å; Y706-L710 WeakPolarHBondContact O-CG 3.39Å; Y706-L710 PolarHBondContact O-N 2.81Å; Y706-L710 VanDerWaalsContact O-N 3.17Å; L707-L710 PolarHBondContact O-N 2.86Å; E708-L710 VanDerWaalsContact C-N 3.3Å; E708-L710 PolarHBondContact O-N 2.86Å; L710-S713 WeakPolarHBondContact CA-OG 3.38Å; L710-S713 PolarHBondContact O-OG 2.88Å; L710-N714 WeakPolarHBondContact O-CB 3.4Å; L710-N714 VanDerWaalsContact O-CG 3.3Å; L710-N714 PolarHBondContact O-N 3.29Å; L710-N714 PolarHBondContact O-ND2 2.7Å; L710-M726 HydrophobicContact CD1-CE 4.12Å; L710-M726 HydrophobicContact CD2-CE 4.34Å; L710-I728 HydrophobicContact CD1-CD1 3.64Å
711	N	66.2	Low	63.7	Low	27 Å²	27	68.7 Å²	68.7	14%	0.144	37%	0.373	C	S	.	.	H	α-helix	trans	-80.9	-42.7	175.3	-67.4	-40.8	0	0	0	112.1	F531 L707 E708 D709 S713 N714 S715 K779	F531-N711 VanDerWaalsContact CE1-ND2 3.32Å; F531-N711 WeakPolarHBondContact CE1-ND2 3.27Å; L707-N711 PolarHBondContact O-N 2.89Å; L707-N711 VanDerWaalsContact O-N 3.1Å; L707-N711 PolarHBondContact O-ND2 3.02Å; E708-N711 WeakPolarHBondContact O-CA 3.38Å; E708-N711 WeakPolarHBondContact O-CB 3.43Å; E708-N711 PolarHBondContact O-N 2.94Å; D709-N711 PolarHBondContact O-N 3.32Å; N711-S713 VanDerWaalsContact C-N 3.33Å; N711-S713 PolarHBondContact O-N 3.25Å; N711-N714 PolarHBondContact O-N 3.15Å; N711-S715 PolarHBondContact O-N 3.22Å; N711-S715 PolarHBondContact O-OG 2.84Å; N711-K779 VanDerWaalsContact ND2-CE 3.26Å; N711-K779 WeakPolarHBondContact ND2-CE 3.38Å; N711-K779 WeakPolarHBondContact OD1-CE 3.41Å; N711-K779 PolarHBondContact OD1-NZ 3.36Å
712	A	66.8	Low	61.6	Low	62 Å²	62	78.2 Å²	78.2	51%	0.512	42%	0.418	S	S	.	.	H	α-helix	trans	-63.9	-37.9	176.4	0	0	0	0	0	112.3	E708 D709 S715 L716	E708-A712 PolarHBondContact O-N 2.67Å; D709-A712 PolarHBondContact O-N 3.46Å; A712-S715 PolarHBondContact O-OG 2.94Å; A712-S715 VanDerWaalsContact O-OG 3.13Å; A712-L716 PolarHBondContact O-N 3.12Å
713	S	60	Low	59.7	Low	53 Å²	53	82.9 Å²	82.9	37%	0.371	45%	0.452	S	S	.	.	H	α-helix	trans	-71.5	-31.4	174.2	53.3	0	0	0	0	113.2	D709 L710 N711 N717	D709-S713 WeakPolarHBondContact O-CB 3.46Å; D709-S713 PolarHBondContact O-N 2.67Å; D709-S713 PolarHBondContact O-OG 3.09Å; L710-S713 WeakPolarHBondContact CA-OG 3.38Å; L710-S713 PolarHBondContact O-OG 2.88Å; N711-S713 VanDerWaalsContact C-N 3.33Å; N711-S713 PolarHBondContact O-N 3.25Å; S713-N717 PolarHBondContact O-ND2 3.42Å
714	N	53.9	Low	58.1	Low	87 Å²	87	88.1 Å²	88.1	47%	0.465	49%	0.487	S	S	.	.	H	α-helix	trans	-74.9	-38.1	174.6	-83.1	-48	0	0	0	113	L710 N711 L716 N717	L710-N714 WeakPolarHBondContact O-CB 3.4Å; L710-N714 VanDerWaalsContact O-CG 3.3Å; L710-N714 PolarHBondContact O-N 3.29Å; L710-N714 PolarHBondContact O-ND2 2.7Å; N711-N714 PolarHBondContact O-N 3.15Å; N714-L716 VanDerWaalsContact C-N 3.3Å; N714-L716 PolarHBondContact O-N 3.25Å; N714-N717 PolarHBondContact O-N 3.39Å
715	S	54.1	Low	56.8	Low	79 Å²	79	93.8 Å²	93.8	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-67.3	-30.1	178.6	60.9	0	0	0	0	113	N711 A712 N717 S718	N711-S715 PolarHBondContact O-N 3.22Å; N711-S715 PolarHBondContact O-OG 2.84Å; A712-S715 PolarHBondContact O-OG 2.94Å; A712-S715 VanDerWaalsContact O-OG 3.13Å; S715-N717 PolarHBondContact O-N 2.88Å; S715-S718 PolarHBondContact O-OG 2.92Å
716	L	51.1	Low	56.3	Low	154 Å²	154	97.5 Å²	97.5	81%	0.806	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-13.1	174.7	-147.6	79.2	0	0	0	114.1	A712 N714	A712-L716 PolarHBondContact O-N 3.12Å; N714-L716 VanDerWaalsContact C-N 3.3Å; N714-L716 PolarHBondContact O-N 3.25Å
717	N	48.4	Very low	55.8	Low	120 Å²	120	100.8 Å²	100.8	64%	0.642	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	20.2	-175.2	-79.4	-63.5	0	0	0	113.5	S713 N714 S715 D719	S713-N717 PolarHBondContact O-ND2 3.42Å; N714-N717 PolarHBondContact O-N 3.39Å; S715-N717 PolarHBondContact O-N 2.88Å; N717-D719 PolarHBondContact O-N 3.31Å
718	S	42	Very low	55.5	Low	103 Å²	103	101.5 Å²	101.5	72%	0.72	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	30.7	-166.4	50.7	0	0	0	0	117.1	S715	S715-S718 PolarHBondContact O-OG 2.92Å
719	D	41.7	Very low	55.4	Low	167 Å²	167	102.4 Å²	102.4	89%	0.893	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	6.7	178.2	-102.2	-20.1	0	0	0	113.9	N717	N717-D719 PolarHBondContact O-N 3.31Å
720	K	39	Very low	55.1	Low	197 Å²	197	99.9 Å²	99.9	86%	0.857	54%	0.543	S	S	*	.	S	Bend	trans	-133.5	149.9	176.2	-70.5	-171.3	178.7	176.8	0	113.9
721	E	35.8	Very low	55.1	Low	181 Å²	181	99 Å²	99	85%	0.846	54%	0.538	S	S	*	.			trans	-71.6	152.8	-159.2	-62.1	161.4	111.6	0	0	115	S723	E721-S723 PolarHBondContact O-N 3.01Å
722	Q	36.9	Very low	55.4	Low	201 Å²	201	104 Å²	104	94%	0.939	56%	0.56	S	S	*	*			trans	7.4	81.8	155.5	-60.4	-178.9	5.7	0	0	116.6
723	S	38.7	Very low	55.6	Low	109 Å²	109	101.1 Å²	101.1	76%	0.762	54%	0.537	S	S	*	.			trans	-85.1	145.4	163.3	50.1	0	0	0	0	110.6	E721	E721-S723 PolarHBondContact O-N 3.01Å
724	P	48.5	Very low	56.2	Low	121 Å²	121	99.1 Å²	99.1	79%	0.786	52%	0.521	S	S	*	.			trans	-68.5	159.9	179.1	30.2	-35.9	0	0	0	111.2	M726	P724-M726 PolarHBondContact O-N 3.34Å
725	E	54	Low	57.1	Low	123 Å²	123	98.9 Å²	98.9	58%	0.575	52%	0.519	S	S	*	.			trans	-42	110.7	-175.8	-61	-174.2	133.9	0	0	113	K727	E725-K727 PolarHBondContact O-N 3.48Å
726	M	66.4	Low	58	Low	86 Å²	86	98.4 Å²	98.4	42%	0.424	51%	0.509	S	S	.	.			trans	-59	116.3	176.4	-175.5	-179.6	179.8	0	0	108.9	L710 P724 I728 V775	L710-M726 HydrophobicContact CD1-CE 4.12Å; L710-M726 HydrophobicContact CD2-CE 4.34Å; P724-M726 PolarHBondContact O-N 3.34Å; M726-I728 HydrophobicContact CE-CD1 4.35Å; M726-I728 HydrophobicContact CE-CG1 4.27Å; M726-V775 HydrophobicContact CB-CB 4.46Å; M726-V775 HydrophobicContact CB-CG2 4.16Å; M726-V775 HydrophobicContact CG-CG2 3.96Å; M726-V775 WeakPolarHBondContact O-CB 3.31Å; M726-V775 VanDerWaalsContact O-CG2 3.3Å; M726-V775 WeakPolarHBondContact O-CG2 3.34Å; M726-V775 PolarHBondContact O-N 2.68Å; M726-V775 HydrophobicContact SD-CG2 4.19Å
727	K	67.4	Low	59	Low	109 Å²	109	91.2 Å²	91.2	47%	0.474	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.3	176.9	-73.9	176.3	-173.7	-176.3	0	109.4	E725 Q772 V773 P774	E725-K727 PolarHBondContact O-N 3.48Å; K727-Q772 HydrophobicContact CB-CB 4.2Å; K727-Q772 HydrophobicContact CD-CB 4.22Å; K727-V773 WeakPolarHBondContact CA-O 3.06Å; K727-P774 HydrophobicContact CG-CB 4.33Å
728	I	70.8	Confident	60.1	Low	19 Å²	19	90.1 Å²	90.1	10%	0.097	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.9	177.1	-72.3	177.8	0	0	0	108.8	L707 L710 M726 A733 V773 V775	L707-I728 HydrophobicContact CD2-CD1 3.58Å; L710-I728 HydrophobicContact CD1-CD1 3.64Å; M726-I728 HydrophobicContact CE-CD1 4.35Å; M726-I728 HydrophobicContact CE-CG1 4.27Å; I728-A733 HydrophobicContact CG2-CB 3.78Å; I728-V773 PolarHBondContact N-O 3.5Å; I728-V773 PolarHBondContact O-N 3.37Å; I728-V773 VanDerWaalsContact O-N 3.11Å; I728-V775 HydrophobicContact CB-CG2 4.46Å; I728-V775 HydrophobicContact CD1-CG2 3.46Å; I728-V775 VanDerWaalsContact CD1-CG2 3.46Å; I728-V775 HydrophobicContact CG1-CG2 3.64Å
729	N	73.3	Confident	61.5	Low	52 Å²	52	91.6 Å²	91.6	28%	0.278	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	116.4	160.3	-173.4	-21.3	0	0	0	108.2	M731 E732 A733	N729-M731 PolarHBondContact O-N 2.69Å; N729-M731 WeakPolarHBondContact OD1-CB 3.44Å; N729-M731 PolarHBondContact OD1-N 3.19Å; N729-M731 VanDerWaalsContact OD1-N 3.08Å; N729-E732 HydrophobicContact CB-CB 4.02Å; N729-E732 WeakPolarHBondContact O-CB 3.48Å; N729-E732 PolarHBondContact O-N 3.3Å; N729-A733 PolarHBondContact O-N 3.06Å; N729-A733 VanDerWaalsContact O-N 3.12Å
730	L	70.4	Confident	62.6	Low	15 Å²	15	88.4 Å²	88.4	8%	0.079	43%	0.429	C	S	.	.	H	α-helix	trans	-66.9	-22.3	-173.7	-155.3	141.9	0	0	0	112.4	L692 L703 F734 L765	L692-L730 HydrophobicContact CD1-CD1 4.32Å; L692-L730 HydrophobicContact CD1-CD2 4.08Å; L703-L730 HydrophobicContact CD2-CD1 4.25Å; L703-L730 HydrophobicContact CD2-CD2 4.34Å; L703-L730 HydrophobicContact CD2-CG 4.27Å; L730-F734 VanDerWaalsContact O-CB 3.27Å; L730-F734 WeakPolarHBondContact O-CB 3.41Å; L730-F734 PolarHBondContact O-N 2.83Å; L730-F734 VanDerWaalsContact O-N 3.1Å; L730-L765 HydrophobicContact CD2-CD1 4.12Å; L730-L765 HydrophobicContact CD2-CD2 3.38Å; L730-L765 HydrophobicContact CD2-CG 4.39Å
731	M	71.9	Confident	64	Low	14 Å²	14	79.2 Å²	79.2	7%	0.069	39%	0.389	C	S	.	.	H	α-helix	trans	-69.2	-40.2	168.9	177.8	58.6	70.8	0	0	112.2	N729 F734 L735 L765 Y766	N729-M731 PolarHBondContact O-N 2.69Å; N729-M731 WeakPolarHBondContact OD1-CB 3.44Å; N729-M731 PolarHBondContact OD1-N 3.19Å; N729-M731 VanDerWaalsContact OD1-N 3.08Å; M731-F734 PolarHBondContact O-N 2.99Å; M731-F734 HydrophobicContact SD-CD1 4.47Å; M731-L735 HydrophobicContact CG-CD1 4.19Å; M731-L735 WeakPolarHBondContact O-CG 3.25Å; M731-L735 PolarHBondContact O-N 3.42Å; M731-L735 HydrophobicContact SD-CD1 4.38Å; M731-L735 HydrophobicContact SD-CG 4.23Å; M731-L765 HydrophobicContact CE-CB 3.56Å; M731-Y766 HydrophobicContact CE-CD1 3.63Å; M731-Y766 HydrophobicContact CE-CD2 3.63Å; M731-Y766 HydrophobicContact CE-CE1 3.77Å; M731-Y766 HydrophobicContact CE-CE2 3.77Å; M731-Y766 HydrophobicContact CE-CG 3.53Å; M731-Y766 HydrophobicContact SD-CE1 4.32Å; M731-Y766 HydrophobicContact SD-CE2 4.42Å
732	E	71.5	Confident	65.2	Low	132 Å²	132	72.8 Å²	72.8	62%	0.617	37%	0.372	S	S	*	.	H	α-helix	trans	-69.8	-44.9	-178	-170.8	168.1	-158.9	0	0	110.9	N729 F734 L735 E736	N729-E732 HydrophobicContact CB-CB 4.02Å; N729-E732 WeakPolarHBondContact O-CB 3.48Å; N729-E732 PolarHBondContact O-N 3.3Å; E732-F734 VanDerWaalsContact C-N 3.31Å; E732-F734 PolarHBondContact O-N 3.36Å; E732-L735 PolarHBondContact O-N 3.22Å; E732-E736 PolarHBondContact O-N 2.7Å
733	A	71.2	Confident	66.1	Low	2 Å²	2	69.5 Å²	69.5	2%	0.017	36%	0.357	C	S	.	.	H	α-helix	trans	-57	-43.6	169.5	0	0	0	0	0	111.8	L703 Y706 I728 N729 L735 E736 I737	L703-A733 HydrophobicContact CD1-CB 3.93Å; Y706-A733 HydrophobicContact CD1-CB 4.05Å; Y706-A733 HydrophobicContact CE1-CB 3.72Å; I728-A733 HydrophobicContact CG2-CB 3.78Å; N729-A733 PolarHBondContact O-N 3.06Å; N729-A733 VanDerWaalsContact O-N 3.12Å; A733-L735 PolarHBondContact O-N 3.47Å; A733-E736 PolarHBondContact O-N 3.46Å; A733-I737 WeakPolarHBondContact O-CB 3.42Å; A733-I737 VanDerWaalsContact O-CD1 3.27Å; A733-I737 WeakPolarHBondContact O-CD1 3.26Å; A733-I737 WeakPolarHBondContact O-CG1 3.05Å; A733-I737 PolarHBondContact O-N 2.72Å
734	F	73.7	Confident	67.2	Low	10 Å²	10	64.3 Å²	64.3	4%	0.044	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-36.7	176.8	179.5	-102.5	0	0	0	113.4	H699 L730 M731 E732 K738 L758 L761 K762 L765	H699-F734 HydrophobicContact CB-CE2 4.26Å; H699-F734 AromaticContact CD2-CE2 3.66Å; L730-F734 VanDerWaalsContact O-CB 3.27Å; L730-F734 WeakPolarHBondContact O-CB 3.41Å; L730-F734 PolarHBondContact O-N 2.83Å; L730-F734 VanDerWaalsContact O-N 3.1Å; M731-F734 PolarHBondContact O-N 2.99Å; M731-F734 HydrophobicContact SD-CD1 4.47Å; E732-F734 VanDerWaalsContact C-N 3.31Å; E732-F734 PolarHBondContact O-N 3.36Å; F734-K738 VanDerWaalsContact O-CB 3.27Å; F734-K738 WeakPolarHBondContact O-CB 3.21Å; F734-K738 PolarHBondContact O-N 3.06Å; F734-L758 HydrophobicContact CZ-CD1 3.94Å; F734-L761 HydrophobicContact CD2-CD2 4.08Å; F734-L761 HydrophobicContact CE2-CD2 3.3Å; F734-L761 HydrophobicContact CE2-CG 4Å; F734-L761 HydrophobicContact CZ-CD2 3.69Å; F734-L761 HydrophobicContact CZ-CG 4.07Å; F734-K762 HydrophobicContact CE1-CG 3.95Å; F734-L765 HydrophobicContact CB-CD1 3.71Å; F734-L765 HydrophobicContact CD1-CD1 3.94Å; F734-L765 HydrophobicContact CD2-CD1 4.02Å; F734-L765 HydrophobicContact CG-CD1 3.59Å
735	L	72.6	Confident	67.9	Low	82 Å²	82	62.1 Å²	62.1	43%	0.429	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-36.8	173.9	-72.5	169.6	0	0	0	111.9	M731 E732 A733 K738 K739	M731-L735 HydrophobicContact CG-CD1 4.19Å; M731-L735 WeakPolarHBondContact O-CG 3.25Å; M731-L735 PolarHBondContact O-N 3.42Å; M731-L735 HydrophobicContact SD-CD1 4.38Å; M731-L735 HydrophobicContact SD-CG 4.23Å; E732-L735 PolarHBondContact O-N 3.22Å; A733-L735 PolarHBondContact O-N 3.47Å; L735-K738 PolarHBondContact O-N 2.81Å; L735-K739 PolarHBondContact O-N 3.34Å
736	E	71.8	Confident	68.1	Low	70 Å²	70	63.9 Å²	63.9	33%	0.327	31%	0.309	S	S	.	.	H	α-helix	trans	-69.3	-44.2	175.7	-147.2	59.8	-147.5	0	0	112	Y706 E732 A733 K738 K739 R740	Y706-E736 HydrophobicContact CE2-CB 4.33Å; Y706-E736 HydrophobicContact CE2-CG 4.17Å; E732-E736 PolarHBondContact O-N 2.7Å; A733-E736 PolarHBondContact O-N 3.46Å; E736-K738 VanDerWaalsContact C-N 3.33Å; E736-K738 PolarHBondContact O-N 3.13Å; E736-K739 WeakPolarHBondContact O-CB 3.48Å; E736-K739 PolarHBondContact O-N 2.93Å; E736-K739 VanDerWaalsContact O-N 3.17Å; E736-K739 WeakPolarHBondContact OE1-CD 3.24Å; E736-K739 IonicContact OE1-NZ 2.94Å; E736-K739 PolarHBondContact OE1-NZ 3.02Å; E736-K739 IonicContact OE2-NZ 3.61Å; E736-K739 PolarHBondContact OE2-NZ 3.05Å; E736-R740 PolarHBondContact O-N 3.34Å
737	I	72.4	Confident	67.8	Low	2 Å²	2	62.6 Å²	62.6	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-56.6	-46.7	171.5	-72.3	158	0	0	0	110.5	W702 L703 Y706 A733 K739 R740 V741	W702-I737 HydrophobicContact CB-CG2 3.59Å; W702-I737 HydrophobicContact CG-CG2 4.32Å; L703-I737 VanDerWaalsContact CA-CD1 3.45Å; L703-I737 HydrophobicContact CB-CD1 3.72Å; L703-I737 HydrophobicContact CD1-CD1 3.69Å; L703-I737 HydrophobicContact CG-CD1 4.3Å; Y706-I737 HydrophobicContact CG-CG1 4.32Å; A733-I737 WeakPolarHBondContact O-CB 3.42Å; A733-I737 VanDerWaalsContact O-CD1 3.27Å; A733-I737 WeakPolarHBondContact O-CD1 3.26Å; A733-I737 WeakPolarHBondContact O-CG1 3.05Å; A733-I737 PolarHBondContact O-N 2.72Å; I737-K739 PolarHBondContact O-N 3.25Å; I737-K739 VanDerWaalsContact O-N 3.14Å; I737-R740 PolarHBondContact O-N 3.39Å; I737-V741 HydrophobicContact CG2-CG2 3.68Å; I737-V741 WeakPolarHBondContact O-CB 3.23Å; I737-V741 VanDerWaalsContact O-CG2 3.25Å; I737-V741 WeakPolarHBondContact O-CG2 3.27Å; I737-V741 PolarHBondContact O-N 2.82Å
738	K	72.4	Confident	67.6	Low	98 Å²	98	57.7 Å²	57.7	43%	0.426	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-25.3	-179.8	-176.2	-178.1	173.4	-60.2	0	113.1	F734 L735 E736	F734-K738 VanDerWaalsContact O-CB 3.27Å; F734-K738 WeakPolarHBondContact O-CB 3.21Å; F734-K738 PolarHBondContact O-N 3.06Å; L735-K738 PolarHBondContact O-N 2.81Å; E736-K738 VanDerWaalsContact C-N 3.33Å; E736-K738 PolarHBondContact O-N 3.13Å
739	K	70.2	Confident	67.3	Low	134 Å²	134	62 Å²	62	58%	0.583	30%	0.302	S	S	*	.	H	α-helix	trans	-69	-55.2	169.8	-61.5	163.8	-179.7	167.9	0	110.3	L735 E736 I737 V741 G742	L735-K739 PolarHBondContact O-N 3.34Å; E736-K739 WeakPolarHBondContact O-CB 3.48Å; E736-K739 PolarHBondContact O-N 2.93Å; E736-K739 VanDerWaalsContact O-N 3.17Å; E736-K739 WeakPolarHBondContact OE1-CD 3.24Å; E736-K739 IonicContact OE1-NZ 2.94Å; E736-K739 PolarHBondContact OE1-NZ 3.02Å; E736-K739 IonicContact OE2-NZ 3.61Å; E736-K739 PolarHBondContact OE2-NZ 3.05Å; I737-K739 PolarHBondContact O-N 3.25Å; I737-K739 VanDerWaalsContact O-N 3.14Å; K739-V741 VanDerWaalsContact C-N 3.35Å; K739-V741 PolarHBondContact O-N 2.63Å; K739-G742 PolarHBondContact O-N 3.32Å
740	R	66.5	Low	66.7	Low	100 Å²	100	60.9 Å²	60.9	38%	0.377	30%	0.3	S	S	.	.	H	α-helix	trans	-59.9	-39.7	-178.2	-65	176	168.5	-152.2	-1	113.3	W702 D709 E736 I737 G742	W702-R740 HydrophobicContact CZ3-CB 4.38Å; D709-R740 IonicContact OD2-CZ 2.81Å; D709-R740 VanDerWaalsContact OD2-CZ 3.29Å; D709-R740 IonicContact OD2-NH1 3.32Å; D709-R740 PolarHBondContact OD2-NH1 3.11Å; D709-R740 IonicContact OD2-NH2 3.71Å; D709-R740 PolarHBondContact OD2-NH2 2.73Å; E736-R740 PolarHBondContact O-N 3.34Å; I737-R740 PolarHBondContact O-N 3.39Å; R740-G742 PolarHBondContact O-N 3.46Å
741	V	66.9	Low	66.2	Low	3 Å²	3	60.2 Å²	60.2	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-29.3	-179	166.4	0	0	0	0	112.4	Y698 W702 I737 K739 E743 S744 I745	Y698-V741 HydrophobicContact CE1-CG1 3.98Å; Y698-V741 HydrophobicContact CE1-CG2 4.5Å; W702-V741 HydrophobicContact CB-CG2 4.35Å; W702-V741 HydrophobicContact CD2-CG2 3.88Å; W702-V741 HydrophobicContact CG-CG2 3.72Å; I737-V741 HydrophobicContact CG2-CG2 3.68Å; I737-V741 WeakPolarHBondContact O-CB 3.23Å; I737-V741 VanDerWaalsContact O-CG2 3.25Å; I737-V741 WeakPolarHBondContact O-CG2 3.27Å; I737-V741 PolarHBondContact O-N 2.82Å; K739-V741 VanDerWaalsContact C-N 3.35Å; K739-V741 PolarHBondContact O-N 2.63Å; V741-E743 VanDerWaalsContact C-N 3.29Å; V741-E743 PolarHBondContact O-N 2.87Å; V741-S744 PolarHBondContact O-N 3.23Å; V741-S744 PolarHBondContact O-OG 3.36Å; V741-I745 HydrophobicContact CG1-CD1 3.79Å; V741-I745 HydrophobicContact CG1-CG1 3.7Å; V741-I745 PolarHBondContact O-N 3.05Å
742	G	61.2	Low	65.9	Low	46 Å²	46	60.8 Å²	60.8	47%	0.474	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36.7	-172.8	0	0	0	0	0	114.9	K739 R740 S744	K739-G742 PolarHBondContact O-N 3.32Å; R740-G742 PolarHBondContact O-N 3.46Å; G742-S744 VanDerWaalsContact C-N 3.29Å; G742-S744 PolarHBondContact O-N 3.46Å
743	E	57.1	Low	65.6	Low	133 Å²	133	59.7 Å²	59.7	62%	0.621	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-12.4	179	-60.7	-177.6	176.2	0	0	113.4	V741	V741-E743 VanDerWaalsContact C-N 3.29Å; V741-E743 PolarHBondContact O-N 2.87Å
744	S	60.4	Low	65.1	Low	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-19.5	-171.5	71.9	0	0	0	0	114.9	Y698 W702 V741 G742 E746 I747 L748	Y698-S744 PolarHBondContact OH-OG 2.89Å; W702-S744 WeakPolarHBondContact CZ2-OG 3.21Å; V741-S744 PolarHBondContact O-N 3.23Å; V741-S744 PolarHBondContact O-OG 3.36Å; G742-S744 VanDerWaalsContact C-N 3.29Å; G742-S744 PolarHBondContact O-N 3.46Å; S744-E746 VanDerWaalsContact C-N 3.3Å; S744-E746 PolarHBondContact O-N 3.23Å; S744-I747 PolarHBondContact O-N 3.44Å; S744-I747 VanDerWaalsContact O-N 3.1Å; S744-L748 PolarHBondContact O-N 3.44Å
745	I	63.4	Low	65	Low	75 Å²	75	61.9 Å²	61.9	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-42.5	-179	-71.7	169.7	0	0	0	111.1	V741 I747 L748 E749	V741-I745 HydrophobicContact CG1-CD1 3.79Å; V741-I745 HydrophobicContact CG1-CG1 3.7Å; V741-I745 PolarHBondContact O-N 3.05Å; I745-I747 PolarHBondContact O-N 3.49Å; I745-I747 VanDerWaalsContact O-N 3.11Å; I745-L748 PolarHBondContact O-N 3.39Å; I745-E749 WeakPolarHBondContact O-CA 3.46Å; I745-E749 PolarHBondContact O-N 3.32Å
746	E	58.5	Low	64.7	Low	159 Å²	159	62.4 Å²	62.4	74%	0.743	31%	0.313	S	S	*	.	H	α-helix	trans	-62.8	-20.3	-178.9	-65.9	-166.7	165.4	0	0	113.7	K503 S744	K503-E746 WeakPolarHBondContact CE-O 3.33Å; K503-E746 PolarHBondContact NZ-O 2.88Å; S744-E746 VanDerWaalsContact C-N 3.3Å; S744-E746 PolarHBondContact O-N 3.23Å
747	I	59.7	Low	64.5	Low	59 Å²	59	62.9 Å²	62.9	30%	0.303	32%	0.318	S	S	.	.	H	α-helix	trans	-101.7	-37.4	-178.7	-52.7	175.2	0	0	0	111.2	S502 S744 I745 L799	S502-I747 WeakPolarHBondContact OG-CG2 3.33Å; S744-I747 PolarHBondContact O-N 3.44Å; S744-I747 VanDerWaalsContact O-N 3.1Å; I745-I747 PolarHBondContact O-N 3.49Å; I745-I747 VanDerWaalsContact O-N 3.11Å; I747-L799 HydrophobicContact CB-CD1 3.98Å; I747-L799 HydrophobicContact CD1-CD1 4.15Å; I747-L799 HydrophobicContact CG2-CD1 3.6Å
748	L	63	Low	64.4	Low	7 Å²	7	65.8 Å²	65.8	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-106.9	21.3	-174.7	-63.4	177.3	0	0	0	113.9	A506 Y698 S744 I745 A750 L751 A752 I796 L799	A506-L748 HydrophobicContact CB-CD2 4.18Å; Y698-L748 HydrophobicContact CE2-CB 4.03Å; Y698-L748 HydrophobicContact CE2-CD1 4.18Å; S744-L748 PolarHBondContact O-N 3.44Å; I745-L748 PolarHBondContact O-N 3.39Å; L748-A750 PolarHBondContact O-N 3.28Å; L748-A750 VanDerWaalsContact O-N 3.08Å; L748-L751 HydrophobicContact CD2-CD1 4.4Å; L748-L751 PolarHBondContact O-N 3.18Å; L748-A752 PolarHBondContact O-N 2.84Å; L748-I796 HydrophobicContact CD1-CG1 3.93Å; L748-L799 HydrophobicContact CD1-CB 4.39Å; L748-L799 HydrophobicContact CD1-CD1 4.08Å; L748-L799 HydrophobicContact CD1-CD2 3.96Å; L748-L799 HydrophobicContact CD1-CG 4.37Å; L748-L799 HydrophobicContact CD2-CD1 4.25Å; L748-L799 HydrophobicContact CG-CD1 3.97Å
749	E	65.2	Low	64.2	Low	108 Å²	108	66.8 Å²	66.8	51%	0.505	34%	0.339	S	S	.	.	H	α-helix	trans	-41.3	-45.5	-179.6	-169.8	176.3	-174.2	0	0	114	K503 I745 L751 A752 T753	K503-E749 IonicContact NZ-OE2 2.66Å; K503-E749 PolarHBondContact NZ-OE2 3.38Å; I745-E749 WeakPolarHBondContact O-CA 3.46Å; I745-E749 PolarHBondContact O-N 3.32Å; E749-L751 VanDerWaalsContact C-N 3.31Å; E749-L751 PolarHBondContact O-N 2.93Å; E749-A752 CarbonylContact O-C 3.47Å; E749-A752 WeakPolarHBondContact O-CB 3.33Å; E749-A752 PolarHBondContact O-N 3.09Å; E749-A752 VanDerWaalsContact O-N 3.13Å; E749-T753 PolarHBondContact O-N 3.44Å; E749-T753 PolarHBondContact O-OG1 2.85Å
750	A	59.8	Low	64.3	Low	29 Å²	29	65.2 Å²	65.2	24%	0.24	33%	0.33	C	S	.	.	H	α-helix	trans	-69.2	-20.7	-179.2	0	0	0	0	0	115	A506 Q507 L748 T753	A506-A750 HydrophobicContact CB-CB 4.27Å; Q507-A750 HydrophobicContact CB-CB 4.08Å; L748-A750 PolarHBondContact O-N 3.28Å; L748-A750 VanDerWaalsContact O-N 3.08Å; A750-T753 VanDerWaalsContact C-OG1 3.29Å; A750-T753 WeakPolarHBondContact CA-OG1 3.49Å; A750-T753 PolarHBondContact O-OG1 3.42Å
751	L	61.2	Low	64.7	Low	1 Å²	1	60.6 Å²	60.6	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-88	-33.6	168.9	-63.7	179.7	0	0	0	111.1	A506 V509 Y698 L748 E749 T753 E754	A506-L751 HydrophobicContact CB-CD1 4.46Å; A506-L751 HydrophobicContact CB-CG 4.13Å; V509-L751 HydrophobicContact CB-CD2 4.02Å; V509-L751 HydrophobicContact CG1-CD2 3.75Å; Y698-L751 HydrophobicContact CD2-CB 3.84Å; Y698-L751 HydrophobicContact CE2-CB 4.38Å; L748-L751 HydrophobicContact CD2-CD1 4.4Å; L748-L751 PolarHBondContact O-N 3.18Å; E749-L751 VanDerWaalsContact C-N 3.31Å; E749-L751 PolarHBondContact O-N 2.93Å; L751-T753 PolarHBondContact O-N 2.88Å; L751-E754 WeakPolarHBondContact O-CB 3.21Å; L751-E754 PolarHBondContact O-N 3.49Å; L751-E754 VanDerWaalsContact O-N 3.14Å
752	A	66	Low	64.9	Low	26 Å²	26	63.6 Å²	63.6	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-65.1	-25.2	173.2	0	0	0	0	0	112.6	Y698 L748 E749 E754 D755	Y698-A752 HydrophobicContact CE1-CB 4.5Å; L748-A752 PolarHBondContact O-N 2.84Å; E749-A752 CarbonylContact O-C 3.47Å; E749-A752 WeakPolarHBondContact O-CB 3.33Å; E749-A752 PolarHBondContact O-N 3.09Å; E749-A752 VanDerWaalsContact O-N 3.13Å; A752-E754 VanDerWaalsContact C-N 3.28Å; A752-E754 PolarHBondContact O-N 3.05Å; A752-D755 PolarHBondContact O-N 3.05Å
753	T	63.6	Low	65.5	Low	109 Å²	109	66 Å²	66	67%	0.669	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.2	172.6	45.7	0	0	0	0	115.1	E749 A750 L751	E749-T753 PolarHBondContact O-N 3.44Å; E749-T753 PolarHBondContact O-OG1 2.85Å; A750-T753 VanDerWaalsContact C-OG1 3.29Å; A750-T753 WeakPolarHBondContact CA-OG1 3.49Å; A750-T753 PolarHBondContact O-OG1 3.42Å; L751-T753 PolarHBondContact O-N 2.88Å
754	E	61.3	Low	66.2	Low	39 Å²	39	60 Å²	60	18%	0.182	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-22.6	174.2	-52.9	-154.4	110.4	0	0	112.3	G510 F513 P697 L751 A752	G510-E754 VanDerWaalsContact CA-OE1 3.22Å; G510-E754 WeakPolarHBondContact CA-OE1 3.29Å; G510-E754 VanDerWaalsContact O-OE1 3.11Å; F513-E754 VanDerWaalsContact CD1-CD 3.5Å; F513-E754 VanDerWaalsContact CD1-OE1 3.24Å; F513-E754 WeakPolarHBondContact CD1-OE1 3.42Å; F513-E754 WeakPolarHBondContact CD1-OE2 3.34Å; P697-E754 HydrophobicContact CG-CB 4.32Å; L751-E754 WeakPolarHBondContact O-CB 3.21Å; L751-E754 PolarHBondContact O-N 3.49Å; L751-E754 VanDerWaalsContact O-N 3.14Å; A752-E754 VanDerWaalsContact C-N 3.28Å; A752-E754 PolarHBondContact O-N 3.05Å
755	D	72.7	Confident	66.8	Low	19 Å²	19	60.3 Å²	60.3	10%	0.102	30%	0.296	C	S	.	.	S	Bend	trans	-78.3	125.3	176.6	-82.7	27.1	0	0	0	110.7	W696 P697 Y698 H699 A752	W696-D755 VanDerWaalsContact CA-OD1 3.31Å; W696-D755 WeakPolarHBondContact CA-OD1 3.24Å; W696-D755 WeakPolarHBondContact CA-OD2 3.31Å; P697-D755 WeakPolarHBondContact CD-OD1 3.47Å; P697-D755 WeakPolarHBondContact CG-OD1 3.27Å; Y698-D755 WeakPolarHBondContact CB-OD1 3.38Å; Y698-D755 PolarHBondContact N-OD1 3.4Å; H699-D755 IonicContact CE1-OD2 2.78Å; H699-D755 IonicContact CG-OD2 3.29Å; H699-D755 PolarHBondContact N-OD2 2.94Å; H699-D755 IonicContact ND1-OD2 2.7Å; H699-D755 PolarHBondContact ND1-OD2 3.05Å; A752-D755 PolarHBondContact O-N 3.05Å
756	R	66.1	Low	67.1	Low	94 Å²	94	63.4 Å²	63.4	36%	0.355	30%	0.304	S	S	.	.			trans	-70.1	141.9	179	-64.5	179.3	174.9	178.1	-1.1	110.8	H695 W696 L758	H695-R756 PolarHBondContact CE1-NH1 3.49Å; H695-R756 PolarHBondContact NE2-NH1 3.36Å; H695-R756 VanDerWaalsContact NE2-NH1 3.11Å; H695-R756 PolarHBondContact O-N 2.91Å; W696-R756 PolarHBondContact NE1-O 2.9Å; R756-L758 PolarHBondContact O-N 3.28Å
757	D	67.5	Low	67.7	Low	80 Å²	80	59.3 Å²	59.3	43%	0.428	29%	0.293	S	S	.	.			trans	13.8	95.4	169.9	-57.4	-34.7	0	0	0	115.6	E759 R760 L761	D757-E759 PolarHBondContact O-N 3.42Å; D757-R760 HydrophobicContact CB-CB 4.02Å; D757-R760 HydrophobicContact CB-CG 3.8Å; D757-R760 WeakPolarHBondContact O-CA 3.39Å; D757-R760 WeakPolarHBondContact O-CB 3.29Å; D757-R760 PolarHBondContact O-N 3.05Å; D757-R760 WeakPolarHBondContact OD2-CD 3.17Å; D757-R760 IonicContact OD2-CZ 3.51Å; D757-R760 IonicContact OD2-NE 2.85Å; D757-R760 IonicContact OD2-NH1 3.26Å; D757-R760 PolarHBondContact OD2-NH1 3.17Å; D757-L761 PolarHBondContact O-N 3.38Å
758	L	69	Low	68.1	Low	62 Å²	62	58.1 Å²	58.1	33%	0.325	29%	0.285	S	S	.	.	H	α-helix	trans	-57.8	-19.5	-175.4	-170.5	59.2	0	0	0	114.2	H699 F734 R756 L761 K762	H699-L758 VanDerWaalsContact CE1-CD1 3.46Å; H699-L758 WeakPolarHBondContact CE1-CD1 3.49Å; F734-L758 HydrophobicContact CZ-CD1 3.94Å; R756-L758 PolarHBondContact O-N 3.28Å; L758-L761 HydrophobicContact CD1-CB 4.45Å; L758-L761 HydrophobicContact CD1-CD2 4.07Å; L758-K762 WeakPolarHBondContact O-CG 3.41Å; L758-K762 PolarHBondContact O-N 3.02Å
759	E	67.9	Low	67.8	Low	119 Å²	119	60.1 Å²	60.1	56%	0.556	30%	0.3	S	S	*	.	H	α-helix	trans	-72.1	-34.9	168.8	-64.5	-155.1	165.3	0	0	114.5	D757 L761 K762 K763	D757-E759 PolarHBondContact O-N 3.42Å; E759-L761 VanDerWaalsContact C-N 3.33Å; E759-K762 PolarHBondContact O-N 3.33Å; E759-K763 WeakPolarHBondContact O-CB 3.42Å; E759-K763 VanDerWaalsContact O-CG 3.3Å; E759-K763 WeakPolarHBondContact O-CG 3.31Å; E759-K763 PolarHBondContact O-N 2.94Å; E759-K763 IonicContact OE2-NZ 3.16Å; E759-K763 PolarHBondContact OE2-NZ 2.95Å
760	R	73.2	Confident	67.3	Low	102 Å²	102	60 Å²	60	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-66.7	-37.3	174.4	-72.1	-175.7	156.3	155.6	-21.4	110.7	D654 W696 D757 K762 K763 F764	D654-R760 IonicContact OD2-CZ 3.32Å; D654-R760 IonicContact OD2-NH2 3.75Å; D654-R760 PolarHBondContact OD2-NH2 2.91Å; W696-R760 HydrophobicContact CZ2-CB 4.22Å; D757-R760 HydrophobicContact CB-CB 4.02Å; D757-R760 HydrophobicContact CB-CG 3.8Å; D757-R760 WeakPolarHBondContact O-CA 3.39Å; D757-R760 WeakPolarHBondContact O-CB 3.29Å; D757-R760 PolarHBondContact O-N 3.05Å; D757-R760 WeakPolarHBondContact OD2-CD 3.17Å; D757-R760 IonicContact OD2-CZ 3.51Å; D757-R760 IonicContact OD2-NE 2.85Å; D757-R760 IonicContact OD2-NH1 3.26Å; D757-R760 PolarHBondContact OD2-NH1 3.17Å; R760-K762 PolarHBondContact O-N 3.21Å; R760-K763 PolarHBondContact O-N 3.03Å; R760-F764 WeakPolarHBondContact O-CB 3.3Å; R760-F764 PolarHBondContact O-N 2.99Å
761	L	74.5	Confident	67.4	Low	3 Å²	3	61.3 Å²	61.3	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-57.6	-50.2	170.3	-179	51.8	0	0	0	111	L692 W696 H699 F734 D757 L758 E759 K763 F764 L765	L692-L761 HydrophobicContact CD2-CD1 3.83Å; W696-L761 HydrophobicContact CB-CD1 4.4Å; W696-L761 HydrophobicContact CB-CD2 4.06Å; W696-L761 HydrophobicContact CD2-CB 4.03Å; W696-L761 HydrophobicContact CD2-CD1 3.62Å; W696-L761 HydrophobicContact CD2-CD2 4.38Å; W696-L761 HydrophobicContact CD2-CG 4.2Å; W696-L761 HydrophobicContact CE3-CD1 3.71Å; W696-L761 HydrophobicContact CG-CB 4.14Å; W696-L761 HydrophobicContact CG-CD1 3.91Å; W696-L761 HydrophobicContact CG-CD2 3.83Å; W696-L761 HydrophobicContact CG-CG 4.17Å; W696-L761 HydrophobicContact CZ2-CB 4.1Å; W696-L761 HydrophobicContact CZ3-CD1 4.2Å; H699-L761 HydrophobicContact CB-CD2 3.94Å; F734-L761 HydrophobicContact CD2-CD2 4.08Å; F734-L761 HydrophobicContact CE2-CD2 3.3Å; F734-L761 HydrophobicContact CE2-CG 4Å; F734-L761 HydrophobicContact CZ-CD2 3.69Å; F734-L761 HydrophobicContact CZ-CG 4.07Å; D757-L761 PolarHBondContact O-N 3.38Å; L758-L761 HydrophobicContact CD1-CB 4.45Å; L758-L761 HydrophobicContact CD1-CD2 4.07Å; E759-L761 VanDerWaalsContact C-N 3.33Å; L761-K763 PolarHBondContact O-N 3.46Å; L761-F764 PolarHBondContact O-N 3.35Å; L761-L765 HydrophobicContact CD1-CD1 3.85Å; L761-L765 HydrophobicContact CD1-CD2 4.36Å; L761-L765 HydrophobicContact CD1-CG 3.82Å; L761-L765 HydrophobicContact CG-CD1 4.15Å; L761-L765 HydrophobicContact CG-CG 4.42Å; L761-L765 WeakPolarHBondContact O-CB 3.36Å; L761-L765 VanDerWaalsContact O-CG 3.3Å; L761-L765 WeakPolarHBondContact O-CG 3.31Å; L761-L765 PolarHBondContact O-N 3.4Å
762	K	72.3	Confident	67.7	Low	66 Å²	66	67.5 Å²	67.5	29%	0.287	35%	0.345	S	S	.	.	H	α-helix	trans	-57.8	-48.8	177.2	-67.4	169	-162.8	161.5	0	111.8	F734 L758 E759 R760 L765 Y766	F734-K762 HydrophobicContact CE1-CG 3.95Å; L758-K762 WeakPolarHBondContact O-CG 3.41Å; L758-K762 PolarHBondContact O-N 3.02Å; E759-K762 PolarHBondContact O-N 3.33Å; R760-K762 PolarHBondContact O-N 3.21Å; K762-L765 PolarHBondContact O-N 2.99Å; K762-Y766 HydrophobicContact CB-CD2 4.35Å; K762-Y766 HydrophobicContact CB-CE2 4.36Å; K762-Y766 WeakPolarHBondContact O-CB 3.4Å; K762-Y766 WeakPolarHBondContact O-CD2 3.36Å; K762-Y766 PolarHBondContact O-N 3.11Å
