A0A087YK49_POEFO Loading...

PR domain zinc finger protein 1

Transcription factor that mediates a transcriptional program in various innate and adaptive immune tissue-resident lymphocyte T cell types such as tissue-resident memory T (Trm), natural killer (trNK) and natural killer T (NKT) cells and negatively regulates gene expression of proteins that promote the egress of tissue-resident T-cell populations from non-lymphoid organs. Plays a role in the development, retention and long-term establishment of adaptive and innate tissue-resident lymphocyte T cell types in non-lymphoid organs, such as the skin and gut, but also in other nonbarrier tissues like liver and kidney, and therefore may provide immediate immunological protection against reactivating infections or viral reinfection. Binds specifically to the PRDI element in the promoter of the beta-interferon gene. Drives the maturation of B-lymphocytes into Ig secreting cells. Associates with the transcriptional repressor ZNF683 to chromatin at gene promoter regions.

AlphaFold DB , UniProt , Accession A0A087YK49, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 844 aa.

						>A0A087YK49_POEFO|A0A087YK49
MCGWDQSYTATSHSSAMLTSEGAHAMEQDGTNHKMASTATSTGSDGAETMTDTDVDMDMEMEEADMTHWGEAEFEEKCTYIVKDTPWEAGPDADFAMTTTRAEASLPRNLVLKHLAGTKEVVGVCSREYIPKGTRFGPLVGEIYTADSVPKDANRKYFWRIFVDGEFHHFVDGLDETRSNWMRYVNPAKSAAEQNLAACQNGMEIYFYTVKPVPAGAELLVWYCHDFARRLRYPPSGELMMQKLKQSLMEVKQQHVDREDSTVEMSSMSPVSMTPTPPKREHSVLSILRGTNSTSSSLAPKREPSRPLPTRPRCADSPERPLYPRALYPLLRPHFPLSEDLLKPSHPGYPLTHSPGKQSSATPSPSARSSPETSPHSSPSGPALSPASIYPYPGYSPPSAPLPSTFYPPHQYPRYLLPHHYPLPGGGVPTVGGIFPRIYPVYGTLMPPHLALLPSDPAARRLVIPEPVHPSSISAHRDYLLPGPRSAFSTATLRDKAGVHSSYPGHPNPHGPAHAPSSGSPTAAIAPPSEQMPTKPTSAHMGNTSERHPDEEAINLTKVKRGAGSAGYKALPYPLKKQNGKIKYECNVCSKTFGQLSNLKVHLRVHSGERPFKCQTCSKGFTQLAHLQKHYLVHTGEKPHECQVCHKRFSSTSNLKTHLRLHSGEKPYHCKLCPAKFTQFVHLKLHKRLHSRERPHKCPHCHRHYIHLVSLRLHLKGYCLAATSGPGCPNVSSQAALEEVHRANEEIERFDVSEHAERLEQLQGSVEMDAMLEKQVLGMLWRESDLKSPNFHPSYNGTATDLLSAGYGPFESPNETSVIKIRRSNPISPVAASITVKQESEDHA
					

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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	27	Very low	26.7	Very low	231 Å²	231	144 Å²	144	100%	1.138	79%	0.793	S	S	*	*				0	151.1	0	-78.8	156.5	58	0	0	108.6
2	C	29.2	Very low	26.8	Very low	130 Å²	130	139.2 Å²	139.2	88%	0.878	78%	0.777	S	S	*	*			trans	26.8	134.7	154.1	-48.9	0	0	0	0	121.2
3	G	25.5	Very low	26.9	Very low	77 Å²	77	141.6 Å²	141.6	79%	0.794	78%	0.778	S	S	*	*			trans	115.4	128.2	157.1	0	0	0	0	0	114.5
4	W	29.3	Very low	27	Very low	251 Å²	251	137.8 Å²	137.8	95%	0.951	77%	0.766	S	S	*	*			trans	-80	158.1	156.8	-60.6	-6.1	0	0	0	108.8
5	D	28.2	Very low	27	Very low	128 Å²	128	136.3 Å²	136.3	68%	0.684	77%	0.769	S	S	*	*				-164.3	166.2	102.4	-140.4	-6.6	0	0	0	115
6	Q	29.2	Very low	27.1	Very low	148 Å²	148	133.4 Å²	133.4	69%	0.692	77%	0.768	S	S	*	*			trans	62.2	104.7	149.1	-78.1	165.5	62.5	0	0	121.8
7	S	25.1	Very low	27.1	Very low	84 Å²	84	136.1 Å²	136.1	59%	0.587	77%	0.774	S	S	*	*				44.5	134.1	124.8	59.6	0	0	0	0	120.8
8	Y	25.6	Very low	27.2	Very low	213 Å²	213	136.6 Å²	136.6	84%	0.835	77%	0.774	S	S	*	*				-164.4	-177.1	77.1	-111.3	-84.8	0	0	0	115
9	T	24.3	Very low	27.4	Very low	112 Å²	112	135.8 Å²	135.8	69%	0.687	77%	0.772	S	S	*	*			trans	-55.6	144.1	-176	47.1	0	0	0	0	119.1
10	A	25.3	Very low	27.6	Very low	88 Å²	88	133.8 Å²	133.8	73%	0.727	77%	0.767	S	S	*	*			trans	58.7	165.3	130.4	0	0	0	0	0	119.5
11	T	25.2	Very low	27.8	Very low	122 Å²	122	136.5 Å²	136.5	75%	0.748	77%	0.773	S	S	*	*			cis	-159.4	143.9	21.7	-29.5	0	0	0	0	112.1
12	S	27.8	Very low	27.8	Very low	86 Å²	86	129 Å²	129	60%	0.601	75%	0.754	S	S	*	*			trans	53.4	158	139.9	63.2	0	0	0	0	124.8
13	H	28	Very low	27.9	Very low	171 Å²	171	127 Å²	127	79%	0.792	75%	0.748	S	S	*	*			trans	73.8	155.9	154.4	-69.5	-55.6	0	0	0	118.9
14	S	27.8	Very low	28	Very low	88 Å²	88	132.3 Å²	132.3	62%	0.615	75%	0.751	S	S	*	*			cis	-174.8	141.1	-36.9	-107.7	0	0	0	0	111.2
15	S	27.7	Very low	28	Very low	115 Å²	115	123.9 Å²	123.9	80%	0.804	74%	0.735	S	S	*	*			trans	67	167.7	147.5	-55.2	0	0	0	0	120.4
16	A	29	Very low	28	Very low	91 Å²	91	125 Å²	125	75%	0.752	74%	0.738	S	S	*	*			trans	67.8	126.6	172.1	0	0	0	0	0	116.9
17	M	26.5	Very low	28.1	Very low	178 Å²	178	124.7 Å²	124.7	88%	0.877	74%	0.737	S	S	*	*			cis	91.4	155.9	40.3	-78	-81.4	-174.3	0	0	113.8
18	L	29.6	Very low	28.4	Very low	146 Å²	146	127.4 Å²	127.4	76%	0.764	74%	0.74	S	S	*	*			trans	86.2	104.7	178.6	-55.1	-176	0	0	0	113.3
19	T	29.6	Very low	28.5	Very low	122 Å²	122	124.8 Å²	124.8	75%	0.748	74%	0.741	S	S	*	*				74.2	140.3	79.5	59.1	0	0	0	0	113
20	S	32.4	Very low	28.8	Very low	94 Å²	94	122.4 Å²	122.4	66%	0.657	74%	0.738	S	S	*	*			cis	-165.1	-173.4	6.4	28.4	0	0	0	0	111.7
21	E	31.8	Very low	29	Very low	192 Å²	192	124.4 Å²	124.4	90%	0.897	74%	0.741	S	S	*	*			trans	92	143.8	156.1	-55.4	-177.8	-179.4	0	0	118.3
22	G	27.4	Very low	29.2	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	74%	0.737	S	S	*	*			cis	164.9	38.9	-5.1	0	0	0	0	0	120.2
23	A	30	Very low	29.3	Very low	90 Å²	90	127.9 Å²	127.9	74%	0.744	74%	0.743	S	S	*	*			trans	-145.3	133.1	168.4	0	0	0	0	0	109.9
24	H	28.5	Very low	29.3	Very low	187 Å²	187	127.9 Å²	127.9	87%	0.866	74%	0.741	S	S	*	*				67.4	125.7	51.3	-72.6	-76.1	0	0	0	113.7
25	A	29.5	Very low	29.5	Very low	75 Å²	75	131.1 Å²	131.1	62%	0.62	75%	0.748	S	S	*	*			cis	-163.1	166.4	-6.1	0	0	0	0	0	112.8
26	M	28.2	Very low	29.5	Very low	152 Å²	152	129.9 Å²	129.9	75%	0.749	75%	0.745	S	S	*	*			trans	57.3	114.4	149.3	-70.2	164	73.1	0	0	119.8
27	E	30.7	Very low	29.5	Very low	141 Å²	141	130.3 Å²	130.3	66%	0.659	74%	0.743	S	S	*	*				94.7	155.5	102.2	-75.6	-168.8	132.1	0	0	112.8
28	Q	31	Very low	29.5	Very low	140 Å²	140	128.6 Å²	128.6	65%	0.654	74%	0.742	S	S	*	*			cis	-153.9	159.2	0.6	-131.2	167.4	36.3	0	0	110.4
29	D	28.6	Very low	29.4	Very low	159 Å²	159	125.5 Å²	125.5	85%	0.85	74%	0.737	S	S	*	*			trans	50.8	-178.4	156.4	-72	-11.6	0	0	0	121.3
30	G	30	Very low	29.4	Very low	61 Å²	61	126.3 Å²	126.3	63%	0.629	74%	0.743	S	S	*	*			trans	172.5	-82.2	174	0	0	0	0	0	116.3
31	T	30.6	Very low	29.3	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	75%	0.746	S	S	*	*			trans	69.2	145.9	-177.8	75.8	0	0	0	0	119.7
32	N	29.3	Very low	29.2	Very low	124 Å²	124	124.4 Å²	124.4	66%	0.663	75%	0.745	S	S	*	*			trans	87.4	136.1	139.5	-85.9	-35.7	0	0	0	125
33	H	29	Very low	29.2	Very low	158 Å²	158	124.6 Å²	124.6	73%	0.731	75%	0.747	S	S	*	*			trans	65.3	134.2	155.8	-53.8	-26.4	0	0	0	119.5
34	K	28.6	Very low	29.3	Very low	171 Å²	171	126 Å²	126	74%	0.743	75%	0.752	S	S	*	*			cis	109.2	137.6	12.9	-173.8	-170.7	176.1	-173.7	0	113
35	M	30.8	Very low	29.4	Very low	156 Å²	156	125.2 Å²	125.2	77%	0.768	75%	0.753	S	S	*	*			trans	84.9	125.4	179.6	-59.8	-142.4	179.4	0	0	113.4
36	A	27.8	Very low	29.4	Very low	89 Å²	89	125.1 Å²	125.1	74%	0.736	76%	0.76	S	S	*	*				81.9	148.1	62.2	0	0	0	0	0	111.6
37	S	29.1	Very low	29.6	Very low	100 Å²	100	122.9 Å²	122.9	70%	0.699	77%	0.765	S	S	*	*			cis	-168	164.1	-5.7	-111.2	0	0	0	0	108.8
38	T	27	Very low	29.6	Very low	142 Å²	142	125.7 Å²	125.7	87%	0.871	78%	0.778	S	S	*	*			trans	59.3	171.3	160.2	48.1	0	0	0	0	117.7
39	A	28	Very low	29.7	Very low	80 Å²	80	125.5 Å²	125.5	66%	0.661	79%	0.787	S	S	*	*			cis	-162.1	145.4	-44.7	0	0	0	0	0	110.2
40	T	30.1	Very low	29.9	Very low	140 Å²	140	126.9 Å²	126.9	86%	0.859	79%	0.791	S	S	*	*			trans	24.5	123.8	155	54.8	0	0	0	0	122.1
41	S	29	Very low	30	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	80%	0.802	S	S	*	*			trans	-159.2	133.4	148.8	59.6	0	0	0	0	113
42	T	29	Very low	30	Very low	140 Å²	140	132 Å²	132	86%	0.859	80%	0.804	S	S	*	*			trans	36	134.2	147.2	57.9	0	0	0	0	121.1
43	G	28.3	Very low	30.4	Very low	77 Å²	77	131.6 Å²	131.6	79%	0.794	81%	0.806	S	S	*	*			cis	114.6	101.9	2	0	0	0	0	0	114
44	S	31.7	Very low	30.6	Very low	120 Å²	120	131.8 Å²	131.8	84%	0.839	81%	0.813	S	S	*	*			trans	-168.7	156	166.8	58.8	0	0	0	0	112.6
45	D	30.4	Very low	31	Very low	169 Å²	169	129.4 Å²	129.4	90%	0.904	81%	0.812	S	S	*	*			trans	-72.1	164.2	-170	-42.4	-83.3	0	0	0	116.6
46	G	29.9	Very low	31.1	Very low	73 Å²	73	128.4 Å²	128.4	75%	0.753	81%	0.81	S	S	*	*			trans	162.7	110.8	156.2	0	0	0	0	0	118.5
47	A	32.5	Very low	31.6	Very low	105 Å²	105	132 Å²	132	87%	0.868	81%	0.814	S	S	*	*			trans	60.8	104.7	158.1	0	0	0	0	0	119.7
48	E	30.8	Very low	32	Very low	200 Å²	200	133.7 Å²	133.7	94%	0.935	82%	0.815	S	S	*	*			trans	-82.5	134.6	161.9	-64.4	-177.8	149.7	0	0	111.7
49	T	33	Very low	32.5	Very low	136 Å²	136	134.2 Å²	134.2	83%	0.834	81%	0.809	S	S	*	*			trans	-128.4	139.2	158.3	48.9	0	0	0	0	109.2
50	M	33.1	Very low	33	Very low	188 Å²	188	138.9 Å²	138.9	93%	0.926	82%	0.817	S	S	*	*			trans	-57.2	135.3	-176.4	-58.7	171.3	178.8	0	0	112.9
51	T	31.8	Very low	33.7	Very low	140 Å²	140	140.4 Å²	140.4	86%	0.859	82%	0.817	S	S	*	*				-156.8	138.4	117.6	24	0	0	0	0	111.2
52	D	31.6	Very low	34.6	Very low	160 Å²	160	144 Å²	144	86%	0.856	82%	0.822	S	S	*	*			trans	10	157.3	159.9	-119.4	-42.9	0	0	0	124.2
53	T	36.5	Very low	35.9	Very low	115 Å²	115	143.7 Å²	143.7	71%	0.706	81%	0.811	S	S	*	*			trans	-94.5	101.2	-177.6	54.6	0	0	0	0	113.2
54	D	33.4	Very low	37.5	Very low	162 Å²	162	142.6 Å²	142.6	87%	0.866	79%	0.794	S	S	*	*			trans	-99.8	102.9	144.5	-88.3	-47.9	0	0	0	107.6	D56	D54-D56 PolarHBondContact O-N 3.1Å
55	V	37.5	Very low	39.9	Very low	121 Å²	121	141.2 Å²	141.2	73%	0.733	78%	0.778	S	S	*	*			trans	-82.9	105	173.3	177.3	0	0	0	0	107.5	M57	V55-M57 PolarHBondContact O-N 3.29Å
56	D	32.8	Very low	42.7	Very low	134 Å²	134	133.4 Å²	133.4	72%	0.717	74%	0.736	S	S	*	*			trans	-52.1	112.3	172.2	-81.7	-52.2	0	0	0	110.1	D54 D58	D54-D56 PolarHBondContact O-N 3.1Å; D56-D58 HydrophobicContact CB-CB 4.49Å; D56-D58 PolarHBondContact O-N 3.32Å; D56-D58 VanDerWaalsContact O-N 3.11Å
57	M	38.9	Very low	45.2	Very low	165 Å²	165	133.7 Å²	133.7	81%	0.813	72%	0.723	S	S	*	*			trans	-81.8	40.2	165.7	-78.3	-135.9	70.2	0	0	111.1	V55 M59	V55-M57 PolarHBondContact O-N 3.29Å; M57-M59 PolarHBondContact O-N 3.3Å
58	D	36.8	Very low	47.5	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	71%	0.712	S	S	*	*			trans	-68.8	70.7	156.5	-88.2	-12.9	0	0	0	108.4	D56 E60	D56-D58 HydrophobicContact CB-CB 4.49Å; D56-D58 PolarHBondContact O-N 3.32Å; D56-D58 VanDerWaalsContact O-N 3.11Å; D58-E60 PolarHBondContact O-N 2.63Å
59	M	38.1	Very low	50.3	Low	153 Å²	153	127.4 Å²	127.4	75%	0.754	67%	0.674	S	S	*	*			trans	-67.5	82.7	161.4	-174	-169.5	77.4	0	0	106.6	M57 M61	M57-M59 PolarHBondContact O-N 3.3Å; M59-M61 PolarHBondContact O-N 2.88Å
60	E	38.7	Very low	53	Low	178 Å²	178	121.6 Å²	121.6	83%	0.832	64%	0.641	S	S	*	*			trans	-44	116.8	176.3	-71	-167.9	128.4	0	0	108.9	D58 E62	D58-E60 PolarHBondContact O-N 2.63Å; E60-E62 PolarHBondContact O-N 3.27Å
61	M	44.1	Very low	55.8	Low	172 Å²	172	113.7 Å²	113.7	85%	0.847	60%	0.602	S	S	*	*			trans	-76.5	76.9	-179.6	-170	-170.7	-47.7	0	0	108	M59 E63	M59-M61 PolarHBondContact O-N 2.88Å; M61-E63 WeakPolarHBondContact O-CA 3.32Å; M61-E63 PolarHBondContact O-N 2.63Å
62	E	46.8	Very low	58.6	Low	181 Å²	181	110.6 Å²	110.6	85%	0.846	59%	0.59	S	S	*	*			trans	-40.2	117.2	173.9	-175.3	-176.6	-140.5	0	0	107.9	E60 A64	E60-E62 PolarHBondContact O-N 3.27Å; E62-A64 PolarHBondContact O-N 3.14Å
63	E	56.5	Low	61.5	Low	132 Å²	132	106.5 Å²	106.5	62%	0.617	57%	0.566	S	S	*	*			trans	-78.5	66.5	-152.4	-158.1	-140.2	124.9	0	0	112.1	M61 D65 K132	M61-E63 WeakPolarHBondContact O-CA 3.32Å; M61-E63 PolarHBondContact O-N 2.63Å; E63-D65 PolarHBondContact O-N 2.67Å; E63-K132 PolarHBondContact O-NZ 3.21Å; E63-K132 WeakPolarHBondContact OE1-CD 3.36Å; E63-K132 IonicContact OE1-NZ 3.31Å; E63-K132 PolarHBondContact OE1-NZ 3.48Å
64	A	63.4	Low	64.2	Low	54 Å²	54	101.1 Å²	101.1	45%	0.446	53%	0.533	S	S	.	.			trans	-35.2	114.5	-158.7	0	0	0	0	0	113.2	E62 M66 W69 K132	E62-A64 PolarHBondContact O-N 3.14Å; A64-M66 PolarHBondContact O-N 3.04Å; A64-W69 HydrophobicContact CB-CZ2 4.12Å; A64-K132 WeakPolarHBondContact O-CE 3.48Å; A64-K132 PolarHBondContact O-NZ 2.97Å
65	D	82	Confident	66.9	Low	92 Å²	92	97.6 Å²	97.6	49%	0.492	51%	0.511	S	S	.	.			trans	-65.7	120.5	-177.7	-177.5	7.7	0	0	0	110	E63 T67 H68 W69	E63-D65 PolarHBondContact O-N 2.67Å; D65-T67 WeakPolarHBondContact OD1-CB 3.37Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.47Å; D65-T67 PolarHBondContact OD1-N 3.43Å; D65-T67 PolarHBondContact OD1-OG1 2.85Å; D65-T67 PolarHBondContact OD2-OG1 2.9Å; D65-H68 IonicContact OD2-CD2 3.16Å; D65-W69 PolarHBondContact O-NE1 3.22Å
66	M	88.3	Confident	69.5	Low	5 Å²	5	99.6 Å²	99.6	3%	0.025	51%	0.512	C	S	.	.			trans	-94.3	-4.3	-178.9	-60.2	178.1	78.8	0	0	112.7	A64 H68 W69 F74 K132 V210	A64-M66 PolarHBondContact O-N 3.04Å; M66-H68 VanDerWaalsContact C-N 3.26Å; M66-H68 PolarHBondContact O-N 2.97Å; M66-W69 HydrophobicContact CB-CD2 4.23Å; M66-W69 HydrophobicContact CB-CE3 4.48Å; M66-W69 HydrophobicContact CB-CG 4.48Å; M66-W69 HydrophobicContact CE-CE3 3.79Å; M66-W69 HydrophobicContact CE-CH2 3.97Å; M66-W69 HydrophobicContact CE-CZ3 3.41Å; M66-W69 VanDerWaalsContact CE-CZ3 3.41Å; M66-W69 HydrophobicContact CG-CD2 4.06Å; M66-W69 HydrophobicContact CG-CE3 4.12Å; M66-W69 HydrophobicContact CG-CH2 3.92Å; M66-W69 HydrophobicContact CG-CZ2 3.84Å; M66-W69 HydrophobicContact CG-CZ3 4.05Å; M66-W69 PolarHBondContact O-N 3.17Å; M66-W69 HydrophobicContact SD-CH2 4.39Å; M66-W69 HydrophobicContact SD-CZ3 4.36Å; M66-F74 HydrophobicContact CB-CE1 4.3Å; M66-F74 HydrophobicContact CB-CZ 4.28Å; M66-F74 HydrophobicContact CE-CD1 3.89Å; M66-F74 HydrophobicContact CE-CE1 3.63Å; M66-F74 VanDerWaalsContact O-CZ 3.3Å; M66-F74 WeakPolarHBondContact O-CZ 3.33Å; M66-K132 HydrophobicContact SD-CD 4.14Å; M66-K132 VanDerWaalsContact SD-CE 3.51Å; M66-K132 HydrophobicContact SD-CG 3.57Å; M66-K132 VanDerWaalsContact SD-CG 3.57Å; M66-V210 HydrophobicContact CB-CB 4.1Å; M66-V210 HydrophobicContact CB-CG1 3.98Å
67	T	82.2	Confident	72.1	Confident	79 Å²	79	97.3 Å²	97.3	49%	0.485	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-33.6	-177.8	61.7	0	0	0	0	112.8	D65	D65-T67 WeakPolarHBondContact OD1-CB 3.37Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.47Å; D65-T67 PolarHBondContact OD1-N 3.43Å; D65-T67 PolarHBondContact OD1-OG1 2.85Å; D65-T67 PolarHBondContact OD2-OG1 2.9Å
68	H	81.9	Confident	74.4	Confident	137 Å²	137	90.7 Å²	90.7	63%	0.634	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-1.3	-177.1	-70.8	-66.1	0	0	0	114.6	D65 M66	D65-H68 IonicContact OD2-CD2 3.16Å; M66-H68 VanDerWaalsContact C-N 3.26Å; M66-H68 PolarHBondContact O-N 2.97Å
69	W	88.9	Confident	76.8	Confident	35 Å²	35	88.8 Å²	88.8	13%	0.133	46%	0.459	C	S	.	.			trans	-65	140.4	-176.9	-76.6	17.2	0	0	0	112.9	A64 D65 M66 E73 F74 K77	A64-W69 HydrophobicContact CB-CZ2 4.12Å; D65-W69 PolarHBondContact O-NE1 3.22Å; M66-W69 HydrophobicContact CB-CD2 4.23Å; M66-W69 HydrophobicContact CB-CE3 4.48Å; M66-W69 HydrophobicContact CB-CG 4.48Å; M66-W69 HydrophobicContact CE-CE3 3.79Å; M66-W69 HydrophobicContact CE-CH2 3.97Å; M66-W69 HydrophobicContact CE-CZ3 3.41Å; M66-W69 VanDerWaalsContact CE-CZ3 3.41Å; M66-W69 HydrophobicContact CG-CD2 4.06Å; M66-W69 HydrophobicContact CG-CE3 4.12Å; M66-W69 HydrophobicContact CG-CH2 3.92Å; M66-W69 HydrophobicContact CG-CZ2 3.84Å; M66-W69 HydrophobicContact CG-CZ3 4.05Å; M66-W69 PolarHBondContact O-N 3.17Å; M66-W69 HydrophobicContact SD-CH2 4.39Å; M66-W69 HydrophobicContact SD-CZ3 4.36Å; W69-E73 WeakPolarHBondContact CA-OE2 3.44Å; W69-E73 HydrophobicContact CB-CB 4.18Å; W69-E73 HydrophobicContact CD2-CB 4.32Å; W69-E73 HydrophobicContact CE3-CB 4.31Å; W69-E73 HydrophobicContact CG-CB 4.27Å; W69-F74 HydrophobicContact CB-CD2 3.78Å; W69-F74 HydrophobicContact CB-CE2 3.54Å; W69-F74 HydrophobicContact CB-CZ 4.1Å; W69-F74 HydrophobicContact CE3-CD1 4.22Å; W69-F74 HydrophobicContact CE3-CE1 4.46Å; W69-F74 HydrophobicContact CE3-CG 4.33Å; W69-F74 WeakPolarHBondContact O-CE2 3.44Å; W69-K77 HydrophobicContact CD2-CD 4.25Å; W69-K77 HydrophobicContact CE3-CB 4.39Å; W69-K77 HydrophobicContact CE3-CD 4.09Å; W69-K77 HydrophobicContact CH2-CB 3.62Å; W69-K77 HydrophobicContact CH2-CD 3.53Å; W69-K77 HydrophobicContact CH2-CG 4.25Å; W69-K77 HydrophobicContact CZ2-CD 3.7Å; W69-K77 HydrophobicContact CZ3-CB 3.49Å; W69-K77 VanDerWaalsContact CZ3-CB 3.49Å; W69-K77 HydrophobicContact CZ3-CD 3.74Å; W69-K77 HydrophobicContact CZ3-CG 4.23Å
70	G	89.3	Confident	79.2	Confident	14 Å²	14	87 Å²	87	14%	0.144	45%	0.445	C	S	.	.			trans	-76.7	161.1	169.3	0	0	0	0	0	112.8	A72 E73 F74 D226	G70-A72 VanDerWaalsContact C-N 3.25Å; G70-A72 PolarHBondContact O-N 3.01Å; G70-E73 PolarHBondContact N-OE2 2.76Å; G70-E73 WeakPolarHBondContact O-CB 3.27Å; G70-E73 PolarHBondContact O-N 2.79Å; G70-F74 WeakPolarHBondContact O-CD2 3.2Å; G70-F74 PolarHBondContact O-N 3.28Å; G70-D226 VanDerWaalsContact CA-OD2 3.24Å; G70-D226 WeakPolarHBondContact CA-OD2 3.32Å
71	E	93.2	Very high	81.8	Confident	23 Å²	23	82.9 Å²	82.9	11%	0.107	43%	0.428	C	S	.	.	H	α-helix	trans	-62.8	-30.1	-174.1	-66.2	173.9	125.1	0	0	113.7	E75 C199 Q200 N201 C224 D226 R230	E71-E75 PolarHBondContact O-N 3.11Å; E71-C199 HydrophobicContact CB-CB 4.3Å; E71-C199 HydrophobicContact CG-CB 3.91Å; E71-Q200 PolarHBondContact OE1-N 2.99Å; E71-N201 PolarHBondContact O-ND2 2.78Å; E71-C224 WeakPolarHBondContact CG-SG 3.27Å; E71-D226 HydrophobicContact CG-CB 4.37Å; E71-R230 VanDerWaalsContact CD-NH2 3.25Å; E71-R230 IonicContact OE1-CZ 2.69Å; E71-R230 IonicContact OE1-NH1 3.23Å; E71-R230 IonicContact OE1-NH2 3.44Å; E71-R230 PolarHBondContact OE1-NH2 3.12Å; E71-R230 IonicContact OE2-CZ 2.74Å; E71-R230 VanDerWaalsContact OE2-CZ 3.23Å; E71-R230 IonicContact OE2-NH1 3.94Å; E71-R230 PolarHBondContact OE2-NH1 3.41Å; E71-R230 IonicContact OE2-NH2 2.61Å; E71-R230 PolarHBondContact OE2-NH2 2.68Å
72	A	90.3	Very high	84.1	Confident	75 Å²	75	76.1 Å²	76.1	62%	0.62	40%	0.396	S	S	*	.	H	α-helix	trans	-71.3	-34	172.7	0	0	0	0	0	112.6	G70 E75 E76	G70-A72 VanDerWaalsContact C-N 3.25Å; G70-A72 PolarHBondContact O-N 3.01Å; A72-E75 PolarHBondContact O-N 2.97Å; A72-E76 PolarHBondContact O-N 2.9Å
73	E	92.2	Very high	86.3	Confident	74 Å²	74	73.9 Å²	73.9	35%	0.346	38%	0.383	S	S	.	.	H	α-helix	trans	-71.3	-39.5	177.1	-59.7	-174.1	97.8	0	0	111.2	W69 G70 E75 E76 K77	W69-E73 WeakPolarHBondContact CA-OE2 3.44Å; W69-E73 HydrophobicContact CB-CB 4.18Å; W69-E73 HydrophobicContact CD2-CB 4.32Å; W69-E73 HydrophobicContact CE3-CB 4.31Å; W69-E73 HydrophobicContact CG-CB 4.27Å; G70-E73 PolarHBondContact N-OE2 2.76Å; G70-E73 WeakPolarHBondContact O-CB 3.27Å; G70-E73 PolarHBondContact O-N 2.79Å; E73-E75 PolarHBondContact O-N 3.25Å; E73-E76 PolarHBondContact O-N 2.96Å; E73-K77 HydrophobicContact CB-CD 4.22Å; E73-K77 WeakPolarHBondContact O-CB 3.38Å; E73-K77 WeakPolarHBondContact O-CG 3.46Å; E73-K77 PolarHBondContact O-N 3.16Å; E73-K77 WeakPolarHBondContact OE1-CE 3.27Å; E73-K77 IonicContact OE1-NZ 2.93Å; E73-K77 PolarHBondContact OE1-NZ 3.28Å
74	F	92.4	Very high	88	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.009	37%	0.365	C	S	.	.	H	α-helix	trans	-56.9	-38.6	168.9	-84.3	-75.8	0	0	0	111.8	M66 W69 G70 C78 A197 C199 Y208 V210 C224	M66-F74 HydrophobicContact CB-CE1 4.3Å; M66-F74 HydrophobicContact CB-CZ 4.28Å; M66-F74 HydrophobicContact CE-CD1 3.89Å; M66-F74 HydrophobicContact CE-CE1 3.63Å; M66-F74 VanDerWaalsContact O-CZ 3.3Å; M66-F74 WeakPolarHBondContact O-CZ 3.33Å; W69-F74 HydrophobicContact CB-CD2 3.78Å; W69-F74 HydrophobicContact CB-CE2 3.54Å; W69-F74 HydrophobicContact CB-CZ 4.1Å; W69-F74 HydrophobicContact CE3-CD1 4.22Å; W69-F74 HydrophobicContact CE3-CE1 4.46Å; W69-F74 HydrophobicContact CE3-CG 4.33Å; W69-F74 WeakPolarHBondContact O-CE2 3.44Å; G70-F74 WeakPolarHBondContact O-CD2 3.2Å; G70-F74 PolarHBondContact O-N 3.28Å; F74-C78 VanDerWaalsContact O-CB 3.24Å; F74-C78 WeakPolarHBondContact O-CB 3.44Å; F74-C78 PolarHBondContact O-N 2.75Å; F74-A197 HydrophobicContact CE1-CB 3.96Å; F74-A197 HydrophobicContact CE2-CB 4.31Å; F74-A197 HydrophobicContact CZ-CB 3.62Å; F74-C199 WeakPolarHBondContact CD2-SG 3.39Å; F74-Y208 HydrophobicContact CB-CD1 4.13Å; F74-Y208 HydrophobicContact CB-CD2 4.13Å; F74-Y208 HydrophobicContact CB-CE1 4.03Å; F74-Y208 HydrophobicContact CB-CE2 4.04Å; F74-Y208 HydrophobicContact CB-CG 4.17Å; F74-Y208 VanDerWaalsContact CD1-CB 3.49Å; F74-Y208 AromaticContact CD1-CD1 4Å; F74-Y208 HydrophobicContact CD1-CD1 4Å; F74-Y208 HydrophobicContact CD1-CD2 4.11Å; F74-Y208 AromaticContact CD1-CG 3.63Å; F74-Y208 HydrophobicContact CD1-CG 3.63Å; F74-Y208 HydrophobicContact CE1-CG 4.41Å; F74-Y208 HydrophobicContact CG-CD2 4.33Å; F74-Y208 HydrophobicContact CG-CG 4.24Å; F74-Y208 WeakPolarHBondContact O-CE1 3.43Å; F74-V210 HydrophobicContact CE1-CG1 3.94Å; F74-V210 HydrophobicContact CZ-CG1 3.91Å; F74-C224 HydrophobicContact CD2-CB 4.47Å; F74-C224 HydrophobicContact CE2-CB 3.98Å