763	K	72.5	Confident	67.9	Low	97 Å²	97	66.5 Å²	66.5	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-61.7	-46.5	-178.8	-71.8	162.9	-174.6	156.1	0	111.5	E651 E759 R760 L761 L765 Y766 S767	E651-K763 WeakPolarHBondContact OE1-CB 3.48Å; E759-K763 WeakPolarHBondContact O-CB 3.42Å; E759-K763 VanDerWaalsContact O-CG 3.3Å; E759-K763 WeakPolarHBondContact O-CG 3.31Å; E759-K763 PolarHBondContact O-N 2.94Å; E759-K763 IonicContact OE2-NZ 3.16Å; E759-K763 PolarHBondContact OE2-NZ 2.95Å; R760-K763 PolarHBondContact O-N 3.03Å; L761-K763 PolarHBondContact O-N 3.46Å; K763-L765 PolarHBondContact O-N 3.36Å; K763-Y766 PolarHBondContact O-N 3.18Å; K763-S767 PolarHBondContact O-N 2.94Å
764	F	73.4	Confident	68.5	Low	5 Å²	5	62.6 Å²	62.6	2%	0.022	31%	0.313	C	S	.	.	H	α-helix	trans	-57.8	-47.2	173.8	-179.7	-115.7	0	0	0	112	E651 L652 L688 T691 L692 W696 R760 L761 S767 K768	E651-F764 PolarHBondContact OE2-N 2.84Å; L652-F764 HydrophobicContact CD1-CE2 4.02Å; L652-F764 HydrophobicContact CD2-CD2 4.29Å; L652-F764 HydrophobicContact CD2-CE2 4.47Å; L688-F764 HydrophobicContact CD1-CD1 4.5Å; L688-F764 HydrophobicContact CD1-CE1 3.48Å; L688-F764 VanDerWaalsContact CD1-CE1 3.48Å; L688-F764 HydrophobicContact CD1-CZ 3.55Å; T691-F764 HydrophobicContact CG2-CE1 4.09Å; T691-F764 HydrophobicContact CG2-CE2 4.4Å; T691-F764 HydrophobicContact CG2-CZ 3.74Å; L692-F764 HydrophobicContact CD2-CD1 4.4Å; L692-F764 HydrophobicContact CD2-CE1 4.13Å; L692-F764 HydrophobicContact CG-CE1 4.49Å; W696-F764 HydrophobicContact CE3-CD1 4.49Å; W696-F764 HydrophobicContact CH2-CB 4.11Å; W696-F764 AromaticContact CH2-CD1 3.86Å; W696-F764 HydrophobicContact CH2-CD1 3.86Å; W696-F764 HydrophobicContact CH2-CE1 4.49Å; W696-F764 HydrophobicContact CH2-CG 4.06Å; W696-F764 AromaticContact CZ3-CD1 3.52Å; W696-F764 HydrophobicContact CZ3-CD1 3.52Å; W696-F764 AromaticContact CZ3-CE1 3.81Å; W696-F764 HydrophobicContact CZ3-CE1 3.81Å; W696-F764 HydrophobicContact CZ3-CG 4.18Å; R760-F764 WeakPolarHBondContact O-CB 3.3Å; R760-F764 PolarHBondContact O-N 2.99Å; L761-F764 PolarHBondContact O-N 3.35Å; F764-S767 PolarHBondContact O-N 2.98Å; F764-S767 PolarHBondContact O-OG 3.39Å; F764-K768 PolarHBondContact O-N 3.08Å
765	L	72.2	Confident	69	Low	7 Å²	7	61.2 Å²	61.2	4%	0.037	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-34.5	176.3	-66.8	-173.3	0	0	0	113.3	L692 L730 M731 F734 L761 K762 K763 K768 S769	L692-L765 HydrophobicContact CD2-CD2 4.17Å; L730-L765 HydrophobicContact CD2-CD1 4.12Å; L730-L765 HydrophobicContact CD2-CD2 3.38Å; L730-L765 HydrophobicContact CD2-CG 4.39Å; M731-L765 HydrophobicContact CE-CB 3.56Å; F734-L765 HydrophobicContact CB-CD1 3.71Å; F734-L765 HydrophobicContact CD1-CD1 3.94Å; F734-L765 HydrophobicContact CD2-CD1 4.02Å; F734-L765 HydrophobicContact CG-CD1 3.59Å; L761-L765 HydrophobicContact CD1-CD1 3.85Å; L761-L765 HydrophobicContact CD1-CD2 4.36Å; L761-L765 HydrophobicContact CD1-CG 3.82Å; L761-L765 HydrophobicContact CG-CD1 4.15Å; L761-L765 HydrophobicContact CG-CG 4.42Å; L761-L765 WeakPolarHBondContact O-CB 3.36Å; L761-L765 VanDerWaalsContact O-CG 3.3Å; L761-L765 WeakPolarHBondContact O-CG 3.31Å; L761-L765 PolarHBondContact O-N 3.4Å; K762-L765 PolarHBondContact O-N 2.99Å; K763-L765 PolarHBondContact O-N 3.36Å; L765-K768 CarbonylContact O-C 3.35Å; L765-K768 PolarHBondContact O-N 3.17Å; L765-S769 WeakPolarHBondContact O-CA 3.43Å; L765-S769 WeakPolarHBondContact O-CB 3.22Å; L765-S769 PolarHBondContact O-N 3Å
766	Y	70.1	Confident	69	Low	140 Å²	140	63.9 Å²	63.9	55%	0.549	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-41.3	171.7	-84.5	-63.8	0	0	0	110.9	M731 K762 K763 K768 S769	M731-Y766 HydrophobicContact CE-CD1 3.63Å; M731-Y766 HydrophobicContact CE-CD2 3.63Å; M731-Y766 HydrophobicContact CE-CE1 3.77Å; M731-Y766 HydrophobicContact CE-CE2 3.77Å; M731-Y766 HydrophobicContact CE-CG 3.53Å; M731-Y766 HydrophobicContact SD-CE1 4.32Å; M731-Y766 HydrophobicContact SD-CE2 4.42Å; K762-Y766 HydrophobicContact CB-CD2 4.35Å; K762-Y766 HydrophobicContact CB-CE2 4.36Å; K762-Y766 WeakPolarHBondContact O-CB 3.4Å; K762-Y766 WeakPolarHBondContact O-CD2 3.36Å; K762-Y766 PolarHBondContact O-N 3.11Å; K763-Y766 PolarHBondContact O-N 3.18Å; Y766-K768 PolarHBondContact O-N 3.41Å; Y766-S769 WeakPolarHBondContact O-CB 3.44Å; Y766-S769 PolarHBondContact O-N 3.18Å; Y766-S769 VanDerWaalsContact O-N 3.16Å; Y766-S769 PolarHBondContact O-OG 2.96Å
767	S	69.7	Low	69.4	Low	73 Å²	73	60.7 Å²	60.7	51%	0.51	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-29.2	176.8	84.2	0	0	0	0	113.4	K763 F764	K763-S767 PolarHBondContact O-N 2.94Å; F764-S767 PolarHBondContact O-N 2.98Å; F764-S767 PolarHBondContact O-OG 3.39Å
768	K	68.8	Low	69.9	Low	34 Å²	34	57 Å²	57	15%	0.148	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	4.5	177.4	-73.1	-80.2	-176.8	177.6	0	113.7	E684 L688 F764 L765 Y766 S770 T771	E684-K768 IonicContact OE2-NZ 2.68Å; E684-K768 PolarHBondContact OE2-NZ 2.93Å; E684-K768 VanDerWaalsContact OE2-NZ 3.1Å; L688-K768 HydrophobicContact CD1-CG 4.28Å; F764-K768 PolarHBondContact O-N 3.08Å; L765-K768 CarbonylContact O-C 3.35Å; L765-K768 PolarHBondContact O-N 3.17Å; Y766-K768 PolarHBondContact O-N 3.41Å; K768-S770 PolarHBondContact O-N 3.11Å; K768-T771 PolarHBondContact O-N 3.31Å; K768-T771 PolarHBondContact O-OG1 2.97Å
769	S	57.4	Low	70.1	Confident	49 Å²	49	56.9 Å²	56.9	34%	0.343	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-9.8	-168.1	60.1	0	0	0	0	116.1	L765 Y766	L765-S769 WeakPolarHBondContact O-CA 3.43Å; L765-S769 WeakPolarHBondContact O-CB 3.22Å; L765-S769 PolarHBondContact O-N 3Å; Y766-S769 WeakPolarHBondContact O-CB 3.44Å; Y766-S769 PolarHBondContact O-N 3.18Å; Y766-S769 VanDerWaalsContact O-N 3.16Å; Y766-S769 PolarHBondContact O-OG 2.96Å
770	S	53.6	Low	70.5	Confident	105 Å²	105	52.9 Å²	52.9	73%	0.734	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-18.3	173.4	54.2	0	0	0	0	114.3	K768 Q772	K768-S770 PolarHBondContact O-N 3.11Å; S770-Q772 PolarHBondContact O-N 2.88Å
771	T	62.2	Low	70.7	Confident	58 Å²	58	48.2 Å²	48.2	36%	0.356	25%	0.254	S	S	.	.			trans	-83.6	96.7	-178.5	59	0	0	0	0	111.2	K768 V773	K768-T771 PolarHBondContact O-N 3.31Å; K768-T771 PolarHBondContact O-OG1 2.97Å; T771-V773 PolarHBondContact O-N 3.01Å
772	Q	67.5	Low	70.8	Confident	131 Å²	131	48.7 Å²	48.7	61%	0.612	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	115.1	166.7	-76.8	-171.7	-6.4	0	0	110.4	K727 S770	K727-Q772 HydrophobicContact CB-CB 4.2Å; K727-Q772 HydrophobicContact CD-CB 4.22Å; S770-Q772 PolarHBondContact O-N 2.88Å
773	V	71	Confident	70.7	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.03	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.3	-177.4	-176.8	0	0	0	0	110.1	L685 K727 I728 T771 V775 L778	L685-V773 HydrophobicContact CD1-CB 4.5Å; L685-V773 HydrophobicContact CD1-CG1 3.91Å; L685-V773 HydrophobicContact CD1-CG2 3.7Å; L685-V773 HydrophobicContact CD2-CG1 3.86Å; K727-V773 WeakPolarHBondContact CA-O 3.06Å; I728-V773 PolarHBondContact N-O 3.5Å; I728-V773 PolarHBondContact O-N 3.37Å; I728-V773 VanDerWaalsContact O-N 3.11Å; T771-V773 PolarHBondContact O-N 3.01Å; V773-V775 PolarHBondContact O-N 3.19Å; V773-L778 HydrophobicContact CG1-CB 4.24Å; V773-L778 HydrophobicContact CG1-CD1 4.43Å
774	P	75.4	Confident	70.5	Confident	26 Å²	26	41.4 Å²	41.4	17%	0.169	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	129.7	172.5	27.9	-32.6	0	0	0	110.5	K727 N776 S777 L778	K727-P774 HydrophobicContact CG-CB 4.33Å; P774-N776 PolarHBondContact O-N 2.87Å; P774-N776 VanDerWaalsContact O-N 3.12Å; P774-S777 PolarHBondContact O-N 3.44Å; P774-S777 VanDerWaalsContact O-N 3.09Å; P774-L778 PolarHBondContact O-N 3.16Å
775	V	72.8	Confident	70.3	Confident	10 Å²	10	41.8 Å²	41.8	6%	0.061	23%	0.23	C	C	.	.	H	α-helix	trans	-54.9	-34.8	-176.8	166.9	0	0	0	0	112.1	M726 I728 V773 L778 K779	M726-V775 HydrophobicContact CB-CB 4.46Å; M726-V775 HydrophobicContact CB-CG2 4.16Å; M726-V775 HydrophobicContact CG-CG2 3.96Å; M726-V775 WeakPolarHBondContact O-CB 3.31Å; M726-V775 VanDerWaalsContact O-CG2 3.3Å; M726-V775 WeakPolarHBondContact O-CG2 3.34Å; M726-V775 PolarHBondContact O-N 2.68Å; M726-V775 HydrophobicContact SD-CG2 4.19Å; I728-V775 HydrophobicContact CB-CG2 4.46Å; I728-V775 HydrophobicContact CD1-CG2 3.46Å; I728-V775 VanDerWaalsContact CD1-CG2 3.46Å; I728-V775 HydrophobicContact CG1-CG2 3.64Å; V773-V775 PolarHBondContact O-N 3.19Å; V775-L778 PolarHBondContact O-N 3.48Å; V775-K779 HydrophobicContact CG1-CD 4.33Å; V775-K779 HydrophobicContact CG1-CG 4.36Å; V775-K779 WeakPolarHBondContact O-CG 3.31Å; V775-K779 PolarHBondContact O-N 3.35Å
776	N	72	Confident	70.2	Confident	76 Å²	76	42.2 Å²	42.2	41%	0.406	23%	0.232	S	C	.	.	H	α-helix	trans	-63.7	-43	179.4	-68.9	-18.9	0	0	0	112.5	P774 L778 K779 Q780	P774-N776 PolarHBondContact O-N 2.87Å; P774-N776 VanDerWaalsContact O-N 3.12Å; N776-L778 VanDerWaalsContact C-N 3.29Å; N776-L778 PolarHBondContact O-N 2.95Å; N776-K779 PolarHBondContact O-N 2.96Å; N776-Q780 WeakPolarHBondContact O-CG 3.46Å; N776-Q780 PolarHBondContact O-N 3.47Å; N776-Q780 VanDerWaalsContact O-N 3.11Å; N776-Q780 PolarHBondContact O-NE2 2.86Å
777	S	75.1	Confident	70.4	Confident	27 Å²	27	35.9 Å²	35.9	19%	0.189	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-32.6	174.2	-56.6	0	0	0	0	112	P774 Q780 L781	P774-S777 PolarHBondContact O-N 3.44Å; P774-S777 VanDerWaalsContact O-N 3.09Å; S777-Q780 PolarHBondContact O-N 3.28Å; S777-L781 WeakPolarHBondContact O-CB 3.29Å; S777-L781 WeakPolarHBondContact O-CD1 3.41Å; S777-L781 WeakPolarHBondContact O-CG 3.4Å; S777-L781 PolarHBondContact O-N 2.76Å
778	L	76.7	Confident	70.8	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-70	-40.7	176.8	-160	59.2	0	0	0	112	W689 L707 V773 P774 V775 N776 Q780 L781 I782	W689-L778 HydrophobicContact CD2-CD1 4.46Å; W689-L778 HydrophobicContact CE3-CD1 3.71Å; W689-L778 HydrophobicContact CZ3-CD1 3.79Å; L707-L778 HydrophobicContact CD1-CD2 3.52Å; L707-L778 HydrophobicContact CD1-CG 3.92Å; L707-L778 HydrophobicContact CD2-CD2 4Å; L707-L778 HydrophobicContact CG-CD2 4.43Å; V773-L778 HydrophobicContact CG1-CB 4.24Å; V773-L778 HydrophobicContact CG1-CD1 4.43Å; P774-L778 PolarHBondContact O-N 3.16Å; V775-L778 PolarHBondContact O-N 3.48Å; N776-L778 VanDerWaalsContact C-N 3.29Å; N776-L778 PolarHBondContact O-N 2.95Å; L778-Q780 VanDerWaalsContact C-N 3.33Å; L778-Q780 PolarHBondContact O-N 3.28Å; L778-L781 HydrophobicContact CD1-CD1 4.47Å; L778-L781 WeakPolarHBondContact O-CB 3.39Å; L778-L781 PolarHBondContact O-N 3.41Å; L778-I782 VanDerWaalsContact O-CG1 3.28Å; L778-I782 WeakPolarHBondContact O-CG1 3.33Å; L778-I782 PolarHBondContact O-N 2.92Å
779	K	74.5	Confident	71	Confident	58 Å²	58	31.6 Å²	31.6	25%	0.252	18%	0.18	S	C	.	.	H	α-helix	trans	-55.8	-46.2	169	-73.4	172.6	173.3	179.9	0	112	F531 N711 V775 N776 L781 I782 A783	F531-K779 HydrophobicContact CD2-CB 4.28Å; F531-K779 HydrophobicContact CD2-CG 4.33Å; F531-K779 HydrophobicContact CE2-CG 4.37Å; N711-K779 VanDerWaalsContact ND2-CE 3.26Å; N711-K779 WeakPolarHBondContact ND2-CE 3.38Å; N711-K779 WeakPolarHBondContact OD1-CE 3.41Å; N711-K779 PolarHBondContact OD1-NZ 3.36Å; V775-K779 HydrophobicContact CG1-CD 4.33Å; V775-K779 HydrophobicContact CG1-CG 4.36Å; V775-K779 WeakPolarHBondContact O-CG 3.31Å; V775-K779 PolarHBondContact O-N 3.35Å; N776-K779 PolarHBondContact O-N 2.96Å; K779-L781 VanDerWaalsContact C-N 3.34Å; K779-I782 PolarHBondContact O-N 2.68Å; K779-A783 WeakPolarHBondContact O-CB 3.31Å; K779-A783 PolarHBondContact O-N 3.1Å
780	Q	75	Confident	71.6	Confident	35 Å²	35	30.1 Å²	30.1	16%	0.164	17%	0.17	C	C	.	.	H	α-helix	trans	-66.5	-36.8	-178.7	-66.1	158.6	7.9	0	0	111.6	M679 I681 N776 S777 L778 C784	M679-Q780 HydrophobicContact CE-CB 4.35Å; M679-Q780 HydrophobicContact CE-CG 3.63Å; I681-Q780 HydrophobicContact CD1-CB 4.01Å; N776-Q780 WeakPolarHBondContact O-CG 3.46Å; N776-Q780 PolarHBondContact O-N 3.47Å; N776-Q780 VanDerWaalsContact O-N 3.11Å; N776-Q780 PolarHBondContact O-NE2 2.86Å; S777-Q780 PolarHBondContact O-N 3.28Å; L778-Q780 VanDerWaalsContact C-N 3.33Å; L778-Q780 PolarHBondContact O-N 3.28Å; Q780-C784 WeakPolarHBondContact O-CB 3.36Å; Q780-C784 PolarHBondContact O-N 3.47Å; Q780-C784 VanDerWaalsContact O-N 3.16Å; Q780-C784 PolarHBondContact O-SG 3.33Å; Q780-C784 VanDerWaalsContact O-SG 3.35Å
781	L	78.4	Confident	72.5	Confident	4 Å²	4	25.7 Å²	25.7	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-64.2	-43.7	170.8	-80	160.1	0	0	0	112.5	L674 I681 L685 V686 W689 S777 L778 K779 C784 S785	L674-L781 HydrophobicContact CD1-CD2 3.91Å; I681-L781 HydrophobicContact CD1-CG 4Å; I681-L781 HydrophobicContact CG2-CD1 4.31Å; L685-L781 HydrophobicContact CD2-CD1 3.77Å; L685-L781 HydrophobicContact CG-CD1 3.71Å; V686-L781 HydrophobicContact CG2-CD2 4.2Å; W689-L781 HydrophobicContact CB-CD1 4.34Å; W689-L781 HydrophobicContact CB-CD2 4.18Å; W689-L781 HydrophobicContact CD2-CB 4.39Å; W689-L781 HydrophobicContact CG-CB 4.11Å; W689-L781 HydrophobicContact CG-CD2 4.23Å; S777-L781 WeakPolarHBondContact O-CB 3.29Å; S777-L781 WeakPolarHBondContact O-CD1 3.41Å; S777-L781 WeakPolarHBondContact O-CG 3.4Å; S777-L781 PolarHBondContact O-N 2.76Å; L778-L781 HydrophobicContact CD1-CD1 4.47Å; L778-L781 WeakPolarHBondContact O-CB 3.39Å; L778-L781 PolarHBondContact O-N 3.41Å; K779-L781 VanDerWaalsContact C-N 3.34Å; L781-C784 CarbonylContact O-C 3.58Å; L781-C784 PolarHBondContact O-N 3.47Å; L781-S785 VanDerWaalsContact O-CB 3.26Å; L781-S785 WeakPolarHBondContact O-CB 3.48Å; L781-S785 PolarHBondContact O-N 2.57Å; L781-S785 PolarHBondContact O-OG 2.88Å
782	I	77.4	Confident	73.1	Confident	13 Å²	13	23 Å²	23	7%	0.067	12%	0.121	C	C	.	.	H	α-helix	trans	-63.1	-48.9	177.1	-67.6	162.3	0	0	0	110.8	F531 W689 I704 L707 L778 K779 C784 S785	F531-I782 HydrophobicContact CD2-CB 4.29Å; F531-I782 HydrophobicContact CD2-CG2 4.04Å; F531-I782 HydrophobicContact CE2-CB 4.11Å; F531-I782 HydrophobicContact CE2-CD1 3.97Å; F531-I782 HydrophobicContact CE2-CG2 3.8Å; W689-I782 HydrophobicContact CH2-CD1 4.16Å; W689-I782 HydrophobicContact CH2-CG1 3.66Å; W689-I782 HydrophobicContact CZ2-CB 4.46Å; W689-I782 HydrophobicContact CZ2-CD1 4.4Å; W689-I782 HydrophobicContact CZ2-CG1 3.42Å; W689-I782 VanDerWaalsContact CZ2-CG1 3.42Å; I704-I782 HydrophobicContact CG1-CD1 4.08Å; I704-I782 HydrophobicContact CG1-CG1 4.1Å; I704-I782 HydrophobicContact CG1-CG2 4.4Å; I704-I782 HydrophobicContact CG2-CG2 4.29Å; L707-I782 HydrophobicContact CD1-CD1 3.64Å; L778-I782 VanDerWaalsContact O-CG1 3.28Å; L778-I782 WeakPolarHBondContact O-CG1 3.33Å; L778-I782 PolarHBondContact O-N 2.92Å; K779-I782 PolarHBondContact O-N 2.68Å; I782-C784 PolarHBondContact O-N 3.32Å; I782-S785 WeakPolarHBondContact CA-OG 3.44Å; I782-S785 PolarHBondContact O-N 3.18Å; I782-S785 VanDerWaalsContact O-N 3.08Å; I782-S785 PolarHBondContact O-OG 2.77Å; I782-S785 VanDerWaalsContact O-OG 3.06Å
783	A	69.6	Low	73.5	Confident	6 Å²	6	17.2 Å²	17.2	5%	0.05	9%	0.094	C	C	.	.	H	α-helix	trans	-59.5	-29.2	177.5	0	0	0	0	0	113	P529 L534 K779	P529-A783 HydrophobicContact CB-CB 4.32Å; L534-A783 HydrophobicContact CD1-CB 4Å; K779-A783 WeakPolarHBondContact O-CB 3.31Å; K779-A783 PolarHBondContact O-N 3.1Å
784	C	67.4	Low	73.6	Confident	4 Å²	4	20 Å²	20	3%	0.027	10%	0.104	C	C	.	.	H	α-helix	trans	-94.9	-5	176.9	-65.8	0	0	0	0	114.6	L673 L674 Q780 L781 I782 L786	L673-C784 HydrophobicContact CD2-CB 4.06Å; L673-C784 HydrophobicContact CG-CB 4.43Å; L674-C784 HydrophobicContact CD2-CB 3.99Å; L674-C784 HydrophobicContact CG-CB 4.3Å; Q780-C784 WeakPolarHBondContact O-CB 3.36Å; Q780-C784 PolarHBondContact O-N 3.47Å; Q780-C784 VanDerWaalsContact O-N 3.16Å; Q780-C784 PolarHBondContact O-SG 3.33Å; Q780-C784 VanDerWaalsContact O-SG 3.35Å; L781-C784 CarbonylContact O-C 3.58Å; L781-C784 PolarHBondContact O-N 3.47Å; I782-C784 PolarHBondContact O-N 3.32Å; C784-L786 PolarHBondContact O-N 3.33Å; C784-L786 VanDerWaalsContact O-N 3.1Å
785	S	69.7	Low	73.3	Confident	14 Å²	14	19.4 Å²	19.4	10%	0.098	10%	0.1	C	C	.	.			trans	-90.4	63.8	-173.8	59.3	0	0	0	0	114.2	W689 L781 I782 I787 H788	W689-S785 VanDerWaalsContact NE1-CB 3.26Å; W689-S785 PolarHBondContact NE1-OG 2.98Å; L781-S785 VanDerWaalsContact O-CB 3.26Å; L781-S785 WeakPolarHBondContact O-CB 3.48Å; L781-S785 PolarHBondContact O-N 2.57Å; L781-S785 PolarHBondContact O-OG 2.88Å; I782-S785 WeakPolarHBondContact CA-OG 3.44Å; I782-S785 PolarHBondContact O-N 3.18Å; I782-S785 VanDerWaalsContact O-N 3.08Å; I782-S785 PolarHBondContact O-OG 2.77Å; I782-S785 VanDerWaalsContact O-OG 3.06Å; S785-I787 PolarHBondContact O-N 3.41Å; S785-H788 PolarHBondContact O-N 2.95Å
786	L	71	Confident	73.4	Confident	15 Å²	15	18.9 Å²	18.9	8%	0.079	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	1.2	175.4	-60.5	167.4	0	0	0	115.4	T70 I524 Y525 F669 L673 C784	T70-L786 HydrophobicContact CG2-CD1 3.43Å; T70-L786 VanDerWaalsContact CG2-CD1 3.43Å; T70-L786 WeakPolarHBondContact OG1-CD1 3.37Å; I524-L786 CarbonylContact C-O 3.59Å; I524-L786 WeakPolarHBondContact CA-O 3.41Å; I524-L786 HydrophobicContact CG2-CB 4.03Å; I524-L786 HydrophobicContact CG2-CD1 4.21Å; Y525-L786 PolarHBondContact N-O 3.38Å; Y525-L786 VanDerWaalsContact O-CD2 3.29Å; Y525-L786 WeakPolarHBondContact O-CD2 3.18Å; F669-L786 HydrophobicContact CE1-CD1 4.45Å; F669-L786 HydrophobicContact CZ-CD1 4.41Å; L673-L786 HydrophobicContact CD2-CD1 3.86Å; L673-L786 HydrophobicContact CD2-CG 4.49Å; C784-L786 PolarHBondContact O-N 3.33Å; C784-L786 VanDerWaalsContact O-N 3.1Å
787	I	74.1	Confident	73.4	Confident	7 Å²	7	19.1 Å²	19.1	4%	0.036	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-21.4	-177	-53	-179.4	0	0	0	110.7	L522 P523 S666 F669 T670 S785	L522-I787 HydrophobicContact CD1-CD1 3.68Å; L522-I787 HydrophobicContact CD1-CG1 4.09Å; P523-I787 HydrophobicContact CG-CG2 4.34Å; S666-I787 VanDerWaalsContact CB-CD1 3.43Å; F669-I787 HydrophobicContact CD1-CD1 4.23Å; F669-I787 HydrophobicContact CD1-CG1 4.47Å; T670-I787 HydrophobicContact CG2-CD1 3.89Å; S785-I787 PolarHBondContact O-N 3.41Å
788	H	76.5	Confident	73	Confident	17 Å²	17	19.3 Å²	19.3	8%	0.079	10%	0.099	C	C	.	.	S	Bend	trans	-71.9	137.2	174.1	-168.8	56.4	0	0	0	110.4	Y525 V693 P697 T701 S785 P790	Y525-H788 VanDerWaalsContact CD2-O 3.29Å; Y525-H788 WeakPolarHBondContact CD2-O 3.41Å; V693-H788 HydrophobicContact CG1-CB 3.83Å; P697-H788 PolarHBondContact O-CE1 3.08Å; T701-H788 PolarHBondContact OG1-CE1 2.89Å; T701-H788 PolarHBondContact OG1-NE2 2.89Å; S785-H788 PolarHBondContact O-N 2.95Å; H788-P790 VanDerWaalsContact O-CD 3.31Å; H788-P790 WeakPolarHBondContact O-CD 3.36Å
789	N	74	Confident	72.6	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.			trans	-80.4	110.9	179	173.2	14.7	0	0	0	110.1	F474 F513 Y525 F791 I792	F474-N789 WeakPolarHBondContact CE1-OD1 3.15Å; F513-N789 HydrophobicContact CD2-CB 3.6Å; F513-N789 WeakPolarHBondContact CD2-ND2 3.49Å; F513-N789 HydrophobicContact CE2-CB 3.58Å; Y525-N789 HydrophobicContact CE1-CB 4.49Å; Y525-N789 HydrophobicContact CE2-CB 3.9Å; N789-F791 PolarHBondContact O-N 3.24Å; N789-F791 PolarHBondContact OD1-N 3.13Å; N789-I792 HydrophobicContact CB-CD1 4.02Å; N789-I792 HydrophobicContact CB-CG1 4.12Å; N789-I792 WeakPolarHBondContact O-CB 3.13Å; N789-I792 PolarHBondContact O-N 2.96Å; N789-I792 VanDerWaalsContact O-N 3.08Å
790	P	70.8	Confident	72.4	Confident	19 Å²	19	18.3 Å²	18.3	12%	0.123	10%	0.098	C	C	.	.	H	α-helix	trans	-69	-17.9	-173.7	29.3	-35.9	0	0	0	113.3	Y525 E527 H788 I792 H793 Y794	Y525-P790 HydrophobicContact CD1-CG 4.39Å; Y525-P790 HydrophobicContact CG-CG 4.39Å; E527-P790 WeakPolarHBondContact OE2-CB 3.28Å; E527-P790 WeakPolarHBondContact OE2-CG 3.09Å; H788-P790 VanDerWaalsContact O-CD 3.31Å; H788-P790 WeakPolarHBondContact O-CD 3.36Å; P790-I792 PolarHBondContact O-N 2.82Å; P790-H793 WeakPolarHBondContact O-CA 3.04Å; P790-H793 VanDerWaalsContact O-CB 3.31Å; P790-H793 WeakPolarHBondContact O-CB 3.22Å; P790-H793 PolarHBondContact O-N 3.43Å; P790-H793 VanDerWaalsContact O-N 3.07Å; P790-Y794 HydrophobicContact CB-CD2 4.49Å; P790-Y794 HydrophobicContact CB-CE2 4.11Å; P790-Y794 VanDerWaalsContact O-CD2 3.22Å; P790-Y794 WeakPolarHBondContact O-CD2 3.1Å; P790-Y794 PolarHBondContact O-N 3.21Å
791	F	71.3	Confident	71.9	Confident	12 Å²	12	18.8 Å²	18.8	5%	0.053	11%	0.111	C	C	.	.	H	α-helix	trans	-68.3	-20.9	174.8	-68.8	-99.1	0	0	0	112.2	F474 L478 L487 N789 S795	F474-F791 AromaticContact CD1-CD2 3.5Å; F474-F791 HydrophobicContact CD1-CD2 3.5Å; F474-F791 AromaticContact CD1-CE2 3.58Å; F474-F791 HydrophobicContact CD1-CE2 3.58Å; F474-F791 HydrophobicContact CD1-CG 4.21Å; F474-F791 HydrophobicContact CD1-CZ 4.3Å; F474-F791 HydrophobicContact CE1-CB 4.44Å; F474-F791 AromaticContact CE1-CD2 3.7Å; F474-F791 HydrophobicContact CE1-CD2 3.7Å; F474-F791 HydrophobicContact CE1-CE2 4.26Å; F474-F791 HydrophobicContact CE1-CG 4.14Å; L478-F791 HydrophobicContact CD1-CD1 4.27Å; L478-F791 HydrophobicContact CD1-CE1 4.44Å; L478-F791 HydrophobicContact CD1-CG 4.43Å; L478-F791 HydrophobicContact CD2-CB 4.33Å; L478-F791 HydrophobicContact CD2-CD1 3.6Å; L478-F791 HydrophobicContact CD2-CE1 4.23Å; L478-F791 HydrophobicContact CD2-CG 4.13Å; L487-F791 HydrophobicContact CD1-CE1 4.02Å; N789-F791 PolarHBondContact O-N 3.24Å; N789-F791 PolarHBondContact OD1-N 3.13Å; F791-S795 VanDerWaalsContact O-CB 3.27Å; F791-S795 WeakPolarHBondContact O-CB 3.3Å; F791-S795 PolarHBondContact O-N 3.35Å; F791-S795 PolarHBondContact O-OG 3Å
792	I	75.6	Confident	71.1	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-70.3	-44.7	169.1	-54	178	0	0	0	109.4	V509 F513 P697 T701 N789 P790 S795 I796	V509-I792 HydrophobicContact CG1-CG1 4.47Å; F513-I792 HydrophobicContact CD2-CD1 4.38Å; F513-I792 HydrophobicContact CE2-CD1 4.29Å; F513-I792 HydrophobicContact CZ-CD1 4.48Å; P697-I792 HydrophobicContact CB-CD1 4.05Å; T701-I792 HydrophobicContact CG2-CG2 4.34Å; T701-I792 VanDerWaalsContact OG1-CG2 3.31Å; T701-I792 WeakPolarHBondContact OG1-CG2 3.44Å; N789-I792 HydrophobicContact CB-CD1 4.02Å; N789-I792 HydrophobicContact CB-CG1 4.12Å; N789-I792 WeakPolarHBondContact O-CB 3.13Å; N789-I792 PolarHBondContact O-N 2.96Å; N789-I792 VanDerWaalsContact O-N 3.08Å; P790-I792 PolarHBondContact O-N 2.82Å; I792-S795 PolarHBondContact O-N 3.06Å; I792-I796 HydrophobicContact CG2-CD1 3.94Å; I792-I796 WeakPolarHBondContact O-CG1 3.47Å; I792-I796 PolarHBondContact O-N 3.26Å
793	H	75.1	Confident	70.4	Confident	10 Å²	10	24.2 Å²	24.2	5%	0.046	14%	0.139	C	C	.	.	H	α-helix	trans	-56.2	-55	173.5	-175.2	83.5	0	0	0	112.2	T701 I705 E708 P790 S795 I796 Q797	T701-H793 HydrophobicContact CG2-CB 3.89Å; I705-H793 WeakPolarHBondContact CG1-CE1 3.4Å; E708-H793 IonicContact OE1-CE1 3.19Å; E708-H793 PolarHBondContact OE1-CE1 3.46Å; E708-H793 IonicContact OE1-NE2 2.96Å; E708-H793 IonicContact OE2-CE1 2.67Å; E708-H793 PolarHBondContact OE2-CE1 2.84Å; E708-H793 IonicContact OE2-NE2 2.85Å; E708-H793 PolarHBondContact OE2-NE2 2.76Å; P790-H793 WeakPolarHBondContact O-CA 3.04Å; P790-H793 VanDerWaalsContact O-CB 3.31Å; P790-H793 WeakPolarHBondContact O-CB 3.22Å; P790-H793 PolarHBondContact O-N 3.43Å; P790-H793 VanDerWaalsContact O-N 3.07Å; H793-S795 VanDerWaalsContact C-N 3.32Å; H793-S795 PolarHBondContact O-N 3.24Å; H793-I796 PolarHBondContact O-N 3.46Å; H793-Q797 PolarHBondContact NE2-NE2 3.22Å; H793-Q797 PolarHBondContact NE2-OE1 3.48Å; H793-Q797 WeakPolarHBondContact O-CB 3.41Å; H793-Q797 PolarHBondContact O-N 3.4Å
794	Y	72.7	Confident	69.9	Low	64 Å²	64	28.3 Å²	28.3	25%	0.251	16%	0.159	S	C	.	.	H	α-helix	trans	-62.8	-35.9	179	-61.8	-52.4	0	0	0	113.1	I486 E527 P790 A798	I486-Y794 HydrophobicContact CG2-CG 4.38Å; E527-Y794 PolarHBondContact OE1-OH 2.9Å; P790-Y794 HydrophobicContact CB-CD2 4.49Å; P790-Y794 HydrophobicContact CB-CE2 4.11Å; P790-Y794 VanDerWaalsContact O-CD2 3.22Å; P790-Y794 WeakPolarHBondContact O-CD2 3.1Å; P790-Y794 PolarHBondContact O-N 3.21Å; Y794-A798 VanDerWaalsContact O-CB 3.26Å; Y794-A798 WeakPolarHBondContact O-CB 3.34Å; Y794-A798 PolarHBondContact O-N 2.76Å
795	S	69.3	Low	69.1	Low	12 Å²	12	30 Å²	30	8%	0.084	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-42.2	176.5	-61.4	0	0	0	0	112.4	F791 I792 H793 L799	F791-S795 VanDerWaalsContact O-CB 3.27Å; F791-S795 WeakPolarHBondContact O-CB 3.3Å; F791-S795 PolarHBondContact O-N 3.35Å; F791-S795 PolarHBondContact O-OG 3Å; I792-S795 PolarHBondContact O-N 3.06Å; H793-S795 VanDerWaalsContact C-N 3.32Å; H793-S795 PolarHBondContact O-N 3.24Å; S795-L799 PolarHBondContact O-N 3.22Å
796	I	74.4	Confident	67.8	Low	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-74.6	-42.4	178.1	-65	171.4	0	0	0	110.5	Y698 T701 W702 I705 L748 I792 H793 A798 L799 V800	Y698-I796 HydrophobicContact CD2-CD1 3.63Å; Y698-I796 HydrophobicContact CD2-CG1 4.45Å; Y698-I796 HydrophobicContact CE2-CD1 3.72Å; Y698-I796 HydrophobicContact CE2-CG1 4.17Å; Y698-I796 HydrophobicContact CG-CD1 4.4Å; T701-I796 HydrophobicContact CG2-CB 4.49Å; T701-I796 HydrophobicContact CG2-CD1 3.8Å; W702-I796 HydrophobicContact CD2-CG2 3.91Å; W702-I796 HydrophobicContact CE3-CG2 4.32Å; W702-I796 HydrophobicContact CG-CG2 4.5Å; W702-I796 HydrophobicContact CH2-CG2 4.11Å; W702-I796 HydrophobicContact CZ2-CG2 3.64Å; W702-I796 HydrophobicContact CZ3-CG2 4.41Å; I705-I796 HydrophobicContact CD1-CB 4.04Å; I705-I796 HydrophobicContact CD1-CG2 3.55Å; L748-I796 HydrophobicContact CD1-CG1 3.93Å; I792-I796 HydrophobicContact CG2-CD1 3.94Å; I792-I796 WeakPolarHBondContact O-CG1 3.47Å; I792-I796 PolarHBondContact O-N 3.26Å; H793-I796 PolarHBondContact O-N 3.46Å; I796-A798 PolarHBondContact O-N 2.98Å; I796-L799 PolarHBondContact O-N 2.92Å; I796-L799 VanDerWaalsContact O-N 3.14Å; I796-V800 HydrophobicContact CG2-CG2 4.27Å; I796-V800 WeakPolarHBondContact O-CG2 3.48Å; I796-V800 PolarHBondContact O-N 2.88Å
797	Q	73.1	Confident	66.4	Low	81 Å²	81	44.7 Å²	44.7	38%	0.379	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-39.7	179.7	-167.8	179.8	58.9	0	0	112.1	H793 V800 G801	H793-Q797 PolarHBondContact NE2-NE2 3.22Å; H793-Q797 PolarHBondContact NE2-OE1 3.48Å; H793-Q797 WeakPolarHBondContact O-CB 3.41Å; H793-Q797 PolarHBondContact O-N 3.4Å; Q797-V800 PolarHBondContact O-N 3.5Å; Q797-G801 PolarHBondContact O-N 2.76Å
798	A	67.3	Low	64.7	Low	31 Å²	31	49.2 Å²	49.2	26%	0.256	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-42.2	172.5	0	0	0	0	0	112.1	Y794 I796 G801 M802	Y794-A798 VanDerWaalsContact O-CB 3.26Å; Y794-A798 WeakPolarHBondContact O-CB 3.34Å; Y794-A798 PolarHBondContact O-N 2.76Å; I796-A798 PolarHBondContact O-N 2.98Å; A798-G801 PolarHBondContact O-N 3.07Å; A798-M802 WeakPolarHBondContact O-CG 3.41Å; A798-M802 PolarHBondContact O-N 3.32Å
799	L	67.3	Low	62.5	Low	13 Å²	13	52.6 Å²	52.6	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-67.7	-40	176.9	-175.7	125.2	0	0	0	112.5	I747 L748 S795 I796 G801 M802 I803	I747-L799 HydrophobicContact CB-CD1 3.98Å; I747-L799 HydrophobicContact CD1-CD1 4.15Å; I747-L799 HydrophobicContact CG2-CD1 3.6Å; L748-L799 HydrophobicContact CD1-CB 4.39Å; L748-L799 HydrophobicContact CD1-CD1 4.08Å; L748-L799 HydrophobicContact CD1-CD2 3.96Å; L748-L799 HydrophobicContact CD1-CG 4.37Å; L748-L799 HydrophobicContact CD2-CD1 4.25Å; L748-L799 HydrophobicContact CG-CD1 3.97Å; S795-L799 PolarHBondContact O-N 3.22Å; I796-L799 PolarHBondContact O-N 2.92Å; I796-L799 VanDerWaalsContact O-N 3.14Å; L799-G801 VanDerWaalsContact C-N 3.3Å; L799-G801 PolarHBondContact O-N 3.37Å; L799-M802 WeakPolarHBondContact O-CB 3.41Å; L799-M802 PolarHBondContact O-N 2.62Å; L799-I803 HydrophobicContact CD2-CD1 3.64Å; L799-I803 HydrophobicContact CG-CD1 4.27Å; L799-I803 WeakPolarHBondContact O-CG1 3.48Å; L799-I803 PolarHBondContact O-N 3.19Å
800	V	69.9	Low	60.2	Low	27 Å²	27	55.8 Å²	55.8	16%	0.164	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-41.2	171.7	170.4	0	0	0	0	110.7	W702 I796 Q797 M802 I803 N804	W702-V800 HydrophobicContact CH2-CG2 3.45Å; W702-V800 VanDerWaalsContact CH2-CG2 3.45Å; W702-V800 HydrophobicContact CZ2-CG2 4.38Å; W702-V800 HydrophobicContact CZ3-CG2 3.64Å; I796-V800 HydrophobicContact CG2-CG2 4.27Å; I796-V800 WeakPolarHBondContact O-CG2 3.48Å; I796-V800 PolarHBondContact O-N 2.88Å; Q797-V800 PolarHBondContact O-N 3.5Å; V800-M802 PolarHBondContact O-N 3.22Å; V800-I803 PolarHBondContact O-N 3.39Å; V800-N804 WeakPolarHBondContact O-CB 3.35Å; V800-N804 VanDerWaalsContact O-CG 3.27Å; V800-N804 PolarHBondContact O-N 2.94Å
801	G	65.9	Low	58.1	Low	44 Å²	44	62.9 Å²	62.9	45%	0.454	36%	0.363	S	S	.	.	H	α-helix	trans	-57.9	-44.1	172	0	0	0	0	0	113.1	Q797 A798 L799 G805	Q797-G801 PolarHBondContact O-N 2.76Å; A798-G801 PolarHBondContact O-N 3.07Å; L799-G801 VanDerWaalsContact C-N 3.3Å; L799-G801 PolarHBondContact O-N 3.37Å; G801-G805 PolarHBondContact O-N 3.06Å
802	M	60.8	Low	55.9	Low	91 Å²	91	71.1 Å²	71.1	45%	0.448	40%	0.401	S	S	.	.	H	α-helix	trans	-65.1	-39.3	175.8	-69.3	175.2	65.5	0	0	113.2	A798 L799 V800 R806	A798-M802 WeakPolarHBondContact O-CG 3.41Å; A798-M802 PolarHBondContact O-N 3.32Å; L799-M802 WeakPolarHBondContact O-CB 3.41Å; L799-M802 PolarHBondContact O-N 2.62Å; V800-M802 PolarHBondContact O-N 3.22Å; M802-R806 PolarHBondContact O-N 3.5Å