75	E	91.8	Very high	89.3	Confident	87 Å²	87	68.9 Å²	68.9	41%	0.407	36%	0.355	S	S	.	.	H	α-helix	trans	-72.7	-47.4	177.9	-153.3	170.5	165.7	0	0	113.1	E71 A72 E73 C78 N201	E71-E75 PolarHBondContact O-N 3.11Å; A72-E75 PolarHBondContact O-N 2.97Å; E73-E75 PolarHBondContact O-N 3.25Å; E75-C78 PolarHBondContact O-SG 3.03Å; E75-N201 WeakPolarHBondContact CB-ND2 3.26Å; E75-N201 WeakPolarHBondContact OE2-CB 3.47Å; E75-N201 PolarHBondContact OE2-ND2 2.66Å
76	E	90.4	Very high	89.3	Confident	163 Å²	163	69.5 Å²	69.5	76%	0.762	36%	0.364	S	S	*	.	H	α-helix	trans	-71.2	-38.3	-176.3	-180	164.7	-141.5	0	0	112.9	A72 E73	A72-E76 PolarHBondContact O-N 2.9Å; E73-E76 PolarHBondContact O-N 2.96Å
77	K	87.8	Confident	88.2	Confident	86 Å²	86	75.3 Å²	75.3	37%	0.374	39%	0.386	S	S	.	.	S	Bend	trans	-96.8	2.5	-172.5	-52.4	175	-168.4	173.1	0	113.7	W69 E73 T79	W69-K77 HydrophobicContact CD2-CD 4.25Å; W69-K77 HydrophobicContact CE3-CB 4.39Å; W69-K77 HydrophobicContact CE3-CD 4.09Å; W69-K77 HydrophobicContact CH2-CB 3.62Å; W69-K77 HydrophobicContact CH2-CD 3.53Å; W69-K77 HydrophobicContact CH2-CG 4.25Å; W69-K77 HydrophobicContact CZ2-CD 3.7Å; W69-K77 HydrophobicContact CZ3-CB 3.49Å; W69-K77 VanDerWaalsContact CZ3-CB 3.49Å; W69-K77 HydrophobicContact CZ3-CD 3.74Å; W69-K77 HydrophobicContact CZ3-CG 4.23Å; E73-K77 HydrophobicContact CB-CD 4.22Å; E73-K77 WeakPolarHBondContact O-CB 3.38Å; E73-K77 WeakPolarHBondContact O-CG 3.46Å; E73-K77 PolarHBondContact O-N 3.16Å; E73-K77 WeakPolarHBondContact OE1-CE 3.27Å; E73-K77 IonicContact OE1-NZ 2.93Å; E73-K77 PolarHBondContact OE1-NZ 3.28Å; K77-T79 PolarHBondContact O-N 3.46Å
78	C	88.1	Confident	86.9	Confident	26 Å²	26	79.4 Å²	79.4	18%	0.176	40%	0.4	C	S	.	.			trans	-69.8	131	177.4	66.6	0	0	0	0	112.4	F74 E75 Y208	F74-C78 VanDerWaalsContact O-CB 3.24Å; F74-C78 WeakPolarHBondContact O-CB 3.44Å; F74-C78 PolarHBondContact O-N 2.75Å; E75-C78 PolarHBondContact O-SG 3.03Å; C78-Y208 HydrophobicContact CB-CD1 3.96Å; C78-Y208 HydrophobicContact CB-CE1 3.79Å
79	T	85.7	Confident	85.3	Confident	96 Å²	96	77.1 Å²	77.1	59%	0.589	40%	0.404	S	S	*	.			trans	-90.8	-33.6	-171.6	-45.1	0	0	0	0	112.3	K77 G133	K77-T79 PolarHBondContact O-N 3.46Å; T79-G133 PolarHBondContact N-O 2.82Å
80	Y	90.2	Very high	83	Confident	115 Å²	115	77.6 Å²	77.6	45%	0.451	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.3	-175.3	-49.6	-84.4	0	0	0	110.8	P131 G133 T134 R135	Y80-P131 HydrophobicContact CD2-CB 3.68Å; Y80-P131 HydrophobicContact CD2-CG 4.03Å; Y80-P131 HydrophobicContact CE2-CB 3.32Å; Y80-P131 HydrophobicContact CE2-CG 3.75Å; Y80-G133 PolarHBondContact N-O 3.21Å; Y80-T134 CarbonylContact O-C 3.56Å; Y80-T134 WeakPolarHBondContact O-CA 3.48Å; Y80-R135 PolarHBondContact O-N 3.15Å
81	I	93	Very high	80.8	Confident	92 Å²	92	83 Å²	83	47%	0.472	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	108.3	177	-57.6	176.5	0	0	0	108.9	K83 R135	I81-K83 HydrophobicContact CG2-CG 4.41Å; I81-R135 HydrophobicContact CG1-CB 4.42Å
82	V	92.8	Very high	78.2	Confident	30 Å²	30	89 Å²	89	18%	0.182	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.9	170.3	178.5	0	0	0	0	108.6	P107 N109 T134 R135 F136	V82-P107 HydrophobicContact CG1-CB 3.53Å; V82-P107 HydrophobicContact CG1-CG 3.81Å; V82-N109 WeakPolarHBondContact CG1-OD1 3.41Å; V82-T134 HydrophobicContact CB-CG2 4.47Å; V82-T134 HydrophobicContact CG2-CG2 3.66Å; V82-R135 PolarHBondContact N-O 2.67Å; V82-F136 HydrophobicContact CB-CD1 3.76Å; V82-F136 HydrophobicContact CB-CE1 3.66Å; V82-F136 HydrophobicContact CB-CZ 4.32Å; V82-F136 HydrophobicContact CG1-CD1 3.81Å; V82-F136 HydrophobicContact CG1-CE1 3.6Å; V82-F136 HydrophobicContact CG2-CE1 3.98Å; V82-F136 HydrophobicContact CG2-CZ 4.22Å
83	K	91.3	Very high	76	Confident	134 Å²	134	89.6 Å²	89.6	58%	0.583	49%	0.49	S	S	*	.			trans	-115	150.9	178.1	-62.9	-179.6	-177.8	177.4	0	109.7	I81	I81-K83 HydrophobicContact CG2-CG 4.41Å
84	D	92.8	Very high	73.3	Confident	43 Å²	43	93 Å²	93	23%	0.23	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-49.5	145.6	169.8	-68.2	15.9	0	0	0	111.7	S105 N180 W181	D84-S105 CarbonylContact C-O 3.6Å; D84-S105 VanDerWaalsContact CA-O 3.31Å; D84-S105 WeakPolarHBondContact CA-O 3.38Å; D84-S105 WeakPolarHBondContact CB-O 3.27Å; D84-N180 VanDerWaalsContact OD2-CB 3.32Å; D84-N180 WeakPolarHBondContact OD2-CB 3.27Å; D84-N180 PolarHBondContact OD2-ND2 3.12Å; D84-W181 PolarHBondContact OD1-NE1 3.09Å
85	T	90.9	Very high	71.1	Confident	38 Å²	38	102.8 Å²	102.8	23%	0.233	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-64.1	131.7	170.2	-70.5	0	0	0	0	109	W87 S105 L106	T85-W87 PolarHBondContact O-N 3.23Å; T85-S105 PolarHBondContact N-O 3.36Å; T85-L106 WeakPolarHBondContact CB-O 3.47Å; T85-L106 PolarHBondContact OG1-O 3.25Å
86	P	81.9	Confident	68.6	Low	106 Å²	106	103 Å²	103	69%	0.688	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-59.5	129.2	179.9	-25.8	35	0	0	0	112.6
87	W	65.1	Low	66.4	Low	127 Å²	127	102.3 Å²	102.3	48%	0.481	57%	0.569	S	S	.	*			trans	-102.1	113.7	172.4	176.3	-105.4	0	0	0	109.7	T85 A104	T85-W87 PolarHBondContact O-N 3.23Å; W87-A104 HydrophobicContact CD2-CB 4.37Å; W87-A104 HydrophobicContact CE3-CB 3.3Å; W87-A104 HydrophobicContact CH2-CB 4.45Å; W87-A104 HydrophobicContact CZ3-CB 3.35Å
88	E	55.5	Low	64.9	Low	165 Å²	165	104.1 Å²	104.1	77%	0.771	59%	0.587	S	S	*	*			trans	-106.3	111.4	175.9	-62.1	-63.9	164.5	0	0	108.8	G90	E88-G90 VanDerWaalsContact C-N 3.32Å; E88-G90 PolarHBondContact O-N 2.85Å
89	A	48	Very low	64	Low	89 Å²	89	106 Å²	106	74%	0.736	60%	0.598	S	S	*	*			trans	-81.1	78.6	176.7	0	0	0	0	0	110.2
90	G	40.8	Very low	64.1	Low	45 Å²	45	102.9 Å²	102.9	46%	0.464	58%	0.579	S	S	.	*			trans	-68.8	146.5	178.1	0	0	0	0	0	112.9	E88	E88-G90 VanDerWaalsContact C-N 3.32Å; E88-G90 PolarHBondContact O-N 2.85Å
91	P	42.7	Very low	64	Low	126 Å²	126	102 Å²	102	82%	0.818	58%	0.575	S	S	*	*	S	Bend	trans	-65.6	-39.8	174.3	-20.3	33.1	0	0	0	112.9	A93	P91-A93 VanDerWaalsContact C-N 3.32Å; P91-A93 PolarHBondContact O-N 3.11Å
92	D	39.8	Very low	64	Low	150 Å²	150	97.6 Å²	97.6	80%	0.802	55%	0.552	S	S	*	*			trans	-94.8	48.9	-169.1	-48.5	-52.5	0	0	0	112.1	D94	D92-D94 PolarHBondContact O-N 3.48Å
93	A	42.3	Very low	64	Low	88 Å²	88	98.3 Å²	98.3	73%	0.727	55%	0.554	S	S	*	*			trans	-83.7	50.6	-178.6	0	0	0	0	0	112.8	P91 F95	P91-A93 VanDerWaalsContact C-N 3.32Å; P91-A93 PolarHBondContact O-N 3.11Å; A93-F95 PolarHBondContact O-N 2.8Å
94	D	36.4	Very low	64	Low	145 Å²	145	93.1 Å²	93.1	78%	0.775	54%	0.536	S	S	*	.			trans	-68.7	117.6	-177.4	-97.5	-35.6	0	0	0	112.7	D92 A96	D92-D94 PolarHBondContact O-N 3.48Å; D94-A96 PolarHBondContact O-N 3.29Å
95	F	45.8	Very low	64.1	Low	208 Å²	208	91.3 Å²	91.3	91%	0.912	53%	0.526	S	S	*	.	S	Bend	trans	55.9	49.2	155.5	-89	-90.2	0	0	0	119.3	A93	A93-F95 PolarHBondContact O-N 2.8Å
96	A	39.5	Very low	64.3	Low	91 Å²	91	90.8 Å²	90.8	75%	0.752	52%	0.522	S	S	*	.			trans	-148.5	121.6	152.8	0	0	0	0	0	115	D94	D94-A96 PolarHBondContact O-N 3.29Å
97	M	45.3	Very low	64.9	Low	149 Å²	149	85.9 Å²	85.9	73%	0.734	49%	0.49	S	S	*	.			trans	61.6	121.2	163.7	-67.3	-63.3	172	0	0	120.3	T99	M97-T99 PolarHBondContact O-N 3.29Å
98	T	54.4	Low	66.2	Low	124 Å²	124	89.6 Å²	89.6	76%	0.761	50%	0.504	S	S	*	.			trans	-45.6	17.9	166.8	-23.3	0	0	0	0	118.3	T100	T98-T100 PolarHBondContact O-N 3.02Å
99	T	69.4	Low	67.7	Low	66 Å²	66	82.6 Å²	82.6	41%	0.405	47%	0.472	S	S	.	.			trans	-76.6	125.2	-168.7	-57.8	0	0	0	0	112.3	M97 E103 A104	M97-T99 PolarHBondContact O-N 3.29Å; T99-E103 VanDerWaalsContact CA-OE2 3.3Å; T99-E103 WeakPolarHBondContact CA-OE2 3.4Å; T99-E103 HydrophobicContact CG2-CB 3.64Å; T99-E103 WeakPolarHBondContact CG2-OE2 3.33Å; T99-A104 HydrophobicContact CG2-CB 3.88Å
100	T	87.4	Confident	70	Confident	29 Å²	29	78.7 Å²	78.7	18%	0.178	44%	0.438	C	S	.	.			trans	-78	165.5	-179.8	70.5	0	0	0	0	111.9	T98 A102 E103 A104 E176	T98-T100 PolarHBondContact O-N 3.02Å; T100-A102 PolarHBondContact O-N 3.27Å; T100-E103 PolarHBondContact N-OE2 2.91Å; T100-E103 PolarHBondContact O-N 2.98Å; T100-E103 WeakPolarHBondContact OG1-CG 3.45Å; T100-E103 PolarHBondContact OG1-N 2.95Å; T100-A104 WeakPolarHBondContact O-CB 3.42Å; T100-A104 PolarHBondContact O-N 2.9Å; T100-E176 HydrophobicContact CG2-CB 3.95Å
101	R	89.8	Confident	72.6	Confident	97 Å²	97	79.8 Å²	79.8	37%	0.366	44%	0.436	S	S	.	.	H	α-helix	trans	-57.6	-42	172.6	-179.6	-169.7	172.5	136.5	4	111	E103 A104 S105 E176 T177 S179	R101-E103 PolarHBondContact O-N 3.28Å; R101-A104 PolarHBondContact O-N 2.89Å; R101-S105 VanDerWaalsContact O-CB 3.24Å; R101-S105 WeakPolarHBondContact O-CB 3.26Å; R101-S105 PolarHBondContact O-N 3.47Å; R101-S105 PolarHBondContact O-OG 3.47Å; R101-E176 PolarHBondContact N-O 2.87Å; R101-T177 VanDerWaalsContact CB-O 3.23Å; R101-T177 WeakPolarHBondContact CB-O 3.22Å; R101-T177 WeakPolarHBondContact CD-O 3.31Å; R101-S179 WeakPolarHBondContact CD-O 3.38Å; R101-S179 WeakPolarHBondContact CG-O 3.29Å
102	A	92.2	Very high	75.1	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-60	-45.3	178.3	0	0	0	0	0	111.3	T100 S105 E176 S179 W181 R183 Y184	T100-A102 PolarHBondContact O-N 3.27Å; A102-S105 PolarHBondContact O-OG 2.86Å; A102-E176 HydrophobicContact CB-CB 4.16Å; A102-E176 WeakPolarHBondContact CB-O 3.43Å; A102-E176 PolarHBondContact N-O 2.61Å; A102-S179 PolarHBondContact N-O 2.79Å; A102-W181 WeakPolarHBondContact O-CA 3.39Å; A102-W181 VanDerWaalsContact O-CB 3.24Å; A102-W181 WeakPolarHBondContact O-CB 3.41Å; A102-W181 PolarHBondContact O-N 2.96Å; A102-W181 VanDerWaalsContact O-N 3.16Å; A102-R183 HydrophobicContact CB-CG 4.29Å; A102-Y184 HydrophobicContact CB-CE2 3.64Å
103	E	93	Very high	77.7	Confident	45 Å²	45	71.6 Å²	71.6	21%	0.21	38%	0.381	C	S	.	.	H	α-helix	trans	-66.6	-49.1	174.9	-66.1	178.1	156.3	0	0	112.8	T99 T100 R101 S105 L106 L112 Y184	T99-E103 VanDerWaalsContact CA-OE2 3.3Å; T99-E103 WeakPolarHBondContact CA-OE2 3.4Å; T99-E103 HydrophobicContact CG2-CB 3.64Å; T99-E103 WeakPolarHBondContact CG2-OE2 3.33Å; T100-E103 PolarHBondContact N-OE2 2.91Å; T100-E103 PolarHBondContact O-N 2.98Å; T100-E103 WeakPolarHBondContact OG1-CG 3.45Å; T100-E103 PolarHBondContact OG1-N 2.95Å; R101-E103 PolarHBondContact O-N 3.28Å; E103-S105 VanDerWaalsContact C-N 3.29Å; E103-S105 PolarHBondContact O-N 3.13Å; E103-L106 VanDerWaalsContact O-CB 3.25Å; E103-L106 WeakPolarHBondContact O-CB 3.35Å; E103-L106 PolarHBondContact O-N 2.81Å; E103-L112 HydrophobicContact CB-CD1 4.04Å; E103-L112 HydrophobicContact CG-CD1 3.78Å; E103-Y184 HydrophobicContact CG-CE2 4.46Å
104	A	91.2	Very high	80.1	Confident	25 Å²	25	71.8 Å²	71.8	21%	0.207	37%	0.367	C	S	.	.	H	α-helix	trans	-68.7	-25.5	-173.8	0	0	0	0	0	113.9	W87 T99 T100 R101 L106	W87-A104 HydrophobicContact CD2-CB 4.37Å; W87-A104 HydrophobicContact CE3-CB 3.3Å; W87-A104 HydrophobicContact CH2-CB 4.45Å; W87-A104 HydrophobicContact CZ3-CB 3.35Å; T99-A104 HydrophobicContact CG2-CB 3.88Å; T100-A104 WeakPolarHBondContact O-CB 3.42Å; T100-A104 PolarHBondContact O-N 2.9Å; R101-A104 PolarHBondContact O-N 2.89Å; A104-L106 PolarHBondContact O-N 2.73Å
105	S	95.2	Very high	82.7	Confident	5 Å²	5	68 Å²	68	4%	0.035	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-9.7	175.3	64.1	0	0	0	0	114.2	D84 T85 R101 A102 E103 P107 N180 W181	D84-S105 CarbonylContact C-O 3.6Å; D84-S105 VanDerWaalsContact CA-O 3.31Å; D84-S105 WeakPolarHBondContact CA-O 3.38Å; D84-S105 WeakPolarHBondContact CB-O 3.27Å; T85-S105 PolarHBondContact N-O 3.36Å; R101-S105 VanDerWaalsContact O-CB 3.24Å; R101-S105 WeakPolarHBondContact O-CB 3.26Å; R101-S105 PolarHBondContact O-N 3.47Å; R101-S105 PolarHBondContact O-OG 3.47Å; A102-S105 PolarHBondContact O-OG 2.86Å; E103-S105 VanDerWaalsContact C-N 3.29Å; E103-S105 PolarHBondContact O-N 3.13Å; S105-P107 WeakPolarHBondContact O-CD 3.28Å; S105-N180 WeakPolarHBondContact OG-CA 3.33Å; S105-N180 WeakPolarHBondContact OG-CB 3.21Å; S105-W181 PolarHBondContact OG-N 3.24Å
106	L	95.1	Very high	84.6	Confident	27 Å²	27	62.7 Å²	62.7	14%	0.141	34%	0.341	C	S	.	.			trans	-58	125.9	-175.4	-172.2	78.3	0	0	0	112.6	T85 E103 A104 L110 L112 V124 W181	T85-L106 WeakPolarHBondContact CB-O 3.47Å; T85-L106 PolarHBondContact OG1-O 3.25Å; E103-L106 VanDerWaalsContact O-CB 3.25Å; E103-L106 WeakPolarHBondContact O-CB 3.35Å; E103-L106 PolarHBondContact O-N 2.81Å; A104-L106 PolarHBondContact O-N 2.73Å; L106-L110 HydrophobicContact CD1-CB 3.85Å; L106-L110 HydrophobicContact CD1-CD1 4.25Å; L106-L110 HydrophobicContact CD2-CB 4.32Å; L106-L110 HydrophobicContact CG-CB 4.04Å; L106-L112 HydrophobicContact CD1-CD2 3.81Å; L106-L112 HydrophobicContact CD1-CG 4.49Å; L106-L112 HydrophobicContact CD2-CD2 4.21Å; L106-L112 HydrophobicContact CD2-CG 3.98Å; L106-V124 HydrophobicContact CD1-CG1 4.05Å; L106-W181 HydrophobicContact CB-CB 4.22Å; L106-W181 HydrophobicContact CD1-CB 3.85Å; L106-W181 HydrophobicContact CD1-CD2 4.05Å; L106-W181 HydrophobicContact CD1-CE3 3.92Å; L106-W181 HydrophobicContact CD1-CG 4.04Å
107	P	94.7	Very high	86.5	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.013	35%	0.351	C	S	.	.			trans	-56.5	142.2	170.6	-28.2	35	0	0	0	113.7	V82 S105 N109 L110 F136 W181	V82-P107 HydrophobicContact CG1-CB 3.53Å; V82-P107 HydrophobicContact CG1-CG 3.81Å; S105-P107 WeakPolarHBondContact O-CD 3.28Å; P107-N109 WeakPolarHBondContact CB-OD1 3.47Å; P107-N109 PolarHBondContact O-N 2.95Å; P107-N109 VanDerWaalsContact O-N 3.1Å; P107-L110 HydrophobicContact CB-CD1 4.27Å; P107-L110 HydrophobicContact CB-CG 4.35Å; P107-L110 HydrophobicContact CG-CD1 4.17Å; P107-L110 PolarHBondContact O-N 3.15Å; P107-F136 HydrophobicContact CG-CD1 4.48Å; P107-W181 VanDerWaalsContact CD-CE2 3.45Å; P107-W181 HydrophobicContact CG-CZ2 3.93Å
108	R	91.2	Very high	88.5	Confident	206 Å²	206	58.9 Å²	58.9	78%	0.777	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.6	-174.1	-66.1	-179.3	173.6	-126.6	-7.9	115.2	L110 R127	R108-L110 VanDerWaalsContact C-N 3.27Å; R108-R127 VanDerWaalsContact O-CD 3.26Å; R108-R127 WeakPolarHBondContact O-CD 3.38Å
109	N	87.6	Confident	89.8	Confident	18 Å²	18	60.2 Å²	60.2	10%	0.096	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	4.3	177.6	65.8	-53.4	0	0	0	113.2	V82 P107 R127 E128	V82-N109 WeakPolarHBondContact CG1-OD1 3.41Å; P107-N109 WeakPolarHBondContact CB-OD1 3.47Å; P107-N109 PolarHBondContact O-N 2.95Å; P107-N109 VanDerWaalsContact O-N 3.1Å; N109-R127 VanDerWaalsContact C-CB 3.48Å; N109-R127 VanDerWaalsContact O-CB 3.3Å; N109-R127 WeakPolarHBondContact O-CB 3.32Å; N109-R127 PolarHBondContact O-N 3.32Å; N109-E128 HydrophobicContact CB-CG 3.7Å; N109-E128 WeakPolarHBondContact CB-OE1 3.43Å
110	L	96.4	Very high	90.7	Very high	6 Å²	6	62.8 Å²	62.8	3%	0.031	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	164.9	177.5	-56.7	-179.2	0	0	0	111.2	L106 P107 R108 V124 C125 I130 F136 W181 L219	L106-L110 HydrophobicContact CD1-CB 3.85Å; L106-L110 HydrophobicContact CD1-CD1 4.25Å; L106-L110 HydrophobicContact CD2-CB 4.32Å; L106-L110 HydrophobicContact CG-CB 4.04Å; P107-L110 HydrophobicContact CB-CD1 4.27Å; P107-L110 HydrophobicContact CB-CG 4.35Å; P107-L110 HydrophobicContact CG-CD1 4.17Å; P107-L110 PolarHBondContact O-N 3.15Å; R108-L110 VanDerWaalsContact C-N 3.27Å; L110-V124 HydrophobicContact CB-CG1 4.04Å; L110-V124 HydrophobicContact CD1-CG1 4.03Å; L110-V124 HydrophobicContact CG-CG1 4.46Å; L110-C125 CarbonylContact C-O 3.55Å; L110-C125 VanDerWaalsContact CA-O 3.32Å; L110-C125 WeakPolarHBondContact CA-O 3.41Å; L110-I130 HydrophobicContact CD2-CD1 3.64Å; L110-F136 HydrophobicContact CD1-CD1 4.28Å; L110-F136 HydrophobicContact CD1-CE1 3.83Å; L110-F136 HydrophobicContact CD2-CE1 4.34Å; L110-F136 HydrophobicContact CD2-CZ 4.39Å; L110-F136 HydrophobicContact CG-CE1 4.28Å; L110-W181 HydrophobicContact CD1-CD2 4.47Å; L110-W181 HydrophobicContact CD1-CE3 3.9Å; L110-W181 HydrophobicContact CD1-CH2 3.49Å; L110-W181 VanDerWaalsContact CD1-CH2 3.49Å; L110-W181 HydrophobicContact CD1-CZ2 4.11Å; L110-W181 HydrophobicContact CD1-CZ3 3.38Å; L110-L219 HydrophobicContact CD1-CD2 3.91Å; L110-L219 HydrophobicContact CD2-CD1 3.96Å; L110-L219 HydrophobicContact CD2-CD2 3.66Å; L110-L219 HydrophobicContact CD2-CG 4.49Å; L110-L219 HydrophobicContact CG-CD2 4.46Å
111	V	95.8	Very high	91	Very high	69 Å²	69	62.4 Å²	62.4	42%	0.418	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.5	176	-170.9	0	0	0	0	109.3	C125 R127	V111-C125 PolarHBondContact N-O 3.06Å; V111-C125 PolarHBondContact O-N 2.9Å; V111-R127 HydrophobicContact CG2-CB 3.75Å; V111-R127 HydrophobicContact CG2-CG 3.87Å
112	L	95.7	Very high	91.1	Very high	19 Å²	19	60.3 Å²	60.3	10%	0.099	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.2	171.5	-62.7	-178.9	0	0	0	110.7	E103 L106 H114 V121 V124 Y184	E103-L112 HydrophobicContact CB-CD1 4.04Å; E103-L112 HydrophobicContact CG-CD1 3.78Å; L106-L112 HydrophobicContact CD1-CD2 3.81Å; L106-L112 HydrophobicContact CD1-CG 4.49Å; L106-L112 HydrophobicContact CD2-CD2 4.21Å; L106-L112 HydrophobicContact CD2-CG 3.98Å; L112-H114 PolarHBondContact O-CE1 3.17Å; L112-H114 PolarHBondContact O-ND1 2.82Å; L112-V121 HydrophobicContact CB-CG1 4.03Å; L112-V121 HydrophobicContact CB-CG2 4.36Å; L112-V121 HydrophobicContact CD1-CG1 4.25Å; L112-V121 HydrophobicContact CD1-CG2 3.9Å; L112-V121 HydrophobicContact CD2-CG1 3.97Å; L112-V121 HydrophobicContact CG-CG1 4.28Å; L112-V124 HydrophobicContact CD2-CG2 4.1Å; L112-Y184 HydrophobicContact CD2-CD2 4.15Å
113	K	93.8	Very high	91.2	Very high	85 Å²	85	60.3 Å²	60.3	37%	0.37	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	120	174.4	-174.3	-173.6	178.7	-170.6	0	108	V122 G123 E218	K113-V122 HydrophobicContact CD-CG2 4.43Å; K113-V122 HydrophobicContact CG-CG2 4.15Å; K113-V122 WeakPolarHBondContact O-CG2 3.2Å; K113-V122 PolarHBondContact O-N 3.28Å; K113-G123 WeakPolarHBondContact CB-O 3.37Å; K113-G123 PolarHBondContact N-O 3.36Å; K113-G123 PolarHBondContact O-N 3.23Å; K113-E218 VanDerWaalsContact NZ-CD 3.33Å; K113-E218 IonicContact NZ-OE1 2.7Å; K113-E218 PolarHBondContact NZ-OE1 2.6Å; K113-E218 IonicContact NZ-OE2 2.93Å; K113-E218 PolarHBondContact NZ-OE2 2.99Å
114	H	92.8	Very high	91.4	Very high	92 Å²	92	58.1 Å²	58.1	43%	0.426	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	148.7	-177.3	-63.8	80.3	0	0	0	111.5	L112 E120	L112-H114 PolarHBondContact O-CE1 3.17Å; L112-H114 PolarHBondContact O-ND1 2.82Å; H114-E120 CarbonylContact C-O 3.46Å; H114-E120 VanDerWaalsContact CA-O 3.26Å; H114-E120 WeakPolarHBondContact CA-O 3.47Å
115	L	90.9	Very high	91.7	Very high	66 Å²	66	58 Å²	58	35%	0.346	32%	0.321	S	S	.	.			trans	-70.6	130.2	171.5	177.7	64.8	0	0	0	110	G117 T118 E120 V122	L115-G117 PolarHBondContact O-N 3.27Å; L115-T118 WeakPolarHBondContact CB-OG1 3.27Å; L115-T118 HydrophobicContact CD2-CG2 4.34Å; L115-T118 HydrophobicContact CG-CG2 4.39Å; L115-T118 PolarHBondContact O-N 3.02Å; L115-T118 PolarHBondContact O-OG1 2.89Å; L115-E120 HydrophobicContact CB-CB 4.48Å; L115-E120 PolarHBondContact N-O 3.01Å; L115-V122 HydrophobicContact CB-CG1 3.82Å
116	A	86.3	Confident	91.7	Very high	96 Å²	96	57.9 Å²	57.9	79%	0.793	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	125.8	-172.5	0	0	0	0	0	112.8	T118	A116-T118 VanDerWaalsContact C-N 3.35Å
117	G	78.6	Confident	91.7	Very high	94 Å²	94	64.7 Å²	64.7	97%	0.969	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	3.6	-177.8	0	0	0	0	0	115.4	L115	L115-G117 PolarHBondContact O-N 3.27Å
118	T	87.6	Confident	91.6	Very high	66 Å²	66	69.7 Å²	69.7	41%	0.405	37%	0.367	S	S	.	.	S	Bend	trans	-127.8	172.1	-178.3	78.2	0	0	0	0	112.2	L115 A116 E120	L115-T118 WeakPolarHBondContact CB-OG1 3.27Å; L115-T118 HydrophobicContact CD2-CG2 4.34Å; L115-T118 HydrophobicContact CG-CG2 4.39Å; L115-T118 PolarHBondContact O-N 3.02Å; L115-T118 PolarHBondContact O-OG1 2.89Å; A116-T118 VanDerWaalsContact C-N 3.35Å; T118-E120 PolarHBondContact OG1-N 3.15Å
119	K	82.1	Confident	91.7	Very high	152 Å²	152	66.5 Å²	66.5	66%	0.661	36%	0.356	S	S	*	.			trans	-95.1	10.8	163.9	-66.8	-169.4	175.6	-170.7	0	113	V121	K119-V121 PolarHBondContact O-N 3.41Å
120	E	88.6	Confident	92.1	Very high	120 Å²	120	65.7 Å²	65.7	56%	0.561	35%	0.352	S	S	*	.			trans	-76.2	122.9	-178.4	-171.4	177.7	177	0	0	110.8	H114 L115 T118 V122	H114-E120 CarbonylContact C-O 3.46Å; H114-E120 VanDerWaalsContact CA-O 3.26Å; H114-E120 WeakPolarHBondContact CA-O 3.47Å; L115-E120 HydrophobicContact CB-CB 4.48Å; L115-E120 PolarHBondContact N-O 3.01Å; T118-E120 PolarHBondContact OG1-N 3.15Å; E120-V122 HydrophobicContact CG-CG1 4.37Å
121	V	91.9	Very high	91.8	Very high	21 Å²	21	67 Å²	67	13%	0.127	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	116.4	178.4	-179.2	0	0	0	0	109.8	L112 K119 Y184	L112-V121 HydrophobicContact CB-CG1 4.03Å; L112-V121 HydrophobicContact CB-CG2 4.36Å; L112-V121 HydrophobicContact CD1-CG1 4.25Å; L112-V121 HydrophobicContact CD1-CG2 3.9Å; L112-V121 HydrophobicContact CD2-CG1 3.97Å; L112-V121 HydrophobicContact CG-CG1 4.28Å; K119-V121 PolarHBondContact O-N 3.41Å; V121-Y184 HydrophobicContact CB-CD1 3.74Å; V121-Y184 HydrophobicContact CB-CE1 3.63Å; V121-Y184 HydrophobicContact CB-CG 4.45Å; V121-Y184 HydrophobicContact CG1-CD1 3.33Å; V121-Y184 HydrophobicContact CG1-CD2 4.17Å; V121-Y184 HydrophobicContact CG1-CE1 3.71Å; V121-Y184 HydrophobicContact CG1-CG 3.6Å; V121-Y184 HydrophobicContact CG2-CE1 4.28Å
122	V	93	Very high	91.6	Very high	52 Å²	52	65.7 Å²	65.7	32%	0.315	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	2.2	-175.1	-62.7	0	0	0	0	114.2	K113 L115 E120 N186	K113-V122 HydrophobicContact CD-CG2 4.43Å; K113-V122 HydrophobicContact CG-CG2 4.15Å; K113-V122 WeakPolarHBondContact O-CG2 3.2Å; K113-V122 PolarHBondContact O-N 3.28Å; L115-V122 HydrophobicContact CB-CG1 3.82Å; E120-V122 HydrophobicContact CG-CG1 4.37Å; V122-N186 PolarHBondContact O-ND2 2.82Å
123	G	93.3	Very high	91.4	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-176.8	177.5	0	0	0	0	0	113.1	K113 Y184	K113-G123 WeakPolarHBondContact CB-O 3.37Å; K113-G123 PolarHBondContact N-O 3.36Å; K113-G123 PolarHBondContact O-N 3.23Å; G123-Y184 WeakPolarHBondContact CA-O 3.46Å
124	V	97.4	Very high	91.5	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.6	174.4	-173.7	0	0	0	0	109.2	L106 L110 L112 W181 V185 L219	L106-V124 HydrophobicContact CD1-CG1 4.05Å; L110-V124 HydrophobicContact CB-CG1 4.04Å; L110-V124 HydrophobicContact CD1-CG1 4.03Å; L110-V124 HydrophobicContact CG-CG1 4.46Å; L112-V124 HydrophobicContact CD2-CG2 4.1Å; V124-W181 HydrophobicContact CG1-CE3 4.26Å; V124-W181 HydrophobicContact CG1-CZ3 4.24Å; V124-W181 HydrophobicContact CG2-CE3 4.31Å; V124-V185 HydrophobicContact CB-CG2 4.4Å; V124-V185 HydrophobicContact CG2-CG2 4.09Å; V124-L219 HydrophobicContact CG1-CD2 4.19Å; V124-L219 PolarHBondContact O-N 2.94Å
125	C	97.2	Very high	91.7	Very high	22 Å²	22	58.2 Å²	58.2	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	156.5	175	-69.1	0	0	0	0	110.9	L110 V111 A217	L110-C125 CarbonylContact C-O 3.55Å; L110-C125 VanDerWaalsContact CA-O 3.32Å; L110-C125 WeakPolarHBondContact CA-O 3.41Å; V111-C125 PolarHBondContact N-O 3.06Å; V111-C125 PolarHBondContact O-N 2.9Å; C125-A217 CarbonylContact C-O 3.39Å; C125-A217 VanDerWaalsContact CA-O 3.26Å; C125-A217 WeakPolarHBondContact CA-O 3.41Å
126	S	96.9	Very high	92	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	142.2	166.3	60.8	0	0	0	0	110.5	E128 P214 A215 G216 A217	S126-E128 WeakPolarHBondContact CB-O 3.35Å; S126-P214 PolarHBondContact OG-O 3.45Å; S126-A215 WeakPolarHBondContact OG-CA 3.07Å; S126-G216 WeakPolarHBondContact O-CA 3.48Å; S126-G216 PolarHBondContact O-N 3.05Å; S126-G216 PolarHBondContact OG-N 3.23Å; S126-A217 PolarHBondContact N-O 3.27Å; S126-A217 PolarHBondContact OG-N 3.26Å; S126-A217 VanDerWaalsContact OG-N 3.15Å; S126-A217 PolarHBondContact OG-O 3.39Å
127	R	93.8	Very high	92.4	Very high	169 Å²	169	50.9 Å²	50.9	64%	0.638	26%	0.264	S	S	*	.	S	Bend	trans	-88.2	-33	169.9	-167.3	-178.9	179.7	154.5	4	112	R108 N109 V111	R108-R127 VanDerWaalsContact O-CD 3.26Å; R108-R127 WeakPolarHBondContact O-CD 3.38Å; N109-R127 VanDerWaalsContact C-CB 3.48Å; N109-R127 VanDerWaalsContact O-CB 3.3Å; N109-R127 WeakPolarHBondContact O-CB 3.32Å; N109-R127 PolarHBondContact O-N 3.32Å; V111-R127 HydrophobicContact CG2-CB 3.75Å; V111-R127 HydrophobicContact CG2-CG 3.87Å
128	E	92.4	Very high	93.2	Very high	107 Å²	107	48.1 Å²	48.1	50%	0.5	23%	0.23	S	C	.	.	S	Bend	trans	-140.4	171.8	-172.9	58.7	-168.4	-149.7	0	0	108.7	N109 S126 I130	N109-E128 HydrophobicContact CB-CG 3.7Å; N109-E128 WeakPolarHBondContact CB-OE1 3.43Å; S126-E128 WeakPolarHBondContact CB-O 3.35Å; E128-I130 PolarHBondContact O-N 3.06Å
129	Y	94.3	Very high	93.6	Very high	139 Å²	139	45.7 Å²	45.7	55%	0.545	21%	0.214	S	C	.	.			trans	-63.6	125.6	177	172.8	-94.9	0	0	0	111.1	P131 P212	Y129-P131 HydrophobicContact CD1-CG 4.39Å; Y129-P131 HydrophobicContact CE1-CB 4.37Å; Y129-P131 HydrophobicContact CE1-CG 4.06Å; Y129-P212 HydrophobicContact CE2-CB 3.69Å
130	I	94.8	Very high	94.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-105.6	118.3	176.1	-43.8	170.9	0	0	0	108.2	L110 E128 T134 F136 T209 V213 L219	L110-I130 HydrophobicContact CD2-CD1 3.64Å; E128-I130 PolarHBondContact O-N 3.06Å; I130-T134 HydrophobicContact CG2-CG2 3.83Å; I130-F136 HydrophobicContact CD1-CZ 4.11Å; I130-F136 HydrophobicContact CG2-CE2 4.09Å; I130-F136 HydrophobicContact CG2-CZ 3.94Å; I130-T209 HydrophobicContact CG2-CG2 4.05Å; I130-V213 HydrophobicContact CB-CB 4.01Å; I130-V213 HydrophobicContact CB-CG2 4.41Å; I130-V213 HydrophobicContact CD1-CB 4.14Å; I130-V213 HydrophobicContact CD1-CG1 4.33Å; I130-V213 HydrophobicContact CG1-CB 4.27Å; I130-V213 PolarHBondContact N-O 2.97Å; I130-V213 PolarHBondContact O-N 3.4Å; I130-L219 HydrophobicContact CD1-CD1 4.16Å
131	P	91	Very high	94.5	Very high	34 Å²	34	35.5 Å²	35.5	22%	0.221	18%	0.176	C	C	.	.			trans	-61.9	157.6	177.4	-23.3	33.5	0	0	0	113.6	Y80 Y129 T134 T209	Y80-P131 HydrophobicContact CD2-CB 3.68Å; Y80-P131 HydrophobicContact CD2-CG 4.03Å; Y80-P131 HydrophobicContact CE2-CB 3.32Å; Y80-P131 HydrophobicContact CE2-CG 3.75Å; Y129-P131 HydrophobicContact CD1-CG 4.39Å; Y129-P131 HydrophobicContact CE1-CB 4.37Å; Y129-P131 HydrophobicContact CE1-CG 4.06Å; P131-T134 WeakPolarHBondContact O-CB 3.27Å; P131-T134 PolarHBondContact O-OG1 3.48Å; P131-T209 PolarHBondContact O-OG1 3.25Å
132	K	92.2	Very high	94.5	Very high	40 Å²	40	36.1 Å²	36.1	17%	0.174	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	148.3	162.1	-173.4	173	-179.8	177.3	0	110.3	E63 A64 M66 T134 V210 P212	E63-K132 PolarHBondContact O-NZ 3.21Å; E63-K132 WeakPolarHBondContact OE1-CD 3.36Å; E63-K132 IonicContact OE1-NZ 3.31Å; E63-K132 PolarHBondContact OE1-NZ 3.48Å; A64-K132 WeakPolarHBondContact O-CE 3.48Å; A64-K132 PolarHBondContact O-NZ 2.97Å; M66-K132 HydrophobicContact SD-CD 4.14Å; M66-K132 VanDerWaalsContact SD-CE 3.51Å; M66-K132 HydrophobicContact SD-CG 3.57Å; M66-K132 VanDerWaalsContact SD-CG 3.57Å; K132-T134 VanDerWaalsContact C-N 3.35Å; K132-T134 PolarHBondContact O-N 2.81Å; K132-V210 VanDerWaalsContact CE-O 3.24Å; K132-V210 WeakPolarHBondContact CE-O 3.47Å; K132-P212 HydrophobicContact CB-CG 4.25Å
133	G	90.9	Very high	94.4	Very high	4 Å²	4	38.9 Å²	38.9	4%	0.041	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	20.9	-178.7	0	0	0	0	0	115.1	T79 Y80 T209	T79-G133 PolarHBondContact N-O 2.82Å; Y80-G133 PolarHBondContact N-O 3.21Å; G133-T209 PolarHBondContact N-O 2.83Å; G133-T209 PolarHBondContact N-OG1 2.87Å
134	T	95.4	Very high	94.3	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.6	175.6	-59	0	0	0	0	111	Y80 V82 I130 P131 K132 F136 Y208 T209	Y80-T134 CarbonylContact O-C 3.56Å; Y80-T134 WeakPolarHBondContact O-CA 3.48Å; V82-T134 HydrophobicContact CB-CG2 4.47Å; V82-T134 HydrophobicContact CG2-CG2 3.66Å; I130-T134 HydrophobicContact CG2-CG2 3.83Å; P131-T134 WeakPolarHBondContact O-CB 3.27Å; P131-T134 PolarHBondContact O-OG1 3.48Å; K132-T134 VanDerWaalsContact C-N 3.35Å; K132-T134 PolarHBondContact O-N 2.81Å; T134-F136 HydrophobicContact CG2-CD2 4.33Å; T134-F136 HydrophobicContact CG2-CE2 3.73Å; T134-F136 HydrophobicContact CG2-CZ 4.01Å; T134-Y208 CarbonylContact O-C 3.6Å; T134-Y208 WeakPolarHBondContact O-CA 3.39Å; T134-T209 WeakPolarHBondContact CA-OG1 3.28Å; T134-T209 WeakPolarHBondContact CB-OG1 3.14Å; T134-T209 PolarHBondContact N-OG1 2.82Å; T134-T209 PolarHBondContact O-N 2.87Å; T134-T209 PolarHBondContact O-OG1 2.84Å
135	R	97.6	Very high	94	Very high	33 Å²	33	43.5 Å²	43.5	13%	0.125	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.9	176.5	-168.3	178.7	85.2	166.5	15.3	112.2	Y80 I81 V82 Y206 F207 Y208	Y80-R135 PolarHBondContact O-N 3.15Å; I81-R135 HydrophobicContact CG1-CB 4.42Å; V82-R135 PolarHBondContact N-O 2.67Å; R135-Y206 HydrophobicContact CG-CD1 3.79Å; R135-Y206 HydrophobicContact CG-CG 4.19Å; R135-Y206 VanDerWaalsContact NH2-CE1 3.33Å; R135-F207 CarbonylContact C-O 3.53Å; R135-F207 WeakPolarHBondContact CA-O 3.24Å; R135-Y208 HydrophobicContact CB-CD1 3.79Å; R135-Y208 HydrophobicContact CB-CE1 3.72Å; R135-Y208 VanDerWaalsContact CD-OH 3.24Å; R135-Y208 WeakPolarHBondContact CD-OH 3.37Å; R135-Y208 HydrophobicContact CG-CD1 3.81Å; R135-Y208 HydrophobicContact CG-CD2 4.49Å; R135-Y208 HydrophobicContact CG-CE1 3.42Å; R135-Y208 VanDerWaalsContact CG-CE1 3.42Å; R135-Y208 HydrophobicContact CG-CE2 4.16Å; R135-Y208 HydrophobicContact CG-CG 4.34Å
136	F	97.7	Very high	93.5	Very high	1 Å²	1	45.6 Å²	45.6	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	144.2	173.8	-69	-87.9	0	0	0	110.9	V82 P107 L110 I130 T134 W181 L196 Y206 F207 T209	V82-F136 HydrophobicContact CB-CD1 3.76Å; V82-F136 HydrophobicContact CB-CE1 3.66Å; V82-F136 HydrophobicContact CB-CZ 4.32Å; V82-F136 HydrophobicContact CG1-CD1 3.81Å; V82-F136 HydrophobicContact CG1-CE1 3.6Å; V82-F136 HydrophobicContact CG2-CE1 3.98Å; V82-F136 HydrophobicContact CG2-CZ 4.22Å; P107-F136 HydrophobicContact CG-CD1 4.48Å; L110-F136 HydrophobicContact CD1-CD1 4.28Å; L110-F136 HydrophobicContact CD1-CE1 3.83Å; L110-F136 HydrophobicContact CD2-CE1 4.34Å; L110-F136 HydrophobicContact CD2-CZ 4.39Å; L110-F136 HydrophobicContact CG-CE1 4.28Å; I130-F136 HydrophobicContact CD1-CZ 4.11Å; I130-F136 HydrophobicContact CG2-CE2 4.09Å; I130-F136 HydrophobicContact CG2-CZ 3.94Å; T134-F136 HydrophobicContact CG2-CD2 4.33Å; T134-F136 HydrophobicContact CG2-CE2 3.73Å; T134-F136 HydrophobicContact CG2-CZ 4.01Å; F136-W181 HydrophobicContact CB-CH2 3.95Å; F136-W181 HydrophobicContact CB-CZ2 3.88Å; F136-W181 AromaticContact CD1-CH2 3.61Å; F136-W181 HydrophobicContact CD1-CH2 3.61Å; F136-W181 AromaticContact CD1-CZ2 3.65Å; F136-W181 HydrophobicContact CD1-CZ2 3.65Å; F136-W181 HydrophobicContact CE1-CH2 4.33Å; F136-W181 AromaticContact CG-CH2 3.92Å; F136-W181 HydrophobicContact CG-CH2 3.92Å; F136-W181 HydrophobicContact CG-CZ2 4.12Å; F136-L196 HydrophobicContact CD2-CD2 4.23Å; F136-L196 HydrophobicContact CE2-CD2 4.45Å; F136-Y206 WeakPolarHBondContact O-CA 3.35Å; F136-Y206 WeakPolarHBondContact O-CD1 3.28Å; F136-F207 HydrophobicContact CB-CB 4.41Å; F136-F207 PolarHBondContact N-O 2.89Å; F136-F207 PolarHBondContact O-N 2.96Å; F136-T209 HydrophobicContact CE2-CG2 4.09Å
137	G	93.9	Very high	93.1	Very high	7 Å²	7	52.8 Å²	52.8	7%	0.072	27%	0.27	C	S	.	.			trans	118.1	-163.2	173.6	0	0	0	0	0	114.7	M182 Y206	G137-M182 WeakPolarHBondContact CA-SD 3.37Å; G137-Y206 VanDerWaalsContact C-CE1 3.48Å
138	P	96.5	Very high	92.8	Very high	37 Å²	37	47.6 Å²	47.6	24%	0.24	26%	0.26	C	S	.	.			cis	-73.9	162.4	14.6	30.7	-37.5	0	0	0	114.4	N180 E204 I205 Y206	P138-N180 PolarHBondContact O-ND2 3.38Å; P138-E204 HydrophobicContact CB-CB 3.86Å; P138-E204 HydrophobicContact CB-CG 4.08Å; P138-I205 CarbonylContact C-O 3.54Å; P138-I205 WeakPolarHBondContact CA-O 3.43Å; P138-Y206 HydrophobicContact CB-CE1 4Å; P138-Y206 HydrophobicContact CB-CE2 4.15Å; P138-Y206 HydrophobicContact CG-CE1 4.47Å
139	L	95.3	Very high	92.6	Very high	15 Å²	15	43.4 Å²	43.4	8%	0.079	24%	0.242	C	C	.	.			trans	-61.5	134.2	167.1	177.4	67.9	0	0	0	110.4	W159 V171 M182 I205	L139-W159 HydrophobicContact CD2-CB 3.87Å; L139-W159 HydrophobicContact CD2-CD2 4.03Å; L139-W159 HydrophobicContact CD2-CG 3.48Å; L139-W159 VanDerWaalsContact CD2-CG 3.48Å; L139-V171 HydrophobicContact CD2-CB 4.38Å; L139-V171 HydrophobicContact CD2-CG1 4.05Å; L139-V171 HydrophobicContact CG-CG1 4.16Å; L139-M182 HydrophobicContact CB-CE 4.02Å; L139-M182 HydrophobicContact CB-SD 4.24Å; L139-M182 HydrophobicContact CD1-CB 3.75Å; L139-I205 HydrophobicContact CB-CB 4.08Å; L139-I205 HydrophobicContact CB-CG2 4.33Å; L139-I205 HydrophobicContact CD2-CB 4.29Å; L139-I205 HydrophobicContact CD2-CD1 4.36Å; L139-I205 HydrophobicContact CD2-CG2 4.36Å; L139-I205 PolarHBondContact N-O 2.78Å
140	V	95.5	Very high	92.1	Very high	40 Å²	40	39.3 Å²	39.3	24%	0.242	23%	0.232	C	C	.	.			trans	-122.7	137.4	176.2	-173.5	0	0	0	0	109.6	S179 N180	V140-S179 WeakPolarHBondContact O-CA 3.32Å; V140-S179 WeakPolarHBondContact O-CB 3.48Å; V140-N180 HydrophobicContact CB-CB 3.99Å; V140-N180 HydrophobicContact CG2-CB 4.24Å; V140-N180 PolarHBondContact N-OD1 3.35Å; V140-N180 PolarHBondContact O-N 3.08Å; V140-N180 VanDerWaalsContact O-N 3.12Å; V140-N180 PolarHBondContact O-OD1 2.71Å
141	G	92.9	Very high	91.5	Very high	17 Å²	17	46.4 Å²	46.4	18%	0.175	26%	0.263	C	S	.	.			trans	-169.1	-169.9	178.6	0	0	0	0	0	111.7	D172	G141-D172 CarbonylContact C-O 3.58Å; G141-D172 WeakPolarHBondContact CA-O 3.48Å
142	E	92.1	Very high	91.1	Very high	34 Å²	34	49.3 Å²	49.3	16%	0.159	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	155.7	167.4	-62.5	-145	59.1	0	0	111.5	Y144 V171 D172 R178	E142-Y144 HydrophobicContact CB-CD2 4.44Å; E142-Y144 HydrophobicContact CB-CE2 3.76Å; E142-Y144 PolarHBondContact OE1-OH 3.38Å; E142-Y144 PolarHBondContact OE2-OH 3.42Å; E142-V171 CarbonylContact O-C 3.58Å; E142-V171 VanDerWaalsContact O-CA 3.28Å; E142-V171 WeakPolarHBondContact O-CA 3.22Å; E142-D172 HydrophobicContact CB-CB 4.39Å; E142-D172 PolarHBondContact N-O 3.05Å; E142-D172 PolarHBondContact O-N 2.92Å; E142-R178 IonicContact OE1-CZ 2.77Å; E142-R178 IonicContact OE1-NH1 3.74Å; E142-R178 PolarHBondContact OE1-NH1 2.9Å; E142-R178 IonicContact OE1-NH2 3.23Å; E142-R178 PolarHBondContact OE1-NH2 3.18Å; E142-R178 IonicContact OE2-NH1 3.77Å
143	I	92.4	Very high	90.7	Very high	110 Å²	110	48.5 Å²	48.5	56%	0.564	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.1	178.8	-68.3	174.5	0	0	0	109.8	H169 F170 V171	I143-H169 HydrophobicContact CG2-CB 4.35Å; I143-F170 WeakPolarHBondContact CA-O 3.08Å; I143-V171 HydrophobicContact CG1-CG2 4.49Å
144	Y	89.8	Confident	90.5	Very high	39 Å²	39	51.9 Å²	51.9	15%	0.153	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.7	178	-58.2	-72.3	0	0	0	111.6	E142 S148 V149 F158 H169 F170 D172	E142-Y144 HydrophobicContact CB-CD2 4.44Å; E142-Y144 HydrophobicContact CB-CE2 3.76Å; E142-Y144 PolarHBondContact OE1-OH 3.38Å; E142-Y144 PolarHBondContact OE2-OH 3.42Å; Y144-S148 WeakPolarHBondContact CA-OG 3.44Å; Y144-S148 WeakPolarHBondContact CD1-O 3.31Å; Y144-V149 HydrophobicContact CG-CG2 4.29Å; Y144-F158 HydrophobicContact CD2-CZ 4.27Å; Y144-H169 CarbonylContact O-C 3.6Å; Y144-H169 WeakPolarHBondContact O-CA 3.27Å; Y144-H169 WeakPolarHBondContact O-CB 3.27Å; Y144-F170 PolarHBondContact N-O 3.45Å; Y144-F170 VanDerWaalsContact N-O 3.08Å; Y144-F170 PolarHBondContact O-N 2.81Å; Y144-D172 HydrophobicContact CD2-CB 4.06Å; Y144-D172 HydrophobicContact CE2-CB 3.88Å
145	T	91.6	Very high	90.1	Very high	59 Å²	59	59.1 Å²	59.1	36%	0.362	32%	0.322	S	S	.	.			trans	-81.2	171	166.8	59.7	0	0	0	0	109.8	D147 S148 V149	T145-D147 PolarHBondContact O-N 2.96Å; T145-D147 VanDerWaalsContact O-N 3.15Å; T145-S148 PolarHBondContact N-OG 3.37Å; T145-S148 PolarHBondContact O-N 3.42Å; T145-S148 VanDerWaalsContact O-N 3.12Å; T145-S148 PolarHBondContact OG1-OG 3.31Å; T145-V149 WeakPolarHBondContact O-CG2 3.37Å; T145-V149 PolarHBondContact O-N 3.01Å
146	A	86.6	Confident	89.6	Confident	65 Å²	65	62.6 Å²	62.6	54%	0.537	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-39.7	178.3	0	0	0	0	0	112.9	F167	A146-F167 HydrophobicContact CB-CE1 4.18Å
147	D	87.8	Confident	89.3	Confident	154 Å²	154	64.7 Å²	64.7	82%	0.824	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-17.6	-176	-40.3	-74.6	0	0	0	113.8	T145	T145-D147 PolarHBondContact O-N 2.96Å; T145-D147 VanDerWaalsContact O-N 3.15Å
148	S	88.6	Confident	89.3	Confident	61 Å²	61	65.5 Å²	65.5	43%	0.427	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-2.1	-176.8	79.7	0	0	0	0	115	Y144 T145 P150	Y144-S148 WeakPolarHBondContact CA-OG 3.44Å; Y144-S148 WeakPolarHBondContact CD1-O 3.31Å; T145-S148 PolarHBondContact N-OG 3.37Å; T145-S148 PolarHBondContact O-N 3.42Å; T145-S148 VanDerWaalsContact O-N 3.12Å; T145-S148 PolarHBondContact OG1-OG 3.31Å; S148-P150 WeakPolarHBondContact O-CD 3.35Å
149	V	88	Confident	89.2	Confident	19 Å²	19	65.5 Å²	65.5	12%	0.115	34%	0.343	C	S	.	.	S	Bend	trans	-69.2	123.7	173.5	170.5	0	0	0	0	110.4	Y144 T145 A153 F158 F170	Y144-V149 HydrophobicContact CG-CG2 4.29Å; T145-V149 WeakPolarHBondContact O-CG2 3.37Å; T145-V149 PolarHBondContact O-N 3.01Å; V149-A153 HydrophobicContact CG1-CB 3.93Å; V149-F158 HydrophobicContact CG1-CE2 3.86Å; V149-F158 HydrophobicContact CG1-CZ 4.07Å; V149-F158 HydrophobicContact CG2-CE2 3.84Å; V149-F158 HydrophobicContact CG2-CZ 4.42Å; V149-F170 HydrophobicContact CG2-CD2 3.49Å; V149-F170 VanDerWaalsContact CG2-CD2 3.49Å; V149-F170 HydrophobicContact CG2-CE2 3.76Å
150	P	84.4	Confident	89.2	Confident	52 Å²	52	69.1 Å²	69.1	34%	0.338	36%	0.356	S	S	.	.			trans	-56.6	142.6	172.5	-23.6	32.3	0	0	0	112.4	S148 D152 A153	S148-P150 WeakPolarHBondContact O-CD 3.35Å; P150-D152 PolarHBondContact O-N 3.42Å; P150-D152 VanDerWaalsContact O-N 3.15Å; P150-A153 HydrophobicContact CB-CB 4.04Å; P150-A153 HydrophobicContact CG-CB 4.32Å; P150-A153 VanDerWaalsContact O-CB 3.22Å; P150-A153 WeakPolarHBondContact O-CB 3.48Å; P150-A153 PolarHBondContact O-N 2.74Å
151	K	81.6	Confident	89.1	Confident	151 Å²	151	67.3 Å²	67.3	66%	0.657	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.4	-175.2	-69.6	-176.2	168.6	-171.9	0	113.5	A513	K151-A513 WeakPolarHBondContact CD-O 3.44Å; K151-A513 PolarHBondContact NZ-O 3.03Å
152	D	83.5	Confident	89.1	Confident	95 Å²	95	67.6 Å²	67.6	51%	0.508	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	9.3	-179.7	56.2	-27	0	0	0	113.2	P150 N154	P150-D152 PolarHBondContact O-N 3.42Å; P150-D152 VanDerWaalsContact O-N 3.15Å; D152-N154 PolarHBondContact O-N 3.03Å
153	A	83.1	Confident	89	Confident	24 Å²	24	68.5 Å²	68.5	20%	0.198	35%	0.348	C	S	.	.			trans	-58.6	131.5	-178.5	0	0	0	0	0	112.9	V149 P150 R155 F158	V149-A153 HydrophobicContact CG1-CB 3.93Å; P150-A153 HydrophobicContact CB-CB 4.04Å; P150-A153 HydrophobicContact CG-CB 4.32Å; P150-A153 VanDerWaalsContact O-CB 3.22Å; P150-A153 WeakPolarHBondContact O-CB 3.48Å; P150-A153 PolarHBondContact O-N 2.74Å; A153-R155 WeakPolarHBondContact O-CG 3.34Å; A153-R155 PolarHBondContact O-N 2.98Å; A153-F158 HydrophobicContact CB-CE1 4.36Å; A153-F158 HydrophobicContact CB-CZ 3.82Å
154	N	86.8	Confident	88.8	Confident	75 Å²	75	71.2 Å²	71.2	40%	0.401	36%	0.364	S	S	.	.			trans	-76	92.2	178.5	-180	5.4	0	0	0	111.4	D152 K156 L174	D152-N154 PolarHBondContact O-N 3.03Å; N154-K156 PolarHBondContact O-N 3.01Å; N154-K156 VanDerWaalsContact OD1-CB 3.27Å; N154-K156 WeakPolarHBondContact OD1-CB 3.35Å; N154-K156 PolarHBondContact OD1-N 2.69Å; N154-L174 HydrophobicContact CB-CD1 4.39Å; N154-L174 HydrophobicContact CB-CD2 4.09Å
155	R	85.9	Confident	88.5	Confident	154 Å²	154	71.8 Å²	71.8	58%	0.581	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-68.3	9.8	-176.2	-56.1	-174.4	-179.3	173.1	-2.8	115.7	A153 Y157 F158	A153-R155 WeakPolarHBondContact O-CG 3.34Å; A153-R155 PolarHBondContact O-N 2.98Å; R155-Y157 VanDerWaalsContact C-N 3.29Å; R155-Y157 PolarHBondContact O-N 3.21Å; R155-F158 HydrophobicContact CB-CB 4.34Å; R155-F158 HydrophobicContact CB-CD1 4.28Å; R155-F158 HydrophobicContact CB-CD2 4.2Å; R155-F158 HydrophobicContact CB-CG 4.03Å; R155-F158 HydrophobicContact CG-CD1 4.4Å; R155-F158 HydrophobicContact CG-CD2 3.87Å; R155-F158 HydrophobicContact CG-CE1 4.37Å; R155-F158 HydrophobicContact CG-CE2 3.9Å; R155-F158 HydrophobicContact CG-CG 4.17Å; R155-F158 HydrophobicContact CG-CZ 4.16Å; R155-F158 PolarHBondContact O-N 3.13Å
156	K	87.2	Confident	88.4	Confident	105 Å²	105	76 Å²	76	46%	0.457	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-59.3	-36	177.4	178.2	179.5	172.9	-158.6	0	112.9	N154 I287	N154-K156 PolarHBondContact O-N 3.01Å; N154-K156 VanDerWaalsContact OD1-CB 3.27Å; N154-K156 WeakPolarHBondContact OD1-CB 3.35Å; N154-K156 PolarHBondContact OD1-N 2.69Å; K156-I287 HydrophobicContact CD-CD1 4.43Å; K156-I287 HydrophobicContact CG-CD1 4.27Å
157	Y	91.9	Very high	88.7	Confident	46 Å²	46	76 Å²	76	18%	0.18	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-106.6	13.7	-175.6	-59.9	-88.1	0	0	0	113.2	R155 D172 G173 L174 R183	R155-Y157 VanDerWaalsContact C-N 3.29Å; R155-Y157 PolarHBondContact O-N 3.21Å; Y157-D172 WeakPolarHBondContact CB-OD1 3.4Å; Y157-G173 PolarHBondContact O-N 3.29Å; Y157-L174 HydrophobicContact CD2-CB 4.34Å; Y157-L174 HydrophobicContact CD2-CD1 3.69Å; Y157-L174 HydrophobicContact CE2-CD1 3.92Å; Y157-R183 HydrophobicContact CD1-CB 4.32Å; Y157-R183 WeakPolarHBondContact CE1-O 3.29Å