803	I	63	Low	53.5	Low	41 Å²	41	80.2 Å²	80.2	21%	0.21	44%	0.443	C	S	.	.	H	α-helix	trans	-67.9	-49.8	178	-68.8	169.4	0	0	0	110.3	L799 V800 G805 R806 Q807	L799-I803 HydrophobicContact CD2-CD1 3.64Å; L799-I803 HydrophobicContact CG-CD1 4.27Å; L799-I803 WeakPolarHBondContact O-CG1 3.48Å; L799-I803 PolarHBondContact O-N 3.19Å; V800-I803 PolarHBondContact O-N 3.39Å; I803-G805 VanDerWaalsContact C-N 3.31Å; I803-G805 PolarHBondContact O-N 3.14Å; I803-R806 WeakPolarHBondContact O-CB 3.44Å; I803-R806 PolarHBondContact O-N 2.98Å; I803-R806 VanDerWaalsContact O-N 3.12Å; I803-Q807 PolarHBondContact O-N 3.34Å
804	N	59.2	Low	51	Low	91 Å²	91	84 Å²	84	49%	0.487	47%	0.471	S	S	.	.	H	α-helix	trans	-63.5	-38.1	179.3	-67.5	-9.2	0	0	0	111.6	V800 R806 Q807 S808	V800-N804 WeakPolarHBondContact O-CB 3.35Å; V800-N804 VanDerWaalsContact O-CG 3.27Å; V800-N804 PolarHBondContact O-N 2.94Å; N804-R806 VanDerWaalsContact C-N 3.29Å; N804-R806 PolarHBondContact O-N 3.34Å; N804-Q807 PolarHBondContact O-N 3.44Å; N804-Q807 VanDerWaalsContact O-N 3.08Å; N804-S808 PolarHBondContact O-N 3.13Å
805	G	49.6	Very low	48.7	Very low	40 Å²	40	90.8 Å²	90.8	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-34.9	174.1	0	0	0	0	0	113.6	G801 I803 S808	G801-G805 PolarHBondContact O-N 3.06Å; I803-G805 VanDerWaalsContact C-N 3.31Å; I803-G805 PolarHBondContact O-N 3.14Å; G805-S808 PolarHBondContact O-OG 3.13Å
806	R	42.9	Very low	46.5	Very low	200 Å²	200	99.3 Å²	99.3	76%	0.755	54%	0.538	S	S	*	.	H	α-helix	trans	-71.1	-27.6	173.7	-81.3	-179.2	167.3	177.3	-3.4	113.9	M802 I803 N804 S809	M802-R806 PolarHBondContact O-N 3.5Å; I803-R806 WeakPolarHBondContact O-CB 3.44Å; I803-R806 PolarHBondContact O-N 2.98Å; I803-R806 VanDerWaalsContact O-N 3.12Å; N804-R806 VanDerWaalsContact C-N 3.29Å; N804-R806 PolarHBondContact O-N 3.34Å; R806-S809 PolarHBondContact O-OG 3.44Å
807	Q	42.6	Very low	44.2	Very low	137 Å²	137	106.7 Å²	106.7	64%	0.64	58%	0.577	S	S	*	*	H	α-helix	trans	-79.4	-27.1	179	-64	-172.9	9.1	0	0	112.5	I803 N804 S809	I803-Q807 PolarHBondContact O-N 3.34Å; N804-Q807 PolarHBondContact O-N 3.44Å; N804-Q807 VanDerWaalsContact O-N 3.08Å; Q807-S809 VanDerWaalsContact C-N 3.33Å; Q807-S809 PolarHBondContact O-N 2.82Å
808	S	36.6	Very low	41.9	Very low	102 Å²	102	108.9 Å²	108.9	71%	0.713	60%	0.598	S	S	*	*	H	α-helix	trans	-72.3	-20.2	175.6	62.7	0	0	0	0	114.8	N804 G805 G810	N804-S808 PolarHBondContact O-N 3.13Å; G805-S808 PolarHBondContact O-OG 3.13Å; S808-G810 VanDerWaalsContact C-N 3.34Å; S808-G810 PolarHBondContact O-N 3.05Å; S808-G810 VanDerWaalsContact O-N 3.1Å
809	S	31.5	Very low	39.7	Very low	88 Å²	88	115 Å²	115	62%	0.615	63%	0.626	S	S	*	*	S	Bend	trans	-83.7	74.2	173.2	53	0	0	0	0	111.3	R806 Q807 L811	R806-S809 PolarHBondContact O-OG 3.44Å; Q807-S809 VanDerWaalsContact C-N 3.33Å; Q807-S809 PolarHBondContact O-N 2.82Å; S809-L811 PolarHBondContact O-N 2.82Å
810	G	26	Very low	37.7	Very low	68 Å²	68	122.5 Å²	122.5	70%	0.701	67%	0.666	S	S	*	*			trans	-70.9	104.5	-175.3	0	0	0	0	0	114.7	S808	S808-G810 VanDerWaalsContact C-N 3.34Å; S808-G810 PolarHBondContact O-N 3.05Å; S808-G810 VanDerWaalsContact O-N 3.1Å
811	L	25.1	Very low	35.7	Very low	168 Å²	168	125.9 Å²	125.9	88%	0.88	70%	0.697	S	S	*	*			trans	-145.5	141.9	147.3	-144.5	77.6	0	0	0	109.6	S809 H813	S809-L811 PolarHBondContact O-N 2.82Å; L811-H813 PolarHBondContact O-N 3.17Å
812	H	25	Very low	33.7	Very low	185 Å²	185	130.3 Å²	130.3	86%	0.856	72%	0.715	S	S	*	*			trans	-62.9	129.4	-176.8	-79	-115.9	0	0	0	112
813	H	27	Very low	32.3	Very low	192 Å²	192	133 Å²	133	89%	0.889	73%	0.73	S	S	*	*			trans	-146.6	140.6	141	-115.6	-77.8	0	0	0	111.6	L811	L811-H813 PolarHBondContact O-N 3.17Å
814	S	21.6	Very low	30.6	Very low	89 Å²	89	139.3 Å²	139.3	62%	0.622	76%	0.758	S	S	*	*			trans	-80.1	147.8	-173.4	51.2	0	0	0	0	113.5
815	F	23.7	Very low	29	Very low	206 Å²	206	141.4 Å²	141.4	90%	0.904	77%	0.765	S	S	*	*			trans	-46.8	134	167.8	-68.6	-96.1	0	0	0	112.9
816	F	24.6	Very low	28	Very low	191 Å²	191	146.7 Å²	146.7	84%	0.838	78%	0.776	S	S	*	*			trans	-148.2	143	158.9	-106	-81.6	0	0	0	110.5
817	N	24.5	Very low	27.2	Very low	156 Å²	156	141.8 Å²	141.8	83%	0.834	77%	0.773	S	S	*	*			trans	-73.1	136.9	-179.1	-76	-15.4	0	0	0	111.9	L819	N817-L819 PolarHBondContact O-N 3.14Å
818	P	25.9	Very low	26.5	Very low	126 Å²	126	142.2 Å²	142.2	82%	0.818	78%	0.78	S	S	*	*			trans	-95.9	85.3	173.3	35.9	-31.2	0	0	0	111.6
819	L	22	Very low	26.1	Very low	161 Å²	161	143 Å²	143	84%	0.843	78%	0.781	S	S	*	*			trans	-154.5	83.6	165.5	-153.8	81.4	0	0	0	113	N817	N817-L819 PolarHBondContact O-N 3.14Å
820	D	23.6	Very low	26	Very low	170 Å²	170	144.4 Å²	144.4	91%	0.909	79%	0.786	S	S	*	*			trans	-167	168	148.6	-116.7	-30.9	0	0	0	112.7
821	A	27.5	Very low	26.2	Very low	97 Å²	97	146.7 Å²	146.7	80%	0.802	78%	0.781	S	S	*	*			trans	66.9	91.1	170.1	0	0	0	0	0	119
822	V	24.2	Very low	26.3	Very low	138 Å²	138	146.2 Å²	146.2	84%	0.836	78%	0.775	S	S	*	*			trans	-99.5	139.6	145.5	169.5	0	0	0	0	107.9
823	I	31.4	Very low	26.4	Very low	148 Å²	148	142 Å²	142	76%	0.759	77%	0.766	S	S	*	*			trans	176.9	126.4	147.9	-95.3	154	0	0	0	111.2
824	E	27.7	Very low	26.5	Very low	172 Å²	172	141.1 Å²	141.1	80%	0.804	77%	0.767	S	S	*	*			trans	33.3	151.8	142.3	-64	178.3	148.8	0	0	123.4
825	E	25.5	Very low	26.9	Very low	136 Å²	136	141 Å²	141	64%	0.636	77%	0.772	S	S	*	*			cis	-168.5	167.2	-23.9	-146.6	-158.9	177.1	0	0	110.5
826	K	28.7	Very low	27.2	Very low	150 Å²	150	138.7 Å²	138.7	65%	0.652	77%	0.768	S	S	*	*			trans	54.7	117	151.9	-87.3	-173.3	-172.5	80.6	0	120.9
827	S	27	Very low	27.4	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	77%	0.766	S	S	*	*				84.7	143.8	87.9	82.6	0	0	0	0	114.8
828	D	27.9	Very low	27.6	Very low	145 Å²	145	138.5 Å²	138.5	78%	0.775	77%	0.766	S	S	*	*			cis	-165.7	168.9	12.6	-141.6	-19.1	0	0	0	116
829	T	27.5	Very low	27.8	Very low	120 Å²	120	138.5 Å²	138.5	74%	0.736	76%	0.764	S	S	*	*			trans	83.1	-144.7	164.4	76	0	0	0	0	121.6
830	T	30.6	Very low	28.2	Very low	117 Å²	117	140.4 Å²	140.4	72%	0.718	76%	0.76	S	S	*	*			trans	-156.3	-173.1	-140.4	60.1	0	0	0	0	112.4
831	N	28.7	Very low	28.6	Very low	115 Å²	115	139 Å²	139	62%	0.615	75%	0.748	S	S	*	*			cis	-165.2	164.3	16.5	-146.2	0	0	0	0	115.2
832	Q	28.3	Very low	28.6	Very low	159 Å²	159	139.9 Å²	139.9	74%	0.743	74%	0.743	S	S	*	*			trans	42.8	150.5	147	-77.9	163.7	16	0	0	124
833	S	26.1	Very low	28.4	Very low	97 Å²	97	140.3 Å²	140.3	68%	0.678	74%	0.741	S	S	*	*			cis	-178.4	141.1	-21.7	51.6	0	0	0	0	113.3
834	L	29.7	Very low	28.1	Very low	172 Å²	172	138.3 Å²	138.3	90%	0.901	74%	0.74	S	S	*	*			trans	174.4	106.1	151	-97.8	148.7	0	0	0	106.4
835	A	29	Very low	27.9	Very low	88 Å²	88	136.9 Å²	136.9	73%	0.727	74%	0.743	S	S	*	*			cis	88.6	101.6	46.3	0	0	0	0	0	114.6
836	L	29.8	Very low	28.2	Very low	156 Å²	156	135 Å²	135	82%	0.817	74%	0.742	S	S	*	*				-153.6	142.9	118.5	-145	74.1	0	0	0	111.8
837	D	29.3	Very low	28	Very low	148 Å²	148	135.6 Å²	135.6	79%	0.791	75%	0.751	S	S	*	*			trans	46.1	142.5	164	-62.1	-12.9	0	0	0	123.6
838	K	28.7	Very low	27.9	Very low	195 Å²	195	141.7 Å²	141.7	85%	0.848	76%	0.761	S	S	*	*			trans	-170.1	167.3	-159.7	-180	177.4	-175.6	173.7	0	106.6
839	V	30.8	Very low	27.7	Very low	127 Å²	127	139.9 Å²	139.9	77%	0.77	77%	0.766	S	S	*	*			trans	112.8	131.3	166.9	168.8	0	0	0	0	112.5
840	R	30.7	Very low	27.7	Very low	201 Å²	201	139.3 Å²	139.3	76%	0.758	77%	0.767	S	S	*	*			cis	178.8	145.7	-6.9	-176.2	169.7	-163	151.8	5.3	107.2
841	Q	31.4	Very low	27.6	Very low	141 Å²	141	140.8 Å²	140.8	66%	0.659	77%	0.769	S	S	*	*			cis	-162.5	165.8	-12.6	-110.1	173.1	-39.8	0	0	106.4
842	T	27.3	Very low	27.5	Very low	114 Å²	114	143.1 Å²	143.1	70%	0.699	78%	0.776	S	S	*	*			cis	-172	136.4	-40.8	28.6	0	0	0	0	106.4
843	N	20.8	Very low	27.4	Very low	147 Å²	147	141.4 Å²	141.4	79%	0.786	77%	0.771	S	S	*	*			trans	-89.3	167	155.8	-79.9	-13.5	0	0	0	110.7
844	S	24.6	Very low	27.3	Very low	107 Å²	107	143.7 Å²	143.7	75%	0.748	78%	0.776	S	S	*	*			trans	20.6	138.3	147.7	61.7	0	0	0	0	121.5
845	V	24.4	Very low	27.3	Very low	142 Å²	142	141.2 Å²	141.2	86%	0.861	77%	0.773	S	S	*	*			trans	-127.9	122.2	163.4	178	0	0	0	0	111.3
846	P	30.3	Very low	27.1	Very low	96 Å²	96	141.9 Å²	141.9	62%	0.623	77%	0.772	S	S	*	*			trans	-109.3	164.9	144.4	28.3	-12	0	0	0	109.9
847	I	24.6	Very low	27	Very low	162 Å²	162	142.4 Å²	142.4	83%	0.831	77%	0.774	S	S	*	*				-178.2	159.2	84.6	-88.2	173.2	0	0	0	109.4
848	Y	25.1	Very low	27.1	Very low	227 Å²	227	138.7 Å²	138.7	89%	0.89	77%	0.771	S	S	*	*			trans	-74.8	161	175.1	-86.9	-106.1	0	0	0	115.5
849	A	24.9	Very low	27.2	Very low	106 Å²	106	137.7 Å²	137.7	88%	0.876	77%	0.769	S	S	*	*			trans	-158.7	155	144.9	0	0	0	0	0	112.8
850	S	25.6	Very low	27	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	76%	0.764	S	S	*	*			trans	-153.6	153.6	177.2	58.5	0	0	0	0	110.6
851	I	29.1	Very low	27	Very low	148 Å²	148	133.8 Å²	133.8	76%	0.759	76%	0.763	S	S	*	*			trans	-177.6	120.4	162.7	-102.6	148.5	0	0	0	107.9
852	Q	27.1	Very low	26.9	Very low	164 Å²	164	135 Å²	135	77%	0.766	77%	0.769	S	S	*	*				74.6	149.6	93.3	-107.5	175.4	-16.5	0	0	113.6
853	L	25.7	Very low	27	Very low	123 Å²	123	138.4 Å²	138.4	64%	0.644	78%	0.779	S	S	*	*			cis	-167	144.2	32.2	-164.7	115.1	0	0	0	113.1
854	N	24.3	Very low	27.3	Very low	144 Å²	144	135 Å²	135	77%	0.77	78%	0.779	S	S	*	*			trans	56.2	154.6	157.5	-64	1.6	0	0	0	120.7
855	S	29.2	Very low	27.3	Very low	121 Å²	121	135.8 Å²	135.8	85%	0.846	78%	0.783	S	S	*	*			cis	-157	-162.4	39.4	57.9	0	0	0	0	113.7
856	S	25.7	Very low	27.4	Very low	102 Å²	102	139 Å²	139	71%	0.713	79%	0.785	S	S	*	*			trans	-149.6	170.5	-154.5	58.1	0	0	0	0	116.1
857	I	28.1	Very low	27.2	Very low	166 Å²	166	140 Å²	140	85%	0.851	79%	0.79	S	S	*	*			trans	123.4	129.4	159.5	-65.8	159.7	0	0	0	114.4
858	G	30	Very low	27.2	Very low	70 Å²	70	139.4 Å²	139.4	72%	0.722	79%	0.794	S	S	*	*			trans	179.7	151.3	174.9	0	0	0	0	0	112
859	Q	31.1	Very low	27.3	Very low	175 Å²	175	132.3 Å²	132.3	82%	0.818	79%	0.79	S	S	*	*			trans	-148.6	156.6	-160.4	-71.1	-171.8	-12.6	0	0	111.7
860	T	26.5	Very low	27.4	Very low	106 Å²	106	132.8 Å²	132.8	65%	0.65	79%	0.787	S	S	*	*			cis	-163.2	-163	-6.3	24.8	0	0	0	0	108.6
861	N	31.4	Very low	27.3	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	79%	0.792	S	S	*	*			trans	92.9	148.2	161.2	-54.7	-9.5	0	0	0	116.9
862	Q	30.3	Very low	27	Very low	167 Å²	167	133.3 Å²	133.3	78%	0.78	79%	0.79	S	S	*	*			cis	-166.1	159.7	-35.5	-146.6	178.8	34.7	0	0	109.9
863	M	28.7	Very low	27	Very low	184 Å²	184	130.9 Å²	130.9	91%	0.906	79%	0.791	S	S	*	*			trans	70.6	132.8	157.5	-132.1	63.5	166.6	0	0	119.5
864	G	26.8	Very low	27	Very low	77 Å²	77	129.1 Å²	129.1	79%	0.794	80%	0.795	S	S	*	*			trans	161.6	33.4	175	0	0	0	0	0	118.4
865	C	24.8	Very low	26.9	Very low	123 Å²	123	130.8 Å²	130.8	83%	0.831	80%	0.797	S	S	*	*			trans	-77.4	144.7	-176.1	-76.3	0	0	0	0	114.9
866	K	26.6	Very low	26.9	Very low	208 Å²	208	132.8 Å²	132.8	90%	0.904	80%	0.799	S	S	*	*			trans	-159.6	142.9	132.8	-109.3	165.6	-173.3	178.4	0	111
867	T	25	Very low	26.9	Very low	117 Å²	117	135.6 Å²	135.6	72%	0.718	81%	0.805	S	S	*	*			trans	-149.8	169.3	-168.9	47.3	0	0	0	0	111.4
868	T	26	Very low	27.1	Very low	150 Å²	150	132.9 Å²	132.9	92%	0.92	80%	0.798	S	S	*	*			trans	73.6	152.3	166.5	77.5	0	0	0	0	118.9
869	G	27.5	Very low	27.2	Very low	79 Å²	79	134 Å²	134	81%	0.814	79%	0.793	S	S	*	*			trans	138.9	105.6	-176.7	0	0	0	0	0	110.9
870	S	25.1	Very low	27	Very low	116 Å²	116	133 Å²	133	81%	0.811	79%	0.793	S	S	*	*			trans	-137.3	143.1	-168.9	60.6	0	0	0	0	114.2
871	L	24.2	Very low	27.1	Very low	164 Å²	164	132 Å²	132	86%	0.859	80%	0.796	S	S	*	*			trans	59.2	110.8	147.2	-149.7	80.6	0	0	0	118.8
872	S	23.9	Very low	26.9	Very low	104 Å²	104	136 Å²	136	73%	0.727	80%	0.802	S	S	*	*				160.5	153.8	109.1	55.8	0	0	0	0	115.5
873	S	25.6	Very low	26.6	Very low	113 Å²	113	138.9 Å²	138.9	79%	0.79	81%	0.806	S	S	*	*			trans	67.7	110.1	148.8	-59.3	0	0	0	0	123.5
874	A	25.2	Very low	26.8	Very low	86 Å²	86	135.3 Å²	135.3	71%	0.711	80%	0.797	S	S	*	*				75.1	120.3	121.5	0	0	0	0	0	123
875	E	23.8	Very low	26.6	Very low	178 Å²	178	137 Å²	137	83%	0.832	80%	0.795	S	S	*	*			trans	57.2	116.8	138	-59.4	-173.6	143.2	0	0	121.5
876	N	28.9	Very low	26.7	Very low	163 Å²	163	136.7 Å²	136.7	87%	0.872	79%	0.794	S	S	*	*				-165.6	136	113.1	-99	-68.8	0	0	0	111.7
877	L	24.8	Very low	26.6	Very low	161 Å²	161	133.1 Å²	133.1	84%	0.843	80%	0.795	S	S	*	*			trans	-102	-171.4	161.6	-127.2	78.3	0	0	0	107.7
878	P	33.2	Very low	26.6	Very low	109 Å²	109	131 Å²	131	71%	0.708	80%	0.797	S	S	*	*			cis	-142	-143.8	27.2	44.5	-20.7	0	0	0	111.2
879	P	31.6	Very low	26.6	Very low	95 Å²	95	129.9 Å²	129.9	62%	0.617	79%	0.79	S	S	*	*			cis	-135.4	165.1	-16	37.6	-19.3	0	0	0	117.8
880	N	26.4	Very low	26.5	Very low	152 Å²	152	133.5 Å²	133.5	81%	0.813	79%	0.789	S	S	*	*			trans	69.2	150.2	153.9	-64.4	-18.4	0	0	0	119.1
881	A	29.6	Very low	26.5	Very low	87 Å²	87	134.4 Å²	134.4	72%	0.719	79%	0.79	S	S	*	*			cis	-141.1	142.8	10.6	0	0	0	0	0	115.3
882	Y	27.7	Very low	26.5	Very low	224 Å²	224	133.3 Å²	133.3	88%	0.878	79%	0.79	S	S	*	*			trans	46.6	121.7	145.5	-85	-95.9	0	0	0	124.5
883	W	23.2	Very low	26.5	Very low	227 Å²	227	131.5 Å²	131.5	86%	0.86	79%	0.788	S	S	*	*			trans	-72.5	-175	155.8	-74.8	99.8	0	0	0	111.8
884	P	32.2	Very low	26.5	Very low	109 Å²	109	133.3 Å²	133.3	71%	0.708	79%	0.788	S	S	*	*			cis	-145.2	170.9	15.7	45	-25.8	0	0	0	119.8
885	C	23.7	Very low	26.8	Very low	112 Å²	112	136.2 Å²	136.2	76%	0.757	79%	0.792	S	S	*	*			trans	-84.9	155.6	151.5	-68.3	0	0	0	0	110.6
886	S	26	Very low	27	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	78%	0.777	S	S	*	*			trans	-156.8	148.7	164.4	-78	0	0	0	0	112
887	S	25.1	Very low	27.3	Very low	133 Å²	133	129.9 Å²	129.9	93%	0.93	75%	0.754	S	S	*	*			trans	-123	137.1	178.2	-59.3	0	0	0	0	109.6
888	G	25.6	Very low	27.8	Very low	72 Å²	72	130.2 Å²	130.2	74%	0.742	76%	0.757	S	S	*	*			trans	-177.8	77.3	-177.1	0	0	0	0	0	117.1
889	T	24.8	Very low	28.5	Very low	126 Å²	126	130.5 Å²	130.5	77%	0.773	75%	0.747	S	S	*	*			trans	39.4	117.4	146.7	51.7	0	0	0	0	122.3
890	I	25.5	Very low	29.5	Very low	156 Å²	156	131.8 Å²	131.8	80%	0.8	76%	0.755	S	S	*	*			trans	66.1	104.1	138.1	-50.8	169.8	0	0	0	118.4
891	T	26.1	Very low	31	Very low	135 Å²	135	125.2 Å²	125.2	83%	0.828	72%	0.722	S	S	*	*				-158.9	153.5	124.5	6.8	0	0	0	0	111.6
892	T	23.5	Very low	32.7	Very low	141 Å²	141	125.3 Å²	125.3	87%	0.865	72%	0.715	S	S	*	*			trans	-38.7	143.3	178.5	49.7	0	0	0	0	118.4
893	G	23.7	Very low	34.6	Very low	66 Å²	66	115.2 Å²	115.2	68%	0.68	68%	0.676	S	S	*	*			trans	129.4	118.1	151.7	0	0	0	0	0	116.2
894	D	25.7	Very low	36.6	Very low	150 Å²	150	114.3 Å²	114.3	80%	0.802	67%	0.672	S	S	*	*			trans	41.5	131.2	152.5	-50.5	-26.7	0	0	0	121.4
895	N	31.8	Very low	38.4	Very low	147 Å²	147	110.3 Å²	110.3	79%	0.786	65%	0.645	S	S	*	*				-174.3	139.6	102.3	-98	-74.9	0	0	0	112.2
896	F	27.5	Very low	40.4	Very low	118 Å²	118	111.4 Å²	111.4	52%	0.518	64%	0.637	S	S	.	*			trans	-83.8	174.4	168.4	-87.3	-126.4	0	0	0	110.8
897	F	35.1	Very low	41.8	Very low	90 Å²	90	112.2 Å²	112.2	40%	0.395	63%	0.626	S	S	.	*			trans	74.4	55	168.7	-52.2	-71.9	0	0	0	119	K899 S986	F897-K899 PolarHBondContact O-N 3.36Å; F897-S986 WeakPolarHBondContact CE1-O 3.49Å
898	N	35.4	Very low	43	Very low	169 Å²	169	117.5 Å²	117.5	90%	0.904	63%	0.625	S	S	*	*			trans	-86.5	67.2	165.5	-81.1	-30.2	0	0	0	113.6
899	K	47.7	Very low	44.7	Very low	114 Å²	114	120.5 Å²	120.5	50%	0.496	62%	0.615	S	S	.	*	S	Bend	trans	-129.9	119.7	160.4	-83.7	173.6	179.5	161.7	0	108.1	F897 W982 D989	F897-K899 PolarHBondContact O-N 3.36Å; K899-W982 WeakPolarHBondContact O-CZ2 3.31Å; K899-D989 IonicContact NZ-OD2 3.49Å; K899-D989 PolarHBondContact NZ-OD2 3.47Å
900	P	52.5	Low	46.5	Very low	122 Å²	122	116.5 Å²	116.5	79%	0.792	59%	0.591	S	S	*	*			trans	-64	138.2	-177.8	26	-33.7	0	0	0	111.4	W982	P900-W982 PolarHBondContact O-NE1 3.49Å
901	C	59.1	Low	48	Very low	15 Å²	15	113.6 Å²	113.6	10%	0.101	58%	0.584	C	S	.	*			trans	-75.3	133.7	176.2	-167.1	0	0	0	0	110.2	I903 Y909 W982	C901-I903 PolarHBondContact O-N 2.84Å; C901-I903 VanDerWaalsContact O-N 3.14Å; C901-Y909 HydrophobicContact CB-CD1 3.83Å; C901-Y909 HydrophobicContact CB-CE1 3.48Å; C901-Y909 VanDerWaalsContact CB-CE1 3.48Å; C901-W982 HydrophobicContact CB-CD2 4.11Å; C901-W982 HydrophobicContact CB-CE3 4.29Å; C901-W982 HydrophobicContact CB-CH2 3.9Å; C901-W982 HydrophobicContact CB-CZ2 3.67Å; C901-W982 HydrophobicContact CB-CZ3 4.19Å; C901-W982 VanDerWaalsContact SG-CE3 3.52Å
902	P	63.8	Low	50.1	Low	89 Å²	89	111.2 Å²	111.2	58%	0.578	57%	0.566	S	S	*	*	S	Bend	trans	-76.5	8.2	-178	31.1	-36.6	0	0	0	114.7
903	I	68.2	Low	52.5	Low	12 Å²	12	105.8 Å²	105.8	6%	0.062	53%	0.533	C	S	.	.	S	Bend	trans	-132.6	140.2	-173.7	-62	165.2	0	0	0	109.7	C901 L905 V975 K978 L979	C901-I903 PolarHBondContact O-N 2.84Å; C901-I903 VanDerWaalsContact O-N 3.14Å; I903-L905 HydrophobicContact CG2-CD2 4.03Å; I903-L905 PolarHBondContact O-N 3.39Å; I903-V975 HydrophobicContact CD1-CG1 4.2Å; I903-V975 VanDerWaalsContact CD1-O 3.22Å; I903-V975 WeakPolarHBondContact CD1-O 3.19Å; I903-V975 HydrophobicContact CG2-CG1 4.22Å; I903-K978 HydrophobicContact CD1-CB 3.86Å; I903-L979 HydrophobicContact CD1-CB 3.64Å; I903-L979 HydrophobicContact CD1-CD1 4.33Å
904	R	65.2	Low	55.4	Low	207 Å²	207	102.9 Å²	102.9	78%	0.781	50%	0.502	S	S	*	.			trans	-79.6	117.9	172.7	-74.3	-173	170.9	-162.1	-2.1	110.7	V930	R904-V930 HydrophobicContact CB-CG2 4.32Å; R904-V930 WeakPolarHBondContact O-CG2 3.28Å
905	L	70.6	Confident	58.1	Low	25 Å²	25	99.1 Å²	99.1	13%	0.131	48%	0.48	C	S	.	.	B	Isolated β-bridge	trans	-105.3	148.1	172.6	-54.1	-178.2	0	0	0	110.4	I903 K907 Y909 L925 S928 I929 L979	I903-L905 HydrophobicContact CG2-CD2 4.03Å; I903-L905 PolarHBondContact O-N 3.39Å; L905-K907 VanDerWaalsContact C-N 3.28Å; L905-K907 PolarHBondContact O-N 2.82Å; L905-Y909 HydrophobicContact CD1-CD1 4.32Å; L905-L925 HydrophobicContact CD1-CD1 4.48Å; L905-S928 CarbonylContact C-O 3.4Å; L905-S928 WeakPolarHBondContact CA-O 3.24Å; L905-I929 HydrophobicContact CD2-CG1 4.07Å; L905-L979 HydrophobicContact CD1-CD1 4.39Å; L905-L979 HydrophobicContact CD2-CD1 4.45Å; L905-L979 HydrophobicContact CD2-CD2 4.46Å
906	K	64.6	Low	60.5	Low	136 Å²	136	97 Å²	97	59%	0.591	47%	0.465	S	S	*	.	S	Bend	trans	-75.8	-9.3	-179	-69.2	171.3	179.1	139.2	0	114.5	S928 I929 V930	K906-S928 WeakPolarHBondContact CG-O 3.48Å; K906-S928 PolarHBondContact N-O 3.03Å; K906-I929 PolarHBondContact NZ-O 3.16Å; K906-I929 VanDerWaalsContact NZ-O 3.13Å; K906-V930 HydrophobicContact CD-CG2 4.49Å; K906-V930 HydrophobicContact CG-CG2 3.71Å
907	K	55.3	Low	63.4	Low	134 Å²	134	92 Å²	92	58%	0.583	44%	0.443	S	S	*	.	S	Bend	trans	-130.7	169.2	177	-80	-171.6	172.5	-173.6	0	109.8	L905 E924	L905-K907 VanDerWaalsContact C-N 3.28Å; L905-K907 PolarHBondContact O-N 2.82Å; K907-E924 WeakPolarHBondContact CD-OE1 3.24Å; K907-E924 WeakPolarHBondContact CE-OE1 3.37Å; K907-E924 IonicContact NZ-OE1 2.7Å; K907-E924 PolarHBondContact NZ-OE1 3.29Å
908	R	52.1	Low	65.9	Low	244 Å²	244	91.1 Å²	91.1	92%	0.921	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-50.5	146.6	170.8	-86.6	-174.2	173.7	176.4	-2.1	110.7
909	Y	60.4	Low	68.4	Low	135 Å²	135	84.2 Å²	84.2	53%	0.529	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-54.5	145.6	173.8	-54	-65	0	0	0	111.1	C901 L905 S911	C901-Y909 HydrophobicContact CB-CD1 3.83Å; C901-Y909 HydrophobicContact CB-CE1 3.48Å; C901-Y909 VanDerWaalsContact CB-CE1 3.48Å; L905-Y909 HydrophobicContact CD1-CD1 4.32Å; Y909-S911 PolarHBondContact O-N 3.05Å
910	P	62.3	Low	70.2	Confident	41 Å²	41	83.5 Å²	83.5	27%	0.266	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-63.8	129.3	179.1	26.2	-34	0	0	0	110.8	F917 L925 L983	P910-F917 HydrophobicContact CB-CE1 4.26Å; P910-F917 HydrophobicContact CB-CE2 4.35Å; P910-F917 HydrophobicContact CB-CZ 3.52Å; P910-F917 HydrophobicContact CG-CZ 3.93Å; P910-L925 HydrophobicContact CG-CD1 4.3Å; P910-L983 HydrophobicContact CG-CD2 3.82Å
911	S	57.4	Low	71.9	Confident	95 Å²	95	80.8 Å²	80.8	66%	0.664	39%	0.389	S	S	*	.			trans	-89.2	-6.5	180	50.7	0	0	0	0	114.1	Y909	Y909-S911 PolarHBondContact O-N 3.05Å
912	L	70.8	Confident	73.2	Confident	85 Å²	85	80.1 Å²	80.1	45%	0.445	39%	0.385	S	S	.	.	S	Bend	trans	-98.2	147	176.2	-75.5	77.6	0	0	0	110.4	Q916 F917	L912-Q916 HydrophobicContact CB-CB 4.43Å; L912-Q916 HydrophobicContact CD2-CB 4.03Å; L912-F917 WeakPolarHBondContact O-CE2 3.44Å
913	P	73.5	Confident	74.3	Confident	27 Å²	27	76.1 Å²	76.1	18%	0.175	36%	0.359	C	S	.	.			trans	-69.6	152.2	172.3	30.7	-35.1	0	0	0	111.1	H915 Q916	P913-H915 PolarHBondContact O-N 2.97Å; P913-Q916 HydrophobicContact CG-CG 3.99Å; P913-Q916 PolarHBondContact O-N 3.35Å
914	I	83.7	Confident	75.1	Confident	5 Å²	5	80 Å²	80	3%	0.026	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-55.1	-33.4	-166.7	-161.7	-177.4	0	0	0	113.6	Q916 F917 G951 L954 L983 R984 S987	I914-Q916 PolarHBondContact O-N 3.36Å; I914-F917 WeakPolarHBondContact O-CD2 3.24Å; I914-F917 PolarHBondContact O-N 3.49Å; I914-G951 CarbonylContact O-C 3.57Å; I914-G951 WeakPolarHBondContact O-CA 3.17Å; I914-L954 HydrophobicContact CD1-CB 4.07Å; I914-L983 HydrophobicContact CB-CB 4.32Å; I914-L983 HydrophobicContact CD1-CB 3.75Å; I914-L983 HydrophobicContact CG1-CB 4.11Å; I914-R984 HydrophobicContact CD1-CG 4.21Å; I914-S987 VanDerWaalsContact CG2-OG 3.28Å; I914-S987 WeakPolarHBondContact CG2-OG 3.22Å; I914-S987 PolarHBondContact N-OG 3.09Å
915	H	82.4	Confident	76	Confident	71 Å²	71	70.8 Å²	70.8	33%	0.329	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-68.9	-15.1	-177.3	65.3	-104.8	0	0	0	114.4	P913 I952 H991	P913-H915 PolarHBondContact O-N 2.97Å; H915-I952 WeakPolarHBondContact O-CG1 3.49Å; H915-H991 AromaticContact CE1-NE2 3.98Å
916	Q	83.5	Confident	76.8	Confident	102 Å²	102	69.7 Å²	69.7	48%	0.477	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-92.2	-8.3	-179.3	-61.2	-178	4.2	0	0	113.7	L912 P913 I914 T918	L912-Q916 HydrophobicContact CB-CB 4.43Å; L912-Q916 HydrophobicContact CD2-CB 4.03Å; P913-Q916 HydrophobicContact CG-CG 3.99Å; P913-Q916 PolarHBondContact O-N 3.35Å; I914-Q916 PolarHBondContact O-N 3.36Å; Q916-T918 PolarHBondContact O-N 3.33Å
917	F	87	Confident	77.7	Confident	15 Å²	15	66.1 Å²	66.1	7%	0.066	33%	0.33	C	S	.	.			trans	-67.3	125.5	-177.4	-75.3	-126.5	0	0	0	111.3	P910 L912 I914 D921 V922 L925 G951	P910-F917 HydrophobicContact CB-CE1 4.26Å; P910-F917 HydrophobicContact CB-CE2 4.35Å; P910-F917 HydrophobicContact CB-CZ 3.52Å; P910-F917 HydrophobicContact CG-CZ 3.93Å; L912-F917 WeakPolarHBondContact O-CE2 3.44Å; I914-F917 WeakPolarHBondContact O-CD2 3.24Å; I914-F917 PolarHBondContact O-N 3.49Å; F917-D921 HydrophobicContact CB-CB 4.09Å; F917-D921 HydrophobicContact CD1-CB 3.72Å; F917-D921 HydrophobicContact CG-CB 4.12Å; F917-V922 HydrophobicContact CB-CG2 3.95Å; F917-V922 HydrophobicContact CD1-CG2 4.34Å; F917-L925 HydrophobicContact CE1-CB 4.17Å; F917-L925 HydrophobicContact CE1-CD1 4.45Å; F917-L925 HydrophobicContact CE1-CD2 3.92Å; F917-L925 HydrophobicContact CE1-CG 4.4Å; F917-G951 PolarHBondContact O-N 2.77Å
918	T	88.6	Confident	78.9	Confident	71 Å²	71	60.4 Å²	60.4	44%	0.436	31%	0.306	S	S	.	.			trans	-71.9	168.2	162.4	75.2	0	0	0	0	110.6	Q916 N920 D921 V922	Q916-T918 PolarHBondContact O-N 3.33Å; T918-N920 PolarHBondContact O-N 3.39Å; T918-N920 PolarHBondContact OG1-N 2.91Å; T918-D921 WeakPolarHBondContact CA-OD2 3.39Å; T918-D921 VanDerWaalsContact CB-OD2 3.22Å; T918-D921 WeakPolarHBondContact CB-OD2 3.33Å; T918-D921 WeakPolarHBondContact CG2-OD2 3.43Å; T918-D921 PolarHBondContact N-OD2 2.79Å; T918-D921 PolarHBondContact O-N 3.37Å; T918-D921 VanDerWaalsContact O-N 3.11Å; T918-D921 PolarHBondContact OG1-N 2.93Å; T918-D921 PolarHBondContact OG1-OD2 2.9Å; T918-V922 WeakPolarHBondContact O-CG2 3.43Å; T918-V922 PolarHBondContact O-N 3.36Å
919	V	87.8	Confident	80.4	Confident	23 Å²	23	48.9 Å²	48.9	14%	0.139	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-29.9	175.4	-173.4	0	0	0	0	111.7	C923 I944 K945 N950	V919-C923 WeakPolarHBondContact O-CB 3.25Å; V919-C923 PolarHBondContact O-N 2.66Å; V919-C923 PolarHBondContact O-SG 3.32Å; V919-I944 HydrophobicContact CG1-CG2 4.15Å; V919-K945 HydrophobicContact CG1-CG 4.26Å; V919-N950 HydrophobicContact CG2-CB 3.97Å
920	N	86.3	Confident	81.1	Confident	99 Å²	99	45.6 Å²	45.6	53%	0.529	26%	0.257	S	S	.	.	H	α-helix	trans	-71.8	-40	175.8	-72.7	-37.5	0	0	0	111.8	T918 V922 C923 E924 K945	T918-N920 PolarHBondContact O-N 3.39Å; T918-N920 PolarHBondContact OG1-N 2.91Å; N920-V922 VanDerWaalsContact C-N 3.33Å; N920-V922 PolarHBondContact O-N 2.85Å; N920-C923 CarbonylContact O-C 3.56Å; N920-C923 WeakPolarHBondContact O-CA 3.43Å; N920-C923 WeakPolarHBondContact O-CB 3.4Å; N920-C923 PolarHBondContact O-N 3.16Å; N920-C923 VanDerWaalsContact O-N 3.1Å; N920-E924 PolarHBondContact O-N 2.81Å; N920-K945 PolarHBondContact OD1-NZ 2.95Å
921	D	86.3	Confident	81.8	Confident	65 Å²	65	48.2 Å²	48.2	35%	0.348	27%	0.269	S	S	.	.	H	α-helix	trans	-67.5	-36.6	177.9	-46.9	-47.5	0	0	0	111	F917 T918 C923 E924 L925	F917-D921 HydrophobicContact CB-CB 4.09Å; F917-D921 HydrophobicContact CD1-CB 3.72Å; F917-D921 HydrophobicContact CG-CB 4.12Å; T918-D921 WeakPolarHBondContact CA-OD2 3.39Å; T918-D921 VanDerWaalsContact CB-OD2 3.22Å; T918-D921 WeakPolarHBondContact CB-OD2 3.33Å; T918-D921 WeakPolarHBondContact CG2-OD2 3.43Å; T918-D921 PolarHBondContact N-OD2 2.79Å; T918-D921 PolarHBondContact O-N 3.37Å; T918-D921 VanDerWaalsContact O-N 3.11Å; T918-D921 PolarHBondContact OG1-N 2.93Å; T918-D921 PolarHBondContact OG1-OD2 2.9Å; D921-C923 VanDerWaalsContact C-N 3.34Å; D921-E924 PolarHBondContact O-N 3.07Å; D921-L925 VanDerWaalsContact O-CB 3.25Å; D921-L925 WeakPolarHBondContact O-CB 3.48Å; D921-L925 PolarHBondContact O-N 3.18Å
922	V	87.2	Confident	82.9	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-42.8	169.6	175.4	0	0	0	0	110.9	F917 T918 N920 L925 F926 I944 L954	F917-V922 HydrophobicContact CB-CG2 3.95Å; F917-V922 HydrophobicContact CD1-CG2 4.34Å; T918-V922 WeakPolarHBondContact O-CG2 3.43Å; T918-V922 PolarHBondContact O-N 3.36Å; N920-V922 VanDerWaalsContact C-N 3.33Å; N920-V922 PolarHBondContact O-N 2.85Å; V922-L925 PolarHBondContact O-N 3.18Å; V922-F926 HydrophobicContact CG1-CD2 4.05Å; V922-F926 HydrophobicContact CG1-CE2 4.02Å; V922-F926 VanDerWaalsContact O-CD2 3.27Å; V922-F926 WeakPolarHBondContact O-CD2 3.39Å; V922-F926 PolarHBondContact O-N 3.37Å; V922-I944 HydrophobicContact CG1-CD1 4.43Å; V922-I944 HydrophobicContact CG1-CG2 3.92Å; V922-L954 HydrophobicContact CB-CD1 4.39Å; V922-L954 HydrophobicContact CG1-CD1 3.64Å; V922-L954 HydrophobicContact CG2-CD1 3.79Å
923	C	86.2	Confident	83.4	Confident	6 Å²	6	46 Å²	46	4%	0.041	25%	0.246	C	C	.	.	H	α-helix	trans	-66.3	-38.1	177.6	-69.9	0	0	0	0	112.7	V919 N920 D921 S927 I941 K945	V919-C923 WeakPolarHBondContact O-CB 3.25Å; V919-C923 PolarHBondContact O-N 2.66Å; V919-C923 PolarHBondContact O-SG 3.32Å; N920-C923 CarbonylContact O-C 3.56Å; N920-C923 WeakPolarHBondContact O-CA 3.43Å; N920-C923 WeakPolarHBondContact O-CB 3.4Å; N920-C923 PolarHBondContact O-N 3.16Å; N920-C923 VanDerWaalsContact O-N 3.1Å; D921-C923 VanDerWaalsContact C-N 3.34Å; C923-S927 WeakPolarHBondContact O-CB 3.44Å; C923-S927 PolarHBondContact O-N 3.01Å; C923-S927 PolarHBondContact O-OG 3.19Å; C923-I941 HydrophobicContact CB-CG2 4.23Å; C923-K945 WeakPolarHBondContact SG-CE 3.42Å
924	E	85	Confident	83.5	Confident	94 Å²	94	48.9 Å²	48.9	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-70.6	-41.3	175.3	-179.1	160.8	-164.8	0	0	111.9	K907 N920 D921 F926 S927 S928	K907-E924 WeakPolarHBondContact CD-OE1 3.24Å; K907-E924 WeakPolarHBondContact CE-OE1 3.37Å; K907-E924 IonicContact NZ-OE1 2.7Å; K907-E924 PolarHBondContact NZ-OE1 3.29Å; N920-E924 PolarHBondContact O-N 2.81Å; D921-E924 PolarHBondContact O-N 3.07Å; E924-F926 PolarHBondContact O-N 3.08Å; E924-S927 CarbonylContact O-C 3.58Å; E924-S927 WeakPolarHBondContact O-CB 3.45Å; E924-S927 PolarHBondContact O-N 3.29Å; E924-S928 PolarHBondContact O-N 2.96Å
925	L	85.9	Confident	83.4	Confident	13 Å²	13	51.8 Å²	51.8	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-54.2	-51.5	172.3	175.9	73.5	0	0	0	111.1	L905 P910 F917 D921 V922 S928 L979 L983	L905-L925 HydrophobicContact CD1-CD1 4.48Å; P910-L925 HydrophobicContact CG-CD1 4.3Å; F917-L925 HydrophobicContact CE1-CB 4.17Å; F917-L925 HydrophobicContact CE1-CD1 4.45Å; F917-L925 HydrophobicContact CE1-CD2 3.92Å; F917-L925 HydrophobicContact CE1-CG 4.4Å; D921-L925 VanDerWaalsContact O-CB 3.25Å; D921-L925 WeakPolarHBondContact O-CB 3.48Å; D921-L925 PolarHBondContact O-N 3.18Å; V922-L925 PolarHBondContact O-N 3.18Å; L925-S928 WeakPolarHBondContact O-CB 3.49Å; L925-S928 PolarHBondContact O-N 2.66Å; L925-S928 PolarHBondContact O-OG 2.37Å; L925-L979 HydrophobicContact CD1-CD2 4.05Å; L925-L979 HydrophobicContact CD2-CD2 4.28Å; L925-L979 HydrophobicContact CG-CD2 3.98Å; L925-L983 HydrophobicContact CD1-CD1 4.23Å; L925-L983 HydrophobicContact CD2-CD1 3.45Å; L925-L983 VanDerWaalsContact CD2-CD1 3.45Å; L925-L983 HydrophobicContact CG-CD1 4.46Å