158	F	93.1	Very high	88.9	Confident	24 Å²	24	73 Å²	73	11%	0.105	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	119.3	-178.2	-83.9	40	0	0	0	111.8	Y144 V149 A153 R155 F170 D172	Y144-F158 HydrophobicContact CD2-CZ 4.27Å; V149-F158 HydrophobicContact CG1-CE2 3.86Å; V149-F158 HydrophobicContact CG1-CZ 4.07Å; V149-F158 HydrophobicContact CG2-CE2 3.84Å; V149-F158 HydrophobicContact CG2-CZ 4.42Å; A153-F158 HydrophobicContact CB-CE1 4.36Å; A153-F158 HydrophobicContact CB-CZ 3.82Å; R155-F158 HydrophobicContact CB-CB 4.34Å; R155-F158 HydrophobicContact CB-CD1 4.28Å; R155-F158 HydrophobicContact CB-CD2 4.2Å; R155-F158 HydrophobicContact CB-CG 4.03Å; R155-F158 HydrophobicContact CG-CD1 4.4Å; R155-F158 HydrophobicContact CG-CD2 3.87Å; R155-F158 HydrophobicContact CG-CE1 4.37Å; R155-F158 HydrophobicContact CG-CE2 3.9Å; R155-F158 HydrophobicContact CG-CG 4.17Å; R155-F158 HydrophobicContact CG-CZ 4.16Å; R155-F158 PolarHBondContact O-N 3.13Å; F158-F170 HydrophobicContact CB-CD1 4.07Å; F158-F170 HydrophobicContact CD2-CB 3.88Å; F158-F170 AromaticContact CD2-CD1 3.43Å; F158-F170 HydrophobicContact CD2-CD1 3.43Å; F158-F170 VanDerWaalsContact CD2-CD1 3.43Å; F158-F170 AromaticContact CD2-CD2 3.98Å; F158-F170 HydrophobicContact CD2-CD2 3.98Å; F158-F170 AromaticContact CD2-CE1 3.84Å; F158-F170 HydrophobicContact CD2-CE1 3.84Å; F158-F170 HydrophobicContact CD2-CE2 4.36Å; F158-F170 AromaticContact CD2-CG 3.49Å; F158-F170 HydrophobicContact CD2-CG 3.49Å; F158-F170 VanDerWaalsContact CD2-CG 3.49Å; F158-F170 HydrophobicContact CD2-CZ 4.3Å; F158-F170 HydrophobicContact CE2-CB 4.2Å; F158-F170 HydrophobicContact CE2-CD1 4.26Å; F158-F170 AromaticContact CE2-CD2 3.98Å; F158-F170 HydrophobicContact CE2-CD2 3.98Å; F158-F170 HydrophobicContact CE2-CE2 4.41Å; F158-F170 AromaticContact CE2-CG 3.9Å; F158-F170 HydrophobicContact CE2-CG 3.9Å; F158-F170 HydrophobicContact CG-CB 4.46Å; F158-F170 HydrophobicContact CG-CD1 4.17Å; F158-F170 HydrophobicContact CG-CG 4.39Å; F158-D172 HydrophobicContact CD1-CB 3.68Å; F158-D172 VanDerWaalsContact CD1-OD1 3.31Å; F158-D172 WeakPolarHBondContact CD1-OD1 3.38Å; F158-D172 HydrophobicContact CE1-CB 3.64Å; F158-D172 VanDerWaalsContact CE1-OD2 3.27Å; F158-D172 WeakPolarHBondContact CE1-OD2 3.37Å; F158-D172 HydrophobicContact CZ-CB 4.39Å
159	W	96.3	Very high	89.1	Confident	36 Å²	36	70.6 Å²	70.6	14%	0.136	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.1	167	-65.5	78.9	0	0	0	110.1	L139 F170 V171 A198 I205 F207 V221 Y223 F227	L139-W159 HydrophobicContact CD2-CB 3.87Å; L139-W159 HydrophobicContact CD2-CD2 4.03Å; L139-W159 HydrophobicContact CD2-CG 3.48Å; L139-W159 VanDerWaalsContact CD2-CG 3.48Å; W159-F170 CarbonylContact O-C 3.43Å; W159-F170 WeakPolarHBondContact O-CA 3.21Å; W159-V171 PolarHBondContact N-O 2.81Å; W159-V171 PolarHBondContact O-N 3.36Å; W159-A198 HydrophobicContact CH2-CB 3.85Å; W159-A198 HydrophobicContact CZ3-CB 3.53Å; W159-I205 HydrophobicContact CB-CD1 3.59Å; W159-I205 HydrophobicContact CD2-CD1 4.36Å; W159-I205 HydrophobicContact CE3-CD1 4.05Å; W159-I205 HydrophobicContact CE3-CG2 4.26Å; W159-I205 HydrophobicContact CG-CD1 4.23Å; W159-F207 AromaticContact CH2-CE1 3.6Å; W159-F207 HydrophobicContact CH2-CE1 3.6Å; W159-F207 AromaticContact CH2-CZ 3.82Å; W159-F207 HydrophobicContact CH2-CZ 3.82Å; W159-F207 AromaticContact CZ2-CE1 3.88Å; W159-F207 HydrophobicContact CZ2-CE1 3.88Å; W159-F207 AromaticContact CZ2-CZ 3.64Å; W159-F207 HydrophobicContact CZ2-CZ 3.64Å; W159-F207 HydrophobicContact CZ3-CE1 4.12Å; W159-V221 HydrophobicContact CH2-CG1 4.44Å; W159-Y223 AromaticContact CE3-CE1 3.85Å; W159-Y223 HydrophobicContact CE3-CE1 3.85Å; W159-Y223 HydrophobicContact CH2-CE1 4.25Å; W159-Y223 AromaticContact CZ3-CD1 3.97Å; W159-Y223 HydrophobicContact CZ3-CD1 3.97Å; W159-Y223 AromaticContact CZ3-CE1 3.44Å; W159-Y223 HydrophobicContact CZ3-CE1 3.44Å; W159-Y223 VanDerWaalsContact CZ3-CE1 3.44Å; W159-F227 HydrophobicContact CE3-CE1 4.44Å
160	R	94.1	Very high	89.4	Confident	92 Å²	92	70.8 Å²	70.8	35%	0.347	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.9	-179.4	-67.3	-175.2	-173.2	138.8	4.1	111.1	F162 F167 F170 F227 L231	R160-F162 HydrophobicContact CB-CD2 4.29Å; R160-F162 HydrophobicContact CB-CE2 3.6Å; R160-F162 HydrophobicContact CB-CZ 4.12Å; R160-F167 HydrophobicContact CB-CD2 4.08Å; R160-F167 HydrophobicContact CB-CE2 4.08Å; R160-F167 HydrophobicContact CG-CD2 4.09Å; R160-F167 HydrophobicContact CG-CE2 3.91Å; R160-F170 HydrophobicContact CG-CD1 3.83Å; R160-F170 HydrophobicContact CG-CE1 3.58Å; R160-F227 WeakPolarHBondContact O-CE2 3.41Å; R160-F227 VanDerWaalsContact O-CZ 3.29Å; R160-F227 WeakPolarHBondContact O-CZ 3.26Å; R160-L231 HydrophobicContact CB-CD2 4.26Å; R160-L231 HydrophobicContact CG-CD2 4.34Å
161	I	94.3	Very high	89.9	Confident	1 Å²	1	69 Å²	69	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.4	168.9	-57.3	-62.6	0	0	0	109.1	H168 H169 V171 Q200 I205	I161-H168 PolarHBondContact O-N 2.8Å; I161-H169 PolarHBondContact N-O 2.81Å; I161-H169 PolarHBondContact O-N 2.96Å; I161-V171 HydrophobicContact CD1-CG2 4.41Å; I161-V171 HydrophobicContact CG1-CG2 3.97Å; I161-Q200 HydrophobicContact CD1-CG 4.05Å; I161-I205 HydrophobicContact CD1-CD1 3.56Å; I161-I205 HydrophobicContact CD1-CG1 3.63Å
162	F	92.7	Very high	90.5	Very high	24 Å²	24	62 Å²	62	11%	0.105	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.2	178.1	-65.8	-96.7	0	0	0	110.9	R160 E166 F167 Q200 F227 R230 L231	R160-F162 HydrophobicContact CB-CD2 4.29Å; R160-F162 HydrophobicContact CB-CE2 3.6Å; R160-F162 HydrophobicContact CB-CZ 4.12Å; F162-E166 CarbonylContact C-O 3.58Å; F162-E166 WeakPolarHBondContact CA-O 3.45Å; F162-E166 WeakPolarHBondContact CB-O 3.45Å; F162-F167 HydrophobicContact CD1-CB 4.41Å; F162-F167 HydrophobicContact CE1-CB 4.25Å; F162-Q200 PolarHBondContact O-NE2 2.89Å; F162-F227 HydrophobicContact CD2-CE2 4.24Å; F162-F227 HydrophobicContact CE2-CE2 4.06Å; F162-R230 HydrophobicContact CD2-CB 4.46Å; F162-R230 HydrophobicContact CE1-CB 4.44Å; F162-R230 HydrophobicContact CE2-CB 4.23Å; F162-R230 HydrophobicContact CZ-CB 4.22Å; F162-L231 HydrophobicContact CE2-CD2 3.99Å; F162-L231 HydrophobicContact CZ-CD2 4.08Å
163	V	90.4	Very high	90.9	Very high	52 Å²	52	57.5 Å²	57.5	32%	0.315	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.7	173	177.7	0	0	0	0	108	G165 E166 H168	V163-G165 PolarHBondContact O-N 3.25Å; V163-G165 VanDerWaalsContact O-N 3.08Å; V163-E166 PolarHBondContact N-O 2.92Å; V163-E166 PolarHBondContact O-N 3.32Å; V163-H168 HydrophobicContact CB-CB 4.31Å; V163-H168 HydrophobicContact CG2-CB 3.99Å
164	D	86.9	Confident	91.3	Very high	167 Å²	167	59.5 Å²	59.5	89%	0.893	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	28.9	-175.3	-53.1	-28.7	0	0	0	114	E166	D164-E166 VanDerWaalsContact C-N 3.33Å
165	G	84.1	Confident	91.5	Very high	52 Å²	52	58 Å²	58	54%	0.536	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	-21.7	-177	0	0	0	0	0	114.8	V163	V163-G165 PolarHBondContact O-N 3.25Å; V163-G165 VanDerWaalsContact O-N 3.08Å
166	E	89.4	Confident	91.8	Very high	148 Å²	148	53.9 Å²	53.9	69%	0.692	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	155.6	-177.6	-74.9	-58.2	150.8	0	0	113.3	F162 V163 D164 H168	F162-E166 CarbonylContact C-O 3.58Å; F162-E166 WeakPolarHBondContact CA-O 3.45Å; F162-E166 WeakPolarHBondContact CB-O 3.45Å; V163-E166 PolarHBondContact N-O 2.92Å; V163-E166 PolarHBondContact O-N 3.32Å; D164-E166 VanDerWaalsContact C-N 3.33Å; E166-H168 PolarHBondContact O-N 2.84Å
167	F	92.3	Very high	92	Very high	64 Å²	64	53.2 Å²	53.2	28%	0.281	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	125.8	177	169.3	-97	0	0	0	111.1	A146 R160 F162 H169 F170	A146-F167 HydrophobicContact CB-CE1 4.18Å; R160-F167 HydrophobicContact CB-CD2 4.08Å; R160-F167 HydrophobicContact CB-CE2 4.08Å; R160-F167 HydrophobicContact CG-CD2 4.09Å; R160-F167 HydrophobicContact CG-CE2 3.91Å; F162-F167 HydrophobicContact CD1-CB 4.41Å; F162-F167 HydrophobicContact CE1-CB 4.25Å; F167-H169 VanDerWaalsContact CE2-C 3.43Å; F167-H169 VanDerWaalsContact CE2-O 3.25Å; F167-H169 WeakPolarHBondContact CE2-O 3.34Å; F167-F170 HydrophobicContact CE1-CD2 4.46Å; F167-F170 HydrophobicContact CE1-CE2 4.06Å; F167-F170 HydrophobicContact CE1-CZ 4.44Å; F167-F170 AromaticContact CE2-CD1 3.99Å; F167-F170 HydrophobicContact CE2-CD1 3.99Å; F167-F170 HydrophobicContact CE2-CD2 4.2Å; F167-F170 AromaticContact CE2-CE1 3.9Å; F167-F170 HydrophobicContact CE2-CE1 3.9Å; F167-F170 HydrophobicContact CE2-CE2 4.08Å; F167-F170 HydrophobicContact CE2-CG 4.15Å; F167-F170 AromaticContact CE2-CZ 3.93Å; F167-F170 HydrophobicContact CE2-CZ 3.93Å; F167-F170 HydrophobicContact CZ-CD1 4.14Å; F167-F170 AromaticContact CZ-CD2 3.51Å; F167-F170 HydrophobicContact CZ-CD2 3.51Å; F167-F170 HydrophobicContact CZ-CE1 4.06Å; F167-F170 AromaticContact CZ-CE2 3.37Å; F167-F170 HydrophobicContact CZ-CE2 3.37Å; F167-F170 AromaticContact CZ-CG 3.9Å; F167-F170 HydrophobicContact CZ-CG 3.9Å; F167-F170 AromaticContact CZ-CZ 3.67Å; F167-F170 HydrophobicContact CZ-CZ 3.67Å
168	H	92.1	Very high	91.8	Very high	90 Å²	90	56.8 Å²	56.8	42%	0.417	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	-52.3	-180	-175.5	-38	0	0	0	113	I161 V163 E166	I161-H168 PolarHBondContact O-N 2.8Å; V163-H168 HydrophobicContact CB-CB 4.31Å; V163-H168 HydrophobicContact CG2-CB 3.99Å; E166-H168 PolarHBondContact O-N 2.84Å
169	H	93.4	Very high	91.9	Very high	12 Å²	12	55.6 Å²	55.6	6%	0.056	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	163.9	-177.6	64.2	-87.6	0	0	0	112.7	I143 Y144 I161 F167	I143-H169 HydrophobicContact CG2-CB 4.35Å; Y144-H169 CarbonylContact O-C 3.6Å; Y144-H169 WeakPolarHBondContact O-CA 3.27Å; Y144-H169 WeakPolarHBondContact O-CB 3.27Å; I161-H169 PolarHBondContact N-O 2.81Å; I161-H169 PolarHBondContact O-N 2.96Å; F167-H169 VanDerWaalsContact CE2-C 3.43Å; F167-H169 VanDerWaalsContact CE2-O 3.25Å; F167-H169 WeakPolarHBondContact CE2-O 3.34Å
170	F	93.6	Very high	91.8	Very high	23 Å²	23	54 Å²	54	10%	0.101	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	143.5	167.8	-61.6	-77.1	0	0	0	110.9	I143 Y144 V149 F158 W159 R160 F167	I143-F170 WeakPolarHBondContact CA-O 3.08Å; Y144-F170 PolarHBondContact N-O 3.45Å; Y144-F170 VanDerWaalsContact N-O 3.08Å; Y144-F170 PolarHBondContact O-N 2.81Å; V149-F170 HydrophobicContact CG2-CD2 3.49Å; V149-F170 VanDerWaalsContact CG2-CD2 3.49Å; V149-F170 HydrophobicContact CG2-CE2 3.76Å; F158-F170 HydrophobicContact CB-CD1 4.07Å; F158-F170 HydrophobicContact CD2-CB 3.88Å; F158-F170 AromaticContact CD2-CD1 3.43Å; F158-F170 HydrophobicContact CD2-CD1 3.43Å; F158-F170 VanDerWaalsContact CD2-CD1 3.43Å; F158-F170 AromaticContact CD2-CD2 3.98Å; F158-F170 HydrophobicContact CD2-CD2 3.98Å; F158-F170 AromaticContact CD2-CE1 3.84Å; F158-F170 HydrophobicContact CD2-CE1 3.84Å; F158-F170 HydrophobicContact CD2-CE2 4.36Å; F158-F170 AromaticContact CD2-CG 3.49Å; F158-F170 HydrophobicContact CD2-CG 3.49Å; F158-F170 VanDerWaalsContact CD2-CG 3.49Å; F158-F170 HydrophobicContact CD2-CZ 4.3Å; F158-F170 HydrophobicContact CE2-CB 4.2Å; F158-F170 HydrophobicContact CE2-CD1 4.26Å; F158-F170 AromaticContact CE2-CD2 3.98Å; F158-F170 HydrophobicContact CE2-CD2 3.98Å; F158-F170 HydrophobicContact CE2-CE2 4.41Å; F158-F170 AromaticContact CE2-CG 3.9Å; F158-F170 HydrophobicContact CE2-CG 3.9Å; F158-F170 HydrophobicContact CG-CB 4.46Å; F158-F170 HydrophobicContact CG-CD1 4.17Å; F158-F170 HydrophobicContact CG-CG 4.39Å; W159-F170 CarbonylContact O-C 3.43Å; W159-F170 WeakPolarHBondContact O-CA 3.21Å; R160-F170 HydrophobicContact CG-CD1 3.83Å; R160-F170 HydrophobicContact CG-CE1 3.58Å; F167-F170 HydrophobicContact CE1-CD2 4.46Å; F167-F170 HydrophobicContact CE1-CE2 4.06Å; F167-F170 HydrophobicContact CE1-CZ 4.44Å; F167-F170 AromaticContact CE2-CD1 3.99Å; F167-F170 HydrophobicContact CE2-CD1 3.99Å; F167-F170 HydrophobicContact CE2-CD2 4.2Å; F167-F170 AromaticContact CE2-CE1 3.9Å; F167-F170 HydrophobicContact CE2-CE1 3.9Å; F167-F170 HydrophobicContact CE2-CE2 4.08Å; F167-F170 HydrophobicContact CE2-CG 4.15Å; F167-F170 AromaticContact CE2-CZ 3.93Å; F167-F170 HydrophobicContact CE2-CZ 3.93Å; F167-F170 HydrophobicContact CZ-CD1 4.14Å; F167-F170 AromaticContact CZ-CD2 3.51Å; F167-F170 HydrophobicContact CZ-CD2 3.51Å; F167-F170 HydrophobicContact CZ-CE1 4.06Å; F167-F170 AromaticContact CZ-CE2 3.37Å; F167-F170 HydrophobicContact CZ-CE2 3.37Å; F167-F170 AromaticContact CZ-CG 3.9Å; F167-F170 HydrophobicContact CZ-CG 3.9Å; F167-F170 AromaticContact CZ-CZ 3.67Å; F167-F170 HydrophobicContact CZ-CZ 3.67Å
171	V	94.4	Very high	92	Very high	13 Å²	13	49.6 Å²	49.6	8%	0.079	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116.8	156.4	-179.5	0	0	0	0	107	L139 E142 I143 W159 I161	L139-V171 HydrophobicContact CD2-CB 4.38Å; L139-V171 HydrophobicContact CD2-CG1 4.05Å; L139-V171 HydrophobicContact CG-CG1 4.16Å; E142-V171 CarbonylContact O-C 3.58Å; E142-V171 VanDerWaalsContact O-CA 3.28Å; E142-V171 WeakPolarHBondContact O-CA 3.22Å; I143-V171 HydrophobicContact CG1-CG2 4.49Å; W159-V171 PolarHBondContact N-O 2.81Å; W159-V171 PolarHBondContact O-N 3.36Å; I161-V171 HydrophobicContact CD1-CG2 4.41Å; I161-V171 HydrophobicContact CG1-CG2 3.97Å
172	D	94.6	Very high	92.1	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	117.3	179.5	-179	21.9	0	0	0	111.3	G141 E142 Y144 Y157 F158 L174	G141-D172 CarbonylContact C-O 3.58Å; G141-D172 WeakPolarHBondContact CA-O 3.48Å; E142-D172 HydrophobicContact CB-CB 4.39Å; E142-D172 PolarHBondContact N-O 3.05Å; E142-D172 PolarHBondContact O-N 2.92Å; Y144-D172 HydrophobicContact CD2-CB 4.06Å; Y144-D172 HydrophobicContact CE2-CB 3.88Å; Y157-D172 WeakPolarHBondContact CB-OD1 3.4Å; F158-D172 HydrophobicContact CD1-CB 3.68Å; F158-D172 VanDerWaalsContact CD1-OD1 3.31Å; F158-D172 WeakPolarHBondContact CD1-OD1 3.38Å; F158-D172 HydrophobicContact CE1-CB 3.64Å; F158-D172 VanDerWaalsContact CE1-OD2 3.27Å; F158-D172 WeakPolarHBondContact CE1-OD2 3.37Å; F158-D172 HydrophobicContact CZ-CB 4.39Å; D172-L174 VanDerWaalsContact C-N 3.28Å; D172-L174 PolarHBondContact O-N 2.78Å; D172-L174 WeakPolarHBondContact OD1-CB 3.39Å; D172-L174 PolarHBondContact OD1-N 2.96Å; D172-L174 VanDerWaalsContact OD2-CB 3.31Å; D172-L174 WeakPolarHBondContact OD2-CB 3.48Å
173	G	91.6	Very high	92.3	Very high	2 Å²	2	49.6 Å²	49.6	2%	0.021	26%	0.258	C	S	.	.			trans	-81.7	8.9	176	0	0	0	0	0	115.1	Y157 S179 R183	Y157-G173 PolarHBondContact O-N 3.29Å; G173-S179 VanDerWaalsContact C-OG 3.26Å; G173-S179 WeakPolarHBondContact CA-OG 3.13Å; G173-S179 PolarHBondContact O-OG 2.99Å; G173-R183 PolarHBondContact O-NE 2.86Å
174	L	92.6	Very high	92.6	Very high	66 Å²	66	47.8 Å²	47.8	35%	0.346	25%	0.246	S	C	.	.			trans	-62.1	-49.4	-171.6	-176.4	66	0	0	0	113.6	N154 Y157 D172 E176 R183	N154-L174 HydrophobicContact CB-CD1 4.39Å; N154-L174 HydrophobicContact CB-CD2 4.09Å; Y157-L174 HydrophobicContact CD2-CB 4.34Å; Y157-L174 HydrophobicContact CD2-CD1 3.69Å; Y157-L174 HydrophobicContact CE2-CD1 3.92Å; D172-L174 VanDerWaalsContact C-N 3.28Å; D172-L174 PolarHBondContact O-N 2.78Å; D172-L174 WeakPolarHBondContact OD1-CB 3.39Å; D172-L174 PolarHBondContact OD1-N 2.96Å; D172-L174 VanDerWaalsContact OD2-CB 3.31Å; D172-L174 WeakPolarHBondContact OD2-CB 3.48Å; L174-E176 PolarHBondContact O-N 3.06Å; L174-R183 PolarHBondContact O-NH2 2.8Å
175	D	90.4	Very high	93.1	Very high	44 Å²	44	40.5 Å²	40.5	24%	0.235	21%	0.207	C	C	.	.			trans	-77.1	114.6	-178.1	176.6	5.4	0	0	0	112.1	T177 R178 S179	D175-T177 VanDerWaalsContact C-N 3.27Å; D175-T177 VanDerWaalsContact CG-OG1 3.28Å; D175-T177 PolarHBondContact O-N 3.3Å; D175-T177 WeakPolarHBondContact OD1-CA 3.25Å; D175-T177 WeakPolarHBondContact OD1-CB 3.37Å; D175-T177 PolarHBondContact OD1-N 2.99Å; D175-T177 PolarHBondContact OD1-OG1 2.89Å; D175-T177 PolarHBondContact OD2-OG1 3.03Å; D175-T177 VanDerWaalsContact OD2-OG1 3.05Å; D175-R178 HydrophobicContact CB-CB 4.34Å; D175-R178 PolarHBondContact O-N 2.85Å; D175-R178 WeakPolarHBondContact OD2-CB 3.47Å; D175-R178 WeakPolarHBondContact OD2-CD 3.35Å; D175-R178 WeakPolarHBondContact OD2-CG 3.44Å; D175-S179 WeakPolarHBondContact O-CB 3.47Å; D175-S179 PolarHBondContact O-N 2.75Å; D175-S179 PolarHBondContact O-OG 3.15Å
176	E	92.9	Very high	93.6	Very high	66 Å²	66	40.6 Å²	40.6	31%	0.308	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-19.3	-179.7	-61.6	-170	166	0	0	114.2	T100 R101 A102 L174 R183 Y184	T100-E176 HydrophobicContact CG2-CB 3.95Å; R101-E176 PolarHBondContact N-O 2.87Å; A102-E176 HydrophobicContact CB-CB 4.16Å; A102-E176 WeakPolarHBondContact CB-O 3.43Å; A102-E176 PolarHBondContact N-O 2.61Å; L174-E176 PolarHBondContact O-N 3.06Å; E176-R183 VanDerWaalsContact CG-NH2 3.35Å; E176-R183 IonicContact OE1-CZ 3.28Å; E176-R183 VanDerWaalsContact OE1-CZ 3.23Å; E176-R183 IonicContact OE1-NH1 2.59Å; E176-R183 PolarHBondContact OE1-NH1 3.44Å; E176-R183 IonicContact OE1-NH2 3.14Å; E176-R183 PolarHBondContact OE1-NH2 2.84Å; E176-Y184 PolarHBondContact OE1-OH 3.34Å; E176-Y184 VanDerWaalsContact OE1-OH 3.09Å; E176-Y184 PolarHBondContact OE2-OH 2.83Å
177	T	90.8	Very high	93.8	Very high	92 Å²	92	37.1 Å²	37.1	56%	0.564	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-22.6	176.1	74.5	0	0	0	0	112.3	R101 D175	R101-T177 VanDerWaalsContact CB-O 3.23Å; R101-T177 WeakPolarHBondContact CB-O 3.22Å; R101-T177 WeakPolarHBondContact CD-O 3.31Å; D175-T177 VanDerWaalsContact C-N 3.27Å; D175-T177 VanDerWaalsContact CG-OG1 3.28Å; D175-T177 PolarHBondContact O-N 3.3Å; D175-T177 WeakPolarHBondContact OD1-CA 3.25Å; D175-T177 WeakPolarHBondContact OD1-CB 3.37Å; D175-T177 PolarHBondContact OD1-N 2.99Å; D175-T177 PolarHBondContact OD1-OG1 2.89Å; D175-T177 PolarHBondContact OD2-OG1 3.03Å; D175-T177 VanDerWaalsContact OD2-OG1 3.05Å
178	R	87.6	Confident	93.9	Very high	120 Å²	120	34.2 Å²	34.2	45%	0.453	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-19.6	-177.3	-70	177.2	61.8	-160.7	-15.2	114.3	E142 D175	E142-R178 IonicContact OE1-CZ 2.77Å; E142-R178 IonicContact OE1-NH1 3.74Å; E142-R178 PolarHBondContact OE1-NH1 2.9Å; E142-R178 IonicContact OE1-NH2 3.23Å; E142-R178 PolarHBondContact OE1-NH2 3.18Å; E142-R178 IonicContact OE2-NH1 3.77Å; D175-R178 HydrophobicContact CB-CB 4.34Å; D175-R178 PolarHBondContact O-N 2.85Å; D175-R178 WeakPolarHBondContact OD2-CB 3.47Å; D175-R178 WeakPolarHBondContact OD2-CD 3.35Å; D175-R178 WeakPolarHBondContact OD2-CG 3.44Å
179	S	94.5	Very high	93.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-90.5	172.4	179	-50.9	0	0	0	0	113.4	R101 A102 V140 G173 D175	R101-S179 WeakPolarHBondContact CD-O 3.38Å; R101-S179 WeakPolarHBondContact CG-O 3.29Å; A102-S179 PolarHBondContact N-O 2.79Å; V140-S179 WeakPolarHBondContact O-CA 3.32Å; V140-S179 WeakPolarHBondContact O-CB 3.48Å; G173-S179 VanDerWaalsContact C-OG 3.26Å; G173-S179 WeakPolarHBondContact CA-OG 3.13Å; G173-S179 PolarHBondContact O-OG 2.99Å; D175-S179 WeakPolarHBondContact O-CB 3.47Å; D175-S179 PolarHBondContact O-N 2.75Å; D175-S179 PolarHBondContact O-OG 3.15Å
180	N	96	Very high	93.4	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.187	C	C	.	.			trans	-107.2	173	167.5	71.6	-18	0	0	0	112.9	D84 S105 P138 V140 M182 R183	D84-N180 VanDerWaalsContact OD2-CB 3.32Å; D84-N180 WeakPolarHBondContact OD2-CB 3.27Å; D84-N180 PolarHBondContact OD2-ND2 3.12Å; S105-N180 WeakPolarHBondContact OG-CA 3.33Å; S105-N180 WeakPolarHBondContact OG-CB 3.21Å; P138-N180 PolarHBondContact O-ND2 3.38Å; V140-N180 HydrophobicContact CB-CB 3.99Å; V140-N180 HydrophobicContact CG2-CB 4.24Å; V140-N180 PolarHBondContact N-OD1 3.35Å; V140-N180 PolarHBondContact O-N 3.08Å; V140-N180 VanDerWaalsContact O-N 3.12Å; V140-N180 PolarHBondContact O-OD1 2.71Å; N180-M182 PolarHBondContact O-N 3.16Å; N180-R183 WeakPolarHBondContact O-CG 3.24Å; N180-R183 PolarHBondContact O-N 3.45Å