926	F	85.5	Confident	83.5	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-46.8	176.4	-87.4	-120.2	0	0	0	111	V922 E924 S928 I929 M937 I944 L954 I976 I980	V922-F926 HydrophobicContact CG1-CD2 4.05Å; V922-F926 HydrophobicContact CG1-CE2 4.02Å; V922-F926 VanDerWaalsContact O-CD2 3.27Å; V922-F926 WeakPolarHBondContact O-CD2 3.39Å; V922-F926 PolarHBondContact O-N 3.37Å; E924-F926 PolarHBondContact O-N 3.08Å; F926-S928 PolarHBondContact O-N 2.6Å; F926-S928 VanDerWaalsContact O-N 3.08Å; F926-I929 WeakPolarHBondContact O-CB 3.21Å; F926-I929 WeakPolarHBondContact O-CG1 3.43Å; F926-I929 PolarHBondContact O-N 2.81Å; F926-I929 VanDerWaalsContact O-N 3.1Å; F926-M937 VanDerWaalsContact C-SD 3.54Å; F926-M937 HydrophobicContact CB-SD 3.88Å; F926-M937 WeakPolarHBondContact O-CE 3.21Å; F926-M937 VanDerWaalsContact O-SD 3.36Å; F926-I944 HydrophobicContact CD1-CD1 3.64Å; F926-I944 HydrophobicContact CD2-CD1 4.25Å; F926-I944 HydrophobicContact CE1-CD1 3.66Å; F926-I944 HydrophobicContact CE2-CD1 4.27Å; F926-I944 HydrophobicContact CG-CD1 3.95Å; F926-I944 HydrophobicContact CZ-CD1 3.98Å; F926-L954 HydrophobicContact CE2-CD1 4.47Å; F926-I976 HydrophobicContact CD1-CD1 4.33Å; F926-I976 HydrophobicContact CE1-CD1 3.87Å; F926-I976 HydrophobicContact CE1-CG1 4.05Å; F926-I976 HydrophobicContact CE1-CG2 3.83Å; F926-I976 HydrophobicContact CZ-CG2 3.68Å; F926-I980 HydrophobicContact CZ-CD1 4.42Å
927	S	83.8	Confident	83.7	Confident	61 Å²	61	47 Å²	47	43%	0.427	26%	0.263	S	S	.	.	H	α-helix	trans	-57.1	-25	176.4	-57.9	0	0	0	0	114	C923 E924 I941	C923-S927 WeakPolarHBondContact O-CB 3.44Å; C923-S927 PolarHBondContact O-N 3.01Å; C923-S927 PolarHBondContact O-OG 3.19Å; E924-S927 CarbonylContact O-C 3.58Å; E924-S927 WeakPolarHBondContact O-CB 3.45Å; E924-S927 PolarHBondContact O-N 3.29Å; S927-I941 WeakPolarHBondContact OG-CD1 3.34Å
928	S	81.4	Confident	83.6	Confident	13 Å²	13	52.8 Å²	52.8	9%	0.091	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-14.4	-179	80.7	0	0	0	0	114.2	L905 K906 E924 L925 F926 V930	L905-S928 CarbonylContact C-O 3.4Å; L905-S928 WeakPolarHBondContact CA-O 3.24Å; K906-S928 WeakPolarHBondContact CG-O 3.48Å; K906-S928 PolarHBondContact N-O 3.03Å; E924-S928 PolarHBondContact O-N 2.96Å; L925-S928 WeakPolarHBondContact O-CB 3.49Å; L925-S928 PolarHBondContact O-N 2.66Å; L925-S928 PolarHBondContact O-OG 2.37Å; F926-S928 PolarHBondContact O-N 2.6Å; F926-S928 VanDerWaalsContact O-N 3.08Å; S928-V930 PolarHBondContact O-N 3.35Å
929	I	83.1	Confident	83.6	Confident	2 Å²	2	52 Å²	52	1%	0.01	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-64.6	134.5	179.1	-58.3	171.6	0	0	0	109.8	L905 K906 F926 I932 M937 V975 I976 L979	L905-I929 HydrophobicContact CD2-CG1 4.07Å; K906-I929 PolarHBondContact NZ-O 3.16Å; K906-I929 VanDerWaalsContact NZ-O 3.13Å; F926-I929 WeakPolarHBondContact O-CB 3.21Å; F926-I929 WeakPolarHBondContact O-CG1 3.43Å; F926-I929 PolarHBondContact O-N 2.81Å; F926-I929 VanDerWaalsContact O-N 3.1Å; I929-I932 HydrophobicContact CB-CD1 4.46Å; I929-I932 HydrophobicContact CD1-CD1 4.1Å; I929-I932 HydrophobicContact CG2-CD1 3.88Å; I929-I932 HydrophobicContact CG2-CG1 3.97Å; I929-M937 HydrophobicContact CB-CE 4.17Å; I929-M937 HydrophobicContact CD1-CE 4.44Å; I929-V975 HydrophobicContact CG2-CG1 3.76Å; I929-I976 HydrophobicContact CD1-CG1 4.18Å; I929-L979 HydrophobicContact CD1-CD2 3.81Å; I929-L979 HydrophobicContact CG1-CD2 4Å
930	V	74.7	Confident	83.6	Confident	66 Å²	66	51.2 Å²	51.2	40%	0.4	28%	0.282	S	S	.	.	S	Bend	trans	-80.1	-40.7	178.5	176.9	0	0	0	0	111.6	R904 K906 S928 I932	R904-V930 HydrophobicContact CB-CG2 4.32Å; R904-V930 WeakPolarHBondContact O-CG2 3.28Å; K906-V930 HydrophobicContact CD-CG2 4.49Å; K906-V930 HydrophobicContact CG-CG2 3.71Å; S928-V930 PolarHBondContact O-N 3.35Å; V930-I932 VanDerWaalsContact C-N 3.33Å; V930-I932 PolarHBondContact O-N 2.93Å
931	D	76.9	Confident	83.8	Confident	97 Å²	97	47.7 Å²	47.7	52%	0.519	26%	0.263	S	S	.	.	S	Bend	trans	-90	19	-157.7	-46.2	-50.6	0	0	0	114.9
932	I	82.1	Confident	83.8	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.072	26%	0.264	C	S	.	.	S	Bend	trans	-125.2	134.8	-177.2	-62	175.1	0	0	0	110.1	I929 V930 H936 M937 Y940 D972 V975 I976	I929-I932 HydrophobicContact CB-CD1 4.46Å; I929-I932 HydrophobicContact CD1-CD1 4.1Å; I929-I932 HydrophobicContact CG2-CD1 3.88Å; I929-I932 HydrophobicContact CG2-CG1 3.97Å; V930-I932 VanDerWaalsContact C-N 3.33Å; V930-I932 PolarHBondContact O-N 2.93Å; I932-H936 HydrophobicContact CG2-CB 4.4Å; I932-M937 HydrophobicContact CB-CE 3.85Å; I932-M937 HydrophobicContact CD1-CE 3.9Å; I932-M937 HydrophobicContact CG1-CE 4.43Å; I932-M937 HydrophobicContact CG2-CB 4.4Å; I932-M937 HydrophobicContact CG2-CE 3.9Å; I932-Y940 HydrophobicContact CG2-CE2 4.31Å; I932-D972 HydrophobicContact CD1-CB 4.37Å; I932-D972 HydrophobicContact CG1-CB 4.43Å; I932-D972 HydrophobicContact CG2-CB 4.48Å; I932-V975 HydrophobicContact CD1-CB 4.45Å; I932-I976 HydrophobicContact CD1-CD1 3.85Å; I932-I976 HydrophobicContact CD1-CG1 3.81Å
933	H	80	Confident	83.8	Confident	119 Å²	119	49 Å²	49	55%	0.551	27%	0.272	S	S	*	.			trans	-65.3	133.9	-177.2	-167.3	-98.6	0	0	0	111.6	S935 H936 M937	H933-S935 VanDerWaalsContact C-N 3.29Å; H933-S935 PolarHBondContact CE1-OG 3.17Å; H933-S935 PolarHBondContact ND1-OG 3.43Å; H933-S935 PolarHBondContact O-N 3.25Å; H933-S935 VanDerWaalsContact O-N 3.15Å; H933-H936 PolarHBondContact O-N 3.25Å; H933-M937 PolarHBondContact O-N 3.25Å; H933-M937 VanDerWaalsContact O-N 3.1Å
934	P	76.8	Confident	83.9	Confident	87 Å²	87	48.7 Å²	48.7	57%	0.565	27%	0.27	S	S	*	.	H	α-helix	trans	-62.1	-29	-168.6	20.7	-33.2	0	0	0	114.6	Q938	P934-Q938 PolarHBondContact O-N 2.96Å
935	S	80.1	Confident	84.1	Confident	67 Å²	67	49.3 Å²	49.3	47%	0.469	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-37.3	174.6	57.8	0	0	0	0	112.9	H933 S939	H933-S935 VanDerWaalsContact C-N 3.29Å; H933-S935 PolarHBondContact CE1-OG 3.17Å; H933-S935 PolarHBondContact ND1-OG 3.43Å; H933-S935 PolarHBondContact O-N 3.25Å; H933-S935 VanDerWaalsContact O-N 3.15Å; S935-S939 PolarHBondContact O-N 3.34Å
936	H	85.7	Confident	84.1	Confident	58 Å²	58	56 Å²	56	27%	0.269	30%	0.302	S	S	.	.	H	α-helix	trans	-73.6	-43.8	178.4	-65	-168	0	0	0	109.7	I932 H933 Q938 S939 Y940 E969 D972	I932-H936 HydrophobicContact CG2-CB 4.4Å; H933-H936 PolarHBondContact O-N 3.25Å; H936-Q938 VanDerWaalsContact C-N 3.31Å; H936-Q938 PolarHBondContact O-N 3.06Å; H936-S939 WeakPolarHBondContact O-CA 3.31Å; H936-S939 VanDerWaalsContact O-CB 3.3Å; H936-S939 WeakPolarHBondContact O-CB 3.45Å; H936-S939 PolarHBondContact O-N 2.58Å; H936-Y940 HydrophobicContact CB-CD2 4.49Å; H936-Y940 HydrophobicContact CB-CE2 3.77Å; H936-Y940 VanDerWaalsContact O-CD2 3.28Å; H936-Y940 WeakPolarHBondContact O-CD2 3.48Å; H936-Y940 VanDerWaalsContact O-CG 3.26Å; H936-Y940 PolarHBondContact O-N 3.25Å; H936-E969 IonicContact CE1-OE2 2.89Å; H936-E969 PolarHBondContact CE1-OE2 3.1Å; H936-E969 IonicContact ND1-OE2 3.13Å; H936-D972 IonicContact CG-OD2 3.18Å; H936-D972 IonicContact ND1-OD2 2.61Å; H936-D972 PolarHBondContact ND1-OD2 2.98Å
937	M	86.5	Confident	84.2	Confident	14 Å²	14	59.8 Å²	59.8	7%	0.069	32%	0.322	C	S	.	.	H	α-helix	trans	-54.1	-45.7	174.2	-173.2	56.7	70.2	0	0	112.2	F926 I929 I932 H933 S939 Y940 I941	F926-M937 VanDerWaalsContact C-SD 3.54Å; F926-M937 HydrophobicContact CB-SD 3.88Å; F926-M937 WeakPolarHBondContact O-CE 3.21Å; F926-M937 VanDerWaalsContact O-SD 3.36Å; I929-M937 HydrophobicContact CB-CE 4.17Å; I929-M937 HydrophobicContact CD1-CE 4.44Å; I932-M937 HydrophobicContact CB-CE 3.85Å; I932-M937 HydrophobicContact CD1-CE 3.9Å; I932-M937 HydrophobicContact CG1-CE 4.43Å; I932-M937 HydrophobicContact CG2-CB 4.4Å; I932-M937 HydrophobicContact CG2-CE 3.9Å; H933-M937 PolarHBondContact O-N 3.25Å; H933-M937 VanDerWaalsContact O-N 3.1Å; M937-S939 VanDerWaalsContact C-N 3.3Å; M937-S939 PolarHBondContact O-N 3.32Å; M937-Y940 PolarHBondContact O-N 3.44Å; M937-I941 HydrophobicContact CG-CD1 3.74Å; M937-I941 HydrophobicContact CG-CG1 4.47Å; M937-I941 WeakPolarHBondContact O-CB 3.42Å; M937-I941 VanDerWaalsContact O-CG1 3.29Å; M937-I941 WeakPolarHBondContact O-CG1 3.12Å; M937-I941 PolarHBondContact O-N 2.74Å; M937-I941 HydrophobicContact SD-CD1 3.95Å; M937-I941 HydrophobicContact SD-CG1 4.2Å
938	Q	86.1	Confident	84.3	Confident	137 Å²	137	62.2 Å²	62.2	64%	0.64	33%	0.33	S	S	*	.	H	α-helix	trans	-60.7	-39.3	177.2	-144.1	75.5	1.9	0	0	112.3	P934 H936 S942	P934-Q938 PolarHBondContact O-N 2.96Å; H936-Q938 VanDerWaalsContact C-N 3.31Å; H936-Q938 PolarHBondContact O-N 3.06Å; Q938-S942 WeakPolarHBondContact O-CB 3.01Å; Q938-S942 PolarHBondContact O-N 2.86Å
939	S	87.3	Confident	84.6	Confident	53 Å²	53	62 Å²	62	37%	0.371	33%	0.328	S	S	.	.	H	α-helix	trans	-64.6	-50.5	175.7	-173.3	0	0	0	0	111.4	S935 H936 M937 I941 S942 K943	S935-S939 PolarHBondContact O-N 3.34Å; H936-S939 WeakPolarHBondContact O-CA 3.31Å; H936-S939 VanDerWaalsContact O-CB 3.3Å; H936-S939 WeakPolarHBondContact O-CB 3.45Å; H936-S939 PolarHBondContact O-N 2.58Å; M937-S939 VanDerWaalsContact C-N 3.3Å; M937-S939 PolarHBondContact O-N 3.32Å; S939-I941 PolarHBondContact O-N 3.37Å; S939-S942 PolarHBondContact O-N 2.89Å; S939-S942 VanDerWaalsContact O-N 3.14Å; S939-S942 PolarHBondContact O-OG 2.88Å; S939-K943 PolarHBondContact O-N 2.67Å; S939-K943 VanDerWaalsContact O-N 3.08Å
940	Y	89.4	Confident	84.8	Confident	8 Å²	8	64.2 Å²	64.2	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-43.9	179.5	-54	-33.9	0	0	0	111.9	I932 H936 M937 S942 K943 I944 I968 E969 D972 I976	I932-Y940 HydrophobicContact CG2-CE2 4.31Å; H936-Y940 HydrophobicContact CB-CD2 4.49Å; H936-Y940 HydrophobicContact CB-CE2 3.77Å; H936-Y940 VanDerWaalsContact O-CD2 3.28Å; H936-Y940 WeakPolarHBondContact O-CD2 3.48Å; H936-Y940 VanDerWaalsContact O-CG 3.26Å; H936-Y940 PolarHBondContact O-N 3.25Å; M937-Y940 PolarHBondContact O-N 3.44Å; Y940-S942 VanDerWaalsContact C-N 3.32Å; Y940-S942 PolarHBondContact O-N 3.12Å; Y940-K943 PolarHBondContact O-N 3.41Å; Y940-I944 VanDerWaalsContact O-CG1 3.31Å; Y940-I944 WeakPolarHBondContact O-CG1 3.22Å; Y940-I944 PolarHBondContact O-N 3.22Å; Y940-I968 HydrophobicContact CD1-CG1 3.86Å; Y940-I968 HydrophobicContact CE1-CB 4.15Å; Y940-I968 HydrophobicContact CE1-CG1 3.83Å; Y940-I968 HydrophobicContact CE1-CG2 4.26Å; Y940-I968 HydrophobicContact CE2-CG2 4.18Å; Y940-I968 HydrophobicContact CG-CG1 4.3Å; Y940-E969 PolarHBondContact OH-N 3.32Å; Y940-D972 HydrophobicContact CE2-CB 4.02Å; Y940-D972 WeakPolarHBondContact CE2-OD2 2.93Å; Y940-D972 PolarHBondContact OH-OD2 2.95Å; Y940-I976 HydrophobicContact CD2-CD1 4.41Å
941	I	89.2	Confident	85.2	Confident	24 Å²	24	61 Å²	61	12%	0.123	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-41.8	174.4	-71.3	166.6	0	0	0	111.3	C923 S927 M937 S939 K943 I944 K945	C923-I941 HydrophobicContact CB-CG2 4.23Å; S927-I941 WeakPolarHBondContact OG-CD1 3.34Å; M937-I941 HydrophobicContact CG-CD1 3.74Å; M937-I941 HydrophobicContact CG-CG1 4.47Å; M937-I941 WeakPolarHBondContact O-CB 3.42Å; M937-I941 VanDerWaalsContact O-CG1 3.29Å; M937-I941 WeakPolarHBondContact O-CG1 3.12Å; M937-I941 PolarHBondContact O-N 2.74Å; M937-I941 HydrophobicContact SD-CD1 3.95Å; M937-I941 HydrophobicContact SD-CG1 4.2Å; S939-I941 PolarHBondContact O-N 3.37Å; I941-K943 VanDerWaalsContact C-N 3.33Å; I941-K943 PolarHBondContact O-N 2.82Å; I941-I944 PolarHBondContact O-N 3.1Å; I941-K945 WeakPolarHBondContact O-CG 3.14Å; I941-K945 PolarHBondContact O-N 3.28Å; I941-K945 VanDerWaalsContact O-N 3.1Å
942	S	87.1	Confident	85.5	Confident	53 Å²	53	61.3 Å²	61.3	37%	0.371	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-39.5	177.8	79.5	0	0	0	0	112.3	Q938 S939 Y940 K945 Q946	Q938-S942 WeakPolarHBondContact O-CB 3.01Å; Q938-S942 PolarHBondContact O-N 2.86Å; S939-S942 PolarHBondContact O-N 2.89Å; S939-S942 VanDerWaalsContact O-N 3.14Å; S939-S942 PolarHBondContact O-OG 2.88Å; Y940-S942 VanDerWaalsContact C-N 3.32Å; Y940-S942 PolarHBondContact O-N 3.12Å; S942-K945 PolarHBondContact O-N 3.33Å; S942-Q946 VanDerWaalsContact O-CG 3.3Å; S942-Q946 WeakPolarHBondContact O-CG 3.47Å; S942-Q946 PolarHBondContact O-N 2.87Å
943	K	86.8	Confident	85.7	Confident	41 Å²	41	63.4 Å²	63.4	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-71.8	-39.8	176	-69.7	-175.5	178.6	-172.4	0	113.2	S939 Y940 I941 K945 Q946 L947 L966 M967	S939-K943 PolarHBondContact O-N 2.67Å; S939-K943 VanDerWaalsContact O-N 3.08Å; Y940-K943 PolarHBondContact O-N 3.41Å; I941-K943 VanDerWaalsContact C-N 3.33Å; I941-K943 PolarHBondContact O-N 2.82Å; K943-K945 PolarHBondContact O-N 3.34Å; K943-Q946 PolarHBondContact O-N 3.08Å; K943-Q946 VanDerWaalsContact O-N 3.12Å; K943-L947 WeakPolarHBondContact O-CB 3.37Å; K943-L947 WeakPolarHBondContact O-CG 3.49Å; K943-L947 PolarHBondContact O-N 3.42Å; K943-L966 HydrophobicContact CB-CD2 3.76Å; K943-L966 WeakPolarHBondContact CD-O 3.45Å; K943-L966 PolarHBondContact NZ-O 3Å; K943-M967 VanDerWaalsContact NZ-CB 3.35Å; K943-M967 VanDerWaalsContact NZ-CG 3.32Å; K943-M967 PolarHBondContact NZ-SD 3.09Å
944	I	88.1	Confident	86	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-56.4	-40.7	174	-73.7	166	0	0	0	110.6	V919 V922 F926 Y940 I941 N948 I949 L966	V919-I944 HydrophobicContact CG1-CG2 4.15Å; V922-I944 HydrophobicContact CG1-CD1 4.43Å; V922-I944 HydrophobicContact CG1-CG2 3.92Å; F926-I944 HydrophobicContact CD1-CD1 3.64Å; F926-I944 HydrophobicContact CD2-CD1 4.25Å; F926-I944 HydrophobicContact CE1-CD1 3.66Å; F926-I944 HydrophobicContact CE2-CD1 4.27Å; F926-I944 HydrophobicContact CG-CD1 3.95Å; F926-I944 HydrophobicContact CZ-CD1 3.98Å; Y940-I944 VanDerWaalsContact O-CG1 3.31Å; Y940-I944 WeakPolarHBondContact O-CG1 3.22Å; Y940-I944 PolarHBondContact O-N 3.22Å; I941-I944 PolarHBondContact O-N 3.1Å; I944-N948 PolarHBondContact O-N 3.46Å; I944-I949 HydrophobicContact CG2-CB 4.3Å; I944-I949 PolarHBondContact O-N 2.9Å; I944-L966 HydrophobicContact CG1-CD1 4.3Å; I944-L966 HydrophobicContact CG1-CD2 3.81Å
945	K	89.4	Confident	86.3	Confident	107 Å²	107	55.7 Å²	55.7	47%	0.465	30%	0.295	S	S	.	.	H	α-helix	trans	-72.3	-37.8	174.6	-65.5	-166.2	-178.8	-153.7	0	113.4	V919 N920 C923 I941 S942 K943 N948	V919-K945 HydrophobicContact CG1-CG 4.26Å; N920-K945 PolarHBondContact OD1-NZ 2.95Å; C923-K945 WeakPolarHBondContact SG-CE 3.42Å; I941-K945 WeakPolarHBondContact O-CG 3.14Å; I941-K945 PolarHBondContact O-N 3.28Å; I941-K945 VanDerWaalsContact O-N 3.1Å; S942-K945 PolarHBondContact O-N 3.33Å; K943-K945 PolarHBondContact O-N 3.34Å; K945-N948 PolarHBondContact O-N 3Å
946	Q	87.1	Confident	86.4	Confident	154 Å²	154	58.1 Å²	58.1	72%	0.72	31%	0.307	S	S	*	.	H	α-helix	trans	-66.1	-39.1	175.4	-74.7	169.8	1.4	0	0	113	S942 K943 N948	S942-Q946 VanDerWaalsContact O-CG 3.3Å; S942-Q946 WeakPolarHBondContact O-CG 3.47Å; S942-Q946 PolarHBondContact O-N 2.87Å; K943-Q946 PolarHBondContact O-N 3.08Å; K943-Q946 VanDerWaalsContact O-N 3.12Å; Q946-N948 VanDerWaalsContact C-N 3.32Å
947	L	85.8	Confident	86.3	Confident	80 Å²	80	56.9 Å²	56.9	42%	0.419	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-0.4	178.6	-61.9	175.2	0	0	0	113	K943 I949 E965 L966	K943-L947 WeakPolarHBondContact O-CB 3.37Å; K943-L947 WeakPolarHBondContact O-CG 3.49Å; K943-L947 PolarHBondContact O-N 3.42Å; L947-I949 HydrophobicContact CB-CD1 3.71Å; L947-I949 HydrophobicContact CB-CG1 3.79Å; L947-I949 HydrophobicContact CD1-CD1 3.95Å; L947-I949 HydrophobicContact CG-CD1 4.49Å; L947-I949 PolarHBondContact O-N 2.93Å; L947-E965 HydrophobicContact CD1-CB 4.1Å; L947-L966 HydrophobicContact CD1-CD2 4.1Å
948	N	87.8	Confident	86.2	Confident	113 Å²	113	60.5 Å²	60.5	60%	0.604	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	35.8	177.9	-157.3	39.9	0	0	0	114	I944 K945 Q946 N950	I944-N948 PolarHBondContact O-N 3.46Å; K945-N948 PolarHBondContact O-N 3Å; Q946-N948 VanDerWaalsContact C-N 3.32Å; N948-N950 PolarHBondContact O-N 3.11Å
949	I	86.4	Confident	86.1	Confident	7 Å²	7	54.8 Å²	54.8	4%	0.036	30%	0.298	C	S	.	.			trans	-73.5	113.7	-172.4	-67.2	165	0	0	0	110.1	I944 L947 V953 L954 L962 L966	I944-I949 HydrophobicContact CG2-CB 4.3Å; I944-I949 PolarHBondContact O-N 2.9Å; L947-I949 HydrophobicContact CB-CD1 3.71Å; L947-I949 HydrophobicContact CB-CG1 3.79Å; L947-I949 HydrophobicContact CD1-CD1 3.95Å; L947-I949 HydrophobicContact CG-CD1 4.49Å; L947-I949 PolarHBondContact O-N 2.93Å; I949-V953 HydrophobicContact CG1-CG1 4.42Å; I949-V953 HydrophobicContact CG2-CB 4.3Å; I949-V953 HydrophobicContact CG2-CG1 4.08Å; I949-L954 HydrophobicContact CG2-CD2 3.79Å; I949-L954 HydrophobicContact CG2-CG 3.89Å; I949-L962 HydrophobicContact CD1-CD1 3.94Å; I949-L966 HydrophobicContact CD1-CD1 4.39Å; I949-L966 HydrophobicContact CD1-CD2 3.9Å; I949-L966 HydrophobicContact CD1-CG 4.26Å
950	N	88.3	Confident	85.8	Confident	49 Å²	49	56 Å²	56	26%	0.262	30%	0.298	S	S	.	.			trans	-109.5	180	179.1	70.7	16.8	0	0	0	112	V919 N948 I952 V953 L954	V919-N950 HydrophobicContact CG2-CB 3.97Å; N948-N950 PolarHBondContact O-N 3.11Å; N950-I952 VanDerWaalsContact C-N 3.27Å; N950-I952 PolarHBondContact O-N 2.85Å; N950-I952 WeakPolarHBondContact OD1-CB 3.43Å; N950-I952 PolarHBondContact OD1-N 3.18Å; N950-V953 PolarHBondContact O-N 2.75Å; N950-V953 PolarHBondContact OD1-N 3.27Å; N950-L954 PolarHBondContact O-N 3.25Å
951	G	83.2	Confident	85.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.2	-30.7	179.2	0	0	0	0	0	115.6	I914 F917 L954 S955	I914-G951 CarbonylContact O-C 3.57Å; I914-G951 WeakPolarHBondContact O-CA 3.17Å; F917-G951 PolarHBondContact O-N 2.77Å; G951-L954 PolarHBondContact O-N 2.92Å; G951-S955 WeakPolarHBondContact O-CB 3.32Å; G951-S955 PolarHBondContact O-N 2.96Å
952	I	83	Confident	85.3	Confident	102 Å²	102	57.1 Å²	57.1	52%	0.523	31%	0.309	S	S	.	.	H	α-helix	trans	-72.7	-41.2	176.8	-53.8	175.9	0	0	0	110.2	H915 N950 L954 S955 V956	H915-I952 WeakPolarHBondContact O-CG1 3.49Å; N950-I952 VanDerWaalsContact C-N 3.27Å; N950-I952 PolarHBondContact O-N 2.85Å; N950-I952 WeakPolarHBondContact OD1-CB 3.43Å; N950-I952 PolarHBondContact OD1-N 3.18Å; I952-L954 VanDerWaalsContact C-N 3.35Å; I952-S955 PolarHBondContact O-N 2.98Å; I952-S955 PolarHBondContact O-OG 3.04Å; I952-V956 PolarHBondContact O-N 3.36Å
953	V	85.7	Confident	85.2	Confident	59 Å²	59	57.7 Å²	57.7	36%	0.358	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-45.8	171.2	177.1	0	0	0	0	109.8	I949 N950 S955 V956 C957	I949-V953 HydrophobicContact CG1-CG1 4.42Å; I949-V953 HydrophobicContact CG2-CB 4.3Å; I949-V953 HydrophobicContact CG2-CG1 4.08Å; N950-V953 PolarHBondContact O-N 2.75Å; N950-V953 PolarHBondContact OD1-N 3.27Å; V953-S955 VanDerWaalsContact C-N 3.25Å; V953-S955 PolarHBondContact O-N 2.67Å; V953-V956 PolarHBondContact O-N 2.79Å; V953-C957 HydrophobicContact CG1-CB 4.17Å; V953-C957 WeakPolarHBondContact O-CB 3.44Å; V953-C957 PolarHBondContact O-N 3.3Å
954	L	85.6	Confident	85.1	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-68.1	-16.6	178.1	-69.5	-173.2	0	0	0	114.8	I914 V922 F926 I949 N950 G951 I952 L962 I980 R984	I914-L954 HydrophobicContact CD1-CB 4.07Å; V922-L954 HydrophobicContact CB-CD1 4.39Å; V922-L954 HydrophobicContact CG1-CD1 3.64Å; V922-L954 HydrophobicContact CG2-CD1 3.79Å; F926-L954 HydrophobicContact CE2-CD1 4.47Å; I949-L954 HydrophobicContact CG2-CD2 3.79Å; I949-L954 HydrophobicContact CG2-CG 3.89Å; N950-L954 PolarHBondContact O-N 3.25Å; G951-L954 PolarHBondContact O-N 2.92Å; I952-L954 VanDerWaalsContact C-N 3.35Å; L954-L962 HydrophobicContact CD2-CD1 4.39Å; L954-L962 HydrophobicContact CD2-CD2 3.62Å; L954-I980 HydrophobicContact CD2-CD1 4.24Å; L954-R984 PolarHBondContact O-NE 3.43Å; L954-R984 PolarHBondContact O-NH2 2.94Å
955	S	83.7	Confident	84.8	Confident	39 Å²	39	68.2 Å²	68.2	27%	0.273	35%	0.353	S	S	.	.	H	α-helix	trans	-84.7	-37.7	174.4	75.3	0	0	0	0	113	G951 I952 V953 R984	G951-S955 WeakPolarHBondContact O-CB 3.32Å; G951-S955 PolarHBondContact O-N 2.96Å; I952-S955 PolarHBondContact O-N 2.98Å; I952-S955 PolarHBondContact O-OG 3.04Å; V953-S955 VanDerWaalsContact C-N 3.25Å; V953-S955 PolarHBondContact O-N 2.67Å; S955-R984 PolarHBondContact O-NE 2.86Å
956	V	82.9	Confident	84.3	Confident	118 Å²	118	63.2 Å²	63.2	72%	0.715	33%	0.331	S	S	*	.	H	α-helix	trans	-100.3	-30.2	-172.7	-173.9	0	0	0	0	114.2	I952 V953	I952-V956 PolarHBondContact O-N 3.36Å; V953-V956 PolarHBondContact O-N 2.79Å
957	C	83	Confident	84.1	Confident	32 Å²	32	62.4 Å²	62.4	22%	0.216	33%	0.329	C	S	.	.	S	Bend	trans	-62.9	147.4	-169.5	-171.7	0	0	0	0	113.6	V953 L959 R984	V953-C957 HydrophobicContact CG1-CB 4.17Å; V953-C957 WeakPolarHBondContact O-CB 3.44Å; V953-C957 PolarHBondContact O-N 3.3Å; C957-L959 PolarHBondContact O-N 3.48Å; C957-R984 VanDerWaalsContact O-CZ 3.31Å; C957-R984 PolarHBondContact O-NH1 3.1Å; C957-R984 PolarHBondContact O-NH2 3.09Å
958	D	83.9	Confident	84	Confident	91 Å²	91	59 Å²	59	49%	0.487	31%	0.311	S	S	.	.			trans	-66.3	130	166.2	168.2	45.3	0	0	0	110.3	E960 S961 L962	D958-E960 PolarHBondContact OD1-N 2.97Å; D958-S961 PolarHBondContact O-N 2.74Å; D958-S961 WeakPolarHBondContact OD2-CB 3.37Å; D958-S961 PolarHBondContact OD2-N 3.2Å; D958-S961 PolarHBondContact OD2-OG 3.47Å; D958-L962 WeakPolarHBondContact O-CB 3.39Å; D958-L962 PolarHBondContact O-N 3.32Å
959	L	85.2	Confident	83.8	Confident	16 Å²	16	58.6 Å²	58.6	8%	0.084	31%	0.306	C	S	.	.	H	α-helix	trans	-70.6	-35.4	-173.1	-64.6	174.3	0	0	0	111.4	C957 L962 R963 W973 Y977 I980 T981	C957-L959 PolarHBondContact O-N 3.48Å; L959-L962 HydrophobicContact CD2-CD2 4.39Å; L959-L962 PolarHBondContact O-N 2.64Å; L959-R963 WeakPolarHBondContact O-CB 3.37Å; L959-R963 PolarHBondContact O-N 3.38Å; L959-W973 HydrophobicContact CB-CH2 4.21Å; L959-W973 HydrophobicContact CB-CZ2 3.94Å; L959-W973 WeakPolarHBondContact O-CH2 3.09Å; L959-W973 WeakPolarHBondContact O-CZ2 3.33Å; L959-Y977 HydrophobicContact CB-CD2 4.15Å; L959-Y977 HydrophobicContact CB-CE2 3.98Å; L959-Y977 HydrophobicContact CD1-CD2 3.84Å; L959-Y977 HydrophobicContact CD1-CE2 3.42Å; L959-Y977 VanDerWaalsContact CD1-CE2 3.42Å; L959-Y977 HydrophobicContact CG-CE2 4.33Å; L959-I980 HydrophobicContact CD2-CB 4.4Å; L959-I980 HydrophobicContact CD2-CG2 3.72Å; L959-T981 HydrophobicContact CD1-CG2 3.79Å
960	E	80.9	Confident	83.6	Confident	78 Å²	78	64.3 Å²	64.3	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-76.2	-27.2	-178.5	-149.2	60.2	-144.5	0	0	112.4	D958 R963 Q964	D958-E960 PolarHBondContact OD1-N 2.97Å; E960-R963 WeakPolarHBondContact OE1-CD 3.49Å; E960-R963 IonicContact OE1-CZ 3.54Å; E960-R963 IonicContact OE1-NE 3.62Å; E960-R963 IonicContact OE1-NH1 3.79Å; E960-R963 PolarHBondContact OE1-NH1 3.42Å; E960-Q964 WeakPolarHBondContact O-CG 3.26Å; E960-Q964 PolarHBondContact O-NE2 2.97Å; E960-Q964 VanDerWaalsContact O-NE2 3.15Å
961	S	81.7	Confident	83.3	Confident	54 Å²	54	65.4 Å²	65.4	38%	0.378	35%	0.347	S	S	.	.	H	α-helix	trans	-69	-49.5	167.5	-59.5	0	0	0	0	111.8	D958 R963 Q964 E965	D958-S961 PolarHBondContact O-N 2.74Å; D958-S961 WeakPolarHBondContact OD2-CB 3.37Å; D958-S961 PolarHBondContact OD2-N 3.2Å; D958-S961 PolarHBondContact OD2-OG 3.47Å; S961-R963 VanDerWaalsContact C-N 3.26Å; S961-R963 PolarHBondContact O-N 2.84Å; S961-Q964 WeakPolarHBondContact O-CB 3.44Å; S961-Q964 PolarHBondContact O-N 3.14Å; S961-E965 PolarHBondContact O-N 3.44Å
962	L	85.6	Confident	83.4	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-54.7	-41.2	177.4	178.8	67.3	0	0	0	112.4	I949 L954 D958 L959 Q964 L966 W973 I980	I949-L962 HydrophobicContact CD1-CD1 3.94Å; L954-L962 HydrophobicContact CD2-CD1 4.39Å; L954-L962 HydrophobicContact CD2-CD2 3.62Å; D958-L962 WeakPolarHBondContact O-CB 3.39Å; D958-L962 PolarHBondContact O-N 3.32Å; L959-L962 HydrophobicContact CD2-CD2 4.39Å; L959-L962 PolarHBondContact O-N 2.64Å; L962-Q964 VanDerWaalsContact C-N 3.33Å; L962-Q964 PolarHBondContact O-N 3.3Å; L962-L966 HydrophobicContact CD1-CD1 3.85Å; L962-L966 HydrophobicContact CD1-CG 4.38Å; L962-L966 HydrophobicContact CG-CD1 4.06Å; L962-L966 WeakPolarHBondContact O-CB 3.38Å; L962-L966 PolarHBondContact O-N 3.37Å; L962-L966 VanDerWaalsContact O-N 3.11Å; L962-W973 HydrophobicContact CD2-CH2 4.4Å; L962-I980 HydrophobicContact CD2-CD1 4.06Å
963	R	86.1	Confident	83.7	Confident	65 Å²	65	62 Å²	62	25%	0.245	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-41.7	175.2	-176.1	-165.4	169.7	-161.7	-11.8	112.6	L959 E960 S961 M967 I968 I970 W973	L959-R963 WeakPolarHBondContact O-CB 3.37Å; L959-R963 PolarHBondContact O-N 3.38Å; E960-R963 WeakPolarHBondContact OE1-CD 3.49Å; E960-R963 IonicContact OE1-CZ 3.54Å; E960-R963 IonicContact OE1-NE 3.62Å; E960-R963 IonicContact OE1-NH1 3.79Å; E960-R963 PolarHBondContact OE1-NH1 3.42Å; S961-R963 VanDerWaalsContact C-N 3.26Å; S961-R963 PolarHBondContact O-N 2.84Å; R963-M967 WeakPolarHBondContact O-CA 3.33Å; R963-M967 PolarHBondContact O-N 2.65Å; R963-I968 PolarHBondContact O-N 3.41Å; R963-I970 VanDerWaalsContact NH2-CG1 3.28Å; R963-W973 HydrophobicContact CB-CD2 3.94Å; R963-W973 HydrophobicContact CB-CE3 4.06Å; R963-W973 HydrophobicContact CB-CH2 3.9Å; R963-W973 HydrophobicContact CB-CZ2 3.76Å; R963-W973 HydrophobicContact CB-CZ3 4.05Å; R963-W973 HydrophobicContact CG-CD2 3.66Å; R963-W973 HydrophobicContact CG-CE3 4.03Å; R963-W973 HydrophobicContact CG-CG 3.88Å; R963-W973 HydrophobicContact CG-CZ2 4.35Å
964	Q	83.8	Confident	83.6	Confident	139 Å²	139	65.1 Å²	65.1	65%	0.65	34%	0.339	S	S	*	.	H	α-helix	trans	-71.7	-43	-177.2	-72.7	173.2	55.2	0	0	111.7	E960 S961 L962 M967	E960-Q964 WeakPolarHBondContact O-CG 3.26Å; E960-Q964 PolarHBondContact O-NE2 2.97Å; E960-Q964 VanDerWaalsContact O-NE2 3.15Å; S961-Q964 WeakPolarHBondContact O-CB 3.44Å; S961-Q964 PolarHBondContact O-N 3.14Å; L962-Q964 VanDerWaalsContact C-N 3.33Å; L962-Q964 PolarHBondContact O-N 3.3Å; Q964-M967 VanDerWaalsContact O-CG 3.25Å; Q964-M967 WeakPolarHBondContact O-CG 3.46Å; Q964-M967 PolarHBondContact O-N 3.06Å
965	E	81.8	Confident	83.6	Confident	123 Å²	123	66.3 Å²	66.3	58%	0.575	35%	0.346	S	S	*	.	H	α-helix	trans	-68	-40.7	178.1	-67.3	-172.7	117	0	0	112.5	L947 S961 M967	L947-E965 HydrophobicContact CD1-CB 4.1Å; S961-E965 PolarHBondContact O-N 3.44Å; E965-M967 VanDerWaalsContact C-N 3.26Å; E965-M967 PolarHBondContact O-N 3.26Å
966	L	79.9	Confident	83.8	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-72.8	-19.8	173.3	-67.5	174.2	0	0	0	112.6	K943 I944 L947 I949 L962 I968	K943-L966 HydrophobicContact CB-CD2 3.76Å; K943-L966 WeakPolarHBondContact CD-O 3.45Å; K943-L966 PolarHBondContact NZ-O 3Å; I944-L966 HydrophobicContact CG1-CD1 4.3Å; I944-L966 HydrophobicContact CG1-CD2 3.81Å; L947-L966 HydrophobicContact CD1-CD2 4.1Å; I949-L966 HydrophobicContact CD1-CD1 4.39Å; I949-L966 HydrophobicContact CD1-CD2 3.9Å; I949-L966 HydrophobicContact CD1-CG 4.26Å; L962-L966 HydrophobicContact CD1-CD1 3.85Å; L962-L966 HydrophobicContact CD1-CG 4.38Å; L962-L966 HydrophobicContact CG-CD1 4.06Å; L962-L966 WeakPolarHBondContact O-CB 3.38Å; L962-L966 PolarHBondContact O-N 3.37Å; L962-L966 VanDerWaalsContact O-N 3.11Å; L966-I968 HydrophobicContact CB-CD1 3.7Å; L966-I968 HydrophobicContact CB-CG1 3.68Å; L966-I968 HydrophobicContact CD1-CD1 3.75Å; L966-I968 HydrophobicContact CG-CD1 4.38Å
967	M	82.8	Confident	84	Confident	137 Å²	137	63.7 Å²	63.7	68%	0.675	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	53.7	-174.1	-40.7	170.7	85.1	0	0	111.7	K943 R963 Q964 E965	K943-M967 VanDerWaalsContact NZ-CB 3.35Å; K943-M967 VanDerWaalsContact NZ-CG 3.32Å; K943-M967 PolarHBondContact NZ-SD 3.09Å; R963-M967 WeakPolarHBondContact O-CA 3.33Å; R963-M967 PolarHBondContact O-N 2.65Å; Q964-M967 VanDerWaalsContact O-CG 3.25Å; Q964-M967 WeakPolarHBondContact O-CG 3.46Å; Q964-M967 PolarHBondContact O-N 3.06Å; E965-M967 VanDerWaalsContact C-N 3.26Å; E965-M967 PolarHBondContact O-N 3.26Å
968	I	83.2	Confident	84.2	Confident	9 Å²	9	66.9 Å²	66.9	5%	0.046	33%	0.328	C	S	.	.			trans	-80.9	137	-179.3	-62	164	0	0	0	110	Y940 R963 L966 D972 W973 I976	Y940-I968 HydrophobicContact CD1-CG1 3.86Å; Y940-I968 HydrophobicContact CE1-CB 4.15Å; Y940-I968 HydrophobicContact CE1-CG1 3.83Å; Y940-I968 HydrophobicContact CE1-CG2 4.26Å; Y940-I968 HydrophobicContact CE2-CG2 4.18Å; Y940-I968 HydrophobicContact CG-CG1 4.3Å; R963-I968 PolarHBondContact O-N 3.41Å; L966-I968 HydrophobicContact CB-CD1 3.7Å; L966-I968 HydrophobicContact CB-CG1 3.68Å; L966-I968 HydrophobicContact CD1-CD1 3.75Å; L966-I968 HydrophobicContact CG-CD1 4.38Å; I968-D972 HydrophobicContact CG2-CB 3.87Å; I968-W973 HydrophobicContact CB-CE3 4.39Å; I968-W973 HydrophobicContact CD1-CE3 3.78Å; I968-W973 HydrophobicContact CD1-CZ3 3.96Å; I968-W973 HydrophobicContact CG2-CB 3.89Å; I968-W973 HydrophobicContact CG2-CE3 4.38Å; I968-I976 HydrophobicContact CD1-CD1 4.06Å; I968-I976 HydrophobicContact CG2-CD1 4.07Å
969	E	83.9	Confident	84.2	Confident	105 Å²	105	62.6 Å²	62.6	49%	0.491	31%	0.305	S	S	.	.			trans	-65	154.4	176.8	-64.3	-162.5	149.6	0	0	112.7	H936 Y940 S971 D972 W973	H936-E969 IonicContact CE1-OE2 2.89Å; H936-E969 PolarHBondContact CE1-OE2 3.1Å; H936-E969 IonicContact ND1-OE2 3.13Å; Y940-E969 PolarHBondContact OH-N 3.32Å; E969-S971 VanDerWaalsContact C-N 3.26Å; E969-S971 PolarHBondContact O-N 3.46Å; E969-D972 PolarHBondContact O-N 2.92Å; E969-W973 WeakPolarHBondContact O-CB 3.33Å; E969-W973 PolarHBondContact O-N 3.3Å
970	I	81.5	Confident	84.3	Confident	126 Å²	126	61.9 Å²	61.9	65%	0.646	30%	0.302	S	S	*	.	H	α-helix	trans	-61.1	-34	-171.6	-67.4	157.2	0	0	0	112.3	R963	R963-I970 VanDerWaalsContact NH2-CG1 3.28Å
971	S	81.1	Confident	84.5	Confident	73 Å²	73	60.2 Å²	60.2	51%	0.51	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-60.7	174	43.6	0	0	0	0	111.6	E969 W973 Q974	E969-S971 VanDerWaalsContact C-N 3.26Å; E969-S971 PolarHBondContact O-N 3.46Å; S971-W973 PolarHBondContact O-N 3.35Å; S971-Q974 PolarHBondContact O-N 3.32Å; S971-Q974 VanDerWaalsContact O-N 3.14Å
972	D	87.2	Confident	84.7	Confident	15 Å²	15	59.5 Å²	59.5	8%	0.08	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-33.8	-170	-53.3	5.4	0	0	0	110.3	I932 H936 Y940 I968 E969 Q974 V975 I976	I932-D972 HydrophobicContact CD1-CB 4.37Å; I932-D972 HydrophobicContact CG1-CB 4.43Å; I932-D972 HydrophobicContact CG2-CB 4.48Å; H936-D972 IonicContact CG-OD2 3.18Å; H936-D972 IonicContact ND1-OD2 2.61Å; H936-D972 PolarHBondContact ND1-OD2 2.98Å; Y940-D972 HydrophobicContact CE2-CB 4.02Å; Y940-D972 WeakPolarHBondContact CE2-OD2 2.93Å; Y940-D972 PolarHBondContact OH-OD2 2.95Å; I968-D972 HydrophobicContact CG2-CB 3.87Å; E969-D972 PolarHBondContact O-N 2.92Å; D972-Q974 VanDerWaalsContact C-N 3.32Å; D972-Q974 PolarHBondContact O-N 3.15Å; D972-V975 PolarHBondContact O-N 2.94Å; D972-I976 PolarHBondContact O-N 3.1Å; D972-I976 VanDerWaalsContact O-N 3.15Å
973	W	88.5	Confident	84.5	Confident	15 Å²	15	59.7 Å²	59.7	6%	0.057	29%	0.287	C	S	.	.	H	α-helix	trans	-59.3	-37.7	176.6	-178.6	-119.4	0	0	0	113	L959 L962 R963 I968 E969 S971 V975 I976 Y977	L959-W973 HydrophobicContact CB-CH2 4.21Å; L959-W973 HydrophobicContact CB-CZ2 3.94Å; L959-W973 WeakPolarHBondContact O-CH2 3.09Å; L959-W973 WeakPolarHBondContact O-CZ2 3.33Å; L962-W973 HydrophobicContact CD2-CH2 4.4Å; R963-W973 HydrophobicContact CB-CD2 3.94Å; R963-W973 HydrophobicContact CB-CE3 4.06Å; R963-W973 HydrophobicContact CB-CH2 3.9Å; R963-W973 HydrophobicContact CB-CZ2 3.76Å; R963-W973 HydrophobicContact CB-CZ3 4.05Å; R963-W973 HydrophobicContact CG-CD2 3.66Å; R963-W973 HydrophobicContact CG-CE3 4.03Å; R963-W973 HydrophobicContact CG-CG 3.88Å; R963-W973 HydrophobicContact CG-CZ2 4.35Å; I968-W973 HydrophobicContact CB-CE3 4.39Å; I968-W973 HydrophobicContact CD1-CE3 3.78Å; I968-W973 HydrophobicContact CD1-CZ3 3.96Å; I968-W973 HydrophobicContact CG2-CB 3.89Å; I968-W973 HydrophobicContact CG2-CE3 4.38Å; E969-W973 WeakPolarHBondContact O-CB 3.33Å; E969-W973 PolarHBondContact O-N 3.3Å; S971-W973 PolarHBondContact O-N 3.35Å; W973-V975 VanDerWaalsContact C-N 3.28Å; W973-V975 PolarHBondContact O-N 2.96Å; W973-I976 HydrophobicContact CE3-CB 4.34Å; W973-I976 HydrophobicContact CE3-CG2 4.1Å; W973-I976 HydrophobicContact CZ3-CG2 3.94Å; W973-I976 PolarHBondContact O-N 3.06Å; W973-Y977 AromaticContact CE2-CD2 3.99Å; W973-Y977 AromaticContact CZ2-CD2 3.76Å; W973-Y977 HydrophobicContact CZ2-CD2 3.76Å; W973-Y977 WeakPolarHBondContact O-CB 3.46Å; W973-Y977 PolarHBondContact O-N 3.14Å
974	Q	84.2	Confident	84.5	Confident	124 Å²	124	59.4 Å²	59.4	58%	0.579	29%	0.286	S	S	*	.	H	α-helix	trans	-67.1	-30.4	-179.2	-68	-154	4.3	0	0	113	S971 D972 K978	S971-Q974 PolarHBondContact O-N 3.32Å; S971-Q974 VanDerWaalsContact O-N 3.14Å; D972-Q974 VanDerWaalsContact C-N 3.32Å; D972-Q974 PolarHBondContact O-N 3.15Å; Q974-K978 WeakPolarHBondContact O-CB 3.38Å; Q974-K978 VanDerWaalsContact O-CG 3.3Å; Q974-K978 WeakPolarHBondContact O-CG 3.27Å; Q974-K978 PolarHBondContact O-N 3.42Å
975	V	85.6	Confident	84.2	Confident	29 Å²	29	55.5 Å²	55.5	18%	0.176	27%	0.274	C	S	.	.	H	α-helix	trans	-73	-48.2	174.5	-174.1	0	0	0	0	110	I903 I929 I932 D972 W973 Y977 K978 L979	I903-V975 HydrophobicContact CD1-CG1 4.2Å; I903-V975 VanDerWaalsContact CD1-O 3.22Å; I903-V975 WeakPolarHBondContact CD1-O 3.19Å; I903-V975 HydrophobicContact CG2-CG1 4.22Å; I929-V975 HydrophobicContact CG2-CG1 3.76Å; I932-V975 HydrophobicContact CD1-CB 4.45Å; D972-V975 PolarHBondContact O-N 2.94Å; W973-V975 VanDerWaalsContact C-N 3.28Å; W973-V975 PolarHBondContact O-N 2.96Å; V975-Y977 PolarHBondContact O-N 2.81Å; V975-K978 PolarHBondContact O-N 2.85Å; V975-L979 PolarHBondContact O-N 3.26Å; V975-L979 VanDerWaalsContact O-N 3.1Å
976	I	86.9	Confident	83.4	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-42.5	179.9	-69.5	163.4	0	0	0	111.6	F926 I929 I932 Y940 I968 D972 W973 L979 I980	F926-I976 HydrophobicContact CD1-CD1 4.33Å; F926-I976 HydrophobicContact CE1-CD1 3.87Å; F926-I976 HydrophobicContact CE1-CG1 4.05Å; F926-I976 HydrophobicContact CE1-CG2 3.83Å; F926-I976 HydrophobicContact CZ-CG2 3.68Å; I929-I976 HydrophobicContact CD1-CG1 4.18Å; I932-I976 HydrophobicContact CD1-CD1 3.85Å; I932-I976 HydrophobicContact CD1-CG1 3.81Å; Y940-I976 HydrophobicContact CD2-CD1 4.41Å; I968-I976 HydrophobicContact CD1-CD1 4.06Å; I968-I976 HydrophobicContact CG2-CD1 4.07Å; D972-I976 PolarHBondContact O-N 3.1Å; D972-I976 VanDerWaalsContact O-N 3.15Å; W973-I976 HydrophobicContact CE3-CB 4.34Å; W973-I976 HydrophobicContact CE3-CG2 4.1Å; W973-I976 HydrophobicContact CZ3-CG2 3.94Å; W973-I976 PolarHBondContact O-N 3.06Å; I976-L979 PolarHBondContact O-N 3.16Å; I976-I980 HydrophobicContact CG2-CD1 3.65Å; I976-I980 HydrophobicContact CG2-CG1 4.4Å; I976-I980 WeakPolarHBondContact O-CG1 3.49Å; I976-I980 PolarHBondContact O-N 3.34Å
977	Y	88.2	Confident	82.4	Confident	102 Å²	102	50.9 Å²	50.9	40%	0.4	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-46.4	177	-178.6	-85.6	0	0	0	111.8	L959 W973 V975 L979 I980 T981	L959-Y977 HydrophobicContact CB-CD2 4.15Å; L959-Y977 HydrophobicContact CB-CE2 3.98Å; L959-Y977 HydrophobicContact CD1-CD2 3.84Å; L959-Y977 HydrophobicContact CD1-CE2 3.42Å; L959-Y977 VanDerWaalsContact CD1-CE2 3.42Å; L959-Y977 HydrophobicContact CG-CE2 4.33Å; W973-Y977 AromaticContact CE2-CD2 3.99Å; W973-Y977 AromaticContact CZ2-CD2 3.76Å; W973-Y977 HydrophobicContact CZ2-CD2 3.76Å; W973-Y977 WeakPolarHBondContact O-CB 3.46Å; W973-Y977 PolarHBondContact O-N 3.14Å; V975-Y977 PolarHBondContact O-N 2.81Å; Y977-L979 VanDerWaalsContact C-N 3.3Å; Y977-L979 PolarHBondContact O-N 3.42Å; Y977-I980 PolarHBondContact O-N 2.83Å; Y977-T981 HydrophobicContact CD1-CG2 4.14Å; Y977-T981 HydrophobicContact CE1-CG2 3.74Å; Y977-T981 HydrophobicContact CE2-CG2 4.39Å; Y977-T981 WeakPolarHBondContact O-CB 3.16Å; Y977-T981 WeakPolarHBondContact O-CG2 3.43Å; Y977-T981 PolarHBondContact O-N 3.25Å; Y977-T981 PolarHBondContact O-OG1 3.29Å
978	K	85.5	Confident	81	Confident	98 Å²	98	48.8 Å²	48.8	43%	0.426	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-35.9	175.7	-77.1	177.6	-179.8	-174.7	0	112.2	I903 Q974 V975 T981 W982	I903-K978 HydrophobicContact CD1-CB 3.86Å; Q974-K978 WeakPolarHBondContact O-CB 3.38Å; Q974-K978 VanDerWaalsContact O-CG 3.3Å; Q974-K978 WeakPolarHBondContact O-CG 3.27Å; Q974-K978 PolarHBondContact O-N 3.42Å; V975-K978 PolarHBondContact O-N 2.85Å; K978-T981 WeakPolarHBondContact CA-OG1 3.42Å; K978-T981 PolarHBondContact O-OG1 2.92Å; K978-W982 WeakPolarHBondContact O-CB 3.47Å; K978-W982 PolarHBondContact O-N 3.41Å
979	L	85.3	Confident	79.2	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-69	-48.1	176.4	-172	59.7	0	0	0	112	I903 L905 L925 I929 V975 I976 Y977 W982 L983	I903-L979 HydrophobicContact CD1-CB 3.64Å; I903-L979 HydrophobicContact CD1-CD1 4.33Å; L905-L979 HydrophobicContact CD1-CD1 4.39Å; L905-L979 HydrophobicContact CD2-CD1 4.45Å; L905-L979 HydrophobicContact CD2-CD2 4.46Å; L925-L979 HydrophobicContact CD1-CD2 4.05Å; L925-L979 HydrophobicContact CD2-CD2 4.28Å; L925-L979 HydrophobicContact CG-CD2 3.98Å; I929-L979 HydrophobicContact CD1-CD2 3.81Å; I929-L979 HydrophobicContact CG1-CD2 4Å; V975-L979 PolarHBondContact O-N 3.26Å; V975-L979 VanDerWaalsContact O-N 3.1Å; I976-L979 PolarHBondContact O-N 3.16Å; Y977-L979 VanDerWaalsContact C-N 3.3Å; Y977-L979 PolarHBondContact O-N 3.42Å; L979-W982 PolarHBondContact O-N 2.94Å; L979-L983 HydrophobicContact CD1-CD1 4.45Å; L979-L983 HydrophobicContact CG-CD1 4.17Å; L979-L983 WeakPolarHBondContact O-CG 3.49Å; L979-L983 PolarHBondContact O-N 3.1Å
980	I	87.1	Confident	77	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-39.7	-177.7	-62.8	166.5	0	0	0	110.9	F926 L954 L959 L962 I976 Y977 L983 R984	F926-I980 HydrophobicContact CZ-CD1 4.42Å; L954-I980 HydrophobicContact CD2-CD1 4.24Å; L959-I980 HydrophobicContact CD2-CB 4.4Å; L959-I980 HydrophobicContact CD2-CG2 3.72Å; L962-I980 HydrophobicContact CD2-CD1 4.06Å; I976-I980 HydrophobicContact CG2-CD1 3.65Å; I976-I980 HydrophobicContact CG2-CG1 4.4Å; I976-I980 WeakPolarHBondContact O-CG1 3.49Å; I976-I980 PolarHBondContact O-N 3.34Å; Y977-I980 PolarHBondContact O-N 2.83Å; I980-L983 PolarHBondContact O-N 3.23Å; I980-R984 HydrophobicContact CG2-CG 4.46Å; I980-R984 WeakPolarHBondContact O-CG 3.18Å; I980-R984 PolarHBondContact O-N 3.21Å
981	T	85.8	Confident	74.8	Confident	44 Å²	44	49.5 Å²	49.5	27%	0.27	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-36.2	176.4	48.2	0	0	0	0	112.6	L959 Y977 K978 S985	L959-T981 HydrophobicContact CD1-CG2 3.79Å; Y977-T981 HydrophobicContact CD1-CG2 4.14Å; Y977-T981 HydrophobicContact CE1-CG2 3.74Å; Y977-T981 HydrophobicContact CE2-CG2 4.39Å; Y977-T981 WeakPolarHBondContact O-CB 3.16Å; Y977-T981 WeakPolarHBondContact O-CG2 3.43Å; Y977-T981 PolarHBondContact O-N 3.25Å; Y977-T981 PolarHBondContact O-OG1 3.29Å; K978-T981 WeakPolarHBondContact CA-OG1 3.42Å; K978-T981 PolarHBondContact O-OG1 2.92Å; T981-S985 WeakPolarHBondContact O-CB 3.26Å; T981-S985 PolarHBondContact O-N 3.32Å; T981-S985 VanDerWaalsContact O-N 3.07Å; T981-S985 PolarHBondContact O-OG 2.96Å
982	W	84.7	Confident	72.3	Confident	39 Å²	39	57.1 Å²	57.1	15%	0.148	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-42.6	170.7	-178.5	81.7	0	0	0	112.3	K899 P900 C901 K978 L979 R984 S985 S986	K899-W982 WeakPolarHBondContact O-CZ2 3.31Å; P900-W982 PolarHBondContact O-NE1 3.49Å; C901-W982 HydrophobicContact CB-CD2 4.11Å; C901-W982 HydrophobicContact CB-CE3 4.29Å; C901-W982 HydrophobicContact CB-CH2 3.9Å; C901-W982 HydrophobicContact CB-CZ2 3.67Å; C901-W982 HydrophobicContact CB-CZ3 4.19Å; C901-W982 VanDerWaalsContact SG-CE3 3.52Å; K978-W982 WeakPolarHBondContact O-CB 3.47Å; K978-W982 PolarHBondContact O-N 3.41Å; L979-W982 PolarHBondContact O-N 2.94Å; W982-R984 PolarHBondContact O-N 2.96Å; W982-S985 PolarHBondContact O-N 3.39Å; W982-S985 PolarHBondContact O-OG 3.49Å; W982-S986 PolarHBondContact O-N 3.42Å; W982-S986 PolarHBondContact O-OG 2.93Å
983	L	81.4	Confident	69.4	Low	6 Å²	6	60.1 Å²	60.1	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-31.3	177.4	-71	170.2	0	0	0	114	P910 I914 L925 L979 I980 S986 S987	P910-L983 HydrophobicContact CG-CD2 3.82Å; I914-L983 HydrophobicContact CB-CB 4.32Å; I914-L983 HydrophobicContact CD1-CB 3.75Å; I914-L983 HydrophobicContact CG1-CB 4.11Å; L925-L983 HydrophobicContact CD1-CD1 4.23Å; L925-L983 HydrophobicContact CD2-CD1 3.45Å; L925-L983 VanDerWaalsContact CD2-CD1 3.45Å; L925-L983 HydrophobicContact CG-CD1 4.46Å; L979-L983 HydrophobicContact CD1-CD1 4.45Å; L979-L983 HydrophobicContact CG-CD1 4.17Å; L979-L983 WeakPolarHBondContact O-CG 3.49Å; L979-L983 PolarHBondContact O-N 3.1Å; I980-L983 PolarHBondContact O-N 3.23Å; L983-S986 PolarHBondContact O-OG 3.4Å; L983-S987 WeakPolarHBondContact O-CB 3.01Å; L983-S987 PolarHBondContact O-N 3.49Å; L983-S987 PolarHBondContact O-OG 3.41Å
984	R	86.8	Confident	66.5	Low	58 Å²	58	67.8 Å²	67.8	22%	0.219	33%	0.33	C	S	.	.	H	α-helix	trans	-68.6	-47.6	171.9	-74.2	-179.4	-175.4	-166.5	0.1	111.4	I914 L954 S955 C957 I980 W982 S987 T988	I914-R984 HydrophobicContact CD1-CG 4.21Å; L954-R984 PolarHBondContact O-NE 3.43Å; L954-R984 PolarHBondContact O-NH2 2.94Å; S955-R984 PolarHBondContact O-NE 2.86Å; C957-R984 VanDerWaalsContact O-CZ 3.31Å; C957-R984 PolarHBondContact O-NH1 3.1Å; C957-R984 PolarHBondContact O-NH2 3.09Å; I980-R984 HydrophobicContact CG2-CG 4.46Å; I980-R984 WeakPolarHBondContact O-CG 3.18Å; I980-R984 PolarHBondContact O-N 3.21Å; W982-R984 PolarHBondContact O-N 2.96Å; R984-S987 PolarHBondContact O-N 3.18Å; R984-T988 PolarHBondContact O-N 2.99Å
985	S	76.2	Confident	63.8	Low	57 Å²	57	67.2 Å²	67.2	40%	0.399	34%	0.34	S	S	.	.	H	α-helix	trans	-74.4	-22.8	-176.4	53.2	0	0	0	0	114.6	T981 W982 T988	T981-S985 WeakPolarHBondContact O-CB 3.26Å; T981-S985 PolarHBondContact O-N 3.32Å; T981-S985 VanDerWaalsContact O-N 3.07Å; T981-S985 PolarHBondContact O-OG 2.96Å; W982-S985 PolarHBondContact O-N 3.39Å; W982-S985 PolarHBondContact O-OG 3.49Å; S985-T988 PolarHBondContact O-OG1 2.86Å
986	S	66.3	Low	60.9	Low	15 Å²	15	75.2 Å²	75.2	11%	0.105	38%	0.375	C	S	.	.	H	α-helix	trans	-73.1	-39.2	166.4	59	0	0	0	0	111.9	F897 W982 L983 T988 D989	F897-S986 WeakPolarHBondContact CE1-O 3.49Å; W982-S986 PolarHBondContact O-N 3.42Å; W982-S986 PolarHBondContact O-OG 2.93Å; L983-S986 PolarHBondContact O-OG 3.4Å; S986-T988 VanDerWaalsContact C-N 3.28Å; S986-T988 PolarHBondContact O-N 2.66Å; S986-D989 PolarHBondContact O-N 2.95Å
987	S	59.2	Low	57.9	Low	14 Å²	14	79.8 Å²	79.8	10%	0.098	41%	0.407	C	S	.	.	H	α-helix	trans	-70.5	-18.7	-176.4	-59.9	0	0	0	0	114.4	I914 L983 R984	I914-S987 VanDerWaalsContact CG2-OG 3.28Å; I914-S987 WeakPolarHBondContact CG2-OG 3.22Å; I914-S987 PolarHBondContact N-OG 3.09Å; L983-S987 WeakPolarHBondContact O-CB 3.01Å; L983-S987 PolarHBondContact O-N 3.49Å; L983-S987 PolarHBondContact O-OG 3.41Å; R984-S987 PolarHBondContact O-N 3.18Å
988	T	53.5	Low	54.9	Low	92 Å²	92	80.5 Å²	80.5	56%	0.564	43%	0.427	S	S	*	.	H	α-helix	trans	-75.4	-34.2	175.6	42.2	0	0	0	0	113.5	R984 S985 S986 G990 H991	R984-T988 PolarHBondContact O-N 2.99Å; S985-T988 PolarHBondContact O-OG1 2.86Å; S986-T988 VanDerWaalsContact C-N 3.28Å; S986-T988 PolarHBondContact O-N 2.66Å; T988-G990 VanDerWaalsContact C-N 3.27Å; T988-G990 PolarHBondContact O-N 2.87Å; T988-H991 PolarHBondContact O-N 3.34Å
989	D	44.3	Very low	52.1	Low	94 Å²	94	85.1 Å²	85.1	50%	0.503	45%	0.45	S	S	.	.	H	α-helix	trans	-69.3	-26.6	-176.7	-67.8	-15.3	0	0	0	111.9	K899 S986	K899-D989 IonicContact NZ-OD2 3.49Å; K899-D989 PolarHBondContact NZ-OD2 3.47Å; S986-D989 PolarHBondContact O-N 2.95Å
990	G	36.9	Very low	49.2	Very low	21 Å²	21	94 Å²	94	22%	0.216	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-76.1	-17.2	179.6	0	0	0	0	0	115.6	T988 R992 T993	T988-G990 VanDerWaalsContact C-N 3.27Å; T988-G990 PolarHBondContact O-N 2.87Å; G990-R992 VanDerWaalsContact C-N 3.27Å; G990-R992 PolarHBondContact O-N 3.39Å; G990-T993 PolarHBondContact O-N 2.92Å
991	H	36.1	Very low	46.2	Very low	141 Å²	141	105.5 Å²	105.5	65%	0.653	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-81.4	0.3	-176.4	-97	-68.8	0	0	0	114.8	H915 T988	H915-H991 AromaticContact CE1-NE2 3.98Å; T988-H991 PolarHBondContact O-N 3.34Å
992	R	29	Very low	43.4	Very low	233 Å²	233	112.2 Å²	112.2	88%	0.879	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-100.1	-1.4	172.5	-76.5	-176	168.8	175.1	-3.4	114.4	G990	G990-R992 VanDerWaalsContact C-N 3.27Å; G990-R992 PolarHBondContact O-N 3.39Å
993	T	26	Very low	40.5	Very low	77 Å²	77	114.3 Å²	114.3	47%	0.472	60%	0.602	S	S	.	*	S	Bend	trans	-132.9	26.4	-170.8	45.2	0	0	0	0	114.5	G990	G990-T993 PolarHBondContact O-N 2.92Å
994	F	27	Very low	37.9	Very low	176 Å²	176	117.1 Å²	117.1	77%	0.772	63%	0.632	S	S	*	*	S	Bend	trans	-132.3	28.3	171.5	-110.1	-82.5	0	0	0	113.5
995	S	27.6	Very low	35.1	Very low	112 Å²	112	122 Å²	122	78%	0.783	66%	0.661	S	S	*	*	S	Bend	trans	-137.2	23	-174.6	-168.9	0	0	0	0	114.5
996	E	25.9	Very low	32.6	Very low	198 Å²	198	123.9 Å²	123.9	93%	0.925	67%	0.674	S	S	*	*	S	Bend	trans	-148.5	4.8	-178.5	-132.7	165.3	-147.2	0	0	115.1
997	S	23.3	Very low	30.7	Very low	96 Å²	96	127.5 Å²	127.5	67%	0.671	70%	0.7	S	S	*	*	S	Bend	trans	-121.3	20.5	-165.6	51.4	0	0	0	0	115.6
998	S	25.8	Very low	29.3	Very low	117 Å²	117	133.7 Å²	133.7	82%	0.818	73%	0.732	S	S	*	*	S	Bend	trans	-156.8	46.3	177.9	53	0	0	0	0	115.9
999	Q	25.7	Very low	28	Very low	196 Å²	196	137.1 Å²	137.1	92%	0.916	74%	0.741	S	S	*	*			trans	-144.2	44.7	174.2	-132	174.8	29.8	0	0	117
1000	Q	24.3	Very low	27.2	Very low	187 Å²	187	141.5 Å²	141.5	87%	0.874	76%	0.756	S	S	*	*	S	Bend	trans	-138.8	147.8	152.8	-85.2	-169.1	3.2	0	0	110.6
1001	R	25.3	Very low	26.6	Very low	242 Å²	242	146.9 Å²	146.9	91%	0.913	78%	0.78	S	S	*	*			trans	68.4	88.9	-172.9	-49.5	-176.9	-170.9	-161.7	3.8	115.6
1002	L	25.9	Very low	26.1	Very low	186 Å²	186	145.8 Å²	145.8	97%	0.974	78%	0.783	S	S	*	*				-147	137.9	113	-142.7	74.7	0	0	0	111
1003	G	24.2	Very low	25.9	Very low	82 Å²	82	139 Å²	139	85%	0.845	77%	0.771	S	S	*	*			trans	-173.4	98.5	177	0	0	0	0	0	108.1
1004	G	26.5	Very low	25.9	Very low	65 Å²	65	141.8 Å²	141.8	67%	0.67	78%	0.783	S	S	*	*			trans	168	67	-167.8	0	0	0	0	0	116.2
1005	I	27.9	Very low	26	Very low	160 Å²	160	140.9 Å²	140.9	82%	0.821	79%	0.785	S	S	*	*			trans	72.7	105	137.1	-62.1	164.3	0	0	0	119.2
1006	S	24.5	Very low	26	Very low	97 Å²	97	142.2 Å²	142.2	68%	0.678	78%	0.783	S	S	*	*			trans	72.8	147.8	136.2	72.9	0	0	0	0	125
1007	S	26.2	Very low	26.2	Very low	92 Å²	92	138.9 Å²	138.9	64%	0.643	78%	0.777	S	S	*	*			trans	65	125.6	145.5	53.1	0	0	0	0	119.5
1008	N	28.8	Very low	26.5	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	78%	0.777	S	S	*	*			cis	-152.8	142.9	7	-85.6	-20.2	0	0	0	112.6
1009	E	26.1	Very low	26.7	Very low	163 Å²	163	143.6 Å²	143.6	76%	0.762	78%	0.784	S	S	*	*				26.3	114.7	119.4	-142.7	174.7	-124	0	0	119.7
1010	F	27.4	Very low	26.6	Very low	186 Å²	186	140.1 Å²	140.1	82%	0.816	77%	0.772	S	S	*	*				-172	-179.7	104.1	-120.9	-92.1	0	0	0	112.9
1011	D	25.6	Very low	26.8	Very low	135 Å²	135	138.9 Å²	138.9	72%	0.722	77%	0.768	S	S	*	*			trans	-130.9	150.2	-141.8	-125.5	-1.2	0	0	0	116.3
1012	V	24.7	Very low	26.7	Very low	117 Å²	117	133.9 Å²	133.9	71%	0.709	76%	0.76	S	S	*	*			trans	67.4	139.4	137.5	168.9	0	0	0	0	123.9
1013	S	24.9	Very low	26.8	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	75%	0.754	S	S	*	*			trans	83.9	107.3	152.9	-81.5	0	0	0	0	124.5
1014	D	25.7	Very low	26.8	Very low	135 Å²	135	139.6 Å²	139.6	72%	0.722	75%	0.754	S	S	*	*				65.3	115.7	112.8	-57.9	-50.8	0	0	0	124.1
1015	L	30.6	Very low	26.9	Very low	157 Å²	157	139.9 Å²	139.9	82%	0.822	76%	0.756	S	S	*	*			trans	-150.8	104.8	131.7	-135.3	70.5	0	0	0	107.2
1016	L	26.2	Very low	26.7	Very low	140 Å²	140	141.3 Å²	141.3	73%	0.733	76%	0.756	S	S	*	*				53.2	138.4	98	-60.6	164.5	0	0	0	114.1
1017	T	30.9	Very low	27	Very low	129 Å²	129	147 Å²	147	79%	0.791	76%	0.764	S	S	*	*			cis	-162.3	149.1	26.1	-26.3	0	0	0	0	112.9
1018	G	29.4	Very low	27.2	Very low	67 Å²	67	149.8 Å²	149.8	69%	0.691	77%	0.767	S	S	*	*			trans	79.5	141.1	155.3	0	0	0	0	0	117.3
1019	Y	30	Very low	27.2	Very low	244 Å²	244	151 Å²	151	96%	0.957	77%	0.769	S	S	*	*			cis	-131.8	155.4	-0.3	-109.3	-93.4	0	0	0	111.3
1020	N	24.6	Very low	27.5	Very low	123 Å²	123	148.7 Å²	148.7	66%	0.658	77%	0.767	S	S	*	*			trans	-132.1	140.5	-173.3	173.6	8.3	0	0	0	109.5	N1022	N1020-N1022 PolarHBondContact OD1-N 3.24Å; N1020-N1022 VanDerWaalsContact OD1-N 3.13Å
1021	M	28.1	Very low	27.6	Very low	161 Å²	161	148.3 Å²	148.3	79%	0.793	77%	0.768	S	S	*	*			trans	-146	84.1	159.1	-93.2	-57.8	177.2	0	0	111.9	F1023	M1021-F1023 HydrophobicContact SD-CD2 4.04Å; M1021-F1023 HydrophobicContact SD-CE2 4.26Å
1022	N	22.9	Very low	27.8	Very low	138 Å²	138	150.3 Å²	150.3	74%	0.738	77%	0.773	S	S	*	*			trans	-75.7	137.6	145.1	-93.4	-74.5	0	0	0	109.1	N1020	N1020-N1022 PolarHBondContact OD1-N 3.24Å; N1020-N1022 VanDerWaalsContact OD1-N 3.13Å
1023	F	26.8	Very low	27.9	Very low	193 Å²	193	156.4 Å²	156.4	85%	0.846	78%	0.784	S	S	*	*			trans	-117.8	125.1	162	-126.5	-83.6	0	0	0	110.2	M1021	M1021-F1023 HydrophobicContact SD-CD2 4.04Å; M1021-F1023 HydrophobicContact SD-CE2 4.26Å
1024	K	24.2	Very low	27.9	Very low	195 Å²	195	159.5 Å²	159.5	85%	0.848	79%	0.792	S	S	*	*			trans	-147.5	103.2	-173.8	-171.6	176.8	-176.4	176.5	0	111.8
1025	G	28.7	Very low	27.9	Very low	70 Å²	70	157.5 Å²	157.5	72%	0.722	79%	0.789	S	S	*	*			trans	-136.5	116	165	0	0	0	0	0	108.3
1026	K	25.5	Very low	27.6	Very low	190 Å²	190	157.1 Å²	157.1	83%	0.826	79%	0.788	S	S	*	*				79.8	98	64	-78.9	-173.1	175.1	-177.5	0	112.6
1027	Y	30.6	Very low	27.7	Very low	216 Å²	216	159.9 Å²	159.9	85%	0.847	80%	0.796	S	S	*	*			trans	-169.7	112	130.9	-86.2	-64.5	0	0	0	104.8
1028	Q	29.9	Very low	27.5	Very low	151 Å²	151	159.6 Å²	159.6	71%	0.706	80%	0.795	S	S	*	*				74.7	123.7	87.2	-170.2	165.6	-16.8	0	0	111.1
1029	Q	29.1	Very low	27.4	Very low	170 Å²	170	164.1 Å²	164.1	79%	0.794	80%	0.802	S	S	*	*			cis	-149.4	166.2	20.3	-150.3	154.4	-25.9	0	0	111.5
1030	P	31.7	Very low	27.2	Very low	114 Å²	114	159.3 Å²	159.3	74%	0.74	79%	0.792	S	S	*	*			trans	-128.2	163.4	-163.8	42.4	-29.6	0	0	0	118.2
1031	Q	30.6	Very low	27.5	Very low	179 Å²	179	160.5 Å²	160.5	84%	0.836	80%	0.804	S	S	*	*			trans	-169.6	148.8	146.6	-106.3	177.5	7.8	0	0	108.2
1032	Q	29.6	Very low	27.5	Very low	177 Å²	177	158.5 Å²	158.5	83%	0.827	81%	0.806	S	S	*	*			cis	-146.3	174.7	-7.3	-153	170.8	17.9	0	0	108.9
1033	R	26.2	Very low	27.5	Very low	244 Å²	244	160 Å²	160	92%	0.921	81%	0.811	S	S	*	*			trans	-133.8	149.8	-168	-157.9	-178.3	-166.7	-176.8	3.6	114
1034	L	23.9	Very low	28.1	Very low	157 Å²	157	155.5 Å²	155.5	82%	0.822	80%	0.801	S	S	*	*			trans	-20.9	157.9	169.3	-155.2	71.4	0	0	0	120.6
1035	S	26	Very low	28.1	Very low	93 Å²	93	151 Å²	151	65%	0.65	79%	0.794	S	S	*	*			trans	89	111.6	148.3	53.3	0	0	0	0	122
1036	N	24.2	Very low	27.9	Very low	149 Å²	149	154.5 Å²	154.5	80%	0.797	80%	0.795	S	S	*	*				38.6	128.8	129.5	-50.7	0.6	0	0	0	121.2
1037	H	29.7	Very low	27.9	Very low	197 Å²	197	152 Å²	152	91%	0.912	79%	0.791	S	S	*	*				-164.4	169.1	119.5	-104.2	-69.4	0	0	0	111.8
1038	T	25.1	Very low	27.7	Very low	123 Å²	123	146.4 Å²	146.4	76%	0.755	78%	0.784	S	S	*	*			trans	-96	134	-162.1	-47.2	0	0	0	0	114.6
1039	L	28	Very low	27.6	Very low	162 Å²	162	146.2 Å²	146.2	85%	0.848	78%	0.783	S	S	*	*			trans	-148.6	127.9	144	-84.6	115.9	0	0	0	107.1
1040	L	25.6	Very low	27.4	Very low	144 Å²	144	145.4 Å²	145.4	75%	0.754	78%	0.776	S	S	*	*			cis	92.8	87.2	47.2	-162.3	177.6	0	0	0	112.4
1041	T	30.9	Very low	27.1	Very low	147 Å²	147	147.7 Å²	147.7	90%	0.902	78%	0.779	S	S	*	*			trans	-153.9	164	146.6	42.8	0	0	0	0	109.1
1042	S	28	Very low	26.8	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	78%	0.776	S	S	*	*			trans	-118.5	154.3	-155.1	55.3	0	0	0	0	117.7
1043	M	23.7	Very low	26.7	Very low	171 Å²	171	141.8 Å²	141.8	84%	0.842	78%	0.776	S	S	*	*			trans	-56.3	-179.6	159.8	-72.4	-72.8	-173	0	0	114.1
1044	P	38.4	Very low	27	Very low	98 Å²	98	134.5 Å²	134.5	64%	0.636	77%	0.768	S	S	*	*			cis	-143.7	-170.3	-39	38.9	-21	0	0	0	114.8
1045	S	24.9	Very low	27.3	Very low	100 Å²	100	132.8 Å²	132.8	70%	0.699	77%	0.769	S	S	*	*			trans	79.9	157.2	143.3	81.4	0	0	0	0	119.2
1046	L	24.2	Very low	27.6	Very low	144 Å²	144	133.4 Å²	133.4	75%	0.754	77%	0.765	S	S	*	*			cis	-159	167.6	-0.3	-127.8	159.2	0	0	0	111
1047	N	25.7	Very low	27.9	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	77%	0.769	S	S	*	*			trans	89.4	142.9	153.9	-72	-36.1	0	0	0	125.1
1048	S	27.3	Very low	27.8	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	76%	0.757	S	S	*	*			trans	71.5	110.7	142.2	52.7	0	0	0	0	125.1
1049	E	26.6	Very low	28.1	Very low	147 Å²	147	132.8 Å²	132.8	69%	0.687	76%	0.757	S	S	*	*				78.5	117.5	121.1	-58.1	-120	108.9	0	0	124.3
1050	K	26.2	Very low	27.9	Very low	152 Å²	152	134.1 Å²	134.1	66%	0.661	76%	0.756	S	S	*	*				64	104.3	127.3	-66.6	176	-176.9	142.5	0	123.6
1051	M	24.3	Very low	28	Very low	163 Å²	163	134.9 Å²	134.9	80%	0.803	76%	0.759	S	S	*	*				94.8	125.7	102.2	-165.8	157.6	74.2	0	0	122.5
1052	S	24.7	Very low	27.8	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	75%	0.751	S	S	*	*			trans	75.4	152.1	158.7	77.2	0	0	0	0	117.8
1053	C	28	Very low	27.5	Very low	121 Å²	121	134.1 Å²	134.1	82%	0.818	75%	0.748	S	S	*	*			cis	-152.3	157.3	9.6	-149.8	0	0	0	0	114.7
1054	A	30.9	Very low	28.3	Very low	92 Å²	92	130.9 Å²	130.9	76%	0.76	74%	0.74	S	S	*	*			trans	60.4	136.6	160.5	0	0	0	0	0	121.4
1055	S	31.5	Very low	27.5	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	75%	0.751	S	S	*	*			cis	-172.7	166.3	-11.4	65.3	0	0	0	0	109.1
1056	D	30.8	Very low	27.5	Very low	106 Å²	106	138.1 Å²	138.1	57%	0.567	76%	0.756	S	S	*	*			cis	-147.5	-83.3	-22.7	164.1	78.4	0	0	0	109.6	K1058	D1056-K1058 PolarHBondContact O-N 3.08Å; D1056-K1058 WeakPolarHBondContact OD1-CE 3.46Å; D1056-K1058 IonicContact OD1-NZ 2.76Å; D1056-K1058 PolarHBondContact OD1-NZ 3.12Å; D1056-K1058 WeakPolarHBondContact OD2-CE 3.2Å; D1056-K1058 IonicContact OD2-NZ 3.79Å; D1056-K1058 PolarHBondContact OD2-NZ 2.91Å
1057	Q	31.7	Very low	27.6	Very low	187 Å²	187	137.6 Å²	137.6	87%	0.874	76%	0.758	S	S	*	*			trans	4.6	60.7	176.2	-53.9	-151.1	17	0	0	120.2
1058	K	27.6	Very low	27.6	Very low	152 Å²	152	141.7 Å²	141.7	66%	0.661	76%	0.764	S	S	*	*				26.7	159.7	109.8	-63.1	169.4	-176.5	130.6	0	119.8	D1056	D1056-K1058 PolarHBondContact O-N 3.08Å; D1056-K1058 WeakPolarHBondContact OD1-CE 3.46Å; D1056-K1058 IonicContact OD1-NZ 2.76Å; D1056-K1058 PolarHBondContact OD1-NZ 3.12Å; D1056-K1058 WeakPolarHBondContact OD2-CE 3.2Å; D1056-K1058 IonicContact OD2-NZ 3.79Å; D1056-K1058 PolarHBondContact OD2-NZ 2.91Å
1059	P	30.3	Very low	27.5	Very low	117 Å²	117	141.8 Å²	141.8	76%	0.76	75%	0.753	S	S	*	*			cis	-123.6	156.3	-6	22.2	1.8	0	0	0	113.8
1060	K	23.9	Very low	28.1	Very low	189 Å²	189	140.4 Å²	140.4	82%	0.822	75%	0.754	S	S	*	*				55.5	128.4	74.5	-89.6	-177	-179.4	-176.5	0	113.3
1061	I	29	Very low	28.4	Very low	161 Å²	161	134.4 Å²	134.4	83%	0.826	73%	0.731	S	S	*	*			cis	-150.5	177.9	36.1	-100.3	139.3	0	0	0	112.8
1062	S	25.3	Very low	28.6	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	73%	0.726	S	S	*	*			trans	-95.7	156.6	-164.9	57.7	0	0	0	0	119
1063	N	23	Very low	28.6	Very low	147 Å²	147	136 Å²	136	79%	0.786	72%	0.72	S	S	*	*			trans	-16.8	170.1	132	-72.4	-3.2	0	0	0	118.2
1064	P	39.6	Very low	28.5	Very low	103 Å²	103	136 Å²	136	67%	0.669	72%	0.716	S	S	*	*			cis	-145.4	-174.5	-26.1	37.8	-17.7	0	0	0	117.1
1065	F	22.4	Very low	28.1	Very low	198 Å²	198	136.4 Å²	136.4	87%	0.868	71%	0.713	S	S	*	*			trans	82.7	153	149.1	-93.8	-73.8	0	0	0	124.1
1066	L	24.9	Very low	28	Very low	151 Å²	151	136.9 Å²	136.9	79%	0.791	71%	0.713	S	S	*	*			trans	81.5	96.8	158.1	-76.7	163	0	0	0	123.8
1067	V	25.9	Very low	27.9	Very low	133 Å²	133	141.8 Å²	141.8	81%	0.806	73%	0.729	S	S	*	*				23.3	125.2	129.7	-175.2	0	0	0	0	121.5
1068	R	25	Very low	27.7	Very low	223 Å²	223	140.1 Å²	140.1	84%	0.842	73%	0.725	S	S	*	*			trans	-160.9	179.4	134.2	-126.7	-177	179.4	-171.4	0.3	114.6
1069	Q	26	Very low	27.7	Very low	102 Å²	102	138.6 Å²	138.6	48%	0.477	73%	0.731	S	S	.	*			trans	-91	167.1	-165.3	-54.8	152.6	-39.5	0	0	112.7	M600 F601	M600-Q1069 WeakPolarHBondContact O-CG 3.43Å; M600-Q1069 PolarHBondContact O-NE2 3.34Å; F601-Q1069 VanDerWaalsContact C-NE2 3.32Å; F601-Q1069 PolarHBondContact O-NE2 3.29Å
1070	T	37.8	Very low	27.5	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	73%	0.733	S	S	*	*			trans	-131.1	-39.6	-143.8	56.1	0	0	0	0	125.5
1071	P	32.9	Very low	27.8	Very low	26 Å²	26	137.9 Å²	137.9	17%	0.169	73%	0.733	C	S	.	*			trans	-84.5	170.3	-154.7	-14.6	32.7	0	0	0	117.5	R598	R598-P1071 HydrophobicContact CB-CB 4.22Å; R598-P1071 PolarHBondContact N-O 3.08Å; R598-P1071 WeakPolarHBondContact O-CD 3.29Å
1072	W	28.2	Very low	27.8	Very low	184 Å²	184	135 Å²	135	70%	0.697	73%	0.727	S	S	*	*			cis	-166.5	-140.3	47.7	-162	-150.2	0	0	0	116.3	R598	R598-W1072 HydrophobicContact CB-CB 3.97Å; R598-W1072 HydrophobicContact CB-CG 4.48Å
1073	L	25.9	Very low	27.9	Very low	124 Å²	124	138 Å²	138	65%	0.649	73%	0.734	S	S	*	*			trans	-61.9	170	-178	-111.8	95.7	0	0	0	115
1074	V	25.5	Very low	28.2	Very low	121 Å²	121	135.2 Å²	135.2	73%	0.733	73%	0.726	S	S	*	*			cis	-153.1	166.1	38	-175.5	0	0	0	0	111.9
1075	S	23.4	Very low	27.7	Very low	100 Å²	100	138 Å²	138	70%	0.699	74%	0.735	S	S	*	*			trans	-19.7	156	167.7	-48.4	0	0	0	0	122.6
1076	P	29	Very low	28	Very low	130 Å²	130	131.7 Å²	131.7	84%	0.844	73%	0.727	S	S	*	*			trans	-73.8	154.8	174.4	33	-37.1	0	0	0	113.7
1077	K	27.7	Very low	28.1	Very low	209 Å²	209	135 Å²	135	91%	0.909	74%	0.735	S	S	*	*			trans	-111.1	153.3	178.1	-96.9	-173.3	175.7	-178.4	0	114
1078	I	27.8	Very low	28.1	Very low	153 Å²	153	133.5 Å²	133.5	79%	0.785	73%	0.73	S	S	*	*			trans	-62.3	142.8	168.8	-62.2	159.6	0	0	0	109.9
1079	P	28.9	Very low	28.2	Very low	120 Å²	120	130.4 Å²	130.4	78%	0.779	73%	0.73	S	S	*	*			trans	-76.8	144.1	-180	31.5	-36.1	0	0	0	113.1
1080	I	25.4	Very low	28.2	Very low	157 Å²	157	133.6 Å²	133.6	81%	0.805	75%	0.745	S	S	*	*			trans	-142	125.2	168.8	-56.1	178.7	0	0	0	110
1081	T	29.1	Very low	28	Very low	133 Å²	133	132.3 Å²	132.3	82%	0.816	74%	0.738	S	S	*	*			trans	-151.8	137.2	163.7	47	0	0	0	0	107.1
1082	S	29.7	Very low	27.6	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	77%	0.766	S	S	*	*			cis	-167.4	144.7	-0.6	44.4	0	0	0	0	110.6
1083	L	27.1	Very low	27.5	Very low	164 Å²	164	137 Å²	137	86%	0.859	76%	0.763	S	S	*	*			trans	38	148.5	133.1	-104.1	61.5	0	0	0	121.2
1084	S	29.4	Very low	27.5	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	76%	0.761	S	S	*	*			cis	-163.2	159	18.5	54.8	0	0	0	0	114.5
1085	N	28.6	Very low	27.5	Very low	161 Å²	161	139.6 Å²	139.6	86%	0.861	76%	0.762	S	S	*	*			trans	35.1	138.4	145.6	-53.2	-9	0	0	0	121.7
1086	G	28.8	Very low	27.5	Very low	67 Å²	67	140.1 Å²	140.1	69%	0.691	76%	0.761	S	S	*	*			cis	158.3	171.4	-3.6	0	0	0	0	0	114
1087	K	28.2	Very low	27.3	Very low	219 Å²	219	140.4 Å²	140.4	95%	0.952	76%	0.755	S	S	*	*			trans	75.7	147.4	-177.5	-55.8	179.1	-179.5	-179.9	0	116.1
1088	S	26	Very low	27.1	Very low	103 Å²	103	137.1 Å²	137.1	72%	0.72	74%	0.743	S	S	*	*			cis	-176.3	125.8	-21.1	173.6	0	0	0	0	111.2
1089	L	27.3	Very low	26.9	Very low	158 Å²	158	138 Å²	138	83%	0.827	74%	0.743	S	S	*	*			trans	-177.9	126.7	137.5	-126.7	75.7	0	0	0	113.3
1090	E	25.3	Very low	26.6	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	75%	0.749	S	S	*	*			trans	43.9	158	132.4	-68.4	-85.9	102.9	0	0	123.6
1091	P	33.7	Very low	26.8	Very low	89 Å²	89	140.6 Å²	140.6	58%	0.578	74%	0.74	S	S	*	*			trans	-127.2	-142.3	-144.6	45.5	-29.8	0	0	0	115.3
1092	F	24.3	Very low	26.6	Very low	172 Å²	172	139.4 Å²	139.4	75%	0.754	74%	0.737	S	S	*	*			trans	81.2	140.5	-177.9	-63	-74.5	0	0	0	115.3