181	W	96.9	Very high	93.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-52.8	-24.8	-176.2	67.2	-83.3	0	0	0	114.6	D84 A102 S105 L106 P107 L110 V124 F136 R183 Y184 V185 L219	D84-W181 PolarHBondContact OD1-NE1 3.09Å; A102-W181 WeakPolarHBondContact O-CA 3.39Å; A102-W181 VanDerWaalsContact O-CB 3.24Å; A102-W181 WeakPolarHBondContact O-CB 3.41Å; A102-W181 PolarHBondContact O-N 2.96Å; A102-W181 VanDerWaalsContact O-N 3.16Å; S105-W181 PolarHBondContact OG-N 3.24Å; L106-W181 HydrophobicContact CB-CB 4.22Å; L106-W181 HydrophobicContact CD1-CB 3.85Å; L106-W181 HydrophobicContact CD1-CD2 4.05Å; L106-W181 HydrophobicContact CD1-CE3 3.92Å; L106-W181 HydrophobicContact CD1-CG 4.04Å; P107-W181 VanDerWaalsContact CD-CE2 3.45Å; P107-W181 HydrophobicContact CG-CZ2 3.93Å; L110-W181 HydrophobicContact CD1-CD2 4.47Å; L110-W181 HydrophobicContact CD1-CE3 3.9Å; L110-W181 HydrophobicContact CD1-CH2 3.49Å; L110-W181 VanDerWaalsContact CD1-CH2 3.49Å; L110-W181 HydrophobicContact CD1-CZ2 4.11Å; L110-W181 HydrophobicContact CD1-CZ3 3.38Å; V124-W181 HydrophobicContact CG1-CE3 4.26Å; V124-W181 HydrophobicContact CG1-CZ3 4.24Å; V124-W181 HydrophobicContact CG2-CE3 4.31Å; F136-W181 HydrophobicContact CB-CH2 3.95Å; F136-W181 HydrophobicContact CB-CZ2 3.88Å; F136-W181 AromaticContact CD1-CH2 3.61Å; F136-W181 HydrophobicContact CD1-CH2 3.61Å; F136-W181 AromaticContact CD1-CZ2 3.65Å; F136-W181 HydrophobicContact CD1-CZ2 3.65Å; F136-W181 HydrophobicContact CE1-CH2 4.33Å; F136-W181 AromaticContact CG-CH2 3.92Å; F136-W181 HydrophobicContact CG-CH2 3.92Å; F136-W181 HydrophobicContact CG-CZ2 4.12Å; W181-R183 PolarHBondContact O-N 2.94Å; W181-Y184 WeakPolarHBondContact O-CD2 3.4Å; W181-Y184 PolarHBondContact O-N 3.37Å; W181-V185 HydrophobicContact CE3-CG2 4.16Å; W181-V185 HydrophobicContact CZ3-CG2 3.68Å; W181-L219 HydrophobicContact CZ3-CD2 4.22Å
182	M	97.8	Very high	92.8	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-58.2	-22.3	-179.7	-67.4	174.5	68.8	0	0	112.8	G137 L139 N180 Y184 V185 F207	G137-M182 WeakPolarHBondContact CA-SD 3.37Å; L139-M182 HydrophobicContact CB-CE 4.02Å; L139-M182 HydrophobicContact CB-SD 4.24Å; L139-M182 HydrophobicContact CD1-CB 3.75Å; N180-M182 PolarHBondContact O-N 3.16Å; M182-Y184 PolarHBondContact O-N 3.4Å; M182-V185 PolarHBondContact O-N 2.99Å; M182-F207 HydrophobicContact CB-CE2 3.93Å; M182-F207 HydrophobicContact CB-CZ 4.41Å; M182-F207 HydrophobicContact CE-CB 4.33Å; M182-F207 HydrophobicContact CE-CD1 3.74Å; M182-F207 HydrophobicContact CE-CD2 3.55Å; M182-F207 HydrophobicContact CE-CE1 3.84Å; M182-F207 HydrophobicContact CE-CE2 3.65Å; M182-F207 HydrophobicContact CE-CG 3.59Å; M182-F207 HydrophobicContact CE-CZ 3.79Å; M182-F207 HydrophobicContact CG-CD2 4.46Å; M182-F207 HydrophobicContact CG-CE2 4.27Å
183	R	96.2	Very high	92.6	Very high	23 Å²	23	44.3 Å²	44.3	9%	0.087	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-58.5	-24.4	172.5	75.6	-179.1	-62.9	-86.6	18.2	114.5	A102 Y157 G173 L174 E176 N180 W181	A102-R183 HydrophobicContact CB-CG 4.29Å; Y157-R183 HydrophobicContact CD1-CB 4.32Å; Y157-R183 WeakPolarHBondContact CE1-O 3.29Å; G173-R183 PolarHBondContact O-NE 2.86Å; L174-R183 PolarHBondContact O-NH2 2.8Å; E176-R183 VanDerWaalsContact CG-NH2 3.35Å; E176-R183 IonicContact OE1-CZ 3.28Å; E176-R183 VanDerWaalsContact OE1-CZ 3.23Å; E176-R183 IonicContact OE1-NH1 2.59Å; E176-R183 PolarHBondContact OE1-NH1 3.44Å; E176-R183 IonicContact OE1-NH2 3.14Å; E176-R183 PolarHBondContact OE1-NH2 2.84Å; N180-R183 WeakPolarHBondContact O-CG 3.24Å; N180-R183 PolarHBondContact O-N 3.45Å; W181-R183 PolarHBondContact O-N 2.94Å
184	Y	96.6	Very high	92.7	Very high	14 Å²	14	45.3 Å²	45.3	6%	0.055	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-92.3	-2.9	-177.5	-57.8	-72.9	0	0	0	113	A102 E103 L112 V121 G123 E176 W181 M182 N186	A102-Y184 HydrophobicContact CB-CE2 3.64Å; E103-Y184 HydrophobicContact CG-CE2 4.46Å; L112-Y184 HydrophobicContact CD2-CD2 4.15Å; V121-Y184 HydrophobicContact CB-CD1 3.74Å; V121-Y184 HydrophobicContact CB-CE1 3.63Å; V121-Y184 HydrophobicContact CB-CG 4.45Å; V121-Y184 HydrophobicContact CG1-CD1 3.33Å; V121-Y184 HydrophobicContact CG1-CD2 4.17Å; V121-Y184 HydrophobicContact CG1-CE1 3.71Å; V121-Y184 HydrophobicContact CG1-CG 3.6Å; V121-Y184 HydrophobicContact CG2-CE1 4.28Å; G123-Y184 WeakPolarHBondContact CA-O 3.46Å; E176-Y184 PolarHBondContact OE1-OH 3.34Å; E176-Y184 VanDerWaalsContact OE1-OH 3.09Å; E176-Y184 PolarHBondContact OE2-OH 2.83Å; W181-Y184 WeakPolarHBondContact O-CD2 3.4Å; W181-Y184 PolarHBondContact O-N 3.37Å; M182-Y184 PolarHBondContact O-N 3.4Å; Y184-N186 PolarHBondContact O-N 3.08Å
185	V	97.1	Very high	92.9	Very high	15 Å²	15	42.7 Å²	42.7	9%	0.091	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-74.4	123.7	178.6	179.5	0	0	0	0	109.3	V124 W181 M182 L196 F207 L219 V221	V124-V185 HydrophobicContact CB-CG2 4.4Å; V124-V185 HydrophobicContact CG2-CG2 4.09Å; W181-V185 HydrophobicContact CE3-CG2 4.16Å; W181-V185 HydrophobicContact CZ3-CG2 3.68Å; M182-V185 PolarHBondContact O-N 2.99Å; V185-L196 HydrophobicContact CG1-CD1 3.87Å; V185-F207 HydrophobicContact CB-CD2 4.45Å; V185-F207 HydrophobicContact CB-CE2 3.88Å; V185-F207 HydrophobicContact CG1-CD2 4.32Å; V185-F207 HydrophobicContact CG1-CE2 4.1Å; V185-F207 HydrophobicContact CG2-CD2 4.27Å; V185-F207 HydrophobicContact CG2-CE2 3.96Å; V185-L219 HydrophobicContact CG1-CB 4.23Å; V185-V221 HydrophobicContact CG1-CB 3.95Å; V185-V221 HydrophobicContact CG1-CG1 3.81Å
186	N	95	Very high	93.2	Very high	53 Å²	53	40.6 Å²	40.6	28%	0.283	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	147.1	-174.9	-81.2	-43	0	0	0	112	V122 Y184 E218 L220 V221	V122-N186 PolarHBondContact O-ND2 2.82Å; Y184-N186 PolarHBondContact O-N 3.08Å; N186-E218 PolarHBondContact ND2-OE1 2.95Å; N186-L220 HydrophobicContact CB-CD2 3.76Å; N186-L220 WeakPolarHBondContact O-CA 3.47Å; N186-V221 PolarHBondContact O-N 3.01Å
187	P	94.1	Very high	93.4	Very high	75 Å²	75	37.6 Å²	37.6	49%	0.487	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	135.7	173.9	29.8	-33.9	0	0	0	111.1	V221	P187-V221 CarbonylContact C-O 3.52Å; P187-V221 VanDerWaalsContact CA-O 3.29Å; P187-V221 WeakPolarHBondContact CA-O 3.44Å
188	A	92.9	Very high	93.7	Very high	3 Å²	3	33.2 Å²	33.2	3%	0.025	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-69	130.2	173.6	0	0	0	0	0	110.9	E193 Q194 L220 V221	A188-E193 HydrophobicContact CB-CG 3.93Å; A188-Q194 HydrophobicContact CB-CB 3.7Å; A188-Q194 HydrophobicContact CB-CG 4.18Å; A188-L220 HydrophobicContact CB-CB 4.05Å; A188-V221 PolarHBondContact N-O 2.79Å
189	K	87.6	Confident	94.2	Very high	138 Å²	138	27.5 Å²	27.5	60%	0.6	16%	0.162	S	C	*	.	S	Bend	trans	-87.5	-9.2	177.9	-54	154.6	-170.7	158.1	0	112.9	E193 G237 E238 M241	K189-E193 WeakPolarHBondContact CB-OE1 3.48Å; K189-E193 PolarHBondContact N-OE1 3.43Å; K189-G237 CarbonylContact O-C 3.58Å; K189-E238 WeakPolarHBondContact O-CA 3.34Å; K189-E238 WeakPolarHBondContact O-CB 3.36Å; K189-E238 PolarHBondContact O-N 2.83Å; K189-M241 HydrophobicContact CB-CG 4.35Å
190	S	88.2	Confident	94.2	Very high	22 Å²	22	28.3 Å²	28.3	15%	0.154	17%	0.166	C	C	.	.	S	Bend	trans	-150.1	159.9	-179.7	66.4	0	0	0	0	111.5	A192 E193 Q194	S190-A192 VanDerWaalsContact C-N 3.25Å; S190-E193 WeakPolarHBondContact CB-OE2 3.43Å; S190-E193 PolarHBondContact N-OE2 3.08Å; S190-E193 WeakPolarHBondContact OG-CG 3.46Å; S190-E193 PolarHBondContact OG-N 2.83Å; S190-E193 VanDerWaalsContact OG-N 3.08Å; S190-E193 PolarHBondContact OG-OE2 2.87Å; S190-Q194 PolarHBondContact O-N 2.79Å; S190-Q194 VanDerWaalsContact O-N 3.15Å
191	A	86.6	Confident	94	Very high	56 Å²	56	28.9 Å²	28.9	46%	0.463	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-31	170.9	0	0	0	0	0	111.6	Q194	A191-Q194 PolarHBondContact O-N 3.31Å
192	A	88.2	Confident	93.6	Very high	84 Å²	84	31.8 Å²	31.8	69%	0.694	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-37.7	178	0	0	0	0	0	112.9	S190 K211	S190-A192 VanDerWaalsContact C-N 3.25Å; A192-K211 PolarHBondContact O-NZ 3Å
193	E	91.7	Very high	93.4	Very high	55 Å²	55	37.1 Å²	37.1	26%	0.257	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-24.5	176.8	80.1	-160	-120.1	0	0	113.7	A188 K189 S190 N195 L220	A188-E193 HydrophobicContact CB-CG 3.93Å; K189-E193 WeakPolarHBondContact CB-OE1 3.48Å; K189-E193 PolarHBondContact N-OE1 3.43Å; S190-E193 WeakPolarHBondContact CB-OE2 3.43Å; S190-E193 PolarHBondContact N-OE2 3.08Å; S190-E193 WeakPolarHBondContact OG-CG 3.46Å; S190-E193 PolarHBondContact OG-N 2.83Å; S190-E193 VanDerWaalsContact OG-N 3.08Å; S190-E193 PolarHBondContact OG-OE2 2.87Å; E193-N195 PolarHBondContact O-N 3.24Å; E193-L220 HydrophobicContact CB-CD1 3.85Å; E193-L220 HydrophobicContact CG-CD1 3.82Å
194	Q	93.9	Very high	93.3	Very high	22 Å²	22	40.3 Å²	40.3	10%	0.103	24%	0.241	C	C	.	.			trans	-55.8	122.2	179	-176.3	-173.2	-8.6	0	0	111	A188 S190 A191 L196 K211 W222	A188-Q194 HydrophobicContact CB-CB 3.7Å; A188-Q194 HydrophobicContact CB-CG 4.18Å; S190-Q194 PolarHBondContact O-N 2.79Å; S190-Q194 VanDerWaalsContact O-N 3.15Å; A191-Q194 PolarHBondContact O-N 3.31Å; Q194-L196 VanDerWaalsContact CG-O 3.27Å; Q194-L196 WeakPolarHBondContact CG-O 3.3Å; Q194-L196 PolarHBondContact NE2-O 3.41Å; Q194-K211 WeakPolarHBondContact O-CE 3.43Å; Q194-K211 PolarHBondContact O-NZ 2.72Å; Q194-W222 VanDerWaalsContact CD-CB 3.49Å; Q194-W222 HydrophobicContact CG-CB 4.05Å
195	N	95.9	Very high	93.3	Very high	12 Å²	12	39.8 Å²	39.8	6%	0.064	24%	0.239	C	C	.	.			trans	-122.5	-11.7	172.4	59.3	31.5	0	0	0	113.3	E193 T209 V210 K211 V213 E218 L220	E193-N195 PolarHBondContact O-N 3.24Å; N195-T209 CarbonylContact O-C 3.26Å; N195-T209 VanDerWaalsContact O-CA 3.26Å; N195-T209 WeakPolarHBondContact O-CA 3.47Å; N195-V210 WeakPolarHBondContact O-CG2 3.21Å; N195-V210 PolarHBondContact O-N 2.86Å; N195-K211 HydrophobicContact CB-CG 4.18Å; N195-V213 HydrophobicContact CB-CG2 4.04Å; N195-E218 PolarHBondContact ND2-O 3.23Å; N195-L220 PolarHBondContact N-O 3.22Å; N195-L220 PolarHBondContact OD1-N 3.22Å; N195-L220 PolarHBondContact OD1-O 2.9Å
196	L	97.4	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.9	171.1	-66.6	170.7	0	0	0	112.1	F136 V185 Q194 F207 Y208 T209 L219 L220 V221 W222	F136-L196 HydrophobicContact CD2-CD2 4.23Å; F136-L196 HydrophobicContact CE2-CD2 4.45Å; V185-L196 HydrophobicContact CG1-CD1 3.87Å; Q194-L196 VanDerWaalsContact CG-O 3.27Å; Q194-L196 WeakPolarHBondContact CG-O 3.3Å; Q194-L196 PolarHBondContact NE2-O 3.41Å; L196-F207 HydrophobicContact CB-CB 4.42Å; L196-F207 HydrophobicContact CD1-CB 4.22Å; L196-F207 HydrophobicContact CD1-CD2 4.2Å; L196-F207 HydrophobicContact CD2-CB 4.17Å; L196-Y208 CarbonylContact C-O 3.56Å; L196-Y208 VanDerWaalsContact CA-O 3.3Å; L196-Y208 WeakPolarHBondContact CA-O 3.32Å; L196-T209 HydrophobicContact CD2-CG2 3.63Å; L196-L219 HydrophobicContact CD1-CB 3.82Å; L196-L219 HydrophobicContact CD1-CD2 4.09Å; L196-L219 HydrophobicContact CD1-CG 4.02Å; L196-L220 PolarHBondContact N-O 2.66Å; L196-V221 HydrophobicContact CB-CB 3.86Å; L196-V221 HydrophobicContact CB-CG2 3.82Å; L196-V221 HydrophobicContact CD1-CB 4.44Å; L196-V221 WeakPolarHBondContact O-CA 3.5Å; L196-W222 PolarHBondContact O-N 2.91Å
197	A	96.6	Very high	93.5	Very high	2 Å²	2	37.5 Å²	37.5	2%	0.017	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.7	163.4	0	0	0	0	0	110	F74 F207 Y208 V210 W222 C224	F74-A197 HydrophobicContact CE1-CB 3.96Å; F74-A197 HydrophobicContact CE2-CB 4.31Å; F74-A197 HydrophobicContact CZ-CB 3.62Å; A197-F207 CarbonylContact O-C 3.6Å; A197-F207 WeakPolarHBondContact O-CA 3.32Å; A197-Y208 PolarHBondContact N-O 3.41Å; A197-Y208 PolarHBondContact O-N 3.09Å; A197-V210 HydrophobicContact CB-CG1 3.55Å; A197-W222 CarbonylContact C-O 3.57Å; A197-W222 WeakPolarHBondContact CA-O 3.23Å; A197-C224 HydrophobicContact CB-CB 4.3Å
198	A	97.6	Very high	93.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	124.2	170.6	0	0	0	0	0	110.2	W159 Y206 F207 V221 W222 C224	W159-A198 HydrophobicContact CH2-CB 3.85Å; W159-A198 HydrophobicContact CZ3-CB 3.53Å; A198-Y206 WeakPolarHBondContact CA-O 3.3Å; A198-F207 HydrophobicContact CB-CD1 3.67Å; A198-F207 HydrophobicContact CB-CE1 3.73Å; A198-V221 HydrophobicContact CB-CG2 3.77Å; A198-W222 PolarHBondContact N-O 2.89Å; A198-C224 PolarHBondContact O-N 3.05Å; A198-C224 PolarHBondContact O-SG 2.76Å
199	C	96.4	Very high	93.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150	177	-56.8	0	0	0	0	109.9	E71 F74 I205 Y206 Y208 C224	E71-C199 HydrophobicContact CB-CB 4.3Å; E71-C199 HydrophobicContact CG-CB 3.91Å; F74-C199 WeakPolarHBondContact CD2-SG 3.39Å; C199-I205 WeakPolarHBondContact O-CA 3.26Å; C199-Y206 PolarHBondContact N-O 2.66Å; C199-Y206 PolarHBondContact O-N 2.93Å; C199-Y208 HydrophobicContact CB-CD2 4.12Å; C199-Y208 HydrophobicContact CB-CE2 3.8Å; C199-C224 VanDerWaalsContact SG-CB 3.55Å; C199-C224 VanDerWaalsContact SG-SG 3.7Å
200	Q	96	Very high	94.2	Very high	18 Å²	18	28 Å²	28	8%	0.084	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.4	165.9	-167.1	-162.8	-49.1	0	0	109.4	E71 I161 F162 G202 E204 I205 F227	E71-Q200 PolarHBondContact OE1-N 2.99Å; I161-Q200 HydrophobicContact CD1-CG 4.05Å; F162-Q200 PolarHBondContact O-NE2 2.89Å; Q200-G202 PolarHBondContact NE2-O 3.21Å; Q200-E204 CarbonylContact C-O 3.52Å; Q200-E204 WeakPolarHBondContact CA-O 3.36Å; Q200-I205 HydrophobicContact CB-CG1 4.37Å; Q200-I205 HydrophobicContact CG-CG1 4.32Å; Q200-F227 HydrophobicContact CB-CD1 4.42Å; Q200-F227 HydrophobicContact CB-CE1 4.19Å; Q200-F227 HydrophobicContact CB-CZ 4.49Å
201	N	90.8	Very high	94.4	Very high	13 Å²	13	30.2 Å²	30.2	7%	0.07	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	107.5	178.7	-68.1	97.6	0	0	0	108.5	E71 E75 M203 E204 Y206 Y208	E71-N201 PolarHBondContact O-ND2 2.78Å; E75-N201 WeakPolarHBondContact CB-ND2 3.26Å; E75-N201 WeakPolarHBondContact OE2-CB 3.47Å; E75-N201 PolarHBondContact OE2-ND2 2.66Å; N201-M203 PolarHBondContact O-N 2.99Å; N201-E204 PolarHBondContact N-O 3.06Å; N201-E204 PolarHBondContact O-N 3.21Å; N201-E204 VanDerWaalsContact O-N 3.14Å; N201-Y206 HydrophobicContact CB-CD2 3.93Å; N201-Y206 HydrophobicContact CB-CE2 4.21Å; N201-Y208 PolarHBondContact OD1-OH 3.21Å
202	G	89.9	Confident	94.7	Very high	61 Å²	61	29.9 Å²	29.9	63%	0.629	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.2	-117.9	-168.1	0	0	0	0	0	111.3	Q200	Q200-G202 PolarHBondContact NE2-O 3.21Å
203	M	91.6	Very high	95.1	Very high	114 Å²	114	25.9 Å²	25.9	56%	0.562	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.9	6.4	177.8	-60.9	-176.9	72.9	0	0	113.4	N201	N201-M203 PolarHBondContact O-N 2.99Å
204	E	95.4	Very high	95.2	Very high	90 Å²	90	27.1 Å²	27.1	42%	0.421	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	158.7	-174.4	-66.1	-179.7	152.6	0	0	111.1	P138 Q200 N201 Y206	P138-E204 HydrophobicContact CB-CB 3.86Å; P138-E204 HydrophobicContact CB-CG 4.08Å; Q200-E204 CarbonylContact C-O 3.52Å; Q200-E204 WeakPolarHBondContact CA-O 3.36Å; N201-E204 PolarHBondContact N-O 3.06Å; N201-E204 PolarHBondContact O-N 3.21Å; N201-E204 VanDerWaalsContact O-N 3.14Å; E204-Y206 HydrophobicContact CB-CD2 4.3Å; E204-Y206 HydrophobicContact CB-CE2 3.66Å; E204-Y206 WeakPolarHBondContact OE2-CE2 3.5Å; E204-Y206 PolarHBondContact OE2-OH 3.46Å
205	I	96.6	Very high	95.3	Very high	2 Å²	2	29 Å²	29	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.1	174	-72	167.6	0	0	0	109.8	P138 L139 W159 I161 C199 Q200 F207 F227	P138-I205 CarbonylContact C-O 3.54Å; P138-I205 WeakPolarHBondContact CA-O 3.43Å; L139-I205 HydrophobicContact CB-CB 4.08Å; L139-I205 HydrophobicContact CB-CG2 4.33Å; L139-I205 HydrophobicContact CD2-CB 4.29Å; L139-I205 HydrophobicContact CD2-CD1 4.36Å; L139-I205 HydrophobicContact CD2-CG2 4.36Å; L139-I205 PolarHBondContact N-O 2.78Å; W159-I205 HydrophobicContact CB-CD1 3.59Å; W159-I205 HydrophobicContact CD2-CD1 4.36Å; W159-I205 HydrophobicContact CE3-CD1 4.05Å; W159-I205 HydrophobicContact CE3-CG2 4.26Å; W159-I205 HydrophobicContact CG-CD1 4.23Å; I161-I205 HydrophobicContact CD1-CD1 3.56Å; I161-I205 HydrophobicContact CD1-CG1 3.63Å; C199-I205 WeakPolarHBondContact O-CA 3.26Å; Q200-I205 HydrophobicContact CB-CG1 4.37Å; Q200-I205 HydrophobicContact CG-CG1 4.32Å; I205-F207 HydrophobicContact CG2-CD1 4.42Å; I205-F207 HydrophobicContact CG2-CE1 4.05Å; I205-F227 HydrophobicContact CD1-CE1 3.95Å; I205-F227 HydrophobicContact CD1-CZ 3.81Å; I205-F227 HydrophobicContact CG1-CE1 4.07Å; I205-F227 HydrophobicContact CG1-CZ 4.32Å
206	Y	98.2	Very high	95.2	Very high	20 Å²	20	31 Å²	31	8%	0.078	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.4	179.5	-70	-91.3	0	0	0	110.3	R135 F136 G137 P138 A198 C199 N201 E204	R135-Y206 HydrophobicContact CG-CD1 3.79Å; R135-Y206 HydrophobicContact CG-CG 4.19Å; R135-Y206 VanDerWaalsContact NH2-CE1 3.33Å; F136-Y206 WeakPolarHBondContact O-CA 3.35Å; F136-Y206 WeakPolarHBondContact O-CD1 3.28Å; G137-Y206 VanDerWaalsContact C-CE1 3.48Å; P138-Y206 HydrophobicContact CB-CE1 4Å; P138-Y206 HydrophobicContact CB-CE2 4.15Å; P138-Y206 HydrophobicContact CG-CE1 4.47Å; A198-Y206 WeakPolarHBondContact CA-O 3.3Å; C199-Y206 PolarHBondContact N-O 2.66Å; C199-Y206 PolarHBondContact O-N 2.93Å; N201-Y206 HydrophobicContact CB-CD2 3.93Å; N201-Y206 HydrophobicContact CB-CE2 4.21Å; E204-Y206 HydrophobicContact CB-CD2 4.3Å; E204-Y206 HydrophobicContact CB-CE2 3.66Å; E204-Y206 WeakPolarHBondContact OE2-CE2 3.5Å; E204-Y206 PolarHBondContact OE2-OH 3.46Å
207	F	98.3	Very high	95.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.9	172.3	-58.9	-17.3	0	0	0	109.7	R135 F136 W159 M182 V185 L196 A197 A198 I205 V221	R135-F207 CarbonylContact C-O 3.53Å; R135-F207 WeakPolarHBondContact CA-O 3.24Å; F136-F207 HydrophobicContact CB-CB 4.41Å; F136-F207 PolarHBondContact N-O 2.89Å; F136-F207 PolarHBondContact O-N 2.96Å; W159-F207 AromaticContact CH2-CE1 3.6Å; W159-F207 HydrophobicContact CH2-CE1 3.6Å; W159-F207 AromaticContact CH2-CZ 3.82Å; W159-F207 HydrophobicContact CH2-CZ 3.82Å; W159-F207 AromaticContact CZ2-CE1 3.88Å; W159-F207 HydrophobicContact CZ2-CE1 3.88Å; W159-F207 AromaticContact CZ2-CZ 3.64Å; W159-F207 HydrophobicContact CZ2-CZ 3.64Å; W159-F207 HydrophobicContact CZ3-CE1 4.12Å; M182-F207 HydrophobicContact CB-CE2 3.93Å; M182-F207 HydrophobicContact CB-CZ 4.41Å; M182-F207 HydrophobicContact CE-CB 4.33Å; M182-F207 HydrophobicContact CE-CD1 3.74Å; M182-F207 HydrophobicContact CE-CD2 3.55Å; M182-F207 HydrophobicContact CE-CE1 3.84Å; M182-F207 HydrophobicContact CE-CE2 3.65Å; M182-F207 HydrophobicContact CE-CG 3.59Å; M182-F207 HydrophobicContact CE-CZ 3.79Å; M182-F207 HydrophobicContact CG-CD2 4.46Å; M182-F207 HydrophobicContact CG-CE2 4.27Å; V185-F207 HydrophobicContact CB-CD2 4.45Å; V185-F207 HydrophobicContact CB-CE2 3.88Å; V185-F207 HydrophobicContact CG1-CD2 4.32Å; V185-F207 HydrophobicContact CG1-CE2 4.1Å; V185-F207 HydrophobicContact CG2-CD2 4.27Å; V185-F207 HydrophobicContact CG2-CE2 3.96Å; L196-F207 HydrophobicContact CB-CB 4.42Å; L196-F207 HydrophobicContact CD1-CB 4.22Å; L196-F207 HydrophobicContact CD1-CD2 4.2Å; L196-F207 HydrophobicContact CD2-CB 4.17Å; A197-F207 CarbonylContact O-C 3.6Å; A197-F207 WeakPolarHBondContact O-CA 3.32Å; A198-F207 HydrophobicContact CB-CD1 3.67Å; A198-F207 HydrophobicContact CB-CE1 3.73Å; I205-F207 HydrophobicContact CG2-CD1 4.42Å; I205-F207 HydrophobicContact CG2-CE1 4.05Å; F207-V221 HydrophobicContact CD1-CG2 3.99Å; F207-V221 HydrophobicContact CD2-CG2 4.48Å; F207-V221 HydrophobicContact CE1-CG2 4.16Å; F207-V221 HydrophobicContact CG-CG2 4.17Å; F207-V221 HydrophobicContact CZ-CG2 4.48Å
208	Y	97.7	Very high	95.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133	-177.5	-65.9	-100.2	0	0	0	110.6	F74 C78 T134 R135 L196 A197 C199 N201 V210	F74-Y208 HydrophobicContact CB-CD1 4.13Å; F74-Y208 HydrophobicContact CB-CD2 4.13Å; F74-Y208 HydrophobicContact CB-CE1 4.03Å; F74-Y208 HydrophobicContact CB-CE2 4.04Å; F74-Y208 HydrophobicContact CB-CG 4.17Å; F74-Y208 VanDerWaalsContact CD1-CB 3.49Å; F74-Y208 AromaticContact CD1-CD1 4Å; F74-Y208 HydrophobicContact CD1-CD1 4Å; F74-Y208 HydrophobicContact CD1-CD2 4.11Å; F74-Y208 AromaticContact CD1-CG 3.63Å; F74-Y208 HydrophobicContact CD1-CG 3.63Å; F74-Y208 HydrophobicContact CE1-CG 4.41Å; F74-Y208 HydrophobicContact CG-CD2 4.33Å; F74-Y208 HydrophobicContact CG-CG 4.24Å; F74-Y208 WeakPolarHBondContact O-CE1 3.43Å; C78-Y208 HydrophobicContact CB-CD1 3.96Å; C78-Y208 HydrophobicContact CB-CE1 3.79Å; T134-Y208 CarbonylContact O-C 3.6Å; T134-Y208 WeakPolarHBondContact O-CA 3.39Å; R135-Y208 HydrophobicContact CB-CD1 3.79Å; R135-Y208 HydrophobicContact CB-CE1 3.72Å; R135-Y208 VanDerWaalsContact CD-OH 3.24Å; R135-Y208 WeakPolarHBondContact CD-OH 3.37Å; R135-Y208 HydrophobicContact CG-CD1 3.81Å; R135-Y208 HydrophobicContact CG-CD2 4.49Å; R135-Y208 HydrophobicContact CG-CE1 3.42Å; R135-Y208 VanDerWaalsContact CG-CE1 3.42Å; R135-Y208 HydrophobicContact CG-CE2 4.16Å; R135-Y208 HydrophobicContact CG-CG 4.34Å; L196-Y208 CarbonylContact C-O 3.56Å; L196-Y208 VanDerWaalsContact CA-O 3.3Å; L196-Y208 WeakPolarHBondContact CA-O 3.32Å; A197-Y208 PolarHBondContact N-O 3.41Å; A197-Y208 PolarHBondContact O-N 3.09Å; C199-Y208 HydrophobicContact CB-CD2 4.12Å; C199-Y208 HydrophobicContact CB-CE2 3.8Å; N201-Y208 PolarHBondContact OD1-OH 3.21Å; Y208-V210 PolarHBondContact O-N 2.91Å