1093	Q	27.1	Very low	26.8	Very low	137 Å²	137	139.9 Å²	139.9	64%	0.64	74%	0.737	S	S	*	*			cis	-151.9	144	-6.4	-157	144.3	-10.4	0	0	110.1
1094	E	25.4	Very low	26.8	Very low	129 Å²	129	137.3 Å²	137.3	60%	0.603	73%	0.725	S	S	*	*				34.7	137.9	127.6	-127.1	163.9	-164.7	0	0	119.1
1095	F	26	Very low	26.7	Very low	170 Å²	170	135.4 Å²	135.4	75%	0.746	71%	0.709	S	S	*	*				-152	161.4	51	-102.5	-86.3	0	0	0	115.7
1096	T	23.8	Very low	26.6	Very low	112 Å²	112	131.2 Å²	131.2	69%	0.687	69%	0.693	S	S	*	*			trans	-71.1	-179.7	160.6	39.7	0	0	0	0	112
1097	L	24.1	Very low	26.6	Very low	136 Å²	136	133 Å²	133	71%	0.712	69%	0.686	S	S	*	*			cis	-162.8	149.9	26.9	-162	71.7	0	0	0	112
1098	E	23.7	Very low	26.7	Very low	140 Å²	140	131.2 Å²	131.2	65%	0.654	68%	0.681	S	S	*	*			trans	44.5	140.3	147.7	-76.5	-172.1	115.4	0	0	128.8
1099	Q	23.2	Very low	26.9	Very low	171 Å²	171	133.9 Å²	133.9	80%	0.799	68%	0.682	S	S	*	*			trans	85.1	169.2	135.8	-74.6	-176	41.7	0	0	122.8
1100	R	22.4	Very low	26.9	Very low	236 Å²	236	132.9 Å²	132.9	89%	0.891	68%	0.678	S	S	*	*			trans	-110.5	179.5	-152.7	-99.7	-173.5	174	149.9	-5.4	112.1
1101	P	30.4	Very low	27	Very low	95 Å²	95	130.4 Å²	130.4	62%	0.617	68%	0.679	S	S	*	*			cis	-143.3	151.4	-33.1	36.7	-18.7	0	0	0	116.3
1102	S	23.9	Very low	26.7	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	70%	0.697	S	S	*	*			trans	56.2	175.7	148.5	61.6	0	0	0	0	119.9
1103	P	34.8	Very low	26.7	Very low	111 Å²	111	130.5 Å²	130.5	72%	0.721	70%	0.702	S	S	*	*			cis	-106.4	-160	-26.8	9.4	16.4	0	0	0	108.7
1104	D	26.2	Very low	26.7	Very low	110 Å²	110	128.8 Å²	128.8	59%	0.588	71%	0.711	S	S	*	*			cis	-158.9	-177.4	-19.8	-120.1	-54.6	0	0	0	105.9
1105	T	27.5	Very low	26.8	Very low	49 Å²	49	131.5 Å²	131.5	30%	0.301	73%	0.726	S	S	.	*			cis	-150.2	172.5	-5.2	13.5	0	0	0	0	103.9
1106	S	27	Very low	27	Very low	73 Å²	73	132.4 Å²	132.4	51%	0.51	73%	0.732	S	S	.	*			cis	-163.7	-156.4	-15.9	51.1	0	0	0	0	103.4
1107	D	28.6	Very low	27.2	Very low	104 Å²	104	132.9 Å²	132.9	56%	0.556	73%	0.727	S	S	*	*			cis	-153.3	153.4	-5.2	172.8	97.8	0	0	0	104.9
1108	Q	30.5	Very low	27.5	Very low	182 Å²	182	132 Å²	132	85%	0.85	73%	0.729	S	S	*	*			trans	-151.2	151.7	166.7	-146.2	174.4	50.8	0	0	113.1
1109	Q	29.2	Very low	27.5	Very low	159 Å²	159	133.8 Å²	133.8	74%	0.743	74%	0.738	S	S	*	*			trans	-86.4	149.5	-175.4	-68.2	-176.3	-18.1	0	0	114.9
1110	N	28	Very low	27.7	Very low	138 Å²	138	130.4 Å²	130.4	74%	0.738	73%	0.733	S	S	*	*			trans	54.1	102	146.5	-60.4	-20.5	0	0	0	119.3
1111	S	28.1	Very low	27.9	Very low	117 Å²	117	126.1 Å²	126.1	82%	0.818	73%	0.727	S	S	*	*				163.7	118.9	110.7	-72.2	0	0	0	0	112.1
1112	C	26.6	Very low	27.8	Very low	140 Å²	140	131.3 Å²	131.3	95%	0.946	73%	0.734	S	S	*	*			trans	-147.5	98.3	168.7	-92.8	0	0	0	0	111.2
1113	S	23.5	Very low	27.8	Very low	122 Å²	122	136 Å²	136	85%	0.853	74%	0.741	S	S	*	*			trans	-148	53.1	176.1	63.8	0	0	0	0	111.3
1114	A	27.2	Very low	27.4	Very low	101 Å²	101	136 Å²	136	84%	0.835	74%	0.74	S	S	*	*			trans	-157.6	101.7	173.9	0	0	0	0	0	111.1
1115	M	28.4	Very low	27.3	Very low	186 Å²	186	138.1 Å²	138.1	92%	0.916	75%	0.751	S	S	*	*			trans	-151.5	84.9	154.1	-171.1	146.7	67.7	0	0	108.5
1116	E	29.7	Very low	27.1	Very low	189 Å²	189	142.7 Å²	142.7	88%	0.883	77%	0.773	S	S	*	*			trans	-68.5	159.9	172.7	-74.8	178.4	109.9	0	0	111.6
1117	E	29.1	Very low	27.1	Very low	122 Å²	122	149 Å²	149	57%	0.57	79%	0.792	S	S	*	*			trans	-67.2	145.2	174.6	-58.9	-175.6	121.9	0	0	110.7	K240 E1119	K240-E1117 WeakPolarHBondContact CE-OE1 3.43Å; K240-E1117 IonicContact NZ-OE1 3.78Å; K240-E1117 PolarHBondContact NZ-OE1 3.34Å; E1117-E1119 HydrophobicContact CB-CG 4.45Å; E1117-E1119 PolarHBondContact O-N 3.02Å
1118	P	28.5	Very low	27	Very low	118 Å²	118	150 Å²	150	77%	0.766	80%	0.802	S	S	*	*			trans	-75.6	61.3	176.8	31.8	-35.8	0	0	0	112.4	S1120	P1118-S1120 PolarHBondContact O-N 3.46Å
1119	E	25.4	Very low	26.9	Very low	177 Å²	177	148.7 Å²	148.7	83%	0.827	80%	0.801	S	S	*	*			trans	-74	50	169.9	-70.9	-134.1	119.9	0	0	112.1	E1117	E1117-E1119 HydrophobicContact CB-CG 4.45Å; E1117-E1119 PolarHBondContact O-N 3.02Å
1120	S	26.1	Very low	26.6	Very low	101 Å²	101	148 Å²	148	71%	0.706	81%	0.807	S	S	*	*			trans	-136.5	33.2	-171.8	56.6	0	0	0	0	114	P1118	P1118-S1120 PolarHBondContact O-N 3.46Å
1121	L	27.3	Very low	26.5	Very low	145 Å²	145	147 Å²	147	76%	0.759	81%	0.811	S	S	*	*	S	Bend	trans	-122.1	6	179.7	-113.9	169.4	0	0	0	116.4
1122	W	28	Very low	26.5	Very low	204 Å²	204	145.2 Å²	145.2	77%	0.773	80%	0.803	S	S	*	*			trans	-142.5	55.3	170.9	-63.9	100	0	0	0	113
1123	K	23.7	Very low	26.5	Very low	207 Å²	207	144.6 Å²	144.6	90%	0.9	80%	0.795	S	S	*	*			trans	-102.9	117.7	151.5	-81.9	-174.2	175.6	178	0	107.9
1124	T	26.5	Very low	26.7	Very low	113 Å²	113	146.6 Å²	146.6	69%	0.693	79%	0.789	S	S	*	*			trans	-137.4	75.1	177.7	54.7	0	0	0	0	110.9
1125	D	23.4	Very low	26.6	Very low	154 Å²	154	146.9 Å²	146.9	82%	0.824	78%	0.776	S	S	*	*			trans	-141.3	131.8	151.4	-65.8	-58.1	0	0	0	103.9
1126	D	24.3	Very low	26.5	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	78%	0.775	S	S	*	*			cis	-114.5	161.9	6.2	-68	-65.8	0	0	0	113.2
1127	F	27.1	Very low	26.6	Very low	206 Å²	206	145.1 Å²	145.1	90%	0.904	77%	0.772	S	S	*	*			trans	-142.8	96.8	161.8	-117.2	-70.4	0	0	0	111.2
1128	T	26.9	Very low	26.9	Very low	125 Å²	125	144.5 Å²	144.5	77%	0.767	78%	0.778	S	S	*	*			trans	-95.1	106	172.3	32.5	0	0	0	0	111.7
1129	N	27.5	Very low	26.8	Very low	155 Å²	155	144.9 Å²	144.9	83%	0.829	78%	0.778	S	S	*	*			trans	50.4	130.3	151.1	-63.4	-19.3	0	0	0	121.6
1130	V	22.7	Very low	27	Very low	145 Å²	145	142.7 Å²	142.7	88%	0.879	78%	0.777	S	S	*	*			trans	-118.6	130	160.5	172.1	0	0	0	0	109.5
1131	S	26.3	Very low	27	Very low	115 Å²	115	146.4 Å²	146.4	80%	0.804	78%	0.783	S	S	*	*			trans	-159.2	153.8	156.5	57.5	0	0	0	0	110.4
1132	A	29.1	Very low	27.6	Very low	81 Å²	81	144.9 Å²	144.9	67%	0.669	78%	0.782	S	S	*	*			cis	158.4	81.3	-28.7	0	0	0	0	0	108.3
1133	T	25.6	Very low	27.6	Very low	126 Å²	126	141.7 Å²	141.7	77%	0.773	78%	0.78	S	S	*	*			trans	46.6	116.7	140.5	58.6	0	0	0	0	122.3
1134	K	27.2	Very low	27.8	Very low	165 Å²	165	139.3 Å²	139.3	72%	0.717	77%	0.774	S	S	*	*				97.3	139.1	115.7	-87.1	-176.2	142.6	-80.8	0	124.5
1135	D	25.4	Very low	27.7	Very low	107 Å²	107	140.4 Å²	140.4	57%	0.572	78%	0.775	S	S	*	*			trans	72.1	104.2	140.3	-58.4	-9.8	0	0	0	122.7
1136	K	27.1	Very low	27.9	Very low	205 Å²	205	139.6 Å²	139.6	89%	0.891	78%	0.775	S	S	*	*				172.1	157.5	111.7	-90.4	155.4	-172.6	173.1	0	115.7
1137	T	30.9	Very low	28	Very low	133 Å²	133	135.7 Å²	135.7	82%	0.816	77%	0.769	S	S	*	*			trans	-135.3	-178.5	175.6	56.9	0	0	0	0	108
1138	P	36.7	Very low	27.9	Very low	109 Å²	109	131.4 Å²	131.4	71%	0.708	76%	0.764	S	S	*	*			cis	-151.4	-155.2	29.1	39.9	-13	0	0	0	117.6
1139	V	26.5	Very low	27.9	Very low	126 Å²	126	132.3 Å²	132.3	76%	0.764	76%	0.763	S	S	*	*			trans	81.1	132	171.3	-160.1	0	0	0	0	113.9
1140	T	28.8	Very low	27.8	Very low	130 Å²	130	132.2 Å²	132.2	80%	0.798	76%	0.758	S	S	*	*			cis	-141.6	162.3	35.5	-35.3	0	0	0	0	113.7
1141	H	26.6	Very low	28.1	Very low	179 Å²	179	131.2 Å²	131.2	83%	0.829	75%	0.748	S	S	*	*			trans	-125.6	155.7	175.4	-84.8	-75.7	0	0	0	111.2
1142	P	38.5	Very low	28	Very low	114 Å²	114	129.8 Å²	129.8	74%	0.74	74%	0.738	S	S	*	*				-137.5	-176.7	84.3	40.7	-24.6	0	0	0	112.4
1143	N	29.4	Very low	28	Very low	137 Å²	137	133.4 Å²	133.4	73%	0.733	74%	0.74	S	S	*	*			cis	-156.5	150.9	9.4	-143.9	1.2	0	0	0	112.3
1144	M	26.9	Very low	28.2	Very low	156 Å²	156	134 Å²	134	77%	0.768	74%	0.737	S	S	*	*			trans	58.5	166.5	156.7	-66.8	-168	72.2	0	0	121.6
1145	L	25.2	Very low	28.1	Very low	137 Å²	137	132 Å²	132	72%	0.717	74%	0.739	S	S	*	*				-172.1	148.3	-54.4	-119.6	171.3	0	0	0	111
1146	V	27.6	Very low	28.3	Very low	136 Å²	136	131.8 Å²	131.8	82%	0.824	75%	0.746	S	S	*	*			trans	69.8	144	164.4	-172.5	0	0	0	0	119.2
1147	G	26.9	Very low	28.2	Very low	63 Å²	63	129.4 Å²	129.4	65%	0.649	74%	0.743	S	S	*	*			trans	100	111.9	161.1	0	0	0	0	0	113.8
1148	S	23.7	Very low	28.4	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	74%	0.739	S	S	*	*			cis	83.6	143.5	36.9	-54.5	0	0	0	0	115.1
1149	I	28.2	Very low	27.9	Very low	144 Å²	144	131.4 Å²	131.4	74%	0.738	75%	0.749	S	S	*	*			trans	81.6	100.7	160	-68.2	163.3	0	0	0	118.1
1150	E	25.3	Very low	28.1	Very low	153 Å²	153	133.1 Å²	133.1	72%	0.715	75%	0.753	S	S	*	*				64.8	162.5	126.4	-55.4	-175.4	173.4	0	0	124.8
1151	N	27.6	Very low	28.1	Very low	125 Å²	125	136.3 Å²	136.3	67%	0.668	76%	0.756	S	S	*	*			trans	73.8	99.6	142.8	-66.2	-24.5	0	0	0	122.7
1152	S	25.2	Very low	28.4	Very low	85 Å²	85	133 Å²	133	59%	0.594	75%	0.753	S	S	*	*				77.9	165.7	111.7	76.4	0	0	0	0	122
1153	H	29.6	Very low	27.9	Very low	156 Å²	156	136.2 Å²	136.2	72%	0.722	76%	0.758	S	S	*	*			trans	65.6	118.6	179.2	-51.7	-68.8	0	0	0	116.2
1154	I	28	Very low	27.9	Very low	139 Å²	139	138 Å²	138	71%	0.713	76%	0.761	S	S	*	*				73.7	106.5	54.2	-61.8	172.1	0	0	0	111.9
1155	T	27	Very low	27.9	Very low	122 Å²	122	138.9 Å²	138.9	75%	0.748	76%	0.764	S	S	*	*			trans	26.7	128.2	152.2	69.8	0	0	0	0	118.1
1156	S	27.9	Very low	28.1	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	76%	0.764	S	S	*	*				174.2	154.7	56.4	44.5	0	0	0	0	111.9
1157	N	26	Very low	28.2	Very low	156 Å²	156	134.4 Å²	134.4	83%	0.834	76%	0.761	S	S	*	*			trans	59.1	166.1	149	-88.3	2.4	0	0	0	119.5
1158	P	34.8	Very low	28.3	Very low	111 Å²	111	136.3 Å²	136.3	72%	0.721	76%	0.764	S	S	*	*			trans	-82.2	149.9	-169.1	31.7	-36.1	0	0	0	113.1
1159	N	26.2	Very low	28.7	Very low	172 Å²	172	140.3 Å²	140.3	92%	0.92	77%	0.767	S	S	*	*			trans	-141.8	155.1	130.5	-112.4	-30.8	0	0	0	110.9
1160	L	29.9	Very low	29.3	Very low	162 Å²	162	138.9 Å²	138.9	85%	0.848	77%	0.767	S	S	*	*			trans	-97.1	148.3	-169.1	-145.1	75.6	0	0	0	110.8
1161	F	29.8	Very low	29.5	Very low	198 Å²	198	139.1 Å²	139.1	87%	0.868	77%	0.766	S	S	*	*			trans	-69.5	146.4	150.5	-77.9	-101.1	0	0	0	107.8
1162	S	31.9	Very low	29.7	Very low	108 Å²	108	139.8 Å²	139.8	76%	0.755	77%	0.765	S	S	*	*			cis	-144.7	161.4	15.2	50.6	0	0	0	0	112.2
1163	H	28.2	Very low	29.9	Very low	183 Å²	183	143.9 Å²	143.9	85%	0.847	78%	0.778	S	S	*	*			trans	-66.6	141.6	174.7	-90.3	-84.7	0	0	0	113.9
1164	Q	30.4	Very low	29.9	Very low	174 Å²	174	146.3 Å²	146.3	81%	0.813	78%	0.781	S	S	*	*				-147	176.5	118.1	-127.4	170.4	-18	0	0	110.5
1165	E	27.4	Very low	29.9	Very low	175 Å²	175	148.6 Å²	148.6	82%	0.818	79%	0.786	S	S	*	*			trans	-89.1	171.3	-155.3	-60.1	138.3	110.4	0	0	115.5
1166	G	28.4	Very low	30.1	Very low	69 Å²	69	148.5 Å²	148.5	71%	0.711	79%	0.785	S	S	*	*			trans	136.4	61.8	157.7	0	0	0	0	0	120.3
1167	S	29.1	Very low	30.2	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	79%	0.786	S	S	*	*			trans	35.4	134.5	144.1	59.5	0	0	0	0	124.2
1168	S	30.4	Very low	30.4	Very low	103 Å²	103	150.1 Å²	150.1	72%	0.72	79%	0.785	S	S	*	*			trans	67.1	134	151	44.6	0	0	0	0	119.8
1169	K	31.5	Very low	30.2	Very low	199 Å²	199	152.5 Å²	152.5	87%	0.865	79%	0.786	S	S	*	*			cis	70.4	158.1	40.9	-67.5	-173.6	177.2	176.3	0	114.1
1170	P	39.9	Very low	30.4	Very low	114 Å²	114	150 Å²	150	74%	0.74	77%	0.772	S	S	*	*			cis	-96.1	-144	-2.6	41.8	-37.2	0	0	0	111.5
1171	K	30.9	Very low	30.4	Very low	159 Å²	159	148.1 Å²	148.1	69%	0.691	76%	0.763	S	S	*	*			cis	-155.9	162.5	-3.1	-113.6	-150.2	-172.5	-72.9	0	105.5
1172	E	30.9	Very low	30.4	Very low	139 Å²	139	145.1 Å²	145.1	65%	0.65	76%	0.756	S	S	*	*			cis	-170.5	-146.8	-23.2	-151.9	161.3	-99.1	0	0	109.4
1173	I	30.8	Very low	30.2	Very low	170 Å²	170	146.3 Å²	146.3	87%	0.872	75%	0.753	S	S	*	*			trans	72.6	145.3	174.1	-64.8	178	0	0	0	115.9
1174	R	28.4	Very low	30	Very low	208 Å²	208	145 Å²	145	79%	0.785	75%	0.748	S	S	*	*			trans	-172.1	116	-135.1	-162.9	173.8	-169.1	-168.8	5.6	113.6
1175	K	28.3	Very low	29.9	Very low	186 Å²	186	142.6 Å²	142.6	81%	0.809	74%	0.744	S	S	*	*			trans	74.1	171	169.2	-50	168.8	176.7	-174.4	0	114.4
1176	T	31.4	Very low	30	Very low	120 Å²	120	140.9 Å²	140.9	74%	0.736	74%	0.739	S	S	*	*			cis	-148.8	140.3	23.1	50	0	0	0	0	116.9
1177	S	29.1	Very low	30.1	Very low	105 Å²	105	144 Å²	144	73%	0.734	74%	0.738	S	S	*	*			trans	34.1	135.5	141.9	66.9	0	0	0	0	124.6
1178	K	30.7	Very low	30	Very low	188 Å²	188	145.4 Å²	145.4	82%	0.817	74%	0.737	S	S	*	*				-173.5	141.1	105.1	-105.5	-177.2	178.2	-177.4	0	114.9
1179	H	31.2	Very low	29.9	Very low	161 Å²	161	149.9 Å²	149.9	75%	0.745	74%	0.744	S	S	*	*			trans	59.7	149.4	157.1	-87.5	-120.6	0	0	0	121.9
1180	L	30.8	Very low	30.2	Very low	121 Å²	121	145.5 Å²	145.5	63%	0.634	74%	0.736	S	S	*	*			cis	-168.8	166.5	-38.2	-145	70	0	0	0	111
1181	N	29.2	Very low	29.5	Very low	122 Å²	122	148.3 Å²	148.3	65%	0.652	74%	0.739	S	S	*	*			trans	74.7	118.9	164	-63.5	-15.1	0	0	0	117.2
1182	N	29.5	Very low	29.1	Very low	134 Å²	134	146.2 Å²	146.2	72%	0.717	74%	0.739	S	S	*	*				88.1	134.9	50.2	-67.5	9.7	0	0	0	111.5
1183	L	27.6	Very low	28.8	Very low	134 Å²	134	148.5 Å²	148.5	70%	0.702	75%	0.747	S	S	*	*			cis	-149.4	158.2	0.5	-149.9	74.1	0	0	0	112.4
1184	E	25	Very low	28.8	Very low	156 Å²	156	146.7 Å²	146.7	73%	0.729	74%	0.744	S	S	*	*			trans	-9.4	165	164.1	-63	171.9	113.3	0	0	124.4
1185	V	28.4	Very low	28.7	Very low	122 Å²	122	142.7 Å²	142.7	74%	0.739	74%	0.742	S	S	*	*				112.2	133.4	127.6	119.1	0	0	0	0	119.7
1186	I	28	Very low	29.1	Very low	140 Å²	140	139.9 Å²	139.9	72%	0.718	74%	0.743	S	S	*	*			trans	86	113	153.7	-82.9	174.3	0	0	0	122.8
1187	I	30.6	Very low	28.8	Very low	134 Å²	134	137.4 Å²	137.4	69%	0.687	74%	0.741	S	S	*	*			trans	76.4	120	134.6	-64.5	-179.3	0	0	0	123.5
1188	N	27.4	Very low	28.6	Very low	138 Å²	138	141.5 Å²	141.5	74%	0.738	75%	0.748	S	S	*	*			trans	32.4	129.6	139.4	-50.7	-16.2	0	0	0	124.1
1189	K	27.9	Very low	28.3	Very low	197 Å²	197	136.9 Å²	136.9	86%	0.857	74%	0.74	S	S	*	*				25.2	149.1	102.3	-116.1	-167.8	179.4	-176.8	0	118.8
1190	P	38.8	Very low	28.2	Very low	108 Å²	108	137.5 Å²	137.5	70%	0.701	74%	0.741	S	S	*	*				-129.2	-149.6	-80.5	41.4	-24.2	0	0	0	111.3
1191	E	24.1	Very low	28	Very low	173 Å²	173	138 Å²	138	81%	0.808	74%	0.739	S	S	*	*			trans	86.2	128.3	163.6	-80.7	-162.9	135.1	0	0	121.9
1192	V	24	Very low	27.8	Very low	114 Å²	114	141 Å²	141	69%	0.691	74%	0.742	S	S	*	*			trans	75.6	140.3	134.8	175.2	0	0	0	0	121.4
1193	K	23.7	Very low	27.8	Very low	188 Å²	188	139.6 Å²	139.6	82%	0.817	74%	0.742	S	S	*	*			trans	-11.2	147.4	156.9	-54.6	174.3	-179.6	177.5	0	115.9
1194	V	30.1	Very low	27.9	Very low	132 Å²	132	139.3 Å²	139.3	80%	0.8	74%	0.741	S	S	*	*				-159.1	156.5	72.9	149	0	0	0	0	113.3
1195	T	26.3	Very low	28.3	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	74%	0.739	S	S	*	*			trans	-69.2	-166.9	171.5	49.7	0	0	0	0	112.6
1196	P	37	Very low	28.2	Very low	128 Å²	128	140.3 Å²	140.3	83%	0.831	74%	0.742	S	S	*	*			cis	-126.5	-156.1	-12.9	39.5	-19.9	0	0	0	111.9
1197	G	24.9	Very low	28.2	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	74%	0.739	S	S	*	*			trans	105.8	100.1	167.5	0	0	0	0	0	113
1198	H	25.5	Very low	28	Very low	191 Å²	191	139.6 Å²	139.6	88%	0.884	75%	0.745	S	S	*	*				64.3	122.8	56.8	-104.7	-82.9	0	0	0	115.5
1199	S	23.7	Very low	28.1	Very low	92 Å²	92	140.6 Å²	140.6	64%	0.643	75%	0.745	S	S	*	*			trans	66.7	150.1	177.1	75.9	0	0	0	0	115.8
1200	F	29.1	Very low	28	Very low	173 Å²	173	135.4 Å²	135.4	76%	0.759	73%	0.734	S	S	*	*			cis	-109.1	146.9	4	-87.3	-115.2	0	0	0	112.4
1201	H	26.7	Very low	27.4	Very low	131 Å²	131	137.6 Å²	137.6	61%	0.606	74%	0.74	S	S	*	*			cis	91.3	124.3	24.6	176.3	-101.5	0	0	0	114.8
1202	R	25.6	Very low	27.4	Very low	187 Å²	187	139.7 Å²	139.7	71%	0.706	74%	0.74	S	S	*	*			trans	61.1	164.6	176.3	-64.9	178.7	-178	153.5	5.7	113.6
1203	S	29.1	Very low	27.5	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	74%	0.744	S	S	*	*			cis	-154.7	165.2	10.7	-17.1	0	0	0	0	108.3
1204	L	30.1	Very low	27.6	Very low	128 Å²	128	138.8 Å²	138.8	67%	0.67	74%	0.736	S	S	*	*			cis	-164.8	154.4	-9.6	-122.8	166	0	0	0	106.7
1205	Q	33.1	Very low	27.6	Very low	146 Å²	146	139.7 Å²	139.7	68%	0.682	74%	0.736	S	S	*	*			trans	63.7	135	162	-76.2	146.9	-37.5	0	0	116
1206	N	26.3	Very low	27.8	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	73%	0.734	S	S	*	*				60.4	126.8	59.5	-53.3	-8.7	0	0	0	110.6
1207	S	28	Very low	27.3	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	73%	0.733	S	S	*	*			cis	-160.6	158.3	8.2	56.1	0	0	0	0	110.4
1208	M	27.2	Very low	27.6	Very low	166 Å²	166	143.1 Å²	143.1	82%	0.818	74%	0.737	S	S	*	*			trans	67.1	150.6	168.2	-58.1	-166.8	-171.4	0	0	114
1209	H	29	Very low	27.7	Very low	158 Å²	158	144.9 Å²	144.9	73%	0.731	74%	0.737	S	S	*	*			cis	-151.9	156.9	11.8	-141.1	53.5	0	0	0	109.4
1210	S	26	Very low	27.8	Very low	88 Å²	88	144.3 Å²	144.3	62%	0.615	74%	0.738	S	S	*	*			trans	42.4	127.6	153.7	67.1	0	0	0	0	122.7
1211	N	25.4	Very low	27.7	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	74%	0.741	S	S	*	*			trans	82.7	139.3	139.9	-66.6	-32.5	0	0	0	122.8
1212	R	25.2	Very low	27.6	Very low	217 Å²	217	146.6 Å²	146.6	82%	0.819	76%	0.755	S	S	*	*			trans	96.2	112.6	148.1	-70.7	-144.8	170.4	141.3	-1.6	122.5
1213	F	24.5	Very low	27.6	Very low	174 Å²	174	142.6 Å²	142.6	76%	0.763	76%	0.756	S	S	*	*				64.3	124.1	128	-80	-112.8	0	0	0	121.5
1214	V	27	Very low	27.4	Very low	108 Å²	108	142.6 Å²	142.6	66%	0.655	76%	0.755	S	S	*	*			trans	69.9	115.6	134.9	175.6	0	0	0	0	118.7
1215	N	30.4	Very low	27.3	Very low	151 Å²	151	142.3 Å²	142.3	81%	0.807	75%	0.753	S	S	*	*				-153.2	178.3	107.5	-127.8	-38.4	0	0	0	115.3
1216	K	29.9	Very low	26.9	Very low	164 Å²	164	140.5 Å²	140.5	71%	0.713	75%	0.748	S	S	*	*			trans	-106.3	146.2	-155.2	-68	170.4	179.6	172.2	0	115.6
1217	N	27.5	Very low	26.9	Very low	152 Å²	152	140 Å²	140	81%	0.813	75%	0.745	S	S	*	*			trans	52.3	125.2	134.6	-53.3	7.3	0	0	0	121.2
1218	G	30	Very low	26.8	Very low	74 Å²	74	144.7 Å²	144.7	76%	0.763	75%	0.748	S	S	*	*			trans	-164.3	112.2	161.9	0	0	0	0	0	113.6
1219	Y	26.9	Very low	26.8	Very low	228 Å²	228	141.5 Å²	141.5	89%	0.894	74%	0.738	S	S	*	*			trans	-54.3	159.3	176.6	-61.3	-89.9	0	0	0	114.9
1220	A	26	Very low	26.7	Very low	80 Å²	80	140.3 Å²	140.3	66%	0.661	74%	0.742	S	S	*	*			cis	-177.5	156.1	-16.7	0	0	0	0	0	110.4
1221	S	27.3	Very low	26.6	Very low	118 Å²	118	145.1 Å²	145.1	83%	0.825	75%	0.752	S	S	*	*			trans	-178.5	128.4	148.1	-88.1	0	0	0	0	115.9
1222	R	25.9	Very low	26.9	Very low	234 Å²	234	140.7 Å²	140.7	88%	0.883	74%	0.743	S	S	*	*			trans	47.4	133.4	146.1	-70.6	-175.9	165.5	-178.4	-4.9	124.2
1223	S	24.5	Very low	27.4	Very low	104 Å²	104	135.7 Å²	135.7	73%	0.727	74%	0.738	S	S	*	*			trans	75.4	123.1	141.4	49.3	0	0	0	0	122.9
1224	S	25.5	Very low	27.6	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	74%	0.736	S	S	*	*			trans	54.6	129.9	146.4	58.5	0	0	0	0	121.1
1225	I	27.2	Very low	27.6	Very low	123 Å²	123	135.9 Å²	135.9	63%	0.631	74%	0.735	S	S	*	*				-177.6	163.7	121.4	-97.2	161.2	0	0	0	113.6
1226	D	25.6	Very low	27.5	Very low	108 Å²	108	137.4 Å²	137.4	58%	0.578	73%	0.734	S	S	*	*			trans	-41.8	177	-164.9	-63.1	-73.4	0	0	0	124.6
1227	L	25.5	Very low	27.3	Very low	142 Å²	142	135.6 Å²	135.6	74%	0.743	73%	0.732	S	S	*	*			trans	-98	136.6	169.2	-105	168	0	0	0	111.4
1228	R	25.9	Very low	27.8	Very low	191 Å²	191	133.9 Å²	133.9	72%	0.721	73%	0.729	S	S	*	*			trans	90.2	96.9	152.7	-67.3	-167.2	175.4	-161.5	-0.1	122.2
1229	T	27.4	Very low	28.2	Very low	100 Å²	100	135.3 Å²	135.3	61%	0.613	73%	0.725	S	S	*	*				85	150.9	116	58.6	0	0	0	0	122.3
1230	V	26.7	Very low	28.3	Very low	133 Å²	133	130.8 Å²	130.8	81%	0.806	72%	0.716	S	S	*	*			trans	82	77.2	167.7	-161.1	0	0	0	0	115.7
1231	F	25.4	Very low	28.5	Very low	188 Å²	188	132.8 Å²	132.8	83%	0.825	72%	0.721	S	S	*	*			trans	-111.8	130.2	145.8	-102.1	-74	0	0	0	110.9
1232	G	30.9	Very low	28.4	Very low	62 Å²	62	134.6 Å²	134.6	64%	0.639	72%	0.721	S	S	*	*			trans	-171.3	157.6	170.3	0	0	0	0	0	106.6
1233	P	36.5	Very low	28.6	Very low	112 Å²	112	131.3 Å²	131.3	73%	0.727	72%	0.72	S	S	*	*			cis	-139.4	169.1	36.3	41.6	-25.1	0	0	0	116.9
1234	E	26.9	Very low	28.6	Very low	153 Å²	153	135 Å²	135	72%	0.715	72%	0.723	S	S	*	*			trans	64.5	158.1	140.1	-78.5	178.4	-164	0	0	121.4
1235	Q	27	Very low	28.5	Very low	133 Å²	133	134.2 Å²	134.2	62%	0.621	72%	0.718	S	S	*	*			cis	-146.5	157.3	7.1	-132.1	168.8	62.2	0	0	107.1
1236	K	28.4	Very low	28.5	Very low	183 Å²	183	135.6 Å²	135.6	80%	0.796	73%	0.727	S	S	*	*			cis	-157.3	131.8	46.1	-63.7	177.1	178.5	179.5	0	114.3
1237	N	26.9	Very low	28.4	Very low	127 Å²	127	141.7 Å²	141.7	68%	0.679	74%	0.744	S	S	*	*			trans	-13.2	174.5	138.1	-45.9	-19.7	0	0	0	119.3
1238	P	37.3	Very low	28.3	Very low	115 Å²	115	145.5 Å²	145.5	75%	0.747	75%	0.748	S	S	*	*				-137.5	-140.5	-57.5	44.1	-25.4	0	0	0	108.7
1239	P	37.9	Very low	28.2	Very low	105 Å²	105	142.2 Å²	142.2	68%	0.682	74%	0.744	S	S	*	*			cis	-112.9	-159	-32.5	35.5	-14.1	0	0	0	110.4
1240	D	29.5	Very low	28.3	Very low	132 Å²	132	145.6 Å²	145.6	71%	0.706	76%	0.756	S	S	*	*			cis	-167.9	166.1	27.3	-142.8	-22.8	0	0	0	116.3
1241	T	31.4	Very low	28.2	Very low	123 Å²	123	145.9 Å²	145.9	76%	0.755	75%	0.748	S	S	*	*			trans	69.2	153.7	161.8	62	0	0	0	0	122.3
1242	N	24.3	Very low	28.2	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	74%	0.744	S	S	*	*			trans	-122.6	150.9	-178.6	-53.8	-94.6	0	0	0	110.6
1243	L	30.2	Very low	28.2	Very low	164 Å²	164	144.4 Å²	144.4	86%	0.859	74%	0.74	S	S	*	*			trans	-164.1	141.5	136.2	-133.2	69.6	0	0	0	115.8
1244	F	25.1	Very low	27.9	Very low	181 Å²	181	148.2 Å²	148.2	79%	0.794	75%	0.746	S	S	*	*			trans	2.4	143.4	155.8	-82.6	-107.1	0	0	0	123.9
1245	S	23.1	Very low	28	Very low	88 Å²	88	151.6 Å²	151.6	62%	0.615	75%	0.752	S	S	*	*			trans	50	119.8	143.3	66	0	0	0	0	119.3
1246	N	26.1	Very low	27.9	Very low	151 Å²	151	150.2 Å²	150.2	81%	0.807	76%	0.757	S	S	*	*				-173.6	152.9	75.8	-92.8	-57.4	0	0	0	112.9
1247	Y	23.1	Very low	27.9	Very low	237 Å²	237	152.4 Å²	152.4	93%	0.929	76%	0.76	S	S	*	*			trans	-76.5	137.9	151.9	-97.7	-103.6	0	0	0	109.2
1248	R	24	Very low	28.1	Very low	221 Å²	221	153 Å²	153	83%	0.834	77%	0.768	S	S	*	*				147.5	106.1	129.9	-168.7	171.4	-163.6	147.7	2.7	115.6
1249	I	25.1	Very low	27.5	Very low	123 Å²	123	157.1 Å²	157.1	63%	0.631	77%	0.774	S	S	*	*			trans	47.1	108.4	139.9	-48.1	168.8	0	0	0	119.6	H1251	I1249-H1251 HydrophobicContact CG2-CB 4.34Å
1250	I	27.7	Very low	27	Very low	170 Å²	170	162 Å²	162	87%	0.872	79%	0.785	S	S	*	*			trans	-140.5	104	132.8	-55.6	-178.2	0	0	0	105
1251	H	25.3	Very low	27	Very low	140 Å²	140	160 Å²	160	65%	0.648	79%	0.786	S	S	*	*				70.7	133.1	64.7	-129.5	-67.7	0	0	0	115.3	I1249	I1249-H1251 HydrophobicContact CG2-CB 4.34Å
1252	N	26.3	Very low	26.9	Very low	139 Å²	139	161.5 Å²	161.5	74%	0.743	79%	0.789	S	S	*	*			trans	71.7	146.2	165.6	-66.4	-22.6	0	0	0	118.8
1253	S	30.7	Very low	27.2	Very low	79 Å²	79	160.8 Å²	160.8	55%	0.552	78%	0.784	S	S	*	*			cis	-165.6	166.7	-15.4	63.8	0	0	0	0	113.1
1254	K	29.8	Very low	27.1	Very low	193 Å²	193	160.6 Å²	160.6	84%	0.839	78%	0.778	S	S	*	*			trans	64.9	148.7	157.3	-64.9	159.5	-174.1	171.3	0	117.6
1255	R	28.1	Very low	27.1	Very low	223 Å²	223	160.9 Å²	160.9	84%	0.842	78%	0.782	S	S	*	*			cis	153.8	113.5	-24.8	171.5	-177.8	-166.8	-173	6.1	106.7
1256	S	24.8	Very low	27.3	Very low	104 Å²	104	165.7 Å²	165.7	73%	0.727	80%	0.795	S	S	*	*			trans	64.8	140.9	172.3	72.8	0	0	0	0	116.2
1257	R	29.9	Very low	27.4	Very low	230 Å²	230	168.3 Å²	168.3	87%	0.868	79%	0.793	S	S	*	*				-161.6	169	63	-90.4	-179	167.5	175	-3.9	114
1258	V	30.5	Very low	27.7	Very low	140 Å²	140	166.5 Å²	166.5	85%	0.848	79%	0.785	S	S	*	*			trans	74	119.9	166.2	177.2	0	0	0	0	118
1259	K	25.1	Very low	27.8	Very low	200 Å²	200	164.9 Å²	164.9	87%	0.87	79%	0.786	S	S	*	*			trans	-92.8	154.7	164.5	-55.4	174.2	176.7	-178.4	0	110.2
1260	K	27.8	Very low	28	Very low	208 Å²	208	167.8 Å²	167.8	90%	0.904	80%	0.797	S	S	*	*			trans	-162.9	140.3	138.9	-123.1	177.3	-178.6	-178.5	0	112.6
1261	A	29.5	Very low	28	Very low	89 Å²	89	166.5 Å²	166.5	74%	0.736	79%	0.791	S	S	*	*			trans	61.3	143.9	176	0	0	0	0	0	116.9
1262	L	28.9	Very low	28	Very low	155 Å²	155	168 Å²	168	81%	0.812	80%	0.799	S	S	*	*			cis	-157.9	137.3	-23.1	-126.3	80.4	0	0	0	101.3
1263	I	29.8	Very low	28.1	Very low	141 Å²	141	173.3 Å²	173.3	72%	0.723	81%	0.808	S	S	*	*			cis	-160.9	170.9	40.1	-114.9	161.4	0	0	0	108.8
1264	E	28.5	Very low	27.9	Very low	160 Å²	160	179.9 Å²	179.9	75%	0.748	82%	0.821	S	S	*	*			trans	59	72.9	165.2	-127.9	55.8	-154.7	0	0	122
1265	Q	24.3	Very low	27.6	Very low	187 Å²	187	178.3 Å²	178.3	87%	0.874	82%	0.816	S	S	*	*				-160.7	101	119.4	-113.6	-168.7	7.8	0	0	111.4
1266	H	28	Very low	27.6	Very low	190 Å²	190	175.6 Å²	175.6	88%	0.88	81%	0.813	S	S	*	*			trans	-160.9	99.4	148.2	-118.8	-70.1	0	0	0	112.8
1267	R	28.8	Very low	27.9	Very low	206 Å²	206	177.1 Å²	177.1	78%	0.777	81%	0.812	S	S	*	*			trans	-125.5	126.2	166.2	-169.7	174.1	176.6	146.5	-7.5	103.2
1268	R	29.1	Very low	27.7	Very low	199 Å²	199	171.6 Å²	171.6	75%	0.751	80%	0.804	S	S	*	*			cis	-154.3	-173	18.4	-132.2	170.3	-168.6	-174.3	0.2	110.3
1269	Q	26.2	Very low	27.7	Very low	186 Å²	186	172.2 Å²	172.2	87%	0.869	80%	0.798	S	S	*	*			trans	72.6	139.8	-176.2	-49.5	-177.3	3.2	0	0	113.2
1270	Q	28	Very low	27.7	Very low	184 Å²	184	169 Å²	169	86%	0.86	79%	0.79	S	S	*	*			cis	-93.2	145.6	3.4	-68.4	166.6	-12.3	0	0	111.6
1271	L	29.6	Very low	27.8	Very low	143 Å²	143	164.6 Å²	164.6	75%	0.749	78%	0.783	S	S	*	*				71.2	96.8	66.2	-105.5	176.3	0	0	0	114.9
1272	Q	25.1	Very low	27.6	Very low	173 Å²	173	167.4 Å²	167.4	81%	0.808	79%	0.785	S	S	*	*			trans	43.5	109.8	152.4	-67.3	173.6	4.5	0	0	120.5
1273	R	26.8	Very low	27.5	Very low	249 Å²	249	170 Å²	170	94%	0.94	79%	0.79	S	S	*	*				-150.9	149.4	113.1	-111.3	176.3	-167.2	-157.7	3.8	113.2
1274	R	26.5	Very low	27.4	Very low	217 Å²	217	169.5 Å²	169.5	82%	0.819	79%	0.789	S	S	*	*			trans	-43.5	152.2	-172.9	-76.2	173.2	171.4	167.2	-3	118.6
1275	H	24.6	Very low	27.3	Very low	160 Å²	160	170.9 Å²	170.9	74%	0.741	79%	0.789	S	S	*	*			trans	34.7	126.5	143.9	-49.6	-62.7	0	0	0	118.6
1276	H	28.7	Very low	27.4	Very low	166 Å²	166	169.5 Å²	169.5	77%	0.769	78%	0.78	S	S	*	*				-154.6	149.5	81.4	-104.7	-91	0	0	0	114.5
1277	L	29.2	Very low	27.2	Very low	136 Å²	136	164.4 Å²	164.4	71%	0.712	77%	0.771	S	S	*	*			trans	43.2	114.1	146.8	-69	166	0	0	0	121.2
1278	T	26.3	Very low	27	Very low	115 Å²	115	161.5 Å²	161.5	71%	0.706	77%	0.771	S	S	*	*				44.5	142.1	128	61.2	0	0	0	0	121
1279	H	29.9	Very low	27.1	Very low	152 Å²	152	157.2 Å²	157.2	70%	0.704	77%	0.769	S	S	*	*			cis	-161	149.8	34.6	-149.1	-79.2	0	0	0	112.8
1280	N	27	Very low	27	Very low	134 Å²	134	156.4 Å²	156.4	72%	0.717	77%	0.765	S	S	*	*			trans	38.4	118.1	166.1	-74.8	-3.8	0	0	0	122
1281	P	29.2	Very low	27	Very low	115 Å²	115	155.9 Å²	155.9	75%	0.747	76%	0.76	S	S	*	*			trans	-94.8	170.6	159.3	39.4	-34	0	0	0	112.8
1282	N	25.4	Very low	26.8	Very low	147 Å²	147	154.9 Å²	154.9	79%	0.786	76%	0.764	S	S	*	*			trans	-173.8	109.8	141.7	-98.5	-31.6	0	0	0	110.8
1283	F	27.6	Very low	26.7	Very low	210 Å²	210	152.2 Å²	152.2	92%	0.921	76%	0.764	S	S	*	*			trans	-158.6	158.5	136.8	-116.3	-75.6	0	0	0	111
1284	N	26.8	Very low	27	Very low	131 Å²	131	145.4 Å²	145.4	70%	0.701	75%	0.753	S	S	*	*			trans	-85.4	149	-157	-91.8	-3.9	0	0	0	115.6
1285	Y	26.6	Very low	27.1	Very low	188 Å²	188	142.9 Å²	142.9	74%	0.737	75%	0.754	S	S	*	*				32.8	143.8	111.4	-84.8	-117.7	0	0	0	118.7
1286	F	26.3	Very low	27.3	Very low	158 Å²	158	140.8 Å²	140.8	69%	0.693	75%	0.753	S	S	*	*			cis	-172.4	173.4	-4	-142.1	-130.5	0	0	0	109.9
1287	A	24.6	Very low	27.2	Very low	84 Å²	84	138.5 Å²	138.5	69%	0.694	75%	0.754	S	S	*	*			trans	-162.4	138.9	149.8	0	0	0	0	0	107.1
1288	D	23	Very low	27.2	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	76%	0.755	S	S	*	*			cis	-144.9	-166	-7.7	-133.9	4.6	0	0	0	108.7
1289	P	32.3	Very low	27.5	Very low	109 Å²	109	140 Å²	140	71%	0.708	76%	0.764	S	S	*	*			trans	-95	158.5	-152.4	37.7	-39.5	0	0	0	116.9
1290	E	24.3	Very low	27.6	Very low	169 Å²	169	137.9 Å²	137.9	79%	0.79	77%	0.766	S	S	*	*			trans	-157.6	154.5	131.5	-121.5	-179.3	-148.2	0	0	114.7
1291	F	27.3	Very low	27.7	Very low	172 Å²	172	140.2 Å²	140.2	75%	0.754	77%	0.77	S	S	*	*			trans	54	140.2	166	-79.4	-81.5	0	0	0	125
1292	C	24.9	Very low	27.6	Very low	123 Å²	123	144.2 Å²	144.2	83%	0.831	77%	0.77	S	S	*	*			trans	67.9	97.8	149.8	-71.6	0	0	0	0	122
1293	S	23.6	Very low	27.6	Very low	116 Å²	116	143.8 Å²	143.8	81%	0.811	77%	0.768	S	S	*	*			trans	-152.3	169.6	142.2	69.8	0	0	0	0	108.3
1294	P	32.8	Very low	27.6	Very low	106 Å²	106	138.9 Å²	138.9	69%	0.688	76%	0.755	S	S	*	*			cis	-137.6	153.9	7.7	40.4	-22.7	0	0	0	117.8
1295	L	27.9	Very low	27.6	Very low	164 Å²	164	138.5 Å²	138.5	86%	0.859	75%	0.753	S	S	*	*			trans	-135.6	112.5	140.6	-86	159.5	0	0	0	104
1296	V	29.5	Very low	27.7	Very low	116 Å²	116	136.9 Å²	136.9	70%	0.703	75%	0.75	S	S	*	*				53.1	109.4	75.7	-175.8	0	0	0	0	110.8
1297	C	27	Very low	27.8	Very low	118 Å²	118	139 Å²	139	80%	0.797	76%	0.755	S	S	*	*			cis	-153.9	161.3	-3.8	-119.9	0	0	0	0	110.7
1298	P	29.6	Very low	27.8	Very low	114 Å²	114	141.2 Å²	141.2	74%	0.74	76%	0.755	S	S	*	*			trans	-103.7	160.8	-169.9	38.9	-34.5	0	0	0	115.1
1299	L	31.2	Very low	28	Very low	168 Å²	168	142 Å²	142	88%	0.88	75%	0.754	S	S	*	*			trans	-147.7	151.7	160.5	-123.9	113.2	0	0	0	114
1300	S	32.5	Very low	27.8	Very low	108 Å²	108	142 Å²	142	76%	0.755	75%	0.748	S	S	*	*			trans	45.3	99	165.8	56.3	0	0	0	0	121
1301	K	28.4	Very low	28	Very low	184 Å²	184	142.6 Å²	142.6	80%	0.8	75%	0.754	S	S	*	*			trans	-51.2	161.1	135.4	-67.5	166.8	-176.5	166	0	110.2
1302	R	27.7	Very low	28.1	Very low	198 Å²	198	140.7 Å²	140.7	75%	0.747	75%	0.746	S	S	*	*			cis	-167.7	155.1	9.1	-129.2	175.2	-179	167.7	-1.4	110.4
1303	N	25.8	Very low	28.3	Very low	138 Å²	138	140 Å²	140	74%	0.738	73%	0.734	S	S	*	*				34.8	144.8	129.2	-72.5	45.2	0	0	0	121.9
1304	V	26.5	Very low	28.5	Very low	107 Å²	107	141.6 Å²	141.6	65%	0.648	73%	0.734	S	S	*	*			cis	-171.3	177.3	-5.1	109.5	0	0	0	0	109
1305	N	27.8	Very low	28.3	Very low	124 Å²	124	143.8 Å²	143.8	66%	0.663	73%	0.732	S	S	*	*			trans	82.1	145.9	173.7	-67	-23	0	0	0	116
1306	F	28.7	Very low	28.4	Very low	153 Å²	153	142.3 Å²	142.3	67%	0.671	73%	0.725	S	S	*	*			cis	-153.1	155.6	-2.7	-127.1	-52.3	0	0	0	111.7
1307	Y	28.7	Very low	28.4	Very low	202 Å²	202	145.4 Å²	145.4	79%	0.792	73%	0.732	S	S	*	*			trans	77.4	149	165.7	-72.6	-71.8	0	0	0	120.2
1308	N	24.4	Very low	29	Very low	131 Å²	131	144.4 Å²	144.4	70%	0.701	72%	0.724	S	S	*	*			trans	-124.8	166.5	-170.4	-73.3	-4.7	0	0	0	110.6
1309	H	26.9	Very low	28.8	Very low	162 Å²	162	147.9 Å²	147.9	75%	0.75	73%	0.728	S	S	*	*			trans	68	156.1	165.9	-57.1	-64.5	0	0	0	112.8
1310	D	27.9	Very low	28.7	Very low	110 Å²	110	146.1 Å²	146.1	59%	0.588	72%	0.719	S	S	*	*			cis	-132.2	153.3	31	-69.7	-18.4	0	0	0	115.4	F1312	D1310-F1312 HydrophobicContact CB-CB 3.98Å; D1310-F1312 HydrophobicContact CB-CD2 3.86Å; D1310-F1312 HydrophobicContact CB-CG 4.32Å; D1310-F1312 WeakPolarHBondContact OD1-CD2 3.48Å; D1310-F1312 VanDerWaalsContact OD1-CE2 3.28Å; D1310-F1312 WeakPolarHBondContact OD1-CE2 3.47Å
1311	I	28.7	Very low	28.5	Very low	180 Å²	180	144.8 Å²	144.8	92%	0.923	71%	0.71	S	S	*	*				-123.4	124.5	120.3	-62.2	-177.2	0	0	0	105.1
1312	F	29.5	Very low	28.6	Very low	132 Å²	132	142.4 Å²	142.4	58%	0.579	71%	0.706	S	S	*	*			trans	-135.8	164.6	-160.2	-125.8	-106.4	0	0	0	113.4	D1310	D1310-F1312 HydrophobicContact CB-CB 3.98Å; D1310-F1312 HydrophobicContact CB-CD2 3.86Å; D1310-F1312 HydrophobicContact CB-CG 4.32Å; D1310-F1312 WeakPolarHBondContact OD1-CD2 3.48Å; D1310-F1312 VanDerWaalsContact OD1-CE2 3.28Å; D1310-F1312 WeakPolarHBondContact OD1-CE2 3.47Å
1313	N	28.5	Very low	28.6	Very low	109 Å²	109	138.7 Å²	138.7	58%	0.583	70%	0.7	S	S	*	*			trans	68.2	154.1	170.9	-65.5	-52.6	0	0	0	114.9
1314	N	28.5	Very low	28.7	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	70%	0.699	S	S	*	*			cis	-128.6	171.2	20.6	-144.6	-10.1	0	0	0	115.3
1315	K	29.6	Very low	28.7	Very low	152 Å²	152	140.3 Å²	140.3	66%	0.661	70%	0.7	S	S	*	*			trans	-106.6	158.9	-168.3	-52	165.8	-173.2	170.8	0	111.6
1316	N	29.4	Very low	28.9	Very low	133 Å²	133	140.6 Å²	140.6	71%	0.711	70%	0.7	S	S	*	*				162.8	125.3	110.4	-84.3	-29.6	0	0	0	114.8
1317	H	29.3	Very low	29.1	Very low	180 Å²	180	140.6 Å²	140.6	83%	0.833	71%	0.707	S	S	*	*			trans	56.2	162.2	140.7	-79.6	-79.5	0	0	0	122.4
1318	P	40	Very low	29.2	Very low	97 Å²	97	135.6 Å²	135.6	63%	0.63	71%	0.708	S	S	*	*			trans	-126.7	-179.4	-156.7	44.6	-30.6	0	0	0	113.8
1319	F	25.4	Very low	29.4	Very low	188 Å²	188	134.4 Å²	134.4	83%	0.825	71%	0.71	S	S	*	*				169.1	165.5	129.2	-107.5	-86.6	0	0	0	108.7
1320	D	28.1	Very low	29.3	Very low	131 Å²	131	134.3 Å²	134.3	70%	0.701	72%	0.715	S	S	*	*			trans	60.7	125.8	179.8	-65.1	-56.3	0	0	0	117.2
1321	S	28.9	Very low	29.2	Very low	80 Å²	80	135.2 Å²	135.2	56%	0.559	72%	0.719	S	S	*	*			cis	70.8	145.3	42	110.3	0	0	0	0	111.6
1322	N	29.8	Very low	29.4	Very low	134 Å²	134	135.7 Å²	135.7	72%	0.717	71%	0.709	S	S	*	*			cis	-157.2	165.6	10.5	-115.6	-22.7	0	0	0	106.9
1323	L	28.1	Very low	29.6	Very low	119 Å²	119	136.4 Å²	136.4	62%	0.623	71%	0.708	S	S	*	*			cis	-167.3	153.9	-4.8	-177.3	71.6	0	0	0	105.4
1324	Q	29	Very low	29.5	Very low	155 Å²	155	132.8 Å²	132.8	72%	0.724	69%	0.688	S	S	*	*			trans	62.3	143.7	161.3	-82.7	162.8	20.8	0	0	116.2
1325	N	26.3	Very low	30.1	Very low	124 Å²	124	130.7 Å²	130.7	66%	0.663	68%	0.681	S	S	*	*			cis	-169.1	-174.9	14.7	-134.6	-21.3	0	0	0	110.1
1326	I	31.9	Very low	30.5	Very low	131 Å²	131	130 Å²	130	67%	0.672	68%	0.678	S	S	*	*			trans	71.1	119.5	150.6	-70.6	157.7	0	0	0	117.5
1327	N	32.6	Very low	30.4	Very low	152 Å²	152	132.1 Å²	132.1	81%	0.813	68%	0.684	S	S	*	*			trans	70.8	125.5	160.5	-60.2	-12.4	0	0	0	118.8
1328	A	29.8	Very low	30.5	Very low	97 Å²	97	127.9 Å²	127.9	80%	0.802	67%	0.672	S	S	*	*			cis	-151.1	160.5	-9.5	0	0	0	0	0	111.8
1329	S	29.9	Very low	29.6	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	68%	0.68	S	S	*	*			trans	-78.2	143.6	-176	45.7	0	0	0	0	113.9
1330	N	24.6	Very low	29.5	Very low	160 Å²	160	133.8 Å²	133.8	86%	0.856	68%	0.676	S	S	*	*			trans	-46.3	139.9	159.5	-51.4	-78.8	0	0	0	111.5
1331	L	26.4	Very low	29.2	Very low	130 Å²	130	134.1 Å²	134.1	68%	0.681	68%	0.678	S	S	*	*			trans	-166.2	151.5	153.8	-113.9	169.3	0	0	0	113.6
1332	R	31.3	Very low	29.1	Very low	189 Å²	189	135.6 Å²	135.6	71%	0.713	69%	0.687	S	S	*	*			trans	81	130.4	160.4	-63.9	176.7	-167.5	-173.3	4	116.4
1333	R	33.6	Very low	28.7	Very low	147 Å²	147	135.3 Å²	135.3	56%	0.555	69%	0.686	S	S	*	*			cis	78	131.3	41.9	-171.8	-158.7	-63.4	169.5	-5.2	110.6
1334	I	28.1	Very low	28.5	Very low	34 Å²	34	139.3 Å²	139.3	17%	0.174	69%	0.694	C	S	.	*			trans	-79.4	139.2	-178.4	-54.4	175.5	0	0	0	108.9	K1336 D1602 D1604	I1334-K1336 HydrophobicContact CG2-CB 4.28Å; I1334-K1336 HydrophobicContact CG2-CD 3.57Å; I1334-K1336 HydrophobicContact CG2-CG 3.63Å; I1334-D1602 HydrophobicContact CD1-CB 4.12Å; I1334-D1604 HydrophobicContact CB-CB 3.7Å; I1334-D1604 WeakPolarHBondContact CB-O 3.47Å; I1334-D1604 HydrophobicContact CD1-CB 4.11Å; I1334-D1604 HydrophobicContact CG1-CB 4.07Å; I1334-D1604 WeakPolarHBondContact CG2-O 2.81Å
1335	T	40	Very low	28.3	Very low	106 Å²	106	139.3 Å²	139.3	65%	0.65	69%	0.694	S	S	*	*			trans	-151.5	77.5	153.2	41.9	0	0	0	0	104	Y1605	T1335-Y1605 WeakPolarHBondContact CG2-O 3.45Å
1336	K	38.2	Very low	28.1	Very low	137 Å²	137	138.8 Å²	138.8	60%	0.596	70%	0.696	S	S	*	*			trans	-67.9	140.1	-176.2	-79.2	153.9	-176.6	179.5	0	108.9	I1334 D1602	I1334-K1336 HydrophobicContact CG2-CB 4.28Å; I1334-K1336 HydrophobicContact CG2-CD 3.57Å; I1334-K1336 HydrophobicContact CG2-CG 3.63Å; K1336-D1602 PolarHBondContact NZ-O 3.03Å
1337	Q	26.6	Very low	27.8	Very low	177 Å²	177	139.4 Å²	139.4	83%	0.827	70%	0.699	S	S	*	*			trans	65.9	-179.7	-176.6	-39.8	171	-7.6	0	0	110.5
1338	P	31.2	Very low	27.5	Very low	92 Å²	92	139.4 Å²	139.4	60%	0.597	69%	0.694	S	S	*	*			cis	-135.5	151.9	-0.2	37.5	-19	0	0	0	117.1
1339	R	22.3	Very low	27.3	Very low	210 Å²	210	141.4 Å²	141.4	79%	0.792	69%	0.691	S	S	*	*			trans	71.2	144.6	151	-65.4	159.7	-171.2	-176.1	3.1	116
1340	R	23.3	Very low	27	Very low	198 Å²	198	142.6 Å²	142.6	75%	0.747	69%	0.689	S	S	*	*			cis	-163.5	167.4	-10.6	-126.5	175.3	-171.4	168.8	-1.6	109.8
1341	N	22	Very low	27	Very low	139 Å²	139	141 Å²	141	74%	0.743	69%	0.685	S	S	*	*			trans	67.6	151.2	159.3	-60.2	9.5	0	0	0	117.1
1342	C	25.3	Very low	27.2	Very low	110 Å²	110	140.3 Å²	140.3	74%	0.743	69%	0.689	S	S	*	*			trans	-76.8	152.7	149.2	-52.8	0	0	0	0	108.3
1343	D	22.6	Very low	26.9	Very low	128 Å²	128	139.1 Å²	139.1	68%	0.684	70%	0.695	S	S	*	*			trans	164.4	141.1	135.5	-80.1	-17.5	0	0	0	109.8
1344	Y	23.6	Very low	26.6	Very low	203 Å²	203	139.3 Å²	139.3	80%	0.796	71%	0.706	S	S	*	*			trans	61.2	156.4	176.7	-49.8	-70.8	0	0	0	115.2
1345	Q	24.4	Very low	26.5	Very low	155 Å²	155	144.9 Å²	144.9	72%	0.724	73%	0.734	S	S	*	*			cis	-152.1	123.9	-13.4	-124.3	153.9	-5.5	0	0	104
1346	T	23.1	Very low	25.8	Very low	114 Å²	114	143.2 Å²	143.2	70%	0.699	73%	0.732	S	S	*	*				27.6	134.7	88.1	57.8	0	0	0	0	115.7
1347	I	25.3	Very low	25.2	Very low	144 Å²	144	144.8 Å²	144.8	74%	0.738	75%	0.746	S	S	*	*			trans	77.1	119.2	169.3	-58.3	166.1	0	0	0	113
1348	E	25.7	Very low	25.2	Very low	151 Å²	151	140.1 Å²	140.1	71%	0.706	75%	0.746	S	S	*	*			cis	-161.2	-175.2	-10.8	-134.6	150.1	-130.7	0	0	111
1349	D	25.2	Very low	24.9	Very low	140 Å²	140	146 Å²	146	75%	0.749	76%	0.758	S	S	*	*			trans	-53	170.2	159.3	-57.7	-86.2	0	0	0	112.2
1350	N	24.5	Very low	24.9	Very low	131 Å²	131	141.6 Å²	141.6	70%	0.701	75%	0.75	S	S	*	*				-174.8	153	107.9	-101.7	-68.2	0	0	0	115.3
1351	T	23.9	Very low	24.9	Very low	125 Å²	125	138.1 Å²	138.1	77%	0.767	75%	0.746	S	S	*	*	S	Bend	trans	-53.1	155.4	157	34.1	0	0	0	0	112.6
1352	P	31.1	Very low	25.1	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	75%	0.745	S	S	*	*	P	Polyproline II helix		-100.6	164.1	-107.6	35	-39.9	0	0	0	115.9
1353	I	26	Very low	25.3	Very low	163 Å²	163	138.5 Å²	138.5	84%	0.836	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-63.8	128.6	166.9	-61.3	169.2	0	0	0	110.4
1354	L	26.7	Very low	25.4	Very low	151 Å²	151	137 Å²	137	79%	0.791	74%	0.744	S	S	*	*			trans	-161.8	95.1	145.4	-107.4	162.5	0	0	0	112.7
1355	I	26	Very low	25.8	Very low	151 Å²	151	134.2 Å²	134.2	77%	0.774	74%	0.741	S	S	*	*			trans	76	138.5	146.7	-72.1	170.9	0	0	0	121
1356	A	25.1	Very low	26	Very low	72 Å²	72	133.6 Å²	133.6	60%	0.595	74%	0.742	S	S	*	*			trans	87	113.4	154.4	0	0	0	0	0	121.7
1357	N	25	Very low	26.2	Very low	169 Å²	169	134.7 Å²	134.7	90%	0.904	74%	0.743	S	S	*	*			trans	67.7	126	136.6	-54	-13	0	0	0	119.9
1358	G	26.6	Very low	26.4	Very low	80 Å²	80	134 Å²	134	83%	0.825	74%	0.741	S	S	*	*			trans	174.7	90.2	170.6	0	0	0	0	0	112.4
1359	Y	25.6	Very low	26.7	Very low	215 Å²	215	135 Å²	135	84%	0.843	75%	0.746	S	S	*	*			trans	-69.2	144	178.4	-103.8	-114.9	0	0	0	112.7
1360	N	22.8	Very low	27	Very low	117 Å²	117	136.3 Å²	136.3	63%	0.626	75%	0.752	S	S	*	*			trans	42.3	136.6	135	-67	17.8	0	0	0	122.3
1361	N	23.6	Very low	27.4	Very low	125 Å²	125	138.8 Å²	138.8	67%	0.668	76%	0.759	S	S	*	*			trans	73.5	156.5	140.8	-63.7	19.1	0	0	0	116.4
1362	E	25.9	Very low	28.2	Very low	153 Å²	153	139.9 Å²	139.9	72%	0.715	76%	0.759	S	S	*	*			cis	-155.6	153.5	4	-138.3	155	-118.1	0	0	112.7
1363	S	28	Very low	28.5	Very low	105 Å²	105	140.2 Å²	140.2	73%	0.734	76%	0.755	S	S	*	*			trans	69.8	159.4	149.2	90.2	0	0	0	0	118
1364	S	26.5	Very low	28.6	Very low	97 Å²	97	138 Å²	138	68%	0.678	74%	0.744	S	S	*	*			cis	-169.7	-176.9	-25.1	49.8	0	0	0	0	110.5
1365	I	30.1	Very low	28.5	Very low	144 Å²	144	136.9 Å²	136.9	74%	0.738	74%	0.738	S	S	*	*			trans	87.3	83.8	161.4	-58	168	0	0	0	117.5
1366	I	29.9	Very low	28.7	Very low	142 Å²	142	132.5 Å²	132.5	73%	0.728	72%	0.718	S	S	*	*				78.2	111	118.8	-70.6	171.3	0	0	0	120.9
1367	N	27.6	Very low	29	Very low	136 Å²	136	132.6 Å²	132.6	73%	0.727	71%	0.713	S	S	*	*			trans	95.6	112.9	137.9	-73.7	14.8	0	0	0	124.6
1368	N	29	Very low	28.9	Very low	129 Å²	129	129.1 Å²	129.1	69%	0.69	70%	0.702	S	S	*	*				104.8	94.1	128.7	-69.2	22.4	0	0	0	122.2
1369	E	31.1	Very low	28.8	Very low	174 Å²	174	134.3 Å²	134.3	81%	0.813	70%	0.701	S	S	*	*				43.8	97.5	127.6	-60.4	-173.4	139.8	0	0	121.3
1370	D	31.7	Very low	28.9	Very low	166 Å²	166	131.8 Å²	131.8	89%	0.888	70%	0.701	S	S	*	*				47.6	157.6	104.2	-69.1	10.9	0	0	0	123.3
1371	H	34.2	Very low	28.9	Very low	183 Å²	183	134.6 Å²	134.6	85%	0.847	71%	0.71	S	S	*	*			trans	-145.7	173.1	-158.6	-122.6	-9.1	0	0	0	112.2
1372	I	40.8	Very low	28.8	Very low	148 Å²	148	135.5 Å²	135.5	76%	0.759	71%	0.713	S	S	*	*			trans	70.1	135.8	168.9	-62.6	164.5	0	0	0	114.8
1373	N	36.3	Very low	28.9	Very low	125 Å²	125	136.8 Å²	136.8	67%	0.668	72%	0.717	S	S	*	*			cis	169.4	155.2	-20.9	-97.9	-19.2	0	0	0	104.5
1374	N	27.2	Very low	28.7	Very low	116 Å²	116	138.9 Å²	138.9	62%	0.62	72%	0.715	S	S	*	*			cis	-150.1	130.1	6.9	-128.6	-36.4	0	0	0	111
1375	I	25.3	Very low	28.7	Very low	127 Å²	127	140.1 Å²	140.1	65%	0.651	72%	0.722	S	S	*	*			trans	-128.1	121.9	-179.3	-73.7	-179.7	0	0	0	107.5	L1627	I1375-L1627 CarbonylContact C-O 3.55Å; I1375-L1627 WeakPolarHBondContact CG2-O 3.4Å
1376	T	29.4	Very low	28.5	Very low	59 Å²	59	140.3 Å²	140.3	36%	0.362	72%	0.719	S	S	.	*			trans	-152.1	136.7	176.3	72.6	0	0	0	0	109.4	L1627 K1628	T1376-L1627 CarbonylContact C-O 3.59Å; T1376-L1627 WeakPolarHBondContact CA-O 3.43Å; T1376-L1627 PolarHBondContact N-O 3.41Å; T1376-K1628 WeakPolarHBondContact O-CA 3.35Å; T1376-K1628 VanDerWaalsContact O-CB 3.22Å; T1376-K1628 WeakPolarHBondContact O-CB 3.28Å; T1376-K1628 WeakPolarHBondContact O-CD 3.46Å; T1376-K1628 WeakPolarHBondContact O-CE 3.46Å; T1376-K1628 WeakPolarHBondContact O-CG 3.34Å; T1376-K1628 VanDerWaalsContact OG1-CE 3.3Å; T1376-K1628 WeakPolarHBondContact OG1-CE 3.36Å; T1376-K1628 PolarHBondContact OG1-NZ 3.3Å
1377	P	31.6	Very low	28.4	Very low	74 Å²	74	140.3 Å²	140.3	48%	0.481	72%	0.72	S	S	.	*			cis	-129.3	176.9	28.7	41	-23.7	0	0	0	111.9	L1627	P1377-L1627 VanDerWaalsContact N-O 3.09Å; P1377-L1627 WeakPolarHBondContact O-CB 3.42Å
1378	S	23.8	Very low	28.3	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	72%	0.718	S	S	*	*			cis	-171.5	171.2	42.5	63.4	0	0	0	0	108.2
1379	K	24.2	Very low	28.2	Very low	189 Å²	189	142.4 Å²	142.4	82%	0.822	72%	0.722	S	S	*	*			cis	-157.9	-151.9	19.2	-148.6	163.7	-176	179.3	0	107.8
1380	I	28.1	Very low	28	Very low	162 Å²	162	139.4 Å²	139.4	83%	0.831	72%	0.72	S	S	*	*			trans	77.6	104.2	171.5	-50.6	174.4	0	0	0	113.9
1381	H	21.9	Very low	27.7	Very low	177 Å²	177	138.7 Å²	138.7	82%	0.819	72%	0.715	S	S	*	*			trans	-96.9	170.8	154.3	-150.1	-90.2	0	0	0	107.5
1382	I	23.1	Very low	27.3	Very low	144 Å²	144	138.2 Å²	138.2	74%	0.738	71%	0.711	S	S	*	*			trans	80.8	88.5	171.1	-47.4	163.1	0	0	0	115.4
1383	K	26.3	Very low	26.6	Very low	180 Å²	180	137.8 Å²	137.8	78%	0.783	71%	0.71	S	S	*	*				169	151.8	119.8	-88.8	-159.5	174.2	-165.7	0	109.6
1384	Q	24.3	Very low	26.3	Very low	148 Å²	148	138.1 Å²	138.1	69%	0.692	72%	0.716	S	S	*	*			cis	-173.3	122.9	-19.9	171.2	172.7	-6.5	0	0	108.3
1385	C	27	Very low	26.4	Very low	123 Å²	123	140.6 Å²	140.6	83%	0.831	72%	0.724	S	S	*	*			trans	179.9	150.4	167.2	-102.3	0	0	0	0	109.6
1386	H	26.3	Very low	26.5	Very low	148 Å²	148	138.9 Å²	138.9	69%	0.685	72%	0.723	S	S	*	*			cis	-167.1	147.7	-30.8	-138.4	-80.2	0	0	0	108
1387	L	27	Very low	26.4	Very low	143 Å²	143	144.8 Å²	144.8	75%	0.749	75%	0.747	S	S	*	*			trans	64.1	161.3	171	-57.5	156.2	0	0	0	116.1
1388	Q	26	Very low	26.3	Very low	144 Å²	144	146.2 Å²	146.2	67%	0.673	75%	0.754	S	S	*	*			cis	-160.3	158.9	-37.1	178.9	165.1	-60	0	0	107.8
1389	E	26.1	Very low	26.4	Very low	165 Å²	165	148.4 Å²	148.4	77%	0.771	76%	0.758	S	S	*	*			trans	67.8	144.3	178	-77.9	139.3	-127.7	0	0	115.7
1390	S	27.6	Very low	26.6	Very low	110 Å²	110	146.4 Å²	146.4	77%	0.769	76%	0.757	S	S	*	*			cis	-138.7	154.1	8.7	50.2	0	0	0	0	113.3
1391	L	25.4	Very low	26.6	Very low	151 Å²	151	144.1 Å²	144.1	79%	0.791	75%	0.751	S	S	*	*			trans	-82.6	160.3	158.4	-92.9	67.1	0	0	0	108.1
1392	K	25.5	Very low	27	Very low	174 Å²	174	142.1 Å²	142.1	76%	0.757	75%	0.75	S	S	*	*			cis	-163.6	166.7	18.3	-142.3	172.2	-175.8	177.9	0	111.6
1393	N	26.7	Very low	27.3	Very low	138 Å²	138	143.6 Å²	143.6	74%	0.738	75%	0.754	S	S	*	*			trans	107.8	131.2	154.9	-58.3	-17.2	0	0	0	117.6
1394	V	30.3	Very low	27.4	Very low	132 Å²	132	139.9 Å²	139.9	80%	0.8	75%	0.751	S	S	*	*			trans	60.5	110.2	170.8	-169	0	0	0	0	113.5
1395	E	28	Very low	27.5	Very low	168 Å²	168	137.1 Å²	137.1	79%	0.785	75%	0.748	S	S	*	*			cis	-170.8	174.8	7.4	-124.5	-167.3	-115.6	0	0	108.3
1396	S	27.9	Very low	27.6	Very low	92 Å²	92	137.7 Å²	137.7	64%	0.643	74%	0.743	S	S	*	*			cis	-152.1	171.8	-8.7	6.4	0	0	0	0	110.3
1397	E	27	Very low	27.7	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	74%	0.741	S	S	*	*			trans	-137.7	157.1	176.6	-73.1	-175.7	137.9	0	0	107.8
1398	T	30.5	Very low	27.7	Very low	104 Å²	104	138.7 Å²	138.7	64%	0.638	75%	0.745	S	S	*	*			cis	-163.2	159.1	-6.5	15.3	0	0	0	0	109.3
1399	D	25.8	Very low	27.7	Very low	142 Å²	142	136.3 Å²	136.3	76%	0.759	74%	0.744	S	S	*	*			trans	55.3	165	147	-52.7	-26.4	0	0	0	119.8
1400	D	28.9	Very low	27.6	Very low	148 Å²	148	133.6 Å²	133.6	79%	0.791	74%	0.743	S	S	*	*			cis	-144.2	-179.6	11.9	-152.3	-20.6	0	0	0	112.1
1401	T	27.1	Very low	27.5	Very low	114 Å²	114	136.9 Å²	136.9	70%	0.699	75%	0.747	S	S	*	*			trans	-131.2	146.4	-160.8	61.4	0	0	0	0	117.5
1402	V	30.5	Very low	27.4	Very low	134 Å²	134	137.5 Å²	137.5	81%	0.812	75%	0.75	S	S	*	*			trans	-140.2	99.9	159.3	-179	0	0	0	0	106.1
1403	Q	28.9	Very low	27.4	Very low	176 Å²	176	138.6 Å²	138.6	82%	0.822	76%	0.755	S	S	*	*				61.3	137.3	93.1	-64.4	-177.1	2.2	0	0	114.4
1404	S	27.9	Very low	27.2	Very low	101 Å²	101	141.1 Å²	141.1	71%	0.706	76%	0.759	S	S	*	*			cis	-147.3	141.2	9.3	55.8	0	0	0	0	113.2
1405	S	26.8	Very low	26.9	Very low	91 Å²	91	141.4 Å²	141.4	64%	0.636	76%	0.756	S	S	*	*				40.3	148	128.4	89	0	0	0	0	121
1406	D	30.2	Very low	26.6	Very low	134 Å²	134	140 Å²	140	72%	0.717	75%	0.753	S	S	*	*			cis	-140.3	126.8	42.2	-95.5	-30.8	0	0	0	117.5
1407	N	27.7	Very low	26.5	Very low	123 Å²	123	144.5 Å²	144.5	66%	0.658	76%	0.764	S	S	*	*				44.9	96.2	118.3	-74.1	-59.6	0	0	0	121
1408	K	27.6	Very low	26.3	Very low	189 Å²	189	143.6 Å²	143.6	82%	0.822	77%	0.765	S	S	*	*				172.2	122.1	93.5	-97.1	162.4	-177.5	171.3	0	116.7
1409	S	24.9	Very low	25.9	Very low	95 Å²	95	147.7 Å²	147.7	66%	0.664	77%	0.774	S	S	*	*			trans	36.4	112.7	140.2	62.7	0	0	0	0	122.4
1410	S	23.5	Very low	25.9	Very low	107 Å²	107	146.4 Å²	146.4	75%	0.748	78%	0.777	S	S	*	*				53.6	135.9	128.9	75	0	0	0	0	120.6
1411	Q	26.8	Very low	25.5	Very low	180 Å²	180	149.7 Å²	149.7	84%	0.841	78%	0.784	S	S	*	*			cis	-151.5	166.5	33.5	-70.2	-178.4	-6.7	0	0	112.6
1412	L	23.9	Very low	25.3	Very low	163 Å²	163	151.4 Å²	151.4	85%	0.853	79%	0.788	S	S	*	*			trans	-69.4	134.5	162.5	-87	74.6	0	0	0	111.4
1413	K	23.9	Very low	25	Very low	198 Å²	198	152.4 Å²	152.4	86%	0.861	79%	0.789	S	S	*	*				-172.5	132.6	110.8	-107.4	174.8	-178.1	-179.5	0	114.7
1414	F	23.6	Very low	24.8	Very low	190 Å²	190	153 Å²	153	83%	0.833	79%	0.792	S	S	*	*			trans	-61.8	146.6	142.9	-75	-114.5	0	0	0	107.6
1415	L	23.8	Very low	24.6	Very low	139 Å²	139	156.4 Å²	156.4	73%	0.728	80%	0.801	S	S	*	*			cis	-151.4	179.4	12.4	-136.2	157.4	0	0	0	108.8
1416	N	22.2	Very low	24.4	Very low	137 Å²	137	161.2 Å²	161.2	73%	0.733	81%	0.81	S	S	*	*			trans	69	93.7	173.2	-66.7	-22.7	0	0	0	118.3
1417	Q	25.5	Very low	24.1	Very low	187 Å²	187	165.7 Å²	165.7	87%	0.874	82%	0.819	S	S	*	*				-154.1	112.9	114.6	-111.7	177.1	49.4	0	0	112.2	K1419	Q1417-K1419 PolarHBondContact O-N 3.29Å
1418	N	22	Very low	23.9	Very low	163 Å²	163	170.7 Å²	170.7	87%	0.872	83%	0.83	S	S	*	*			trans	-77.3	97.8	168.1	-88.3	-30.7	0	0	0	109.5
1419	K	23	Very low	23.8	Very low	190 Å²	190	167.2 Å²	167.2	83%	0.826	83%	0.827	S	S	*	*			trans	-160.6	59.6	171.5	-129	175.2	-173.4	-178.1	0	116.9	Q1417	Q1417-K1419 PolarHBondContact O-N 3.29Å
1420	S	25	Very low	23.7	Very low	116 Å²	116	168.1 Å²	168.1	81%	0.811	83%	0.833	S	S	*	*			trans	-158.2	16.5	165.2	52.9	0	0	0	0	116.7	L1422	S1420-L1422 PolarHBondContact O-N 3.42Å
1421	F	21.3	Very low	23.8	Very low	217 Å²	217	174.1 Å²	174.1	95%	0.952	84%	0.841	S	S	*	*			trans	-85.8	51.7	173.4	-143.3	-81.1	0	0	0	112.4
1422	L	23.2	Very low	23.5	Very low	149 Å²	149	174.7 Å²	174.7	78%	0.78	84%	0.84	S	S	*	*			trans	-159.8	76	177.1	-131.1	175.8	0	0	0	111.4	S1420	S1420-L1422 PolarHBondContact O-N 3.42Å
1423	N	23.3	Very low	23.5	Very low	156 Å²	156	173.8 Å²	173.8	83%	0.834	84%	0.835	S	S	*	*	S	Bend	trans	-159.4	39.5	169.6	-119.1	-7.4	0	0	0	113.9
1424	H	25	Very low	23.3	Very low	189 Å²	189	172.3 Å²	172.3	88%	0.875	84%	0.836	S	S	*	*	S	Bend	trans	-151	26.7	172.5	-116.2	-69.3	0	0	0	116.7
1425	L	23.5	Very low	23.5	Very low	171 Å²	171	168.5 Å²	168.5	90%	0.895	83%	0.831	S	S	*	*			trans	-130.7	102.1	163.5	-79.6	178.3	0	0	0	109.9
1426	K	22	Very low	23.5	Very low	192 Å²	192	172.1 Å²	172.1	84%	0.835	84%	0.841	S	S	*	*			trans	-152	68.6	178.6	-168.8	-168.8	178.3	-177.9	0	111.6
1427	Y	25.2	Very low	23.5	Very low	228 Å²	228	170.4 Å²	170.4	89%	0.894	85%	0.845	S	S	*	*			trans	-161.8	103	157.2	-93	-63.2	0	0	0	110.9
1428	Y	22.9	Very low	23.5	Very low	229 Å²	229	167.9 Å²	167.9	90%	0.898	84%	0.843	S	S	*	*			trans	-158.1	126.2	149.2	-102.2	-71.6	0	0	0	107.8
1429	P	26.3	Very low	23.6	Very low	116 Å²	116	169.9 Å²	169.9	75%	0.753	84%	0.844	S	S	*	*			trans	-84.8	151.5	-178.8	33.4	-34.3	0	0	0	112.4
1430	S	21.1	Very low	23.7	Very low	113 Å²	113	166 Å²	166	79%	0.79	84%	0.84	S	S	*	*			trans	-86.1	146.1	179.6	-43.2	0	0	0	0	112.6
1431	Y	26.5	Very low	23.7	Very low	233 Å²	233	165.3 Å²	165.3	91%	0.914	84%	0.836	S	S	*	*			trans	-135.3	157.2	158.8	-101.7	-85.4	0	0	0	112
1432	K	21.1	Very low	24.2	Very low	193 Å²	193	158.4 Å²	158.4	84%	0.839	81%	0.813	S	S	*	*			trans	-100.5	137.4	-168.9	-69.1	179.1	178.8	176.9	0	113.1
1433	I	22.2	Very low	24.6	Very low	143 Å²	143	155.6 Å²	155.6	73%	0.733	81%	0.811	S	S	*	*			trans	29.4	115.7	134.3	-51.2	173.6	0	0	0	117.3
1434	N	20.8	Very low	25.2	Very low	167 Å²	167	153 Å²	153	89%	0.893	80%	0.796	S	S	*	*			trans	-157.2	115.5	132	-112.3	-19.4	0	0	0	110.6
1435	P	26.6	Very low	26.6	Very low	110 Å²	110	145.6 Å²	145.6	71%	0.714	76%	0.764	S	S	*	*			trans	-95.7	128.5	-178.5	34.4	-30.8	0	0	0	112.7
1436	K	24.1	Very low	27.9	Very low	216 Å²	216	141.9 Å²	141.9	94%	0.939	75%	0.75	S	S	*	*			trans	-129.9	139.4	150.8	-81.6	-172	175.1	-179.9	0	108.1
1437	A	22.2	Very low	29.1	Very low	100 Å²	100	135.4 Å²	135.4	83%	0.826	73%	0.733	S	S	*	*			trans	-101.7	139.4	-169.3	0	0	0	0	0	112.4
1438	V	26.2	Very low	30.2	Very low	135 Å²	135	126.9 Å²	126.9	82%	0.818	70%	0.701	S	S	*	*			trans	-143.7	124.3	140.1	172.9	0	0	0	0	107.4
1439	F	24.7	Very low	31.8	Very low	205 Å²	205	120.6 Å²	120.6	90%	0.899	68%	0.683	S	S	*	*			trans	16.8	153.8	165.4	-73	-86.3	0	0	0	124.4
1440	S	24.5	Very low	33	Very low	108 Å²	108	119 Å²	119	76%	0.755	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-97.7	127.1	-166.3	53.9	0	0	0	0	114.9
1441	S	25.2	Very low	34.4	Very low	102 Å²	102	115.8 Å²	115.8	71%	0.713	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-70.1	155.2	147.1	49.8	0	0	0	0	110.2	A1443	S1441-A1443 PolarHBondContact O-N 3.5Å
1442	P	32	Very low	35.3	Very low	72 Å²	72	108.9 Å²	108.9	47%	0.468	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-67.6	125.8	-176.7	27.3	-34.8	0	0	0	110.6	L1444	P1442-L1444 PolarHBondContact O-N 3.11Å; P1442-L1444 VanDerWaalsContact O-N 3.1Å
1443	A	31.4	Very low	37.1	Very low	89 Å²	89	104.9 Å²	104.9	74%	0.736	61%	0.611	S	S	*	*			trans	-59.4	115.9	-178.6	0	0	0	0	0	111.4	S1441	S1441-A1443 PolarHBondContact O-N 3.5Å
1444	L	36.4	Very low	38.9	Very low	101 Å²	101	100.7 Å²	100.7	53%	0.529	60%	0.598	S	S	.	*			trans	-66.1	135.6	163.2	-83.1	76.1	0	0	0	108.1	P1442 Q1448 L1452	P1442-L1444 PolarHBondContact O-N 3.11Å; P1442-L1444 VanDerWaalsContact O-N 3.1Å; L1444-Q1448 HydrophobicContact CB-CB 4.18Å; L1444-Q1448 HydrophobicContact CD2-CB 4.34Å; L1444-Q1448 HydrophobicContact CG-CB 4.42Å; L1444-L1452 HydrophobicContact CD2-CD1 4.46Å
1445	T	54.4	Low	40.1	Very low	34 Å²	34	98.1 Å²	98.1	21%	0.209	58%	0.576	C	S	.	*			trans	-68.1	156	177.8	75.7	0	0	0	0	110.6	E397 A1447 Q1448 L1449	E397-T1445 HydrophobicContact CG-CG2 4.01Å; E397-T1445 WeakPolarHBondContact OE1-CB 3.41Å; E397-T1445 WeakPolarHBondContact OE1-CG2 3.46Å; E397-T1445 WeakPolarHBondContact OE2-CB 3.4Å; T1445-A1447 PolarHBondContact O-N 2.96Å; T1445-A1447 VanDerWaalsContact O-N 3.12Å; T1445-Q1448 WeakPolarHBondContact O-CA 3.37Å; T1445-Q1448 WeakPolarHBondContact O-CB 3.38Å; T1445-Q1448 PolarHBondContact O-N 2.87Å; T1445-Q1448 WeakPolarHBondContact OG1-CG 3.43Å; T1445-Q1448 PolarHBondContact OG1-N 3.22Å; T1445-L1449 PolarHBondContact O-N 2.94Å
1446	P	49.4	Very low	41.1	Very low	93 Å²	93	95.9 Å²	95.9	60%	0.604	56%	0.561	S	S	*	*	H	α-helix	trans	-57.3	-28.7	176	-25.7	35.5	0	0	0	113.2	T1450	P1446-T1450 PolarHBondContact O-N 3.15Å; P1446-T1450 PolarHBondContact O-OG1 3.42Å
1447	A	48.2	Very low	42.4	Very low	56 Å²	56	90.9 Å²	90.9	46%	0.463	54%	0.541	S	S	.	.	H	α-helix	trans	-69.9	-36.9	172.3	0	0	0	0	0	112.8	T1445 T1450 S1451	T1445-A1447 PolarHBondContact O-N 2.96Å; T1445-A1447 VanDerWaalsContact O-N 3.12Å; A1447-T1450 WeakPolarHBondContact CA-OG1 3.47Å; A1447-T1450 PolarHBondContact O-OG1 3.31Å; A1447-S1451 WeakPolarHBondContact O-CB 3.4Å; A1447-S1451 PolarHBondContact O-N 3.09Å; A1447-S1451 PolarHBondContact O-OG 3.48Å
1448	Q	47.9	Very low	44	Very low	50 Å²	50	92.6 Å²	92.6	23%	0.234	53%	0.526	C	S	.	.	H	α-helix	trans	-68	-44.9	172.3	-71.4	175.9	-40.2	0	0	110.9	L1444 T1445 T1450 S1451 L1452	L1444-Q1448 HydrophobicContact CB-CB 4.18Å; L1444-Q1448 HydrophobicContact CD2-CB 4.34Å; L1444-Q1448 HydrophobicContact CG-CB 4.42Å; T1445-Q1448 WeakPolarHBondContact O-CA 3.37Å; T1445-Q1448 WeakPolarHBondContact O-CB 3.38Å; T1445-Q1448 PolarHBondContact O-N 2.87Å; T1445-Q1448 WeakPolarHBondContact OG1-CG 3.43Å; T1445-Q1448 PolarHBondContact OG1-N 3.22Å; Q1448-T1450 PolarHBondContact O-N 3.19Å; Q1448-S1451 WeakPolarHBondContact CA-OG 3.48Å; Q1448-S1451 PolarHBondContact O-N 3.31Å; Q1448-S1451 PolarHBondContact O-OG 2.8Å; Q1448-L1452 WeakPolarHBondContact O-CB 3.39Å; Q1448-L1452 PolarHBondContact O-N 3.13Å
1449	L	56.4	Low	44.4	Very low	97 Å²	97	88.5 Å²	88.5	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-58.6	-46.2	176.5	-165.1	100.1	0	0	0	112.1	T1445 L1452 Q1453	T1445-L1449 PolarHBondContact O-N 2.94Å; L1449-L1452 PolarHBondContact O-N 2.64Å; L1449-Q1453 PolarHBondContact O-N 3.13Å
1450	T	52	Low	45.2	Very low	81 Å²	81	83 Å²	83	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-68.6	-34	176.7	43.1	0	0	0	0	112.9	P1446 A1447 Q1448 L1452 Q1453 A1454	P1446-T1450 PolarHBondContact O-N 3.15Å; P1446-T1450 PolarHBondContact O-OG1 3.42Å; A1447-T1450 WeakPolarHBondContact CA-OG1 3.47Å; A1447-T1450 PolarHBondContact O-OG1 3.31Å; Q1448-T1450 PolarHBondContact O-N 3.19Å; T1450-L1452 VanDerWaalsContact C-N 3.3Å; T1450-L1452 PolarHBondContact O-N 3.17Å; T1450-Q1453 PolarHBondContact O-N 3.15Å; T1450-A1454 WeakPolarHBondContact O-CB 3.42Å; T1450-A1454 PolarHBondContact O-N 3.13Å
1451	S	49.6	Very low	46.1	Very low	46 Å²	46	85 Å²	85	32%	0.322	48%	0.482	S	S	.	.	H	α-helix	trans	-66.1	-32.7	171.2	74	0	0	0	0	112.7	Y452 A1447 Q1448 Y1455	Y452-S1451 PolarHBondContact OH-OG 2.9Å; A1447-S1451 WeakPolarHBondContact O-CB 3.4Å; A1447-S1451 PolarHBondContact O-N 3.09Å; A1447-S1451 PolarHBondContact O-OG 3.48Å; Q1448-S1451 WeakPolarHBondContact CA-OG 3.48Å; Q1448-S1451 PolarHBondContact O-N 3.31Å; Q1448-S1451 PolarHBondContact O-OG 2.8Å; S1451-Y1455 WeakPolarHBondContact O-CB 3.39Å; S1451-Y1455 PolarHBondContact O-N 3.28Å
1452	L	46.9	Very low	46.6	Very low	89 Å²	89	86.5 Å²	86.5	47%	0.466	48%	0.479	S	S	.	.	H	α-helix	trans	-76.4	-37.1	176.8	-164.1	146	0	0	0	111.5	L1444 Q1448 L1449 T1450 Y1455 T1456	L1444-L1452 HydrophobicContact CD2-CD1 4.46Å; Q1448-L1452 WeakPolarHBondContact O-CB 3.39Å; Q1448-L1452 PolarHBondContact O-N 3.13Å; L1449-L1452 PolarHBondContact O-N 2.64Å; T1450-L1452 VanDerWaalsContact C-N 3.3Å; T1450-L1452 PolarHBondContact O-N 3.17Å; L1452-Y1455 PolarHBondContact O-N 3.5Å; L1452-T1456 HydrophobicContact CD2-CG2 4.4Å; L1452-T1456 PolarHBondContact O-N 3.35Å; L1452-T1456 PolarHBondContact O-OG1 3.34Å
1453	Q	58.1	Low	46.6	Very low	108 Å²	108	86.6 Å²	86.6	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-63.9	-42.8	168.9	-75.1	-175.9	-62.8	0	0	112.3	L1449 T1450 Y1455 T1456 E1457	L1449-Q1453 PolarHBondContact O-N 3.13Å; T1450-Q1453 PolarHBondContact O-N 3.15Å; Q1453-Y1455 VanDerWaalsContact C-N 3.26Å; Q1453-Y1455 PolarHBondContact O-N 3.37Å; Q1453-T1456 WeakPolarHBondContact CA-OG1 3.25Å; Q1453-T1456 PolarHBondContact O-N 3.27Å; Q1453-T1456 PolarHBondContact O-OG1 2.84Å; Q1453-T1456 VanDerWaalsContact O-OG1 3.12Å; Q1453-E1457 WeakPolarHBondContact O-CB 3.2Å; Q1453-E1457 PolarHBondContact O-N 3.04Å
1454	A	59.8	Low	46.5	Very low	56 Å²	56	87.5 Å²	87.5	46%	0.463	48%	0.475	S	S	.	.	H	α-helix	trans	-63.1	-35.2	174.7	0	0	0	0	0	111.6	T1450 W1458	T1450-A1454 WeakPolarHBondContact O-CB 3.42Å; T1450-A1454 PolarHBondContact O-N 3.13Å; A1454-W1458 WeakPolarHBondContact O-CB 3.41Å; A1454-W1458 PolarHBondContact O-N 2.96Å
1455	Y	45.6	Very low	46.2	Very low	112 Å²	112	92 Å²	92	44%	0.439	49%	0.486	S	S	.	.	H	α-helix	trans	-70.1	-36.9	174.3	-175.3	-99.9	0	0	0	113	S1451 L1452 Q1453 W1458 S1459	S1451-Y1455 WeakPolarHBondContact O-CB 3.39Å; S1451-Y1455 PolarHBondContact O-N 3.28Å; L1452-Y1455 PolarHBondContact O-N 3.5Å; Q1453-Y1455 VanDerWaalsContact C-N 3.26Å; Q1453-Y1455 PolarHBondContact O-N 3.37Å; Y1455-W1458 HydrophobicContact CD2-CE3 4.35Å; Y1455-W1458 HydrophobicContact CE2-CE3 4.28Å; Y1455-W1458 HydrophobicContact CE2-CZ3 4.3Å; Y1455-W1458 PolarHBondContact O-N 3.36Å; Y1455-S1459 WeakPolarHBondContact O-CB 3.47Å; Y1455-S1459 PolarHBondContact O-N 3.23Å; Y1455-S1459 PolarHBondContact O-OG 3.11Å
1456	T	48.2	Very low	44.9	Very low	64 Å²	64	98.9 Å²	98.9	39%	0.393	51%	0.513	S	S	.	.	H	α-helix	trans	-77	-33.4	175.5	54.3	0	0	0	0	113.2	L1452 Q1453 W1458 S1459 T1460	L1452-T1456 HydrophobicContact CD2-CG2 4.4Å; L1452-T1456 PolarHBondContact O-N 3.35Å; L1452-T1456 PolarHBondContact O-OG1 3.34Å; Q1453-T1456 WeakPolarHBondContact CA-OG1 3.25Å; Q1453-T1456 PolarHBondContact O-N 3.27Å; Q1453-T1456 PolarHBondContact O-OG1 2.84Å; Q1453-T1456 VanDerWaalsContact O-OG1 3.12Å; T1456-W1458 VanDerWaalsContact C-N 3.28Å; T1456-W1458 PolarHBondContact O-N 3.24Å; T1456-S1459 WeakPolarHBondContact CA-OG 3.47Å; T1456-S1459 PolarHBondContact O-OG 2.89Å; T1456-T1460 WeakPolarHBondContact O-CB 3.27Å; T1456-T1460 WeakPolarHBondContact O-CG2 3.22Å; T1456-T1460 PolarHBondContact O-N 3.33Å; T1456-T1460 PolarHBondContact O-OG1 3.48Å
1457	E	52.1	Low	43.8	Very low	111 Å²	111	98.4 Å²	98.4	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-37.6	165.5	-87.2	-152.5	90.8	0	0	111.9	Q1453 T1460 K1461	Q1453-E1457 WeakPolarHBondContact O-CB 3.2Å; Q1453-E1457 PolarHBondContact O-N 3.04Å; E1457-T1460 WeakPolarHBondContact CA-OG1 3.49Å; E1457-T1460 PolarHBondContact O-OG1 3.25Å; E1457-K1461 WeakPolarHBondContact O-CB 3.41Å; E1457-K1461 WeakPolarHBondContact O-CD 3.41Å; E1457-K1461 VanDerWaalsContact O-CG 3.23Å; E1457-K1461 WeakPolarHBondContact O-CG 3.48Å; E1457-K1461 PolarHBondContact O-N 2.96Å; E1457-K1461 VanDerWaalsContact O-N 3.16Å; E1457-K1461 IonicContact OE1-NZ 3.44Å; E1457-K1461 PolarHBondContact OE1-NZ 3.28Å