209	T	96.5	Very high	95.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	114.9	175.1	52.6	0	0	0	0	111.2	I130 P131 G133 T134 F136 N195 L196 K211 V213	I130-T209 HydrophobicContact CG2-CG2 4.05Å; P131-T209 PolarHBondContact O-OG1 3.25Å; G133-T209 PolarHBondContact N-O 2.83Å; G133-T209 PolarHBondContact N-OG1 2.87Å; T134-T209 WeakPolarHBondContact CA-OG1 3.28Å; T134-T209 WeakPolarHBondContact CB-OG1 3.14Å; T134-T209 PolarHBondContact N-OG1 2.82Å; T134-T209 PolarHBondContact O-N 2.87Å; T134-T209 PolarHBondContact O-OG1 2.84Å; F136-T209 HydrophobicContact CE2-CG2 4.09Å; N195-T209 CarbonylContact O-C 3.26Å; N195-T209 VanDerWaalsContact O-CA 3.26Å; N195-T209 WeakPolarHBondContact O-CA 3.47Å; L196-T209 HydrophobicContact CD2-CG2 3.63Å; T209-K211 VanDerWaalsContact C-N 3.33Å; T209-V213 HydrophobicContact CG2-CG2 3.95Å
210	V	94.2	Very high	95.2	Very high	18 Å²	18	35.8 Å²	35.8	11%	0.109	23%	0.227	C	C	.	.	S	Bend	trans	-81.7	-14.7	178	-69.1	0	0	0	0	113.1	M66 F74 K132 N195 A197 Y208	M66-V210 HydrophobicContact CB-CB 4.1Å; M66-V210 HydrophobicContact CB-CG1 3.98Å; F74-V210 HydrophobicContact CE1-CG1 3.94Å; F74-V210 HydrophobicContact CZ-CG1 3.91Å; K132-V210 VanDerWaalsContact CE-O 3.24Å; K132-V210 WeakPolarHBondContact CE-O 3.47Å; N195-V210 WeakPolarHBondContact O-CG2 3.21Å; N195-V210 PolarHBondContact O-N 2.86Å; A197-V210 HydrophobicContact CB-CG1 3.55Å; Y208-V210 PolarHBondContact O-N 2.91Å
211	K	93.1	Very high	95.3	Very high	67 Å²	67	35.2 Å²	35.2	29%	0.291	23%	0.225	S	C	.	.	S	Bend	trans	-151.4	164.8	173.9	69.1	-159.3	-172.6	-158.2	0	109.8	A192 Q194 N195 T209	A192-K211 PolarHBondContact O-NZ 3Å; Q194-K211 WeakPolarHBondContact O-CE 3.43Å; Q194-K211 PolarHBondContact O-NZ 2.72Å; N195-K211 HydrophobicContact CB-CG 4.18Å; T209-K211 VanDerWaalsContact C-N 3.33Å
212	P	93.3	Very high	95.5	Very high	49 Å²	49	35.4 Å²	35.4	32%	0.318	23%	0.225	S	C	.	.			trans	-59	145.7	175.7	-22.7	34.7	0	0	0	112.3	Y129 K132	Y129-P212 HydrophobicContact CE2-CB 3.69Å; K132-P212 HydrophobicContact CB-CG 4.25Å
213	V	96	Very high	95.7	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-114.4	107.2	175.4	-170	0	0	0	0	108.4	I130 N195 T209 A217 L219	I130-V213 HydrophobicContact CB-CB 4.01Å; I130-V213 HydrophobicContact CB-CG2 4.41Å; I130-V213 HydrophobicContact CD1-CB 4.14Å; I130-V213 HydrophobicContact CD1-CG1 4.33Å; I130-V213 HydrophobicContact CG1-CB 4.27Å; I130-V213 PolarHBondContact N-O 2.97Å; I130-V213 PolarHBondContact O-N 3.4Å; N195-V213 HydrophobicContact CB-CG2 4.04Å; T209-V213 HydrophobicContact CG2-CG2 3.95Å; V213-A217 HydrophobicContact CG1-CB 3.87Å; V213-L219 HydrophobicContact CG1-CD1 4.36Å
214	P	93.9	Very high	95.9	Very high	80 Å²	80	29.3 Å²	29.3	52%	0.519	18%	0.178	S	C	.	.			trans	-57.8	156.2	173.5	-24.3	34.6	0	0	0	111.8	S126 A217	S126-P214 PolarHBondContact OG-O 3.45Å; P214-A217 VanDerWaalsContact O-CB 3.32Å; P214-A217 WeakPolarHBondContact O-CB 3.39Å; P214-A217 PolarHBondContact O-N 2.87Å
215	A	95.4	Very high	95.6	Very high	63 Å²	63	28.4 Å²	28.4	52%	0.521	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	138.5	175.9	0	0	0	0	0	111.6	S126 A217	S126-A215 WeakPolarHBondContact OG-CA 3.07Å; A215-A217 VanDerWaalsContact C-N 3.26Å; A215-A217 PolarHBondContact O-N 3.15Å
216	G	93.8	Very high	95.4	Very high	54 Å²	54	30.1 Å²	30.1	56%	0.557	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	-11.2	-176.5	0	0	0	0	0	115.4	S126	S126-G216 WeakPolarHBondContact O-CA 3.48Å; S126-G216 PolarHBondContact O-N 3.05Å; S126-G216 PolarHBondContact OG-N 3.23Å
217	A	96.6	Very high	95.2	Very high	32 Å²	32	29.2 Å²	29.2	26%	0.264	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-72	147.5	177.9	0	0	0	0	0	112.1	C125 S126 V213 P214 A215	C125-A217 CarbonylContact C-O 3.39Å; C125-A217 VanDerWaalsContact CA-O 3.26Å; C125-A217 WeakPolarHBondContact CA-O 3.41Å; S126-A217 PolarHBondContact N-O 3.27Å; S126-A217 PolarHBondContact OG-N 3.26Å; S126-A217 VanDerWaalsContact OG-N 3.15Å; S126-A217 PolarHBondContact OG-O 3.39Å; V213-A217 HydrophobicContact CG1-CB 3.87Å; P214-A217 VanDerWaalsContact O-CB 3.32Å; P214-A217 WeakPolarHBondContact O-CB 3.39Å; P214-A217 PolarHBondContact O-N 2.87Å; A215-A217 VanDerWaalsContact C-N 3.26Å; A215-A217 PolarHBondContact O-N 3.15Å
218	E	97.6	Very high	94.9	Very high	43 Å²	43	29.3 Å²	29.3	20%	0.201	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-79.3	138.5	179.9	-170	165.8	-175.9	0	0	111.8	K113 N186 N195 L220	K113-E218 VanDerWaalsContact NZ-CD 3.33Å; K113-E218 IonicContact NZ-OE1 2.7Å; K113-E218 PolarHBondContact NZ-OE1 2.6Å; K113-E218 IonicContact NZ-OE2 2.93Å; K113-E218 PolarHBondContact NZ-OE2 2.99Å; N186-E218 PolarHBondContact ND2-OE1 2.95Å; N195-E218 PolarHBondContact ND2-O 3.23Å; E218-L220 HydrophobicContact CB-CG 4.48Å; E218-L220 HydrophobicContact CG-CD2 4.03Å; E218-L220 HydrophobicContact CG-CG 4.32Å
219	L	98	Very high	94.5	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-79.7	117.8	175.4	-85.1	63.1	0	0	0	108.9	L110 V124 I130 W181 V185 L196 V213	L110-L219 HydrophobicContact CD1-CD2 3.91Å; L110-L219 HydrophobicContact CD2-CD1 3.96Å; L110-L219 HydrophobicContact CD2-CD2 3.66Å; L110-L219 HydrophobicContact CD2-CG 4.49Å; L110-L219 HydrophobicContact CG-CD2 4.46Å; V124-L219 HydrophobicContact CG1-CD2 4.19Å; V124-L219 PolarHBondContact O-N 2.94Å; I130-L219 HydrophobicContact CD1-CD1 4.16Å; W181-L219 HydrophobicContact CZ3-CD2 4.22Å; V185-L219 HydrophobicContact CG1-CB 4.23Å; L196-L219 HydrophobicContact CD1-CB 3.82Å; L196-L219 HydrophobicContact CD1-CD2 4.09Å; L196-L219 HydrophobicContact CD1-CG 4.02Å; V213-L219 HydrophobicContact CG1-CD1 4.36Å
220	L	97.3	Very high	94.3	Very high	25 Å²	25	39.2 Å²	39.2	13%	0.131	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	114.7	-172.6	-64.5	176.5	0	0	0	110.3	N186 A188 E193 N195 L196 E218	N186-L220 HydrophobicContact CB-CD2 3.76Å; N186-L220 WeakPolarHBondContact O-CA 3.47Å; A188-L220 HydrophobicContact CB-CB 4.05Å; E193-L220 HydrophobicContact CB-CD1 3.85Å; E193-L220 HydrophobicContact CG-CD1 3.82Å; N195-L220 PolarHBondContact N-O 3.22Å; N195-L220 PolarHBondContact OD1-N 3.22Å; N195-L220 PolarHBondContact OD1-O 2.9Å; L196-L220 PolarHBondContact N-O 2.66Å; E218-L220 HydrophobicContact CB-CG 4.48Å; E218-L220 HydrophobicContact CG-CD2 4.03Å; E218-L220 HydrophobicContact CG-CG 4.32Å
221	V	96.8	Very high	94.1	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.4	-169.6	70.9	0	0	0	0	113.1	W159 V185 N186 P187 A188 L196 A198 F207	W159-V221 HydrophobicContact CH2-CG1 4.44Å; V185-V221 HydrophobicContact CG1-CB 3.95Å; V185-V221 HydrophobicContact CG1-CG1 3.81Å; N186-V221 PolarHBondContact O-N 3.01Å; P187-V221 CarbonylContact C-O 3.52Å; P187-V221 VanDerWaalsContact CA-O 3.29Å; P187-V221 WeakPolarHBondContact CA-O 3.44Å; A188-V221 PolarHBondContact N-O 2.79Å; L196-V221 HydrophobicContact CB-CB 3.86Å; L196-V221 HydrophobicContact CB-CG2 3.82Å; L196-V221 HydrophobicContact CD1-CB 4.44Å; L196-V221 WeakPolarHBondContact O-CA 3.5Å; A198-V221 HydrophobicContact CB-CG2 3.77Å; F207-V221 HydrophobicContact CD1-CG2 3.99Å; F207-V221 HydrophobicContact CD2-CG2 4.48Å; F207-V221 HydrophobicContact CE1-CG2 4.16Å; F207-V221 HydrophobicContact CG-CG2 4.17Å; F207-V221 HydrophobicContact CZ-CG2 4.48Å
222	W	95.3	Very high	94	Very high	16 Å²	16	44.3 Å²	44.3	6%	0.061	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	167.4	159.7	-162.5	-112.3	0	0	0	109.8	Q194 L196 A197 A198 P234 P235 M240	Q194-W222 VanDerWaalsContact CD-CB 3.49Å; Q194-W222 HydrophobicContact CG-CB 4.05Å; L196-W222 PolarHBondContact O-N 2.91Å; A197-W222 CarbonylContact C-O 3.57Å; A197-W222 WeakPolarHBondContact CA-O 3.23Å; A198-W222 PolarHBondContact N-O 2.89Å; W222-P234 PolarHBondContact NE1-O 3.21Å; W222-P235 VanDerWaalsContact CD1-O 3.26Å; W222-P235 PolarHBondContact NE1-O 2.67Å; W222-M240 HydrophobicContact CH2-CB 3.69Å; W222-M240 HydrophobicContact CH2-CG 3.93Å; W222-M240 HydrophobicContact CZ2-CB 3.98Å; W222-M240 HydrophobicContact CZ2-CG 4.44Å
223	Y	95.2	Very high	93.8	Very high	44 Å²	44	45.8 Å²	45.8	17%	0.173	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	143.9	175	-54.9	-81.7	0	0	0	110.4	W159 F227 L231 Y233	W159-Y223 AromaticContact CE3-CE1 3.85Å; W159-Y223 HydrophobicContact CE3-CE1 3.85Å; W159-Y223 HydrophobicContact CH2-CE1 4.25Å; W159-Y223 AromaticContact CZ3-CD1 3.97Å; W159-Y223 HydrophobicContact CZ3-CD1 3.97Å; W159-Y223 AromaticContact CZ3-CE1 3.44Å; W159-Y223 HydrophobicContact CZ3-CE1 3.44Å; W159-Y223 VanDerWaalsContact CZ3-CE1 3.44Å; Y223-F227 HydrophobicContact CD1-CD1 4.13Å; Y223-F227 HydrophobicContact CD1-CD2 4.48Å; Y223-F227 HydrophobicContact CD1-CE1 4.36Å; Y223-F227 HydrophobicContact CD1-CG 4.19Å; Y223-L231 HydrophobicContact CD1-CD1 3.49Å; Y223-L231 VanDerWaalsContact CD1-CD1 3.49Å; Y223-L231 HydrophobicContact CD2-CD1 4.14Å; Y223-L231 HydrophobicContact CE1-CD1 3.39Å; Y223-L231 HydrophobicContact CE2-CD1 4.06Å; Y223-L231 HydrophobicContact CG-CD1 3.87Å; Y223-Y233 AromaticContact CD2-CD2 3.87Å; Y223-Y233 HydrophobicContact CD2-CD2 3.87Å; Y223-Y233 HydrophobicContact CD2-CE2 4.47Å; Y223-Y233 AromaticContact CE2-CD2 3.53Å; Y223-Y233 HydrophobicContact CE2-CD2 3.53Å; Y223-Y233 AromaticContact CE2-CE2 3.69Å; Y223-Y233 HydrophobicContact CE2-CE2 3.69Å
224	C	94.1	Very high	93.3	Very high	4 Å²	4	46.2 Å²	46.2	3%	0.027	24%	0.236	C	C	.	.			trans	-65.8	168.2	167.9	73	0	0	0	0	111.2	E71 F74 A197 A198 C199 D226 F227 A228	E71-C224 WeakPolarHBondContact CG-SG 3.27Å; F74-C224 HydrophobicContact CD2-CB 4.47Å; F74-C224 HydrophobicContact CE2-CB 3.98Å; A197-C224 HydrophobicContact CB-CB 4.3Å; A198-C224 PolarHBondContact O-N 3.05Å; A198-C224 PolarHBondContact O-SG 2.76Å; C199-C224 VanDerWaalsContact SG-CB 3.55Å; C199-C224 VanDerWaalsContact SG-SG 3.7Å; C224-D226 PolarHBondContact O-N 2.67Å; C224-F227 PolarHBondContact O-N 3.08Å; C224-F227 VanDerWaalsContact SG-CB 3.55Å; C224-A228 WeakPolarHBondContact O-CB 3.39Å; C224-A228 PolarHBondContact O-N 3.19Å
225	H	90.2	Very high	92.7	Very high	70 Å²	70	46.6 Å²	46.6	32%	0.324	24%	0.239	S	C	.	.	H	α-helix	trans	-57	-45.4	-171.4	-176.9	57.2	0	0	0	113.7	R229	H225-R229 PolarHBondContact CD2-NH2 2.74Å; H225-R229 PolarHBondContact NE2-NH2 2.8Å; H225-R229 WeakPolarHBondContact O-CB 3.43Å; H225-R229 PolarHBondContact O-N 2.91Å; H225-R229 VanDerWaalsContact O-N 3.13Å
226	D	91.6	Very high	91.9	Very high	39 Å²	39	44.7 Å²	44.7	21%	0.209	22%	0.222	C	C	.	.	H	α-helix	trans	-69.9	-41.1	178.7	-68.4	-42.6	0	0	0	113.1	G70 E71 C224 R229 R230	G70-D226 VanDerWaalsContact CA-OD2 3.24Å; G70-D226 WeakPolarHBondContact CA-OD2 3.32Å; E71-D226 HydrophobicContact CG-CB 4.37Å; C224-D226 PolarHBondContact O-N 2.67Å; D226-R229 WeakPolarHBondContact O-CB 3.16Å; D226-R229 PolarHBondContact O-N 2.84Å; D226-R229 IonicContact OD1-CZ 3.55Å; D226-R229 IonicContact OD1-NH1 3.9Å; D226-R229 PolarHBondContact OD1-NH1 3.05Å; D226-R229 IonicContact OD1-NH2 2.79Å; D226-R229 PolarHBondContact OD1-NH2 2.87Å; D226-R230 PolarHBondContact O-N 3.45Å
227	F	93.8	Very high	91.1	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-69.4	-40.5	-179	-159.9	173.6	0	0	0	110.9	W159 R160 F162 Q200 I205 Y223 C224 R229 R230 L231	W159-F227 HydrophobicContact CE3-CE1 4.44Å; R160-F227 WeakPolarHBondContact O-CE2 3.41Å; R160-F227 VanDerWaalsContact O-CZ 3.29Å; R160-F227 WeakPolarHBondContact O-CZ 3.26Å; F162-F227 HydrophobicContact CD2-CE2 4.24Å; F162-F227 HydrophobicContact CE2-CE2 4.06Å; Q200-F227 HydrophobicContact CB-CD1 4.42Å; Q200-F227 HydrophobicContact CB-CE1 4.19Å; Q200-F227 HydrophobicContact CB-CZ 4.49Å; I205-F227 HydrophobicContact CD1-CE1 3.95Å; I205-F227 HydrophobicContact CD1-CZ 3.81Å; I205-F227 HydrophobicContact CG1-CE1 4.07Å; I205-F227 HydrophobicContact CG1-CZ 4.32Å; Y223-F227 HydrophobicContact CD1-CD1 4.13Å; Y223-F227 HydrophobicContact CD1-CD2 4.48Å; Y223-F227 HydrophobicContact CD1-CE1 4.36Å; Y223-F227 HydrophobicContact CD1-CG 4.19Å; C224-F227 PolarHBondContact O-N 3.08Å; C224-F227 VanDerWaalsContact SG-CB 3.55Å; F227-R229 VanDerWaalsContact C-N 3.3Å; F227-R229 PolarHBondContact O-N 3.37Å; F227-R230 PolarHBondContact O-N 2.83Å; F227-L231 HydrophobicContact CD2-CD1 4.01Å; F227-L231 HydrophobicContact CD2-CG 4.1Å; F227-L231 HydrophobicContact CE2-CD1 4.11Å; F227-L231 HydrophobicContact CE2-CD2 4.5Å; F227-L231 HydrophobicContact CE2-CG 4.25Å; F227-L231 WeakPolarHBondContact O-CG 3.17Å; F227-L231 PolarHBondContact O-N 3.42Å
228	A	91.9	Very high	90.4	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-56.7	-44.6	169.6	0	0	0	0	0	111.2	C224 L231 R232 Y233	C224-A228 WeakPolarHBondContact O-CB 3.39Å; C224-A228 PolarHBondContact O-N 3.19Å; A228-L231 CarbonylContact O-C 3.59Å; A228-L231 PolarHBondContact O-N 3.21Å; A228-R232 PolarHBondContact O-N 2.88Å; A228-Y233 PolarHBondContact O-N 3.3Å
229	R	90.4	Very high	89.6	Confident	138 Å²	138	47.5 Å²	47.5	52%	0.521	22%	0.217	S	C	.	.	H	α-helix	trans	-60.5	-46	177.6	-155.2	-169	-52.9	113.2	5.6	112	H225 D226 F227 L231 R232	H225-R229 PolarHBondContact CD2-NH2 2.74Å; H225-R229 PolarHBondContact NE2-NH2 2.8Å; H225-R229 WeakPolarHBondContact O-CB 3.43Å; H225-R229 PolarHBondContact O-N 2.91Å; H225-R229 VanDerWaalsContact O-N 3.13Å; D226-R229 WeakPolarHBondContact O-CB 3.16Å; D226-R229 PolarHBondContact O-N 2.84Å; D226-R229 IonicContact OD1-CZ 3.55Å; D226-R229 IonicContact OD1-NH1 3.9Å; D226-R229 PolarHBondContact OD1-NH1 3.05Å; D226-R229 IonicContact OD1-NH2 2.79Å; D226-R229 PolarHBondContact OD1-NH2 2.87Å; F227-R229 VanDerWaalsContact C-N 3.3Å; F227-R229 PolarHBondContact O-N 3.37Å; R229-L231 VanDerWaalsContact C-N 3.33Å; R229-L231 PolarHBondContact O-N 3.26Å; R229-R232 PolarHBondContact O-N 3.35Å
230	R	92.8	Very high	89	Confident	70 Å²	70	49.2 Å²	49.2	26%	0.264	23%	0.225	S	C	.	.	H	α-helix	trans	-61.9	-37.7	175.5	-70.3	-165.8	-60.8	-85	2.2	112.8	E71 F162 D226 F227 R232	E71-R230 VanDerWaalsContact CD-NH2 3.25Å; E71-R230 IonicContact OE1-CZ 2.69Å; E71-R230 IonicContact OE1-NH1 3.23Å; E71-R230 IonicContact OE1-NH2 3.44Å; E71-R230 PolarHBondContact OE1-NH2 3.12Å; E71-R230 IonicContact OE2-CZ 2.74Å; E71-R230 VanDerWaalsContact OE2-CZ 3.23Å; E71-R230 IonicContact OE2-NH1 3.94Å; E71-R230 PolarHBondContact OE2-NH1 3.41Å; E71-R230 IonicContact OE2-NH2 2.61Å; E71-R230 PolarHBondContact OE2-NH2 2.68Å; F162-R230 HydrophobicContact CD2-CB 4.46Å; F162-R230 HydrophobicContact CE1-CB 4.44Å; F162-R230 HydrophobicContact CE2-CB 4.23Å; F162-R230 HydrophobicContact CZ-CB 4.22Å; D226-R230 PolarHBondContact O-N 3.45Å; F227-R230 PolarHBondContact O-N 2.83Å; R230-R232 PolarHBondContact O-N 2.76Å
231	L	90.1	Very high	88.2	Confident	15 Å²	15	51 Å²	51	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-74.8	-9.2	175.2	-66.6	173.3	0	0	0	113.8	R160 F162 Y223 F227 A228 R229 Y233	R160-L231 HydrophobicContact CB-CD2 4.26Å; R160-L231 HydrophobicContact CG-CD2 4.34Å; F162-L231 HydrophobicContact CE2-CD2 3.99Å; F162-L231 HydrophobicContact CZ-CD2 4.08Å; Y223-L231 HydrophobicContact CD1-CD1 3.49Å; Y223-L231 VanDerWaalsContact CD1-CD1 3.49Å; Y223-L231 HydrophobicContact CD2-CD1 4.14Å; Y223-L231 HydrophobicContact CE1-CD1 3.39Å; Y223-L231 HydrophobicContact CE2-CD1 4.06Å; Y223-L231 HydrophobicContact CG-CD1 3.87Å; F227-L231 HydrophobicContact CD2-CD1 4.01Å; F227-L231 HydrophobicContact CD2-CG 4.1Å; F227-L231 HydrophobicContact CE2-CD1 4.11Å; F227-L231 HydrophobicContact CE2-CD2 4.5Å; F227-L231 HydrophobicContact CE2-CG 4.25Å; F227-L231 WeakPolarHBondContact O-CG 3.17Å; F227-L231 PolarHBondContact O-N 3.42Å; A228-L231 CarbonylContact O-C 3.59Å; A228-L231 PolarHBondContact O-N 3.21Å; R229-L231 VanDerWaalsContact C-N 3.33Å; R229-L231 PolarHBondContact O-N 3.26Å; L231-Y233 HydrophobicContact CB-CD1 3.92Å; L231-Y233 HydrophobicContact CB-CD2 4.05Å; L231-Y233 HydrophobicContact CB-CE1 4.32Å; L231-Y233 HydrophobicContact CB-CE2 4.44Å; L231-Y233 HydrophobicContact CB-CG 3.78Å; L231-Y233 HydrophobicContact CD1-CD2 4.02Å; L231-Y233 HydrophobicContact CD1-CE2 4.15Å; L231-Y233 VanDerWaalsContact O-CD1 3.28Å; L231-Y233 WeakPolarHBondContact O-CD1 3.44Å; L231-Y233 PolarHBondContact O-N 2.91Å
232	R	90.2	Very high	87.6	Confident	177 Å²	177	56.4 Å²	56.4	67%	0.668	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	28.9	-167.2	-54.2	-176.1	-177.1	-176	-0	112.7	A228 R229 R230 H506	A228-R232 PolarHBondContact O-N 2.88Å; R229-R232 PolarHBondContact O-N 3.35Å; R230-R232 PolarHBondContact O-N 2.76Å; R232-H506 PolarHBondContact NH2-CD2 2.92Å; R232-H506 PolarHBondContact NH2-NE2 2.77Å
233	Y	88.9	Confident	87	Confident	80 Å²	80	60.7 Å²	60.7	31%	0.314	28%	0.278	S	S	.	.			trans	-89.4	154.9	177.3	-76.7	10.2	0	0	0	110.7	Y223 A228 L231 M240	Y223-Y233 AromaticContact CD2-CD2 3.87Å; Y223-Y233 HydrophobicContact CD2-CD2 3.87Å; Y223-Y233 HydrophobicContact CD2-CE2 4.47Å; Y223-Y233 AromaticContact CE2-CD2 3.53Å; Y223-Y233 HydrophobicContact CE2-CD2 3.53Å; Y223-Y233 AromaticContact CE2-CE2 3.69Å; Y223-Y233 HydrophobicContact CE2-CE2 3.69Å; A228-Y233 PolarHBondContact O-N 3.3Å; L231-Y233 HydrophobicContact CB-CD1 3.92Å; L231-Y233 HydrophobicContact CB-CD2 4.05Å; L231-Y233 HydrophobicContact CB-CE1 4.32Å; L231-Y233 HydrophobicContact CB-CE2 4.44Å; L231-Y233 HydrophobicContact CB-CG 3.78Å; L231-Y233 HydrophobicContact CD1-CD2 4.02Å; L231-Y233 HydrophobicContact CD1-CE2 4.15Å; L231-Y233 VanDerWaalsContact O-CD1 3.28Å; L231-Y233 WeakPolarHBondContact O-CD1 3.44Å; L231-Y233 PolarHBondContact O-N 2.91Å; Y233-M240 HydrophobicContact CD1-CE 4.43Å; Y233-M240 HydrophobicContact CE1-CE 4.23Å
234	P	85.9	Confident	86.4	Confident	9 Å²	9	62.7 Å²	62.7	6%	0.058	29%	0.291	C	S	.	.			trans	-68.1	157.9	174.3	29.2	-33.8	0	0	0	111.9	W222 S236 L239 M240	W222-P234 PolarHBondContact NE1-O 3.21Å; P234-S236 PolarHBondContact O-N 3.49Å; P234-L239 HydrophobicContact CB-CB 3.85Å; P234-L239 HydrophobicContact CB-CD2 3.77Å; P234-L239 HydrophobicContact CB-CG 3.83Å; P234-L239 HydrophobicContact CG-CB 4.22Å; P234-L239 HydrophobicContact CG-CG 4.37Å; P234-M240 HydrophobicContact CG-CB 3.67Å; P234-M240 HydrophobicContact CG-CG 4.45Å; P234-M240 HydrophobicContact CG-SD 4.12Å
235	P	80.3	Confident	85.9	Confident	88 Å²	88	69.2 Å²	69.2	57%	0.571	32%	0.319	S	S	*	.	S	Bend	trans	-67	-18.5	-177	28.1	-36.2	0	0	0	113.8	W222	W222-P235 VanDerWaalsContact CD1-O 3.26Å; W222-P235 PolarHBondContact NE1-O 2.67Å
236	S	80.4	Confident	85.7	Confident	24 Å²	24	71.2 Å²	71.2	17%	0.168	33%	0.328	C	S	.	.	S	Bend	trans	-130.6	152.9	175.3	70.4	0	0	0	0	111.7	P234 E238	P234-S236 PolarHBondContact O-N 3.49Å; S236-E238 PolarHBondContact O-N 3.23Å
237	G	76.8	Confident	85.4	Confident	1 Å²	1	72 Å²	72	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-24.6	176.6	0	0	0	0	0	114	K189 M240 M241	K189-G237 CarbonylContact O-C 3.58Å; G237-M240 WeakPolarHBondContact O-CB 3.35Å; G237-M240 PolarHBondContact O-N 2.82Å; G237-M240 VanDerWaalsContact O-N 3.15Å; G237-M241 WeakPolarHBondContact O-CG 3.45Å; G237-M241 PolarHBondContact O-N 3.02Å
238	E	80.8	Confident	85	Confident	120 Å²	120	74.9 Å²	74.9	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-63.6	-49.3	-177.9	-179.9	169.8	-167.3	0	0	112	K189 S236 M240 M241 Q242	K189-E238 WeakPolarHBondContact O-CA 3.34Å; K189-E238 WeakPolarHBondContact O-CB 3.36Å; K189-E238 PolarHBondContact O-N 2.83Å; S236-E238 PolarHBondContact O-N 3.23Å; E238-M240 PolarHBondContact O-N 2.93Å; E238-M241 CarbonylContact O-C 3.52Å; E238-M241 PolarHBondContact O-N 2.92Å; E238-Q242 WeakPolarHBondContact O-CB 3.39Å; E238-Q242 PolarHBondContact O-N 3.16Å
239	L	81.6	Confident	84.4	Confident	66 Å²	66	80.6 Å²	80.6	35%	0.346	38%	0.38	S	S	.	.	H	α-helix	trans	-68.1	-23.9	176.6	-177.7	57.5	0	0	0	111.8	P234 K243	P234-L239 HydrophobicContact CB-CB 3.85Å; P234-L239 HydrophobicContact CB-CD2 3.77Å; P234-L239 HydrophobicContact CB-CG 3.83Å; P234-L239 HydrophobicContact CG-CB 4.22Å; P234-L239 HydrophobicContact CG-CG 4.37Å; L239-K243 WeakPolarHBondContact O-CB 3.24Å; L239-K243 VanDerWaalsContact O-CG 3.27Å; L239-K243 WeakPolarHBondContact O-CG 3.49Å; L239-K243 PolarHBondContact O-N 2.84Å; L239-K243 VanDerWaalsContact O-N 3.13Å
240	M	84.8	Confident	84	Confident	38 Å²	38	77.9 Å²	77.9	19%	0.187	37%	0.373	C	S	.	.	H	α-helix	trans	-73.3	-44.4	170.6	-166	66.1	179.2	0	0	111.4	W222 Y233 P234 G237 E238 Q242 K243 L244	W222-M240 HydrophobicContact CH2-CB 3.69Å; W222-M240 HydrophobicContact CH2-CG 3.93Å; W222-M240 HydrophobicContact CZ2-CB 3.98Å; W222-M240 HydrophobicContact CZ2-CG 4.44Å; Y233-M240 HydrophobicContact CD1-CE 4.43Å; Y233-M240 HydrophobicContact CE1-CE 4.23Å; P234-M240 HydrophobicContact CG-CB 3.67Å; P234-M240 HydrophobicContact CG-CG 4.45Å; P234-M240 HydrophobicContact CG-SD 4.12Å; G237-M240 WeakPolarHBondContact O-CB 3.35Å; G237-M240 PolarHBondContact O-N 2.82Å; G237-M240 VanDerWaalsContact O-N 3.15Å; E238-M240 PolarHBondContact O-N 2.93Å; M240-Q242 VanDerWaalsContact C-N 3.31Å; M240-Q242 PolarHBondContact O-N 3.48Å; M240-K243 PolarHBondContact O-N 3.24Å; M240-L244 HydrophobicContact CE-CD1 4.19Å; M240-L244 HydrophobicContact CE-CG 4.37Å; M240-L244 HydrophobicContact CG-CD1 4.05Å; M240-L244 WeakPolarHBondContact O-CB 3.3Å; M240-L244 WeakPolarHBondContact O-CG 3.47Å; M240-L244 PolarHBondContact O-N 2.91Å
241	M	80.7	Confident	83.3	Confident	62 Å²	62	78.8 Å²	78.8	31%	0.305	39%	0.386	S	S	.	.	H	α-helix	trans	-63.4	-36.8	175.2	-70.8	-62.5	103.5	0	0	111.6	K189 G237 E238 L244 K245	K189-M241 HydrophobicContact CB-CG 4.35Å; G237-M241 WeakPolarHBondContact O-CG 3.45Å; G237-M241 PolarHBondContact O-N 3.02Å; E238-M241 CarbonylContact O-C 3.52Å; E238-M241 PolarHBondContact O-N 2.92Å; M241-L244 HydrophobicContact CE-CD1 3.79Å; M241-K245 WeakPolarHBondContact O-CB 3.42Å; M241-K245 WeakPolarHBondContact O-CG 3.16Å; M241-K245 PolarHBondContact O-N 2.82Å
242	Q	83.7	Confident	82.7	Confident	121 Å²	121	83.8 Å²	83.8	57%	0.565	41%	0.407	S	S	*	.	H	α-helix	trans	-64.6	-49.2	174.1	-170.6	-179.7	12.3	0	0	111.3	E238 M240 L244 K245 Q246	E238-Q242 WeakPolarHBondContact O-CB 3.39Å; E238-Q242 PolarHBondContact O-N 3.16Å; M240-Q242 VanDerWaalsContact C-N 3.31Å; M240-Q242 PolarHBondContact O-N 3.48Å; Q242-L244 PolarHBondContact O-N 3.36Å; Q242-K245 PolarHBondContact O-N 3.05Å; Q242-Q246 WeakPolarHBondContact O-CB 3.41Å; Q242-Q246 PolarHBondContact O-N 2.95Å
243	K	83.3	Confident	82.1	Confident	106 Å²	106	80.3 Å²	80.3	46%	0.461	40%	0.398	S	S	.	.	H	α-helix	trans	-59.7	-44.4	175.6	-74.8	175.2	179.3	-173.6	0	112.4	L239 M240 Q246 S247	L239-K243 WeakPolarHBondContact O-CB 3.24Å; L239-K243 VanDerWaalsContact O-CG 3.27Å; L239-K243 WeakPolarHBondContact O-CG 3.49Å; L239-K243 PolarHBondContact O-N 2.84Å; L239-K243 VanDerWaalsContact O-N 3.13Å; M240-K243 PolarHBondContact O-N 3.24Å; K243-Q246 PolarHBondContact O-N 3.01Å; K243-S247 PolarHBondContact O-N 3.25Å; K243-S247 PolarHBondContact O-OG 3.24Å
244	L	82.6	Confident	81.1	Confident	85 Å²	85	82.5 Å²	82.5	45%	0.445	41%	0.412	S	S	.	.	H	α-helix	trans	-67.9	-34.9	177.8	-73.2	169.9	0	0	0	112.8	M240 M241 Q242 L248	M240-L244 HydrophobicContact CE-CD1 4.19Å; M240-L244 HydrophobicContact CE-CG 4.37Å; M240-L244 HydrophobicContact CG-CD1 4.05Å; M240-L244 WeakPolarHBondContact O-CB 3.3Å; M240-L244 WeakPolarHBondContact O-CG 3.47Å; M240-L244 PolarHBondContact O-N 2.91Å; M241-L244 HydrophobicContact CE-CD1 3.79Å; Q242-L244 PolarHBondContact O-N 3.36Å; L244-L248 VanDerWaalsContact O-CB 3.28Å; L244-L248 WeakPolarHBondContact O-CB 3.41Å; L244-L248 PolarHBondContact O-N 3.38Å
245	K	83.8	Confident	80.3	Confident	141 Å²	141	86.2 Å²	86.2	61%	0.613	43%	0.428	S	S	*	.	H	α-helix	trans	-63.9	-46.2	169.6	-77.7	170	-179.1	178.5	0	111.1	M241 Q242 L248 M249	M241-K245 WeakPolarHBondContact O-CB 3.42Å; M241-K245 WeakPolarHBondContact O-CG 3.16Å; M241-K245 PolarHBondContact O-N 2.82Å; Q242-K245 PolarHBondContact O-N 3.05Å; K245-L248 PolarHBondContact O-N 3.05Å; K245-M249 WeakPolarHBondContact O-CG 3.05Å; K245-M249 PolarHBondContact O-N 3.03Å
246	Q	85.9	Confident	79.7	Confident	112 Å²	112	85.2 Å²	85.2	52%	0.523	42%	0.42	S	S	.	.	H	α-helix	trans	-58.5	-53.3	178	-177.9	-177.6	-23.4	0	0	110.7	Q242 K243 L248 M249 E250	Q242-Q246 WeakPolarHBondContact O-CB 3.41Å; Q242-Q246 PolarHBondContact O-N 2.95Å; K243-Q246 PolarHBondContact O-N 3.01Å; Q246-L248 VanDerWaalsContact C-N 3.27Å; Q246-L248 PolarHBondContact O-N 3.21Å; Q246-M249 CarbonylContact O-C 3.55Å; Q246-M249 WeakPolarHBondContact O-CA 3.43Å; Q246-M249 WeakPolarHBondContact O-CB 3.39Å; Q246-M249 PolarHBondContact O-N 2.95Å; Q246-E250 HydrophobicContact CG-CG 4.44Å; Q246-E250 WeakPolarHBondContact CG-OE1 3.36Å; Q246-E250 PolarHBondContact NE2-OE1 2.82Å; Q246-E250 WeakPolarHBondContact O-CG 3.24Å; Q246-E250 PolarHBondContact O-N 3.4Å
247	S	84.9	Confident	78.7	Confident	57 Å²	57	87.8 Å²	87.8	40%	0.399	43%	0.432	S	S	.	.	H	α-helix	trans	-67.4	-24.6	179.4	-60.6	0	0	0	0	114.2	K243 E250 V251	K243-S247 PolarHBondContact O-N 3.25Å; K243-S247 PolarHBondContact O-OG 3.24Å; S247-E250 VanDerWaalsContact CA-OE2 3.27Å; S247-E250 WeakPolarHBondContact CA-OE2 3.46Å; S247-E250 PolarHBondContact OG-OE2 2.62Å; S247-E250 VanDerWaalsContact OG-OE2 3.11Å; S247-V251 WeakPolarHBondContact O-CB 3.32Å; S247-V251 VanDerWaalsContact O-CG2 3.26Å; S247-V251 WeakPolarHBondContact O-CG2 3.46Å; S247-V251 PolarHBondContact O-N 2.91Å
248	L	85.9	Confident	77.9	Confident	60 Å²	60	94.5 Å²	94.5	31%	0.314	46%	0.457	S	S	.	.	H	α-helix	trans	-70.2	-33.8	168.3	-178.2	62.2	0	0	0	112.3	L244 K245 Q246 K252 L285	L244-L248 VanDerWaalsContact O-CB 3.28Å; L244-L248 WeakPolarHBondContact O-CB 3.41Å; L244-L248 PolarHBondContact O-N 3.38Å; K245-L248 PolarHBondContact O-N 3.05Å; Q246-L248 VanDerWaalsContact C-N 3.27Å; Q246-L248 PolarHBondContact O-N 3.21Å; L248-K252 WeakPolarHBondContact O-CB 3.32Å; L248-K252 VanDerWaalsContact O-CG 3.27Å; L248-K252 WeakPolarHBondContact O-CG 3.21Å; L248-K252 PolarHBondContact O-N 3.49Å; L248-K252 VanDerWaalsContact O-N 3.09Å; L248-L285 HydrophobicContact CD1-CD1 4.46Å
249	M	78.1	Confident	76.7	Confident	123 Å²	123	93.5 Å²	93.5	61%	0.606	45%	0.452	S	S	*	.	H	α-helix	trans	-72.1	-40.5	172.7	-64.7	-67.4	-74.3	0	0	111.1	K245 Q246 K252 Q253	K245-M249 WeakPolarHBondContact O-CG 3.05Å; K245-M249 PolarHBondContact O-N 3.03Å; Q246-M249 CarbonylContact O-C 3.55Å; Q246-M249 WeakPolarHBondContact O-CA 3.43Å; Q246-M249 WeakPolarHBondContact O-CB 3.39Å; Q246-M249 PolarHBondContact O-N 2.95Å; M249-K252 PolarHBondContact O-N 2.84Å; M249-K252 HydrophobicContact SD-CD 4.5Å; M249-Q253 WeakPolarHBondContact O-CB 3.34Å; M249-Q253 PolarHBondContact O-N 3.24Å
250	E	81.8	Confident	75.4	Confident	81 Å²	81	95.4 Å²	95.4	38%	0.379	46%	0.463	S	S	.	.	H	α-helix	trans	-60.3	-45.7	173.9	-67.3	162.8	171.5	0	0	111.5	Q246 S247 K252 Q253 Q254	Q246-E250 HydrophobicContact CG-CG 4.44Å; Q246-E250 WeakPolarHBondContact CG-OE1 3.36Å; Q246-E250 PolarHBondContact NE2-OE1 2.82Å; Q246-E250 WeakPolarHBondContact O-CG 3.24Å; Q246-E250 PolarHBondContact O-N 3.4Å; S247-E250 VanDerWaalsContact CA-OE2 3.27Å; S247-E250 WeakPolarHBondContact CA-OE2 3.46Å; S247-E250 PolarHBondContact OG-OE2 2.62Å; S247-E250 VanDerWaalsContact OG-OE2 3.11Å; E250-K252 VanDerWaalsContact C-N 3.33Å; E250-K252 PolarHBondContact O-N 2.78Å; E250-Q253 PolarHBondContact O-N 2.98Å; E250-Q254 WeakPolarHBondContact O-CB 3.49Å; E250-Q254 WeakPolarHBondContact O-CG 3.46Å; E250-Q254 PolarHBondContact O-N 2.65Å
251	V	78.1	Confident	73.8	Confident	89 Å²	89	96.7 Å²	96.7	54%	0.539	48%	0.476	S	S	.	.	H	α-helix	trans	-67.2	-31.9	176.2	168.3	0	0	0	0	112.4	S247 H255	S247-V251 WeakPolarHBondContact O-CB 3.32Å; S247-V251 VanDerWaalsContact O-CG2 3.26Å; S247-V251 WeakPolarHBondContact O-CG2 3.46Å; S247-V251 PolarHBondContact O-N 2.91Å; V251-H255 PolarHBondContact O-N 2.88Å
252	K	79.3	Confident	72.3	Confident	120 Å²	120	98.1 Å²	98.1	52%	0.522	49%	0.488	S	S	.	.	H	α-helix	trans	-69.8	-42.8	171.2	-79.7	176.2	175.5	-171.5	0	111.9	L248 M249 E250 H255 V256	L248-K252 WeakPolarHBondContact O-CB 3.32Å; L248-K252 VanDerWaalsContact O-CG 3.27Å; L248-K252 WeakPolarHBondContact O-CG 3.21Å; L248-K252 PolarHBondContact O-N 3.49Å; L248-K252 VanDerWaalsContact O-N 3.09Å; M249-K252 PolarHBondContact O-N 2.84Å; M249-K252 HydrophobicContact SD-CD 4.5Å; E250-K252 VanDerWaalsContact C-N 3.33Å; E250-K252 PolarHBondContact O-N 2.78Å; K252-H255 WeakPolarHBondContact O-CA 3.46Å; K252-H255 VanDerWaalsContact O-CB 3.27Å; K252-H255 WeakPolarHBondContact O-CB 3.45Å; K252-H255 PolarHBondContact O-N 2.9Å; K252-V256 PolarHBondContact O-N 2.81Å
253	Q	75.7	Confident	70.7	Confident	103 Å²	103	96.8 Å²	96.8	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-62.2	-46.2	177.4	-165.6	60.8	47.6	0	0	110.1	M249 E250 H255 V256 D257	M249-Q253 WeakPolarHBondContact O-CB 3.34Å; M249-Q253 PolarHBondContact O-N 3.24Å; E250-Q253 PolarHBondContact O-N 2.98Å; Q253-H255 PolarHBondContact O-N 3.5Å; Q253-V256 CarbonylContact O-C 3.53Å; Q253-V256 PolarHBondContact O-N 3.34Å; Q253-D257 PolarHBondContact NE2-OD1 2.84Å; Q253-D257 WeakPolarHBondContact O-CB 3.31Å; Q253-D257 PolarHBondContact O-N 2.8Å
254	Q	69.8	Low	69	Low	127 Å²	127	99.9 Å²	99.9	59%	0.593	50%	0.504	S	S	*	.	H	α-helix	trans	-61.6	-12.6	171	-70.5	175	7.9	0	0	114.7	E250 R258	E250-Q254 WeakPolarHBondContact O-CB 3.49Å; E250-Q254 WeakPolarHBondContact O-CG 3.46Å; E250-Q254 PolarHBondContact O-N 2.65Å; Q254-R258 WeakPolarHBondContact O-CB 3.23Å
255	H	67.5	Low	67.2	Low	86 Å²	86	103.5 Å²	103.5	40%	0.398	52%	0.521	S	S	.	.	H	α-helix	trans	-85.7	-48.3	168.5	-150.7	-78.2	0	0	0	110.8	V251 K252 Q253 R258 E259	V251-H255 PolarHBondContact O-N 2.88Å; K252-H255 WeakPolarHBondContact O-CA 3.46Å; K252-H255 VanDerWaalsContact O-CB 3.27Å; K252-H255 WeakPolarHBondContact O-CB 3.45Å; K252-H255 PolarHBondContact O-N 2.9Å; Q253-H255 PolarHBondContact O-N 3.5Å; H255-R258 PolarHBondContact NE2-NH2 3.16Å; H255-R258 VanDerWaalsContact NE2-NH2 3.11Å; H255-R258 CarbonylContact O-C 3.37Å; H255-R258 PolarHBondContact O-N 2.8Å; H255-E259 VanDerWaalsContact CE1-CD 3.46Å; H255-E259 IonicContact CE1-OE1 3.39Å; H255-E259 PolarHBondContact CE1-OE1 2.89Å; H255-E259 IonicContact CE1-OE2 3.58Å; H255-E259 IonicContact CG-OE2 2.72Å; H255-E259 IonicContact ND1-OE1 3.28Å; H255-E259 PolarHBondContact ND1-OE1 3.3Å; H255-E259 IonicContact ND1-OE2 3.99Å; H255-E259 PolarHBondContact ND1-OE2 3.42Å; H255-E259 WeakPolarHBondContact O-CG 3.3Å; H255-E259 PolarHBondContact O-N 3.41Å
256	V	68.7	Low	65.3	Low	68 Å²	68	101.1 Å²	101.1	41%	0.412	52%	0.522	S	S	.	.	H	α-helix	trans	-61.7	-49.8	177.3	176.1	0	0	0	0	111.6	K252 Q253 R258 E259 D260	K252-V256 PolarHBondContact O-N 2.81Å; Q253-V256 CarbonylContact O-C 3.53Å; Q253-V256 PolarHBondContact O-N 3.34Å; V256-R258 PolarHBondContact O-N 2.77Å; V256-E259 CarbonylContact O-C 3.53Å; V256-E259 WeakPolarHBondContact O-CA 3.3Å; V256-E259 PolarHBondContact O-N 2.7Å; V256-D260 PolarHBondContact O-N 2.65Å
257	D	59	Low	63.2	Low	78 Å²	78	100.6 Å²	100.6	42%	0.417	53%	0.53	S	S	.	.	H	α-helix	trans	-57.8	-33.3	176.8	-56.5	-24.1	0	0	0	111.6	Q253 S261	Q253-D257 PolarHBondContact NE2-OD1 2.84Å; Q253-D257 WeakPolarHBondContact O-CB 3.31Å; Q253-D257 PolarHBondContact O-N 2.8Å; D257-S261 VanDerWaalsContact O-CB 3.27Å; D257-S261 WeakPolarHBondContact O-CB 3.37Å; D257-S261 PolarHBondContact O-N 3.03Å; D257-S261 PolarHBondContact O-OG 2.88Å
258	R	60.6	Low	61	Low	142 Å²	142	106 Å²	106	54%	0.536	55%	0.552	S	S	.	*	H	α-helix	trans	-85.6	-7.9	178.6	-164	177.6	63.8	78.9	9.4	113	Q254 H255 V256 S261 T262	Q254-R258 WeakPolarHBondContact O-CB 3.23Å; H255-R258 PolarHBondContact NE2-NH2 3.16Å; H255-R258 VanDerWaalsContact NE2-NH2 3.11Å; H255-R258 CarbonylContact O-C 3.37Å; H255-R258 PolarHBondContact O-N 2.8Å; V256-R258 PolarHBondContact O-N 2.77Å; R258-S261 WeakPolarHBondContact CA-OG 3.23Å; R258-T262 WeakPolarHBondContact O-CG2 3.49Å
259	E	54.8	Low	58.7	Low	98 Å²	98	108.5 Å²	108.5	46%	0.458	57%	0.574	S	S	.	*	H	α-helix	trans	-94.5	-47.3	169.5	-75.6	169.2	141.4	0	0	109.3	H255 V256 S261 T262 V263	H255-E259 VanDerWaalsContact CE1-CD 3.46Å; H255-E259 IonicContact CE1-OE1 3.39Å; H255-E259 PolarHBondContact CE1-OE1 2.89Å; H255-E259 IonicContact CE1-OE2 3.58Å; H255-E259 IonicContact CG-OE2 2.72Å; H255-E259 IonicContact ND1-OE1 3.28Å; H255-E259 PolarHBondContact ND1-OE1 3.3Å; H255-E259 IonicContact ND1-OE2 3.99Å; H255-E259 PolarHBondContact ND1-OE2 3.42Å; H255-E259 WeakPolarHBondContact O-CG 3.3Å; H255-E259 PolarHBondContact O-N 3.41Å; V256-E259 CarbonylContact O-C 3.53Å; V256-E259 WeakPolarHBondContact O-CA 3.3Å; V256-E259 PolarHBondContact O-N 2.7Å; E259-S261 PolarHBondContact O-N 3Å; E259-T262 WeakPolarHBondContact O-CA 3.29Å; E259-T262 PolarHBondContact O-N 2.78Å; E259-T262 PolarHBondContact O-OG1 3.33Å; E259-V263 PolarHBondContact O-N 2.76Å
260	D	54.2	Low	57.8	Low	106 Å²	106	108 Å²	108	57%	0.567	58%	0.58	S	S	*	*	H	α-helix	trans	-59.2	-44	173.2	-86.1	-20.6	0	0	0	112.5	V256 T262 V263 E264	V256-D260 PolarHBondContact O-N 2.65Å; D260-T262 PolarHBondContact O-N 3.17Å; D260-T262 VanDerWaalsContact O-N 3.14Å; D260-V263 WeakPolarHBondContact O-CA 3.38Å; D260-V263 WeakPolarHBondContact O-CB 3.38Å; D260-V263 PolarHBondContact O-N 3.36Å; D260-E264 PolarHBondContact O-N 2.99Å
261	S	51.3	Low	55.3	Low	65 Å²	65	110.8 Å²	110.8	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-68.4	-8.8	174.7	57.1	0	0	0	0	114.5	D257 R258 E259	D257-S261 VanDerWaalsContact O-CB 3.27Å; D257-S261 WeakPolarHBondContact O-CB 3.37Å; D257-S261 PolarHBondContact O-N 3.03Å; D257-S261 PolarHBondContact O-OG 2.88Å; R258-S261 WeakPolarHBondContact CA-OG 3.23Å; E259-S261 PolarHBondContact O-N 3Å
262	T	48.7	Very low	53.2	Low	93 Å²	93	110.9 Å²	110.9	57%	0.571	61%	0.607	S	S	*	*	H	α-helix	trans	-90.9	-13.8	165.4	60	0	0	0	0	113.8	R258 E259 D260	R258-T262 WeakPolarHBondContact O-CG2 3.49Å; E259-T262 WeakPolarHBondContact O-CA 3.29Å; E259-T262 PolarHBondContact O-N 2.78Å; E259-T262 PolarHBondContact O-OG1 3.33Å; D260-T262 PolarHBondContact O-N 3.17Å; D260-T262 VanDerWaalsContact O-N 3.14Å
263	V	51.6	Low	50.7	Low	92 Å²	92	113 Å²	113	56%	0.558	62%	0.621	S	S	*	*	H	α-helix	trans	-77.9	-44.4	171.7	-176.3	0	0	0	0	110.7	E259 D260 M265 S266	E259-V263 PolarHBondContact O-N 2.76Å; D260-V263 WeakPolarHBondContact O-CA 3.38Å; D260-V263 WeakPolarHBondContact O-CB 3.38Å; D260-V263 PolarHBondContact O-N 3.36Å; V263-M265 VanDerWaalsContact C-N 3.27Å; V263-M265 PolarHBondContact O-N 3.23Å; V263-S266 VanDerWaalsContact O-CB 3.32Å; V263-S266 WeakPolarHBondContact O-CB 3.41Å; V263-S266 PolarHBondContact O-N 2.82Å; V263-S266 PolarHBondContact O-OG 3.06Å
264	E	46	Very low	48.5	Very low	172 Å²	172	113.9 Å²	113.9	80%	0.804	63%	0.633	S	S	*	*	H	α-helix	trans	-64.6	-29.9	178	-67.4	-159	137.9	0	0	113.2	D260 S266	D260-E264 PolarHBondContact O-N 2.99Å; E264-S266 PolarHBondContact O-N 3.49Å; E264-S266 VanDerWaalsContact O-N 3.1Å
265	M	44.9	Very low	47.6	Very low	161 Å²	161	112.7 Å²	112.7	79%	0.793	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	16.5	179.2	-153.6	68.5	69.5	0	0	113.9	V263	V263-M265 VanDerWaalsContact C-N 3.27Å; V263-M265 PolarHBondContact O-N 3.23Å
266	S	43.8	Very low	45.6	Very low	91 Å²	91	115.4 Å²	115.4	64%	0.636	66%	0.659	S	S	*	*			trans	-98.2	24.6	-172.6	68.7	0	0	0	0	115.8	V263 E264	V263-S266 VanDerWaalsContact O-CB 3.32Å; V263-S266 WeakPolarHBondContact O-CB 3.41Å; V263-S266 PolarHBondContact O-N 2.82Å; V263-S266 PolarHBondContact O-OG 3.06Å; E264-S266 PolarHBondContact O-N 3.49Å; E264-S266 VanDerWaalsContact O-N 3.1Å
267	S	42.7	Very low	44.1	Very low	100 Å²	100	117.4 Å²	117.4	70%	0.699	67%	0.674	S	S	*	*	S	Bend	trans	-119.2	49.3	178.2	59.2	0	0	0	0	115.4
268	M	38.3	Very low	43.5	Very low	172 Å²	172	118.9 Å²	118.9	85%	0.847	69%	0.687	S	S	*	*	S	Bend	trans	-162.3	138.8	159.9	-97.2	-60.8	111.4	0	0	109
269	S	38.2	Very low	42	Very low	111 Å²	111	121.5 Å²	121.5	78%	0.776	70%	0.702	S	S	*	*			trans	-171.6	162.4	-175.7	-86.4	0	0	0	0	112.9
270	P	58.8	Low	40.9	Very low	113 Å²	113	126.9 Å²	126.9	73%	0.734	72%	0.719	S	S	*	*			cis	-142.3	156	-36.6	38.5	-22.5	0	0	0	114.6
271	V	30.3	Very low	40	Very low	139 Å²	139	126.9 Å²	126.9	84%	0.842	72%	0.715	S	S	*	*			trans	-142.6	100.5	155.7	-174	0	0	0	0	106
272	S	32.6	Very low	38.9	Very low	92 Å²	92	132.4 Å²	132.4	64%	0.643	73%	0.734	S	S	*	*				64.1	114.3	83.7	178	0	0	0	0	112.5
273	M	27.8	Very low	38.1	Very low	165 Å²	165	132.4 Å²	132.4	81%	0.813	74%	0.737	S	S	*	*			cis	-148	157.8	4.3	-103	-66.5	126.6	0	0	112.2
274	T	28.8	Very low	37.2	Very low	121 Å²	121	133.3 Å²	133.3	74%	0.742	74%	0.742	S	S	*	*			trans	-119.4	-158.1	170.3	63.4	0	0	0	0	107.9
275	P	50.8	Low	36.4	Very low	101 Å²	101	132 Å²	132	66%	0.656	74%	0.74	S	S	*	*			cis	-130.5	178.3	-29.3	35.6	-19.3	0	0	0	112.9
276	T	25.4	Very low	35.9	Very low	143 Å²	143	128.6 Å²	128.6	88%	0.877	73%	0.732	S	S	*	*				-167.5	132.8	124.1	11.4	0	0	0	0	112.7
277	P	37	Very low	35.7	Very low	111 Å²	111	129.4 Å²	129.4	72%	0.721	73%	0.728	S	S	*	*			trans	-120.4	-162.7	178.2	45.1	-34.9	0	0	0	111.7
278	P	48	Very low	35.2	Very low	108 Å²	108	131.6 Å²	131.6	70%	0.701	73%	0.732	S	S	*	*			cis	-125.5	-170.7	-38.1	30	-10.7	0	0	0	111.6
279	K	27.3	Very low	34.9	Very low	197 Å²	197	135.3 Å²	135.3	86%	0.857	74%	0.736	S	S	*	*				-163.6	150.6	120.7	-104.8	153.4	-171.8	173.4	0	112.9
280	R	32.4	Very low	34.4	Very low	212 Å²	212	133.1 Å²	133.1	80%	0.8	73%	0.731	S	S	*	*			trans	-132.7	160.6	-175.5	-163.4	176.5	-171.3	170.4	3.5	108.9
281	E	34.8	Very low	33	Very low	106 Å²	106	133 Å²	133	50%	0.495	73%	0.729	S	S	.	*			trans	-49	144.1	179.7	-62.5	139	-158.4	0	0	113.8	P512 A513	E281-P512 HydrophobicContact CG-CG 4.39Å; E281-P512 WeakPolarHBondContact OE1-CG 3.35Å; E281-A513 HydrophobicContact CG-CB 4.1Å
282	H	29.6	Very low	32.9	Very low	181 Å²	181	134.8 Å²	134.8	84%	0.838	73%	0.733	S	S	*	*			trans	-105.6	125.7	170.4	-81.7	-66.9	0	0	0	111.7
283	S	32.2	Very low	32.8	Very low	92 Å²	92	135.3 Å²	135.3	64%	0.643	74%	0.737	S	S	*	*			trans	-122.4	123.7	-178.6	-178.7	0	0	0	0	111.4	L285	S283-L285 PolarHBondContact O-N 3.22Å
284	V	30.8	Very low	32.8	Very low	111 Å²	111	134.7 Å²	134.7	67%	0.673	74%	0.743	S	S	*	*	S	Bend	trans	57.6	-20.8	151	-178.2	0	0	0	0	120	S286	V284-S286 VanDerWaalsContact C-N 3.3Å; V284-S286 PolarHBondContact O-N 2.75Å
285	L	31.2	Very low	32.8	Very low	144 Å²	144	134 Å²	134	75%	0.754	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	46.4	-168.6	-64.8	178.5	0	0	0	115.4	L248 S283	L248-L285 HydrophobicContact CD1-CD1 4.46Å; S283-L285 PolarHBondContact O-N 3.22Å
286	S	32.4	Very low	31.7	Very low	90 Å²	90	134.6 Å²	134.6	63%	0.629	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	2.8	176.4	59	0	0	0	0	115.2	V284	V284-S286 VanDerWaalsContact C-N 3.3Å; V284-S286 PolarHBondContact O-N 2.75Å
287	I	39.6	Very low	31.7	Very low	108 Å²	108	132.3 Å²	132.3	55%	0.554	74%	0.739	S	S	*	*	S	Bend	trans	-98	-11.2	-171.4	-61.6	177.6	0	0	0	113.5	K156	K156-I287 HydrophobicContact CD-CD1 4.43Å; K156-I287 HydrophobicContact CG-CD1 4.27Å
288	L	33	Very low	31.2	Very low	147 Å²	147	135 Å²	135	77%	0.77	75%	0.746	S	S	*	*	S	Bend	trans	-116.9	54.7	-177.5	-68.8	177.8	0	0	0	113.5
289	R	32.6	Very low	30.2	Very low	250 Å²	250	134 Å²	134	94%	0.943	75%	0.747	S	S	*	*			trans	-146.8	88	161.5	-137.2	-178.5	-67.2	-164	2	111.4
290	G	26.6	Very low	30.9	Very low	64 Å²	64	129.8 Å²	129.8	66%	0.66	74%	0.74	S	S	*	*			trans	-143.5	125.5	173.8	0	0	0	0	0	110.7
291	T	30	Very low	30.7	Very low	112 Å²	112	128.3 Å²	128.3	69%	0.687	74%	0.739	S	S	*	*			trans	43.2	102.8	160.4	59.5	0	0	0	0	119.1
292	N	29.2	Very low	30.2	Very low	175 Å²	175	134.2 Å²	134.2	94%	0.936	76%	0.757	S	S	*	*			trans	-120.6	143.6	136.9	-98.3	-5.2	0	0	0	107.3
293	S	30.5	Very low	30.1	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	76%	0.756	S	S	*	*			trans	-127	131.9	-165.8	-52.9	0	0	0	0	112.4
294	T	27	Very low	30.7	Very low	153 Å²	153	134.7 Å²	134.7	94%	0.939	76%	0.759	S	S	*	*			trans	-166.5	174.8	152.1	2.8	0	0	0	0	110.3
295	S	28.4	Very low	30.5	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	77%	0.765	S	S	*	*			trans	-132.8	-176.3	-149.3	56.9	0	0	0	0	115.2
296	S	27.2	Very low	30.5	Very low	114 Å²	114	137.2 Å²	137.2	80%	0.797	76%	0.764	S	S	*	*			trans	81.3	146.8	178.6	83.6	0	0	0	0	116.2
297	S	26.2	Very low	31	Very low	96 Å²	96	138.9 Å²	138.9	67%	0.671	77%	0.773	S	S	*	*			cis	-162.6	169.2	-24.7	55.2	0	0	0	0	111.2
298	L	27.1	Very low	30.6	Very low	167 Å²	167	139.6 Å²	139.6	87%	0.874	78%	0.777	S	S	*	*			trans	66	128.2	162.8	-71.5	153.4	0	0	0	119.3
299	A	26.5	Very low	31	Very low	86 Å²	86	137.7 Å²	137.7	71%	0.711	77%	0.773	S	S	*	*			trans	-110.1	170.7	157.9	0	0	0	0	0	108.5
300	P	42.4	Very low	30.8	Very low	109 Å²	109	132.7 Å²	132.7	71%	0.708	77%	0.771	S	S	*	*				-158.5	158.9	85.9	40.3	-20.4	0	0	0	119.3
301	K	27.2	Very low	31	Very low	181 Å²	181	139.9 Å²	139.9	79%	0.787	78%	0.778	S	S	*	*			trans	76	130.1	140.4	-77.7	164.5	-175.4	169.9	0	123
302	R	25.6	Very low	31.5	Very low	230 Å²	230	140.1 Å²	140.1	87%	0.868	78%	0.781	S	S	*	*			trans	90.2	102.5	133.8	-81.2	178.9	172.5	164.3	-4.1	121.9
303	E	26.4	Very low	31.4	Very low	173 Å²	173	141.9 Å²	141.9	81%	0.808	78%	0.775	S	S	*	*			trans	-62.5	167.2	133.4	-129.8	-169.8	171.7	0	0	111.2
304	P	44.2	Very low	31.2	Very low	110 Å²	110	142.5 Å²	142.5	71%	0.714	78%	0.778	S	S	*	*				-156.2	165.7	68.8	42.4	-21.9	0	0	0	120.2
305	S	27.6	Very low	31.2	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	77%	0.766	S	S	*	*			trans	85.4	163.6	138.4	71	0	0	0	0	122.7
306	R	30.9	Very low	31	Very low	194 Å²	194	142 Å²	142	73%	0.732	77%	0.773	S	S	*	*			trans	-116.7	171.6	-155.7	-152.1	-168.3	-165.9	-179.8	6.4	111.2