1458	W	54.9	Low	42.7	Very low	135 Å²	135	103 Å²	103	51%	0.511	53%	0.534	S	S	.	.	H	α-helix	trans	-74.5	-38.7	179.2	-176.9	78.3	0	0	0	112.5	A1454 Y1455 T1456 M1462	A1454-W1458 WeakPolarHBondContact O-CB 3.41Å; A1454-W1458 PolarHBondContact O-N 2.96Å; Y1455-W1458 HydrophobicContact CD2-CE3 4.35Å; Y1455-W1458 HydrophobicContact CE2-CE3 4.28Å; Y1455-W1458 HydrophobicContact CE2-CZ3 4.3Å; Y1455-W1458 PolarHBondContact O-N 3.36Å; T1456-W1458 VanDerWaalsContact C-N 3.28Å; T1456-W1458 PolarHBondContact O-N 3.24Å; W1458-M1462 HydrophobicContact CZ2-CE 4.29Å; W1458-M1462 WeakPolarHBondContact O-CG 3.37Å; W1458-M1462 PolarHBondContact O-N 2.89Å
1459	S	35.2	Very low	41.6	Very low	50 Å²	50	106.7 Å²	106.7	35%	0.35	56%	0.562	S	S	.	*	H	α-helix	trans	-70.1	-40	176.5	70.6	0	0	0	0	112.6	Y1455 T1456 M1462 N1463	Y1455-S1459 WeakPolarHBondContact O-CB 3.47Å; Y1455-S1459 PolarHBondContact O-N 3.23Å; Y1455-S1459 PolarHBondContact O-OG 3.11Å; T1456-S1459 WeakPolarHBondContact CA-OG 3.47Å; T1456-S1459 PolarHBondContact O-OG 2.89Å; S1459-M1462 PolarHBondContact O-N 2.91Å; S1459-M1462 VanDerWaalsContact O-N 3.16Å; S1459-N1463 PolarHBondContact O-N 3.47Å
1460	T	40.8	Very low	40.1	Very low	90 Å²	90	107.2 Å²	107.2	55%	0.552	57%	0.569	S	S	*	*	H	α-helix	trans	-66.3	-36.6	174.9	49.6	0	0	0	0	112.4	T1456 E1457 M1462	T1456-T1460 WeakPolarHBondContact O-CB 3.27Å; T1456-T1460 WeakPolarHBondContact O-CG2 3.22Å; T1456-T1460 PolarHBondContact O-N 3.33Å; T1456-T1460 PolarHBondContact O-OG1 3.48Å; E1457-T1460 WeakPolarHBondContact CA-OG1 3.49Å; E1457-T1460 PolarHBondContact O-OG1 3.25Å; T1460-M1462 PolarHBondContact O-N 3.11Å
1461	K	44.4	Very low	38.9	Very low	149 Å²	149	109.7 Å²	109.7	65%	0.648	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-14.1	172.6	-75.7	167.9	-170.5	153.8	0	114.2	E1457	E1457-K1461 WeakPolarHBondContact O-CB 3.41Å; E1457-K1461 WeakPolarHBondContact O-CD 3.41Å; E1457-K1461 VanDerWaalsContact O-CG 3.23Å; E1457-K1461 WeakPolarHBondContact O-CG 3.48Å; E1457-K1461 PolarHBondContact O-N 2.96Å; E1457-K1461 VanDerWaalsContact O-N 3.16Å; E1457-K1461 IonicContact OE1-NZ 3.44Å; E1457-K1461 PolarHBondContact OE1-NZ 3.28Å
1462	M	34.1	Very low	37.9	Very low	133 Å²	133	115 Å²	115	66%	0.655	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-4.7	-178.5	-84.8	-71.2	-174.7	0	0	114.6	W1458 S1459 T1460	W1458-M1462 HydrophobicContact CZ2-CE 4.29Å; W1458-M1462 WeakPolarHBondContact O-CG 3.37Å; W1458-M1462 PolarHBondContact O-N 2.89Å; S1459-M1462 PolarHBondContact O-N 2.91Å; S1459-M1462 VanDerWaalsContact O-N 3.16Å; T1460-M1462 PolarHBondContact O-N 3.11Å
1463	N	32.4	Very low	36.8	Very low	74 Å²	74	116.9 Å²	116.9	40%	0.396	62%	0.621	S	S	.	*			trans	-141.5	100.2	-178	-160.7	-8.4	0	0	0	112.1	S1459 Y1465	S1459-N1463 PolarHBondContact O-N 3.47Å; N1463-Y1465 PolarHBondContact O-N 2.87Å
1464	P	29.2	Very low	35.4	Very low	109 Å²	109	118.4 Å²	118.4	71%	0.708	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	9.7	-163.6	31.9	-37.1	0	0	0	115.7
1465	Y	31.4	Very low	33.8	Very low	196 Å²	196	122.7 Å²	122.7	77%	0.769	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	2.2	-171.7	-73.7	-71.2	0	0	0	116.1	N1463	N1463-Y1465 PolarHBondContact O-N 2.87Å
1466	F	26	Very low	32.9	Very low	178 Å²	178	121 Å²	121	78%	0.781	67%	0.671	S	S	*	*			trans	-121.9	78.9	174	-89.3	-84.7	0	0	0	112.4
1467	A	26.4	Very low	31.9	Very low	83 Å²	83	123.3 Å²	123.3	69%	0.686	69%	0.689	S	S	*	*			trans	-138.3	62.4	174.8	0	0	0	0	0	111.7
1468	N	25.1	Very low	30.7	Very low	152 Å²	152	123.9 Å²	123.9	81%	0.813	70%	0.7	S	S	*	*			trans	-149.6	81.7	169.7	-98.8	-26.1	0	0	0	111.7	T1470	N1468-T1470 PolarHBondContact O-N 3.49Å
1469	P	25.9	Very low	29.5	Very low	127 Å²	127	124.9 Å²	124.9	83%	0.825	71%	0.713	S	S	*	*			trans	-94.9	73.6	174.5	36.5	-31.6	0	0	0	111.4
1470	T	24.2	Very low	29.1	Very low	108 Å²	108	127.4 Å²	127.4	66%	0.663	73%	0.729	S	S	*	*			trans	-145.1	144.8	174.1	42.6	0	0	0	0	110.5	N1468	N1468-T1470 PolarHBondContact O-N 3.49Å
1471	V	27.7	Very low	28.5	Very low	134 Å²	134	130 Å²	130	81%	0.812	74%	0.74	S	S	*	*			trans	71.3	125	-178.3	-171.4	0	0	0	0	113.1
1472	M	27.6	Very low	27.7	Very low	158 Å²	158	129.7 Å²	129.7	78%	0.778	75%	0.745	S	S	*	*			cis	-157.4	138.7	-20.3	-128	169.8	174	0	0	108.9
1473	T	23.7	Very low	27.5	Very low	128 Å²	128	128.2 Å²	128.2	79%	0.785	75%	0.747	S	S	*	*			trans	-79.2	130.6	150.6	49.6	0	0	0	0	108.3
1474	N	28.1	Very low	27.3	Very low	139 Å²	139	130 Å²	130	74%	0.743	76%	0.761	S	S	*	*			trans	-175.6	139.1	149.2	-99.2	-13.4	0	0	0	113.2
1475	T	25.9	Very low	27.2	Very low	147 Å²	147	131.8 Å²	131.8	90%	0.902	77%	0.765	S	S	*	*			trans	-133.6	117.8	159.2	49.6	0	0	0	0	107.5
1476	G	28.2	Very low	27	Very low	77 Å²	77	129.3 Å²	129.3	79%	0.794	77%	0.77	S	S	*	*			trans	145.8	108.3	-179.7	0	0	0	0	0	113.4
1477	S	26.5	Very low	26.8	Very low	111 Å²	111	132 Å²	132	78%	0.776	78%	0.775	S	S	*	*			trans	-89.2	177.5	168.3	50.4	0	0	0	0	110.4
1478	V	28.2	Very low	26.6	Very low	124 Å²	124	132.6 Å²	132.6	75%	0.752	77%	0.774	S	S	*	*			cis	-130.4	-158.1	3	-133.8	0	0	0	0	108
1479	I	28.4	Very low	26.5	Very low	155 Å²	155	130.3 Å²	130.3	80%	0.795	77%	0.77	S	S	*	*			cis	-135.7	140.9	11.4	-55.9	167.2	0	0	0	107.7
1480	P	28.1	Very low	26.5	Very low	104 Å²	104	134.8 Å²	134.8	68%	0.675	77%	0.772	S	S	*	*			trans	-86.8	163.9	-178.9	35.8	-37.3	0	0	0	114.2
1481	N	28.1	Very low	26.7	Very low	145 Å²	145	135.9 Å²	135.9	78%	0.775	77%	0.773	S	S	*	*			trans	-156.3	120.4	156.9	-111.7	-36.9	0	0	0	114.1
1482	N	27.8	Very low	26.6	Very low	142 Å²	142	136.5 Å²	136.5	76%	0.759	77%	0.767	S	S	*	*			trans	65.4	139.8	148.5	-63	-22.5	0	0	0	125.5
1483	S	28.4	Very low	26.6	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	76%	0.759	S	S	*	*			trans	83	79.8	145.1	44.8	0	0	0	0	122.9
1484	T	28.6	Very low	26.8	Very low	112 Å²	112	136.9 Å²	136.9	69%	0.687	76%	0.757	S	S	*	*				54	119.8	113.4	57	0	0	0	0	123.6
1485	N	26.5	Very low	26.7	Very low	146 Å²	146	136.5 Å²	136.5	78%	0.781	75%	0.751	S	S	*	*				63.9	121	124.5	-49.6	-8.2	0	0	0	121.8
1486	V	27.5	Very low	26.9	Very low	144 Å²	144	136.6 Å²	136.6	87%	0.873	75%	0.751	S	S	*	*				173.6	158.8	99.2	158.4	0	0	0	0	110.6
1487	W	22.6	Very low	26.8	Very low	236 Å²	236	138.6 Å²	138.6	89%	0.894	74%	0.744	S	S	*	*			trans	-88.9	157.7	-175.4	-78.2	-9	0	0	0	116.8
1488	S	22.2	Very low	26.8	Very low	95 Å²	95	143.2 Å²	143.2	66%	0.664	75%	0.75	S	S	*	*			trans	61.3	107	135.3	69	0	0	0	0	123.3
1489	S	22.1	Very low	26.7	Very low	103 Å²	103	144.9 Å²	144.9	72%	0.72	75%	0.747	S	S	*	*				58.3	124	125.7	65.3	0	0	0	0	122.8
1490	Y	25.7	Very low	26.7	Very low	222 Å²	222	143.1 Å²	143.1	87%	0.871	75%	0.746	S	S	*	*				-158.7	-177.4	116.7	-121.1	-89	0	0	0	110.5
1491	L	29	Very low	26.6	Very low	131 Å²	131	143.9 Å²	143.9	69%	0.686	74%	0.743	S	S	*	*			trans	-84.7	160.5	-165.5	-73.6	93.8	0	0	0	116.9
1492	E	26.6	Very low	26.6	Very low	147 Å²	147	145.9 Å²	145.9	69%	0.687	75%	0.745	S	S	*	*			trans	13.6	147.6	139.4	-56.9	-164.2	108.6	0	0	121.1
1493	Q	26.4	Very low	26.6	Very low	129 Å²	129	146 Å²	146	60%	0.603	74%	0.739	S	S	*	*			cis	-164	-177.3	-1.4	-120.1	-165.8	58.8	0	0	111.3
1494	H	27.7	Very low	26.5	Very low	165 Å²	165	147.7 Å²	147.7	76%	0.764	75%	0.747	S	S	*	*			trans	97	146	172.4	-61.5	-70.3	0	0	0	117.7
1495	Q	26.3	Very low	26.4	Very low	131 Å²	131	146 Å²	146	61%	0.612	74%	0.74	S	S	*	*			cis	147.3	118.3	-27.8	-98.5	-165.6	-11.5	0	0	109.3
1496	V	30.3	Very low	26.3	Very low	148 Å²	148	145 Å²	145	90%	0.897	74%	0.739	S	S	*	*			trans	-154.9	143.7	160.6	-176.8	0	0	0	0	108.4
1497	N	26.7	Very low	26.3	Very low	119 Å²	119	145.3 Å²	145.3	64%	0.636	73%	0.731	S	S	*	*			cis	-166	137.4	-47.3	-137.3	-25.8	0	0	0	109.7
1498	K	26.4	Very low	26.6	Very low	209 Å²	209	141.4 Å²	141.4	91%	0.909	72%	0.72	S	S	*	*			trans	-175.3	107.3	148.3	-110.4	170.4	-177.2	177.8	0	112.5
1499	F	25.2	Very low	27	Very low	158 Å²	158	142.7 Å²	142.7	69%	0.693	72%	0.724	S	S	*	*			trans	-111.2	168.5	169.1	-78.6	-89.2	0	0	0	110.2	I1501	F1499-I1501 HydrophobicContact CB-CG1 4.49Å
1500	P	28.5	Very low	27.4	Very low	118 Å²	118	143 Å²	143	77%	0.766	73%	0.726	S	S	*	*				-123.9	145	96	3.1	18.4	0	0	0	111.7
1501	I	25.9	Very low	27.5	Very low	121 Å²	121	138.4 Å²	138.4	62%	0.621	72%	0.717	S	S	*	*				83.4	133.9	50.8	-61.5	163	0	0	0	113.1	F1499	F1499-I1501 HydrophobicContact CB-CG1 4.49Å
1502	F	28.5	Very low	27.6	Very low	187 Å²	187	138.5 Å²	138.5	82%	0.82	71%	0.713	S	S	*	*			trans	71.5	146	-173.1	-54.7	-49.8	0	0	0	114.8
1503	K	27.5	Very low	27.7	Very low	145 Å²	145	138.9 Å²	138.9	63%	0.63	71%	0.713	S	S	*	*			cis	-146.1	150.5	-5.7	-133.2	178.9	179.2	-176	0	110	S1505	K1503-S1505 WeakPolarHBondContact CE-O 3.32Å; K1503-S1505 WeakPolarHBondContact CE-OG 3.45Å; K1503-S1505 PolarHBondContact NZ-O 3Å
1504	P	26.2	Very low	27.7	Very low	135 Å²	135	137.4 Å²	137.4	88%	0.877	72%	0.717	S	S	*	*				-136.5	127.4	99.5	35.7	-25.2	0	0	0	113.6
1505	S	25.9	Very low	27.7	Very low	76 Å²	76	139.5 Å²	139.5	53%	0.531	72%	0.724	S	S	.	*			trans	-164.4	142.9	166.5	57.5	0	0	0	0	111.7	K1503	K1503-S1505 WeakPolarHBondContact CE-O 3.32Å; K1503-S1505 WeakPolarHBondContact CE-OG 3.45Å; K1503-S1505 PolarHBondContact NZ-O 3Å
1506	T	24.9	Very low	27.6	Very low	126 Å²	126	144.3 Å²	144.3	77%	0.773	74%	0.737	S	S	*	*			trans	-133.5	169.5	175.6	56	0	0	0	0	109.7
1507	H	29	Very low	28	Very low	151 Å²	151	142 Å²	142	70%	0.699	73%	0.725	S	S	*	*			trans	93.4	145.1	-172.9	-64	-16.5	0	0	0	115.4
1508	K	27.6	Very low	27.8	Very low	154 Å²	154	141.4 Å²	141.4	67%	0.67	73%	0.73	S	S	*	*			cis	-158.2	171.8	-6.8	-123.8	161.9	-177.4	149.1	0	112.5
1509	T	30.3	Very low	27.7	Very low	122 Å²	122	138.7 Å²	138.7	75%	0.748	72%	0.721	S	S	*	*			trans	63.5	135.9	161.2	41	0	0	0	0	117.2
1510	S	30.8	Very low	27.6	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	72%	0.723	S	S	*	*			cis	-154.3	141.9	3.5	47.5	0	0	0	0	110.1
1511	D	28.7	Very low	27.6	Very low	126 Å²	126	143.8 Å²	143.8	67%	0.674	73%	0.73	S	S	*	*			cis	-143.8	-137.5	0.9	-144.5	-137.9	0	0	0	110.1
1512	H	30.4	Very low	27.8	Very low	132 Å²	132	149.4 Å²	149.4	61%	0.611	74%	0.744	S	S	*	*			cis	-145.2	151.9	4.3	-157.5	41	0	0	0	114.1
1513	K	28.5	Very low	28	Very low	156 Å²	156	145.7 Å²	145.7	68%	0.678	74%	0.739	S	S	*	*			trans	42	83.5	162	-79.8	174.2	-177.5	138.4	0	118.3
1514	S	27.3	Very low	27.9	Very low	98 Å²	98	149.8 Å²	149.8	69%	0.685	75%	0.75	S	S	*	*				78.4	143.6	109.8	73.2	0	0	0	0	123.5
1515	F	27	Very low	27.9	Very low	209 Å²	209	152.2 Å²	152.2	92%	0.917	75%	0.747	S	S	*	*			trans	86.1	166	152.4	-87.7	-68	0	0	0	122.2
1516	R	23.7	Very low	28	Very low	232 Å²	232	155.2 Å²	155.2	88%	0.875	76%	0.762	S	S	*	*			trans	-132.2	-157.1	-156.7	-149.2	-165.4	-175.9	-171.2	4.5	109
1517	P	38.7	Very low	28.7	Very low	100 Å²	100	156.1 Å²	156.1	65%	0.649	76%	0.762	S	S	*	*				-109	177.9	-126.1	41.6	-27.2	0	0	0	115.8
1518	S	22.7	Very low	29.5	Very low	106 Å²	106	154.5 Å²	154.5	74%	0.741	77%	0.765	S	S	*	*			trans	81.6	138.5	152.4	81	0	0	0	0	120.2
1519	Q	24.6	Very low	29.7	Very low	152 Å²	152	154.1 Å²	154.1	71%	0.71	77%	0.77	S	S	*	*			trans	58.3	129.8	160	-62.6	-159.9	25.5	0	0	121.8
1520	K	23.5	Very low	29.8	Very low	172 Å²	172	156.5 Å²	156.5	75%	0.748	77%	0.773	S	S	*	*			trans	60.3	95.9	143.8	-64.7	165.1	177.8	152.9	0	118.6
1521	K	28	Very low	29.9	Very low	210 Å²	210	158.2 Å²	158.2	91%	0.913	77%	0.774	S	S	*	*				178.2	134	101.1	-95.7	164.8	-177.4	179	0	113.7
1522	R	30.3	Very low	30	Very low	239 Å²	239	159.5 Å²	159.5	90%	0.902	78%	0.776	S	S	*	*			trans	-66.1	152.7	148.5	-81.8	176.7	173	173.9	-3.2	107.8
1523	P	32	Very low	29.9	Very low	110 Å²	110	161.1 Å²	161.1	71%	0.714	78%	0.781	S	S	*	*				-153.8	172.4	54.8	44.1	-24.2	0	0	0	118.9
1524	R	25.8	Very low	29.9	Very low	231 Å²	231	160.3 Å²	160.3	87%	0.872	78%	0.783	S	S	*	*			trans	34.5	149.7	134.4	-66.7	179	177.4	175.2	-1.9	120.4
1525	K	26.1	Very low	30.1	Very low	185 Å²	185	162.1 Å²	162.1	80%	0.804	78%	0.783	S	S	*	*			cis	-178.8	156.8	-10.4	-119.3	-168.9	170.3	-159.5	0	105.3
1526	T	28.3	Very low	30.2	Very low	139 Å²	139	158.8 Å²	158.8	85%	0.853	78%	0.775	S	S	*	*			trans	176.7	132.2	130.2	30	0	0	0	0	110.6
1527	N	39.8	Very low	30.6	Very low	146 Å²	146	153 Å²	153	78%	0.781	77%	0.768	S	S	*	*			trans	-102.6	165.1	153.3	-60.2	9.9	0	0	0	107.1
1528	P	45	Very low	30	Very low	116 Å²	116	155.5 Å²	155.5	75%	0.753	78%	0.776	S	S	*	*			trans	-90.6	-152.1	147.9	39.8	-33.2	0	0	0	110.3
1529	D	33	Very low	30.3	Very low	147 Å²	147	158.8 Å²	158.8	79%	0.786	78%	0.776	S	S	*	*				-162.6	-176	-107.4	-70.2	-42.9	0	0	0	105.3
1530	E	31.4	Very low	30.4	Very low	172 Å²	172	158.3 Å²	158.3	80%	0.804	77%	0.774	S	S	*	*			cis	-149.8	-174.1	8	-154.8	170.7	-173.1	0	0	109.1
1531	N	33.8	Very low	30.6	Very low	145 Å²	145	158 Å²	158	78%	0.775	77%	0.773	S	S	*	*			trans	69.8	134.4	-178.2	-54.6	-24.4	0	0	0	115.3
1532	E	29.9	Very low	30.4	Very low	153 Å²	153	155.4 Å²	155.4	72%	0.715	76%	0.764	S	S	*	*			cis	-149.4	152.4	2.2	-135	-175.8	-172.4	0	0	111.8
1533	F	28.6	Very low	30.7	Very low	165 Å²	165	148.8 Å²	148.8	72%	0.724	75%	0.752	S	S	*	*			trans	53.4	122.3	160.3	-69.6	-58.1	0	0	0	124.7
1534	I	28.8	Very low	30.2	Very low	139 Å²	139	149.1 Å²	149.1	71%	0.713	75%	0.753	S	S	*	*				100.4	96.4	127.5	-73.9	169	0	0	0	121.6
1535	I	31.2	Very low	30.2	Very low	137 Å²	137	144.1 Å²	144.1	70%	0.703	75%	0.748	S	S	*	*			trans	79.5	101.6	132.9	-59.6	179.8	0	0	0	121.1
1536	N	28	Very low	30.2	Very low	138 Å²	138	142.9 Å²	142.9	74%	0.738	75%	0.749	S	S	*	*			trans	54.6	127.1	136.4	-67.6	-12.9	0	0	0	123.3
1537	P	32.8	Very low	30.2	Very low	112 Å²	112	142.3 Å²	142.3	73%	0.727	75%	0.745	S	S	*	*			trans	-80.2	158.6	135.9	36.8	-32.5	0	0	0	111.1
1538	N	25.5	Very low	29.6	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	75%	0.748	S	S	*	*			trans	-173.7	159.6	143.5	-104.7	-35.1	0	0	0	113.8
1539	K	30	Very low	29.2	Very low	174 Å²	174	145 Å²	145	76%	0.757	75%	0.751	S	S	*	*			trans	79.7	122.9	177.4	-57.8	-155.6	168.2	-175.9	0	115.8
1540	E	26.5	Very low	28.9	Very low	142 Å²	142	145.1 Å²	145.1	66%	0.664	75%	0.752	S	S	*	*				79.2	140.8	50	-69.7	175.6	148.1	0	0	112.8
1541	F	27.5	Very low	28.9	Very low	165 Å²	165	142.3 Å²	142.3	72%	0.724	75%	0.746	S	S	*	*			cis	-140.4	-165.9	3	-134.1	-79.4	0	0	0	110.7
1542	Q	24.6	Very low	28.5	Very low	157 Å²	157	146.5 Å²	146.5	73%	0.734	75%	0.753	S	S	*	*			trans	-76.3	-167.2	178.2	-57.5	178.4	9.3	0	0	113.2
1543	P	35.4	Very low	28.3	Very low	100 Å²	100	143.7 Å²	143.7	65%	0.649	75%	0.75	S	S	*	*				-132.3	-171.5	-57.7	33.2	-14.9	0	0	0	113.9
1544	T	23.2	Very low	28.1	Very low	117 Å²	117	143.1 Å²	143.1	72%	0.718	75%	0.754	S	S	*	*			trans	81.2	135.2	151.8	23.3	0	0	0	0	121.9
1545	T	24.3	Very low	27.9	Very low	125 Å²	125	143 Å²	143	77%	0.767	76%	0.76	S	S	*	*			trans	56.8	102.8	155.9	50.1	0	0	0	0	120.3
1546	L	27.2	Very low	27.7	Very low	160 Å²	160	144.2 Å²	144.2	84%	0.838	77%	0.767	S	S	*	*			trans	-153.7	128.7	136.2	-138.1	75.2	0	0	0	113.6
1547	T	27.9	Very low	27.6	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	77%	0.771	S	S	*	*			trans	50.1	145.5	145.5	49.7	0	0	0	0	125.6
1548	K	27.7	Very low	27.3	Very low	194 Å²	194	143.4 Å²	143.4	84%	0.843	77%	0.774	S	S	*	*			trans	-64.2	-172.2	154.5	-57.3	179.7	178.5	176.5	0	110.5
1549	P	35.5	Very low	27.6	Very low	124 Å²	124	144.4 Å²	144.4	81%	0.805	78%	0.779	S	S	*	*			cis	-153.1	-152.1	24.1	46.6	-21.9	0	0	0	117.4
1550	N	27.2	Very low	27.4	Very low	150 Å²	150	141.1 Å²	141.1	80%	0.802	78%	0.778	S	S	*	*			trans	-70.7	152.3	-179.4	-73.7	-11.6	0	0	0	115
1551	V	31.6	Very low	27.5	Very low	114 Å²	114	143.7 Å²	143.7	69%	0.691	79%	0.79	S	S	*	*			trans	52.6	113.4	144.6	177.9	0	0	0	0	118.3
1552	Y	26.2	Very low	27.6	Very low	232 Å²	232	140.6 Å²	140.6	91%	0.91	79%	0.794	S	S	*	*				-165.3	-176.4	119.7	-100.5	-64.4	0	0	0	109.9
1553	S	24.2	Very low	27.6	Very low	95 Å²	95	142.3 Å²	142.3	66%	0.664	80%	0.802	S	S	*	*			trans	-118.3	166.8	-164.2	54.3	0	0	0	0	115.2
1554	L	24	Very low	27.3	Very low	153 Å²	153	145.1 Å²	145.1	80%	0.801	81%	0.811	S	S	*	*			trans	72.2	99	161.7	-71.5	160.6	0	0	0	119.2
1555	T	26	Very low	27.4	Very low	136 Å²	136	144.4 Å²	144.4	83%	0.834	81%	0.81	S	S	*	*				171	132.3	110.2	31.7	0	0	0	0	107.6
1556	L	25.8	Very low	27.5	Very low	162 Å²	162	144.8 Å²	144.8	85%	0.848	81%	0.812	S	S	*	*			cis	115.9	99.3	24.8	-178.9	115.4	0	0	0	109.6
1557	S	26.1	Very low	27.4	Very low	119 Å²	119	142.1 Å²	142.1	83%	0.832	81%	0.806	S	S	*	*			trans	-160.3	161.2	141.6	53.8	0	0	0	0	110.6
1558	C	26.2	Very low	27.2	Very low	115 Å²	115	143.1 Å²	143.1	78%	0.777	81%	0.806	S	S	*	*			trans	-57.1	143.3	-163.3	-52.2	0	0	0	0	117
1559	D	31.7	Very low	27.1	Very low	172 Å²	172	140.7 Å²	140.7	92%	0.92	79%	0.793	S	S	*	*				-127.4	152.7	108.1	-112.9	-35	0	0	0	108
1560	S	26.9	Very low	26.6	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	78%	0.784	S	S	*	*			trans	-126.1	109.9	-156	59.3	0	0	0	0	115.9
1561	E	28.4	Very low	26.5	Very low	196 Å²	196	145 Å²	145	92%	0.916	78%	0.783	S	S	*	*			trans	-104.8	129.2	151.3	-68.1	-169.7	154.2	0	0	108.8	E1563	E1561-E1563 PolarHBondContact O-N 2.79Å
1562	A	29	Very low	26.2	Very low	100 Å²	100	145 Å²	145	83%	0.826	78%	0.776	S	S	*	*			trans	-87.2	109.1	-168.9	0	0	0	0	0	112.8	L1564	A1562-L1564 PolarHBondContact O-N 3.22Å
1563	E	26	Very low	26.2	Very low	193 Å²	193	142.2 Å²	142.2	90%	0.902	78%	0.776	S	S	*	*			trans	-64.5	101	160.9	-76	-161.9	130	0	0	109.5	E1561 C1565	E1561-E1563 PolarHBondContact O-N 2.79Å; E1563-C1565 PolarHBondContact O-N 3.28Å
1564	L	27.4	Very low	26.4	Very low	159 Å²	159	145.5 Å²	145.5	83%	0.832	78%	0.781	S	S	*	*			trans	-66.6	118.5	176.9	-173.5	69.5	0	0	0	110.3	A1562 T1566	A1562-L1564 PolarHBondContact O-N 3.22Å; L1564-T1566 PolarHBondContact O-N 2.98Å
1565	C	25.6	Very low	26.5	Very low	103 Å²	103	146.6 Å²	146.6	70%	0.696	78%	0.779	S	S	*	*			trans	-52.7	110.4	178.9	-72.5	0	0	0	0	112.2	E1563 C1567	E1563-C1565 PolarHBondContact O-N 3.28Å; C1565-C1567 PolarHBondContact O-N 3.16Å
1566	T	27.6	Very low	26.6	Very low	132 Å²	132	144.8 Å²	144.8	81%	0.81	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	55.3	174	65	0	0	0	0	111.9	L1564	L1564-T1566 PolarHBondContact O-N 2.98Å
1567	C	25	Very low	26.6	Very low	104 Å²	104	146.2 Å²	146.2	70%	0.703	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-14	170.7	-72.5	0	0	0	0	112.3	C1565	C1565-C1567 PolarHBondContact O-N 3.16Å
1568	D	23.7	Very low	26.6	Very low	147 Å²	147	149.1 Å²	149.1	79%	0.786	78%	0.777	S	S	*	*			trans	-101.9	108.2	171.4	-81.2	-61.2	0	0	0	112
1569	Y	25.4	Very low	26.6	Very low	144 Å²	144	152.1 Å²	152.1	57%	0.565	78%	0.778	S	S	*	*			trans	-157	49	161.8	-127.4	-59	0	0	0	113.2	E1572	Y1569-E1572 HydrophobicContact CE1-CB 4.13Å; Y1569-E1572 HydrophobicContact CE1-CG 4.2Å; Y1569-E1572 WeakPolarHBondContact CE1-OE2 3.25Å; Y1569-E1572 VanDerWaalsContact CZ-OE2 3.23Å; Y1569-E1572 PolarHBondContact OH-OE2 3.44Å
1570	W	24.8	Very low	26.3	Very low	161 Å²	161	153.3 Å²	153.3	61%	0.61	78%	0.775	S	S	*	*	S	Bend	trans	-117.3	-1.5	-179.4	-96.6	109.4	0	0	0	115.4
1571	Y	25.4	Very low	26.1	Very low	202 Å²	202	154.1 Å²	154.1	79%	0.792	78%	0.776	S	S	*	*	S	Bend	trans	-119	20.9	-173.3	-117.6	-70.7	0	0	0	116.5
1572	E	24.7	Very low	26	Very low	114 Å²	114	151.6 Å²	151.6	53%	0.533	77%	0.767	S	S	.	*			trans	-116.8	-5.8	-179.3	-71.5	-150.2	121.7	0	0	116.3	Y1569 E1574	Y1569-E1572 HydrophobicContact CE1-CB 4.13Å; Y1569-E1572 HydrophobicContact CE1-CG 4.2Å; Y1569-E1572 WeakPolarHBondContact CE1-OE2 3.25Å; Y1569-E1572 VanDerWaalsContact CZ-OE2 3.23Å; Y1569-E1572 PolarHBondContact OH-OE2 3.44Å; E1572-E1574 PolarHBondContact O-N 3.4Å
1573	L	27	Very low	25.8	Very low	175 Å²	175	152.5 Å²	152.5	92%	0.916	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	1.9	178.8	-141.6	79.6	0	0	0	114
1574	E	27.8	Very low	25.9	Very low	163 Å²	163	150.3 Å²	150.3	76%	0.762	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-9	-177.4	-157.4	146.9	-122.1	0	0	113	E1572	E1572-E1574 PolarHBondContact O-N 3.4Å
1575	K	27	Very low	25.9	Very low	177 Å²	177	148.5 Å²	148.5	77%	0.77	76%	0.755	S	S	*	*	S	Bend	trans	-94.5	3.1	176.3	-82.3	-177.1	174.6	175.3	0	114.9	K1577	K1575-K1577 PolarHBondContact O-N 3.5Å
1576	A	27.5	Very low	25.8	Very low	97 Å²	97	148.9 Å²	148.9	80%	0.802	76%	0.758	S	S	*	*			trans	-80.7	14.4	174.8	0	0	0	0	0	114.1
1577	K	26.5	Very low	25.9	Very low	192 Å²	192	149.5 Å²	149.5	84%	0.835	76%	0.756	S	S	*	*			trans	-116.7	78.8	171.4	-79	-174.4	175.8	178.4	0	110.7	K1575	K1575-K1577 PolarHBondContact O-N 3.5Å
1578	E	25.7	Very low	26.1	Very low	180 Å²	180	155.2 Å²	155.2	84%	0.841	76%	0.763	S	S	*	*			trans	-164.9	163.9	147.6	-119.5	174.5	-150.5	0	0	112
1579	K	26.2	Very low	26.4	Very low	179 Å²	179	152.6 Å²	152.6	78%	0.778	76%	0.762	S	S	*	*			trans	58.6	48.4	177.9	-63.3	-172.6	178.8	179.5	0	117.1
1580	F	23.9	Very low	26.6	Very low	196 Å²	196	154.7 Å²	154.7	86%	0.86	78%	0.776	S	S	*	*			trans	-98.3	88.1	130.9	-114.1	-84.5	0	0	0	108.4	I1582	F1580-I1582 PolarHBondContact O-N 3.17Å; F1580-I1582 VanDerWaalsContact O-N 3.15Å
1581	T	23.2	Very low	26.8	Very low	123 Å²	123	151.8 Å²	151.8	76%	0.755	78%	0.781	S	S	*	*			trans	-85.1	80	177.9	48.3	0	0	0	0	110.7
1582	I	27.4	Very low	26.8	Very low	143 Å²	143	149.1 Å²	149.1	73%	0.733	78%	0.78	S	S	*	*			trans	-97.6	125.4	154.2	-63.5	178.1	0	0	0	106.2	F1580 E1584	F1580-I1582 PolarHBondContact O-N 3.17Å; F1580-I1582 VanDerWaalsContact O-N 3.15Å; I1582-E1584 PolarHBondContact O-N 3.1Å
1583	S	23.6	Very low	27.1	Very low	118 Å²	118	150.6 Å²	150.6	83%	0.825	79%	0.791	S	S	*	*			trans	-68.3	123.9	-173	52.5	0	0	0	0	112.1
1584	E	28	Very low	26.9	Very low	148 Å²	148	149.7 Å²	149.7	69%	0.692	79%	0.785	S	S	*	*			trans	-112.1	129.6	167.9	-159.3	151.4	-110.6	0	0	108.4	K398 I1582	K398-E1584 IonicContact NZ-OE1 3.34Å; K398-E1584 PolarHBondContact NZ-OE1 3.03Å; I1582-E1584 PolarHBondContact O-N 3.1Å
1585	P	27	Very low	27	Very low	121 Å²	121	147.4 Å²	147.4	79%	0.786	79%	0.787	S	S	*	*			trans	-72.8	145.4	-175.6	29.6	-34.4	0	0	0	111.3
1586	S	24.8	Very low	26.9	Very low	111 Å²	111	145.8 Å²	145.8	78%	0.776	79%	0.786	S	S	*	*			trans	-63.8	137.6	-177.4	55.7	0	0	0	0	113.8
1587	L	30.3	Very low	27	Very low	144 Å²	144	148.3 Å²	148.3	75%	0.754	79%	0.785	S	S	*	*				-170.3	126.2	121.1	-103.7	166	0	0	0	111.7
1588	R	29	Very low	27.1	Very low	225 Å²	225	146 Å²	146	85%	0.849	78%	0.782	S	S	*	*			trans	45.7	114.4	160.3	-70	174.3	170.6	138.8	-2.4	117.7
1589	A	29.7	Very low	27.2	Very low	92 Å²	92	147 Å²	147	76%	0.76	78%	0.78	S	S	*	*				62.9	128.4	78.2	0	0	0	0	0	112.4
1590	E	29.3	Very low	27.3	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	77%	0.774	S	S	*	*			cis	-132.8	159.8	24.8	-63.9	174.1	126.3	0	0	114.8
1591	S	28	Very low	27.6	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	77%	0.767	S	S	*	*			trans	-61.7	160.6	151.8	50	0	0	0	0	111.4
1592	D	25.7	Very low	27.8	Very low	145 Å²	145	141.9 Å²	141.9	78%	0.775	76%	0.762	S	S	*	*			cis	-157.8	-149.5	-9.9	-121.8	-97.5	0	0	0	105.7
1593	L	30.7	Very low	27.9	Very low	146 Å²	146	141.5 Å²	141.5	76%	0.764	76%	0.762	S	S	*	*			cis	-149.5	-122.6	8.2	-166.2	73.1	0	0	0	108.9
1594	I	24.6	Very low	28.3	Very low	156 Å²	156	139.3 Å²	139.3	80%	0.8	74%	0.741	S	S	*	*			trans	-140.9	128	-179.4	-62	156.5	0	0	0	109.1
1595	S	28.1	Very low	28.7	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	74%	0.737	S	S	*	*				-171.3	159.3	128.8	-160.2	0	0	0	0	111.4
1596	I	25.9	Very low	28.9	Very low	144 Å²	144	139.6 Å²	139.6	74%	0.738	73%	0.726	S	S	*	*			trans	-90.1	133.7	163.3	-61.3	160.9	0	0	0	107
1597	D	28.6	Very low	29	Very low	149 Å²	149	140 Å²	140	80%	0.797	72%	0.724	S	S	*	*				175.5	151.7	129.5	-89.5	-26.4	0	0	0	113
1598	D	29.4	Very low	29	Very low	144 Å²	144	139 Å²	139	77%	0.77	73%	0.729	S	S	*	*			trans	20.5	114.9	166.9	-73.2	-23.6	0	0	0	124.4
1599	Y	28.1	Very low	29.1	Very low	200 Å²	200	132.2 Å²	132.2	78%	0.784	72%	0.722	S	S	*	*				43.1	119.4	109.6	-100.3	-110.5	0	0	0	121.4
1600	I	28.5	Very low	29	Very low	130 Å²	130	133.3 Å²	133.3	67%	0.667	72%	0.719	S	S	*	*			trans	63.6	92.2	148.2	-61.3	-177.1	0	0	0	114.9
1601	I	29	Very low	29	Very low	137 Å²	137	132.9 Å²	132.9	70%	0.703	72%	0.717	S	S	*	*				61.9	113.5	87	-61.5	161.9	0	0	0	112.9
1602	D	29	Very low	28.9	Very low	124 Å²	124	132.7 Å²	132.7	66%	0.663	72%	0.716	S	S	*	*				-148.7	114.6	123.3	-118.1	-6.2	0	0	0	112.1	I1334 K1336	I1334-D1602 HydrophobicContact CD1-CB 4.12Å; K1336-D1602 PolarHBondContact NZ-O 3.03Å
1603	N	29.5	Very low	28.9	Very low	135 Å²	135	133.2 Å²	133.2	72%	0.722	72%	0.718	S	S	*	*			trans	-117.8	145.3	179.5	-117.9	-1.8	0	0	0	107.8
1604	D	31.8	Very low	28.6	Very low	72 Å²	72	132.6 Å²	132.6	39%	0.385	72%	0.715	S	S	.	*			trans	-165.1	123.3	158	-99.8	4.8	0	0	0	103.7	I1334	I1334-D1604 HydrophobicContact CB-CB 3.7Å; I1334-D1604 WeakPolarHBondContact CB-O 3.47Å; I1334-D1604 HydrophobicContact CD1-CB 4.11Å; I1334-D1604 HydrophobicContact CG1-CB 4.07Å; I1334-D1604 WeakPolarHBondContact CG2-O 2.81Å
1605	Y	34.8	Very low	28.6	Very low	153 Å²	153	130.5 Å²	130.5	60%	0.6	72%	0.715	S	S	*	*				66.2	149.9	86.5	-68	-42.2	0	0	0	114.9	T1335	T1335-Y1605 WeakPolarHBondContact CG2-O 3.45Å
1606	Q	31.3	Very low	28.7	Very low	122 Å²	122	132.7 Å²	132.7	57%	0.57	71%	0.714	S	S	*	*			cis	-138.4	136.7	-3.8	-102.9	125.9	22.7	0	0	105.7
1607	T	28.7	Very low	28.8	Very low	119 Å²	119	133.8 Å²	133.8	73%	0.73	72%	0.716	S	S	*	*				61.3	75.7	58.1	71	0	0	0	0	116.2
1608	S	29.8	Very low	28.9	Very low	123 Å²	123	132.8 Å²	132.8	86%	0.86	71%	0.709	S	S	*	*			trans	-172.6	145.2	143.3	49.6	0	0	0	0	110.2
1609	A	30.5	Very low	28.7	Very low	84 Å²	84	132.9 Å²	132.9	69%	0.694	72%	0.715	S	S	*	*			cis	-157.2	164	-23.7	0	0	0	0	0	109.9
1610	T	28.7	Very low	28.9	Very low	114 Å²	114	131 Å²	131	70%	0.699	71%	0.713	S	S	*	*			trans	10.8	141.6	146.4	56.1	0	0	0	0	119.9
1611	E	27.9	Very low	29	Very low	179 Å²	179	129.7 Å²	129.7	84%	0.836	71%	0.711	S	S	*	*			cis	-160.8	-177.6	12.2	-127.6	160.5	-166.6	0	0	113.1
1612	S	26.5	Very low	29.2	Very low	96 Å²	96	129 Å²	129	67%	0.671	71%	0.709	S	S	*	*			trans	-62.8	146.6	-175.2	54.1	0	0	0	0	116.4
1613	L	25.5	Very low	29.4	Very low	157 Å²	157	130.6 Å²	130.6	82%	0.822	71%	0.71	S	S	*	*				-161.2	-177.6	111.4	-131.4	81.9	0	0	0	114.1
1614	N	24.6	Very low	29.5	Very low	132 Å²	132	129.3 Å²	129.3	71%	0.706	71%	0.712	S	S	*	*			trans	-76	168.1	-169.9	-50.6	-47.8	0	0	0	115.2
1615	S	24	Very low	29.5	Very low	113 Å²	113	134.4 Å²	134.4	79%	0.79	73%	0.73	S	S	*	*			trans	66.7	150.3	164	72	0	0	0	0	115
1616	M	30.3	Very low	29.3	Very low	160 Å²	160	134.9 Å²	134.9	79%	0.788	74%	0.737	S	S	*	*			cis	-124.4	155.6	24.2	-95.3	166.2	63.6	0	0	111.9
1617	H	28.7	Very low	29.5	Very low	166 Å²	166	132.7 Å²	132.7	77%	0.769	73%	0.729	S	S	*	*				43.5	130.2	92.1	-81.5	-103.6	0	0	0	113.4
1618	I	31.1	Very low	29.5	Very low	128 Å²	128	136.4 Å²	136.4	66%	0.656	74%	0.735	S	S	*	*			cis	-138.4	135	20.3	-59.7	173.6	0	0	0	111.3	Q1620	I1618-Q1620 HydrophobicContact CG2-CB 3.95Å
1619	V	25.2	Very low	29.5	Very low	147 Å²	147	137.1 Å²	137.1	89%	0.891	73%	0.729	S	S	*	*			trans	-123.7	115.1	137.9	171	0	0	0	0	105.5	T1621	V1619-T1621 PolarHBondContact O-N 2.91Å
1620	Q	30.8	Very low	29.4	Very low	161 Å²	161	139.8 Å²	139.8	75%	0.752	73%	0.731	S	S	*	*			trans	-90.9	106.5	176.9	-171.2	159.3	-19.9	0	0	108.1	I1618	I1618-Q1620 HydrophobicContact CG2-CB 3.95Å
1621	T	31.8	Very low	29.4	Very low	102 Å²	102	141.3 Å²	141.3	63%	0.626	73%	0.733	S	S	*	*			trans	1.8	131	152.5	53	0	0	0	0	116.2	V1619	V1619-T1621 PolarHBondContact O-N 2.91Å
1622	D	32.8	Very low	29.5	Very low	121 Å²	121	139.1 Å²	139.1	65%	0.647	73%	0.726	S	S	*	*				-150.4	141.6	58.6	-125.7	-12.5	0	0	0	121.6
1623	K	34	Very low	29.7	Very low	158 Å²	158	141.8 Å²	141.8	69%	0.687	73%	0.73	S	S	*	*			trans	9.8	124.3	156.2	-66.9	164.1	-157.5	91.4	0	121.7
1624	S	30.2	Very low	30	Very low	109 Å²	109	140.7 Å²	140.7	76%	0.762	72%	0.724	S	S	*	*			trans	80.1	145.1	136.4	85.8	0	0	0	0	117.7
1625	K	31.5	Very low	30.4	Very low	179 Å²	179	141.4 Å²	141.4	78%	0.778	73%	0.725	S	S	*	*			cis	-132.4	167.2	14.9	-70.4	173.1	-179.5	167.2	0	112.6
1626	H	31.8	Very low	30.9	Very low	162 Å²	162	143.5 Å²	143.5	75%	0.75	72%	0.72	S	S	*	*			trans	10.7	136.4	147.3	-72.8	-87	0	0	0	118.6
1627	L	34.4	Very low	30.9	Very low	76 Å²	76	142.2 Å²	142.2	40%	0.398	71%	0.714	S	S	.	*			cis	-168.4	146.1	19.9	-141.2	155.7	0	0	0	110.4	I1375 T1376 P1377	I1375-L1627 CarbonylContact C-O 3.55Å; I1375-L1627 WeakPolarHBondContact CG2-O 3.4Å; T1376-L1627 CarbonylContact C-O 3.59Å; T1376-L1627 WeakPolarHBondContact CA-O 3.43Å; T1376-L1627 PolarHBondContact N-O 3.41Å; P1377-L1627 VanDerWaalsContact N-O 3.09Å; P1377-L1627 WeakPolarHBondContact O-CB 3.42Å
1628	K	28.9	Very low	31.1	Very low	197 Å²	197	140 Å²	140	86%	0.857	71%	0.709	S	S	*	*			trans	-147.8	0	138.2	-166.4	147.3	-154	167.1	0	108.9	T1376	T1376-K1628 WeakPolarHBondContact O-CA 3.35Å; T1376-K1628 VanDerWaalsContact O-CB 3.22Å; T1376-K1628 WeakPolarHBondContact O-CB 3.28Å; T1376-K1628 WeakPolarHBondContact O-CD 3.46Å; T1376-K1628 WeakPolarHBondContact O-CE 3.46Å; T1376-K1628 WeakPolarHBondContact O-CG 3.34Å; T1376-K1628 VanDerWaalsContact OG1-CE 3.3Å; T1376-K1628 WeakPolarHBondContact OG1-CE 3.36Å; T1376-K1628 PolarHBondContact OG1-NZ 3.3Å

Retrieved 1,628 of 1,628 residues in 334.9 ms (Link to these results)

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