307	P	43.2	Very low	30.8	Very low	125 Å²	125	142 Å²	142	81%	0.812	77%	0.773	S	S	*	*				-149	-170.7	97.3	38.1	-19.5	0	0	0	115.8
308	L	30.1	Very low	31.5	Very low	124 Å²	124	142.7 Å²	142.7	65%	0.649	78%	0.775	S	S	*	*			trans	-114.9	160.8	-174.4	-79.2	166.9	0	0	0	114
309	P	42.9	Very low	31.4	Very low	107 Å²	107	143.7 Å²	143.7	70%	0.695	78%	0.775	S	S	*	*			trans	-122.4	-179.3	136.5	38.7	-27.8	0	0	0	111.1
310	T	27.4	Very low	31.3	Very low	144 Å²	144	151 Å²	151	88%	0.883	78%	0.784	S	S	*	*			cis	-157.2	176.6	-38.6	34	0	0	0	0	107.7
311	R	30.6	Very low	30.9	Very low	215 Å²	215	151.2 Å²	151.2	81%	0.811	79%	0.786	S	S	*	*			trans	-155.4	147.2	176.7	-176.1	-172.6	-179.5	-155.7	4.3	113.3
312	P	40.2	Very low	30.8	Very low	117 Å²	117	149.5 Å²	149.5	76%	0.76	79%	0.785	S	S	*	*			trans	-122.4	142.3	137.4	7.4	14.5	0	0	0	111.1
313	R	28.3	Very low	30.6	Very low	212 Å²	212	148.8 Å²	148.8	80%	0.8	78%	0.783	S	S	*	*				68	105.8	62.9	-91.1	-167.9	163	-177	-4.1	113.1
314	C	26.7	Very low	31	Very low	116 Å²	116	145.7 Å²	145.7	78%	0.784	78%	0.778	S	S	*	*				86.3	148.6	81.1	-73	0	0	0	0	112
315	A	26.3	Very low	30.1	Very low	83 Å²	83	152.1 Å²	152.1	69%	0.686	79%	0.788	S	S	*	*			cis	-151.9	-164.6	16.9	0	0	0	0	0	114.2
316	D	23.8	Very low	30	Very low	165 Å²	165	150.6 Å²	150.6	88%	0.882	78%	0.782	S	S	*	*			trans	106.4	148.8	150.3	-57.3	-21.8	0	0	0	123.2
317	S	23.6	Very low	29.7	Very low	113 Å²	113	149.8 Å²	149.8	79%	0.79	79%	0.792	S	S	*	*			trans	-167.9	168	-167.9	-139.3	0	0	0	0	106.1
318	P	40.7	Very low	28.9	Very low	111 Å²	111	154 Å²	154	72%	0.721	79%	0.793	S	S	*	*			cis	-151.1	-148.3	37.1	37.3	-10.4	0	0	0	115.4
319	E	24.7	Very low	29.3	Very low	188 Å²	188	153.4 Å²	153.4	88%	0.879	80%	0.796	S	S	*	*			trans	94.3	154.5	158.5	-52.1	-140.8	142.1	0	0	121.4
320	R	25.3	Very low	28.6	Very low	240 Å²	240	155.2 Å²	155.2	91%	0.906	80%	0.8	S	S	*	*			trans	-170.1	125.3	-168.9	-172.7	-169.5	-161.7	-169.4	8	110
321	P	34.2	Very low	28.6	Very low	114 Å²	114	155.9 Å²	155.9	74%	0.74	80%	0.797	S	S	*	*				-154.1	142.7	123.8	33.2	-13.4	0	0	0	118.7
322	L	23.6	Very low	28.7	Very low	145 Å²	145	155.1 Å²	155.1	76%	0.759	79%	0.794	S	S	*	*			trans	53.7	111.3	136	-55.5	172.4	0	0	0	124.7
323	Y	21.2	Very low	28.4	Very low	215 Å²	215	155.1 Å²	155.1	84%	0.843	79%	0.794	S	S	*	*			trans	62.1	170.4	134.8	-83.2	-94.2	0	0	0	120.5
324	P	34.8	Very low	28.3	Very low	108 Å²	108	152 Å²	152	70%	0.701	79%	0.788	S	S	*	*			cis	-130.4	-175	-4	42.4	-25.5	0	0	0	117
325	R	25.2	Very low	28.9	Very low	245 Å²	245	155.8 Å²	155.8	93%	0.925	79%	0.792	S	S	*	*			trans	10.1	162.6	149.2	-77.3	178.9	158.2	152.6	-6.9	122.6
326	A	25.8	Very low	29	Very low	81 Å²	81	157.7 Å²	157.7	67%	0.669	80%	0.797	S	S	*	*			cis	164.8	140	-28.5	0	0	0	0	0	109.7
327	L	25.6	Very low	29.1	Very low	178 Å²	178	157.5 Å²	157.5	93%	0.932	80%	0.795	S	S	*	*			trans	-148.5	151.5	162.7	-79.9	-176.5	0	0	0	112.6
328	Y	26.7	Very low	29.1	Very low	212 Å²	212	156.6 Å²	156.6	83%	0.831	79%	0.789	S	S	*	*			trans	-136	156.7	175.9	-94.9	-78	0	0	0	108.5
329	P	37.9	Very low	28.3	Very low	112 Å²	112	159.2 Å²	159.2	73%	0.727	79%	0.791	S	S	*	*				-126.8	151.2	91.2	3.6	19.5	0	0	0	112.5
330	L	27.3	Very low	28.2	Very low	146 Å²	146	156.5 Å²	156.5	76%	0.764	78%	0.783	S	S	*	*				68.5	145.2	65.7	-60.1	172.7	0	0	0	113.8
331	L	27.5	Very low	28.2	Very low	157 Å²	157	151.1 Å²	151.1	82%	0.822	77%	0.772	S	S	*	*			cis	-127.3	161.9	17.5	-82.5	83	0	0	0	115.2
332	R	33.6	Very low	27.8	Very low	200 Å²	200	152.8 Å²	152.8	76%	0.755	77%	0.773	S	S	*	*			trans	-126.6	152.4	151.6	-149.9	-173.2	-157	175.6	7.2	107.2
333	P	34.4	Very low	28.2	Very low	117 Å²	117	155.2 Å²	155.2	76%	0.76	78%	0.778	S	S	*	*				-122.6	126.4	125.7	-3.3	23.7	0	0	0	110.3
334	H	25.1	Very low	28.4	Very low	146 Å²	146	151 Å²	151	68%	0.676	78%	0.777	S	S	*	*				83.1	103.2	54.7	-79.1	-79.8	0	0	0	113.9
335	F	38.8	Very low	27.9	Very low	195 Å²	195	149.6 Å²	149.6	86%	0.855	77%	0.77	S	S	*	*			trans	-64.7	147.4	150.6	-70	-101.8	0	0	0	109.7
336	P	28.7	Very low	28.5	Very low	124 Å²	124	144.9 Å²	144.9	81%	0.805	76%	0.758	S	S	*	*			trans	-82.2	136.3	145.9	-0.7	20.4	0	0	0	109.9
337	L	26.3	Very low	28.7	Very low	161 Å²	161	145.4 Å²	145.4	84%	0.843	75%	0.754	S	S	*	*			trans	-111.3	-172.4	162.1	-100.1	171.1	0	0	0	108.1
338	S	23.4	Very low	28.5	Very low	94 Å²	94	138 Å²	138	66%	0.657	72%	0.721	S	S	*	*			trans	70.5	146.8	179.1	-69.1	0	0	0	0	113.6
339	E	23.3	Very low	28.7	Very low	165 Å²	165	130 Å²	130	77%	0.771	69%	0.69	S	S	*	*			cis	-157.5	162	-1.8	-121.6	143.9	-131.8	0	0	105.4
340	D	22.9	Very low	28.3	Very low	131 Å²	131	125.1 Å²	125.1	70%	0.701	66%	0.658	S	S	*	*			cis	-166.7	-159.1	7.3	-164.1	-11.6	0	0	0	106.7
341	L	25.4	Very low	28.1	Very low	128 Å²	128	121.5 Å²	121.5	67%	0.67	64%	0.639	S	S	*	*			trans	68.8	117	145.4	-70.3	161.7	0	0	0	120
342	L	25.4	Very low	28	Very low	148 Å²	148	115.7 Å²	115.7	78%	0.775	61%	0.61	S	S	*	*			trans	72	94.4	138.4	-57.5	175.6	0	0	0	119.9
343	K	32.1	Very low	27.5	Very low	197 Å²	197	112.1 Å²	112.1	86%	0.857	60%	0.602	S	S	*	*				-4.6	138	116	-77.2	178.3	179.8	173.8	0	114.5
344	P	25.9	Very low	27.3	Very low	126 Å²	126	110.1 Å²	110.1	82%	0.818	59%	0.59	S	S	*	*				-140.1	-176.1	78.7	39.8	-25.1	0	0	0	116.8
345	S	24.6	Very low	27.7	Very low	79 Å²	79	108.8 Å²	108.8	55%	0.552	60%	0.595	S	S	*	*			trans	-61.6	158.3	-169.6	43.7	0	0	0	0	117.9
346	H	37.4	Very low	27	Very low	145 Å²	145	102.7 Å²	102.7	67%	0.671	59%	0.587	S	S	*	*			trans	-10	141.4	137.6	-77.5	-90	0	0	0	117	L737 H741	H346-L737 WeakPolarHBondContact O-CD2 3.46Å; H346-H741 AromaticContact ND1-NE2 3.85Å
347	P	29.8	Very low	26.9	Very low	92 Å²	92	105.4 Å²	105.4	60%	0.597	59%	0.586	S	S	*	*			trans	-138.7	160.8	133.5	40.9	-31.9	0	0	0	115.9	L737	P347-L737 HydrophobicContact CB-CD1 3.33Å; P347-L737 HydrophobicContact CB-CD2 4.21Å; P347-L737 HydrophobicContact CB-CG 3.49Å; P347-L737 VanDerWaalsContact CB-CG 3.49Å
348	G	22.8	Very low	27	Very low	23 Å²	23	105.3 Å²	105.3	24%	0.237	58%	0.581	C	S	.	*			cis	126.5	148.5	-2	0	0	0	0	0	114.4	P350 A736 H741	G348-P350 WeakPolarHBondContact O-CD 3.49Å; G348-A736 CarbonylContact C-O 3.4Å; G348-H741 VanDerWaalsContact CA-CB 3.43Å; G348-H741 PolarHBondContact N-CD2 3.22Å
349	Y	31.1	Very low	27.4	Very low	45 Å²	45	106 Å²	106	18%	0.176	59%	0.586	C	S	.	*				-80.5	-64.4	-87.6	172.3	-168.4	0	0	0	105.9	A736 L737 E738 E739 V740 R742 A743	Y349-A736 PolarHBondContact N-O 3.32Å; Y349-L737 VanDerWaalsContact CB-C 3.46Å; Y349-L737 WeakPolarHBondContact CB-O 3.39Å; Y349-L737 VanDerWaalsContact N-CA 3.27Å; Y349-L737 PolarHBondContact N-O 2.88Å; Y349-L737 VanDerWaalsContact N-O 3.13Å; Y349-E738 HydrophobicContact CD1-CB 4.42Å; Y349-E738 WeakPolarHBondContact CD1-O 3.17Å; Y349-E738 WeakPolarHBondContact CE1-O 3.35Å; Y349-E739 WeakPolarHBondContact CD2-O 3.23Å; Y349-E739 VanDerWaalsContact CE2-C 3.48Å; Y349-E739 WeakPolarHBondContact CE2-O 3.33Å; Y349-E739 HydrophobicContact CG-CB 4.25Å; Y349-V740 CarbonylContact O-C 3.22Å; Y349-V740 WeakPolarHBondContact O-CA 3.49Å; Y349-V740 WeakPolarHBondContact O-CB 3.35Å; Y349-V740 VanDerWaalsContact O-CG1 3.26Å; Y349-V740 WeakPolarHBondContact O-CG1 3.44Å; Y349-V740 PolarHBondContact O-N 2.59Å; Y349-R742 VanDerWaalsContact CD1-CA 3.43Å; Y349-R742 HydrophobicContact CD1-CB 3.41Å; Y349-R742 VanDerWaalsContact CD1-CB 3.41Å; Y349-R742 HydrophobicContact CD1-CG 4.47Å; Y349-R742 HydrophobicContact CE1-CB 3.73Å; Y349-R742 HydrophobicContact CE1-CG 4.34Å; Y349-R742 HydrophobicContact CG-CB 4.34Å; Y349-A743 HydrophobicContact CD2-CB 3.89Å; Y349-A743 HydrophobicContact CE2-CB 3.19Å
350	P	28.4	Very low	27.6	Very low	9 Å²	9	103.2 Å²	103.2	6%	0.058	59%	0.585	C	S	.	*				-51.2	164.6	-89.1	-29.3	39.1	0	0	0	134.1	G348 P699 L715 A736 E739 V740	G348-P350 WeakPolarHBondContact O-CD 3.49Å; P350-P699 HydrophobicContact CB-CB 4.1Å; P350-P699 HydrophobicContact CB-CG 3.45Å; P350-P699 VanDerWaalsContact CB-CG 3.45Å; P350-P699 HydrophobicContact CG-CG 4.18Å; P350-L715 HydrophobicContact CB-CD1 3.76Å; P350-L715 HydrophobicContact CB-CD2 3.58Å; P350-L715 HydrophobicContact CB-CG 4.23Å; P350-L715 HydrophobicContact CG-CD1 4.33Å; P350-L715 HydrophobicContact CG-CD2 3.99Å; P350-L715 VanDerWaalsContact O-CD1 3.23Å; P350-L715 WeakPolarHBondContact O-CD1 3.5Å; P350-A736 VanDerWaalsContact CD-O 3.28Å; P350-A736 WeakPolarHBondContact CD-O 3.32Å; P350-A736 WeakPolarHBondContact CG-O 3.42Å; P350-E739 CarbonylContact C-O 3.56Å; P350-E739 VanDerWaalsContact C-O 3.22Å; P350-E739 VanDerWaalsContact CA-CA 3.44Å; P350-E739 VanDerWaalsContact CA-OE2 3.23Å; P350-E739 WeakPolarHBondContact CA-OE2 3.46Å; P350-E739 HydrophobicContact CB-CB 3.94Å; P350-E739 HydrophobicContact CB-CG 4.2Å; P350-E739 WeakPolarHBondContact CB-OE2 3.14Å; P350-E739 HydrophobicContact CG-CB 3.86Å; P350-E739 HydrophobicContact CG-CG 4.25Å; P350-E739 VanDerWaalsContact N-C 3.29Å; P350-E739 VanDerWaalsContact N-CB 3.26Å; P350-V740 WeakPolarHBondContact O-CB 3.32Å; P350-V740 WeakPolarHBondContact O-CG2 3.39Å; P350-V740 PolarHBondContact O-N 2.9Å
351	L	23.9	Very low	27.7	Very low	69 Å²	69	101.5 Å²	101.5	36%	0.361	59%	0.589	S	S	.	*			trans	-133.8	155.2	178.9	-120.1	84.8	0	0	0	112.2	K697 P699 E739 V740	L351-K697 CarbonylContact C-O 3.59Å; L351-P699 VanDerWaalsContact C-CD 3.48Å; L351-P699 WeakPolarHBondContact O-CA 3.4Å; L351-P699 WeakPolarHBondContact O-CB 3.32Å; L351-P699 WeakPolarHBondContact O-CD 3.31Å; L351-E739 WeakPolarHBondContact CD1-O 3.38Å; L351-E739 PolarHBondContact N-O 3.48Å; L351-E739 PolarHBondContact N-OE1 3.14Å; L351-E739 PolarHBondContact N-OE2 3.42Å; L351-V740 HydrophobicContact CD1-CG2 4.26Å
352	T	24.8	Very low	27.8	Very low	35 Å²	35	101.5 Å²	101.5	22%	0.215	59%	0.594	C	S	.	*				176.9	136.2	125.8	70.7	0	0	0	0	114.1	K697 C698 P699 H702	T352-K697 PolarHBondContact N-O 2.87Å; T352-K697 CarbonylContact O-C 3.16Å; T352-K697 WeakPolarHBondContact O-CB 3.46Å; T352-K697 WeakPolarHBondContact O-CD 3.47Å; T352-K697 WeakPolarHBondContact O-CE 3.24Å; T352-K697 VanDerWaalsContact O-CG 3.22Å; T352-K697 WeakPolarHBondContact O-CG 3.02Å; T352-C698 CarbonylContact O-C 3.53Å; T352-C698 PolarHBondContact O-N 2.92Å; T352-C698 VanDerWaalsContact O-O 3.06Å; T352-C698 PolarHBondContact OG1-O 3.09Å; T352-P699 WeakPolarHBondContact OG1-CA 3.33Å; T352-P699 PolarHBondContact OG1-O 2.89Å; T352-H702 PolarHBondContact OG1-CE1 3.14Å; T352-H702 VanDerWaalsContact OG1-CE1 3.26Å; T352-H702 PolarHBondContact OG1-ND1 3.21Å
353	H	23.2	Very low	28.7	Very low	126 Å²	126	100.3 Å²	100.3	58%	0.583	60%	0.596	S	S	*	*				39.1	117.8	125.8	-53.7	-55.5	0	0	0	128.9	K697	H353-K697 VanDerWaalsContact C-CD 3.45Å; H353-K697 WeakPolarHBondContact O-CE 3.33Å; H353-K697 PolarHBondContact O-NZ 3.45Å
354	S	30.8	Very low	28.5	Very low	74 Å²	74	96 Å²	96	52%	0.517	59%	0.591	S	S	.	*			trans	77.4	177.5	141.4	-52.3	0	0	0	0	116.2	K697 H704	S354-K697 WeakPolarHBondContact O-CD 3.42Å; S354-K697 VanDerWaalsContact O-CE 3.31Å; S354-K697 WeakPolarHBondContact O-CE 3.42Å; S354-K697 PolarHBondContact O-NZ 2.89Å; S354-H704 PolarHBondContact O-CE1 2.77Å
355	P	33.4	Very low	29.6	Very low	119 Å²	119	95.2 Å²	95.2	77%	0.773	59%	0.585	S	S	*	*			cis	-107.7	178.1	0.4	42.6	-32	0	0	0	114
356	G	23.9	Very low	29.9	Very low	67 Å²	67	97.1 Å²	97.1	69%	0.691	60%	0.598	S	S	*	*			trans	-131	168.5	163.5	0	0	0	0	0	111.2
357	K	26.2	Very low	29.4	Very low	181 Å²	181	94.5 Å²	94.5	79%	0.787	60%	0.602	S	S	*	*			trans	-174	133.8	159	-107	177.8	177.7	-172.6	0	110.8
358	Q	29	Very low	29.3	Very low	158 Å²	158	101.5 Å²	101.5	74%	0.738	62%	0.617	S	S	*	*				55.1	128.2	128.4	-66.3	169.2	-29.6	0	0	120.2
359	S	30.9	Very low	29.5	Very low	108 Å²	108	105.3 Å²	105.3	76%	0.755	64%	0.64	S	S	*	*			cis	-137.2	-114	-5.9	-68.3	0	0	0	0	113.7
360	S	28.2	Very low	29.3	Very low	108 Å²	108	108.2 Å²	108.2	76%	0.755	67%	0.667	S	S	*	*			cis	-163.9	157.6	10	-62.7	0	0	0	0	113.3
361	A	25.6	Very low	30.4	Very low	94 Å²	94	112.9 Å²	112.9	78%	0.777	70%	0.697	S	S	*	*			trans	50.4	95.9	153.6	0	0	0	0	0	123.1
362	T	27.4	Very low	30.4	Very low	128 Å²	128	117.5 Å²	117.5	79%	0.785	72%	0.717	S	S	*	*			trans	-13.7	164.4	130.6	43.1	0	0	0	0	120.5
363	P	44.2	Very low	30.5	Very low	124 Å²	124	122.1 Å²	122.1	81%	0.805	75%	0.745	S	S	*	*			cis	-138.1	177.5	29.5	39.5	-19.3	0	0	0	119.8
364	S	27.6	Very low	30.6	Very low	107 Å²	107	121.3 Å²	121.3	75%	0.748	75%	0.754	S	S	*	*			trans	-97.4	-158.7	-177.2	-30.2	0	0	0	0	111.5
365	P	48.3	Very low	31.5	Very low	108 Å²	108	122.5 Å²	122.5	70%	0.701	76%	0.76	S	S	*	*			cis	-147.2	178.5	29.1	45	-24	0	0	0	119.8
366	S	30.2	Very low	31.2	Very low	119 Å²	119	125 Å²	125	83%	0.832	76%	0.76	S	S	*	*			trans	72.4	139.3	152.5	-67.1	0	0	0	0	120.1
367	A	28	Very low	31.2	Very low	91 Å²	91	127.3 Å²	127.3	75%	0.752	77%	0.766	S	S	*	*			cis	-158.3	162.9	-7.6	0	0	0	0	0	113.8
368	R	27	Very low	31.5	Very low	238 Å²	238	124 Å²	124	90%	0.898	77%	0.766	S	S	*	*			trans	14.9	151.9	147	-73.9	-175.3	167.4	-165.9	-4.7	121.8
369	S	27.1	Very low	32.4	Very low	104 Å²	104	121.9 Å²	121.9	73%	0.727	77%	0.766	S	S	*	*			cis	-173.3	170.5	-11.4	49.1	0	0	0	0	112.1
370	S	26.3	Very low	32.2	Very low	106 Å²	106	122.4 Å²	122.4	74%	0.741	77%	0.769	S	S	*	*			trans	-63.4	-176	171.7	-17.4	0	0	0	0	115
371	P	51.5	Low	32	Very low	106 Å²	106	120.8 Å²	120.8	69%	0.688	77%	0.769	S	S	*	*			cis	-140	-165.6	-8	31.8	-7.3	0	0	0	115.5
372	E	24.9	Very low	33.1	Very low	167 Å²	167	122.2 Å²	122.2	78%	0.78	77%	0.771	S	S	*	*			trans	97.8	155.7	132.2	-113.3	167.7	-129.5	0	0	125
373	T	26.7	Very low	33.2	Very low	131 Å²	131	120.2 Å²	120.2	80%	0.804	77%	0.767	S	S	*	*			trans	72.7	134.4	163	51.5	0	0	0	0	123.4
374	S	26	Very low	32.5	Very low	110 Å²	110	121.7 Å²	121.7	77%	0.769	77%	0.768	S	S	*	*			trans	-91.8	-166.2	159.4	-32.7	0	0	0	0	109.6
375	P	48.2	Very low	32.7	Very low	99 Å²	99	121.4 Å²	121.4	64%	0.643	77%	0.766	S	S	*	*			cis	-136.9	-166.9	-14.2	22.1	5.5	0	0	0	114
376	H	27.6	Very low	32.8	Very low	171 Å²	171	122 Å²	122	79%	0.792	77%	0.77	S	S	*	*			trans	82.9	144.5	152.4	-66.3	-61.1	0	0	0	124.1
377	S	25	Very low	32.8	Very low	115 Å²	115	121.1 Å²	121.1	80%	0.804	77%	0.77	S	S	*	*			trans	71.5	124.6	145.1	46.2	0	0	0	0	123.7
378	S	32	Very low	33.1	Very low	112 Å²	112	122 Å²	122	78%	0.783	77%	0.77	S	S	*	*			trans	-67.7	-175.1	153.7	-23.1	0	0	0	0	111.7
379	P	47	Very low	33	Very low	114 Å²	114	119 Å²	119	74%	0.74	77%	0.77	S	S	*	*			cis	-147.6	-167.3	22.9	41.2	-17.8	0	0	0	118.1
380	S	28.5	Very low	33.3	Very low	119 Å²	119	124.3 Å²	124.3	83%	0.832	78%	0.776	S	S	*	*			trans	86.9	145.5	151.3	-59.9	0	0	0	0	121.7
381	G	24	Very low	34.6	Very low	73 Å²	73	125.1 Å²	125.1	75%	0.753	78%	0.778	S	S	*	*			trans	-101	-139.8	171.5	0	0	0	0	0	112.3
382	P	48.5	Very low	34	Very low	125 Å²	125	130.2 Å²	130.2	81%	0.812	79%	0.785	S	S	*	*			cis	-142.6	-168.7	7.9	43.9	-24.5	0	0	0	116.4
383	A	29.6	Very low	35.3	Very low	86 Å²	86	128.2 Å²	128.2	71%	0.711	79%	0.787	S	S	*	*			trans	67.2	158	146.8	0	0	0	0	0	121.1
384	L	28.5	Very low	35.5	Very low	154 Å²	154	125 Å²	125	81%	0.806	78%	0.78	S	S	*	*			cis	-167.5	150.4	-17.9	-106.1	170.5	0	0	0	111.3
385	S	31.2	Very low	35.7	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	79%	0.788	S	S	*	*			trans	67.3	167.9	145.8	-68.2	0	0	0	0	122.2
386	P	51.7	Low	35.1	Very low	122 Å²	122	132.1 Å²	132.1	79%	0.792	80%	0.797	S	S	*	*			cis	-144.4	-174.7	-42.4	41.6	-24.2	0	0	0	116.8
387	A	28.8	Very low	37	Very low	100 Å²	100	129.9 Å²	129.9	83%	0.826	80%	0.797	S	S	*	*			trans	100.1	159.6	146.2	0	0	0	0	0	122.3
388	S	34.2	Very low	38.6	Very low	110 Å²	110	130 Å²	130	77%	0.769	80%	0.796	S	S	*	*			trans	-132.4	177.4	-156	-37.3	0	0	0	0	114.5
389	I	26.4	Very low	39	Very low	173 Å²	173	130.9 Å²	130.9	89%	0.887	80%	0.802	S	S	*	*			trans	179.7	161.4	137.7	-92.8	153.8	0	0	0	114
390	Y	32.8	Very low	38.5	Very low	216 Å²	216	130.3 Å²	130.3	85%	0.847	81%	0.807	S	S	*	*			trans	-95.8	-165.7	-172.4	-87.7	-94	0	0	0	114.3
391	P	53.7	Low	39.7	Very low	123 Å²	123	130.6 Å²	130.6	80%	0.799	81%	0.806	S	S	*	*			cis	-138.7	-164.5	0.3	28.4	-0.3	0	0	0	119
392	Y	37.9	Very low	40.5	Very low	214 Å²	214	135.1 Å²	135.1	84%	0.839	81%	0.812	S	S	*	*			trans	-75	0	-178.5	-100.9	-118	0	0	0	117
393	P	53.2	Low	40.8	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	81%	0.814	S	S	*	*				0	178.8	0	44.5	-23.6	0	0	0	122.1
394	G	31.5	Very low	41.2	Very low	64 Å²	64	136.6 Å²	136.6	66%	0.66	82%	0.817	S	S	*	*			trans	139.1	123.1	136.7	0	0	0	0	0	125.7
395	Y	29.7	Very low	41.5	Very low	239 Å²	239	134.7 Å²	134.7	94%	0.937	81%	0.812	S	S	*	*			trans	76.5	165.1	148.2	-72.4	-83.7	0	0	0	125.8
396	S	35.6	Very low	41.6	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	82%	0.819	S	S	*	*			trans	-144.5	162.4	-151.7	-50.1	0	0	0	0	119.7
397	P	66.7	Low	40.5	Very low	124 Å²	124	143.8 Å²	143.8	81%	0.805	82%	0.822	S	S	*	*			trans	-131.6	174.5	-179.4	44	-30.2	0	0	0	119.8
398	P	58.7	Low	42.2	Very low	119 Å²	119	144 Å²	144	77%	0.773	81%	0.814	S	S	*	*			trans	-142.6	154.8	-171	42	-22.7	0	0	0	123.2
399	S	42	Very low	43.4	Very low	129 Å²	129	144.8 Å²	144.8	90%	0.902	82%	0.817	S	S	*	*			trans	51.2	147	142.2	-53.3	0	0	0	0	128.7
400	A	36.3	Very low	43.7	Very low	102 Å²	102	145.2 Å²	145.2	84%	0.843	82%	0.815	S	S	*	*			trans	-159.3	170.2	176.2	0	0	0	0	0	117.8
401	P	53.5	Low	43.3	Very low	125 Å²	125	144 Å²	144	81%	0.812	82%	0.817	S	S	*	*			trans	-135.3	-177.7	-168.5	43.5	-26.4	0	0	0	120.6
402	L	39.6	Very low	42	Very low	168 Å²	168	148.8 Å²	148.8	88%	0.88	82%	0.821	S	S	*	*			trans	-150.1	163.4	175.3	-73.6	176.5	0	0	0	113.8
403	P	55.2	Low	43	Very low	134 Å²	134	143.4 Å²	143.4	87%	0.87	81%	0.812	S	S	*	*				-160	-158.4	111.2	41.4	-18.8	0	0	0	117.8
404	S	37.3	Very low	41.9	Very low	109 Å²	109	148 Å²	148	76%	0.762	81%	0.813	S	S	*	*			trans	-151.8	178.1	-161.3	63.3	0	0	0	0	120.9
405	T	36.8	Very low	41.9	Very low	114 Å²	114	155 Å²	155	70%	0.699	82%	0.821	S	S	*	*			trans	107.6	148.1	142.4	-11.8	0	0	0	0	125.4
406	F	31.3	Very low	41.8	Very low	194 Å²	194	151.4 Å²	151.4	85%	0.851	82%	0.818	S	S	*	*			trans	101.1	173.9	156.5	-79.2	-71.9	0	0	0	124.8
407	Y	28.6	Very low	41.5	Very low	220 Å²	220	153.3 Å²	153.3	86%	0.863	82%	0.817	S	S	*	*			trans	-137	-171.2	-133.4	-125.6	-21.5	0	0	0	117.7
408	P	66.3	Low	40.9	Very low	103 Å²	103	151.8 Å²	151.8	67%	0.669	81%	0.808	S	S	*	*			trans	-134.1	-170.6	-137	46.4	-24	0	0	0	119.2
409	P	59.2	Low	39.6	Very low	128 Å²	128	154 Å²	154	83%	0.831	81%	0.807	S	S	*	*			trans	-116.2	-163.8	-175.9	42.4	-32.7	0	0	0	118.6
410	H	31.4	Very low	38.9	Very low	182 Å²	182	156.6 Å²	156.6	84%	0.843	81%	0.805	S	S	*	*			trans	-136.4	155.1	-167.8	-79.8	-83.8	0	0	0	115.9
411	Q	25.5	Very low	38.4	Very low	191 Å²	191	162.5 Å²	162.5	89%	0.893	81%	0.807	S	S	*	*				164.7	-177.3	119.5	-84.5	-167	15.8	0	0	116.2
412	Y	25.3	Very low	38.3	Very low	223 Å²	223	160.9 Å²	160.9	88%	0.875	80%	0.797	S	S	*	*			trans	-148	-170.4	-152.1	-101.1	-61.5	0	0	0	112.2
413	P	58.4	Low	37.9	Very low	100 Å²	100	160.5 Å²	160.5	65%	0.649	80%	0.795	S	S	*	*			cis	-140.6	-161.6	-32.1	36.7	-14.2	0	0	0	116.1
414	R	30.2	Very low	37.7	Very low	223 Å²	223	160 Å²	160	84%	0.842	79%	0.791	S	S	*	*			trans	100.3	150.9	158.5	-55.7	-155.4	166.5	177.3	-3.7	119.4
415	Y	32.9	Very low	37.2	Very low	209 Å²	209	158.9 Å²	158.9	82%	0.82	80%	0.797	S	S	*	*			cis	-173.6	165.7	-34.4	-109.1	-56	0	0	0	112.7
416	L	27.9	Very low	36.7	Very low	165 Å²	165	157.7 Å²	157.7	86%	0.864	81%	0.808	S	S	*	*			trans	98.9	162.5	159.4	-69.4	170.4	0	0	0	123.7
417	L	27.8	Very low	36.5	Very low	157 Å²	157	152.1 Å²	152.1	82%	0.822	81%	0.805	S	S	*	*			trans	-152.6	-170.2	-162.6	-114.4	78.6	0	0	0	109.5
418	P	54.9	Low	36.3	Very low	93 Å²	93	148.7 Å²	148.7	60%	0.604	81%	0.807	S	S	*	*			cis	-144.9	-174.9	-42.8	43.2	-24.6	0	0	0	117.7
419	H	31.6	Very low	35.4	Very low	164 Å²	164	149.3 Å²	149.3	76%	0.759	81%	0.81	S	S	*	*			trans	71.2	143.3	148.6	-70.3	-52.2	0	0	0	126.6
420	H	26.7	Very low	33.9	Very low	184 Å²	184	150.2 Å²	150.2	85%	0.852	81%	0.814	S	S	*	*				173	-178.7	123.2	-86.9	-63.2	0	0	0	114.5
421	Y	25.1	Very low	33.8	Very low	226 Å²	226	149 Å²	149	89%	0.886	82%	0.819	S	S	*	*			trans	-162.6	-175.4	-150.9	-114.4	-155.6	0	0	0	113.5
422	P	53.1	Low	33.8	Very low	92 Å²	92	143.5 Å²	143.5	60%	0.597	81%	0.814	S	S	*	*			cis	-146.8	-167.3	-45	44.3	-24.1	0	0	0	117.2
423	L	30.1	Very low	33.7	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	80%	0.801	S	S	*	*			trans	73.6	170.4	154.4	-70.5	169.5	0	0	0	122.3
424	P	51.6	Low	32.2	Very low	122 Å²	122	138.6 Å²	138.6	79%	0.792	81%	0.809	S	S	*	*			cis	-139.6	166.3	-35.6	37	-18.6	0	0	0	118.8
425	G	26.8	Very low	31.9	Very low	87 Å²	87	137.6 Å²	137.6	90%	0.897	81%	0.811	S	S	*	*			trans	159.1	169.8	164.5	0	0	0	0	0	115.3
426	G	26.1	Very low	32.3	Very low	89 Å²	89	132.4 Å²	132.4	92%	0.918	80%	0.803	S	S	*	*			cis	160.8	134.2	-16.3	0	0	0	0	0	116.3
427	G	26.1	Very low	32.1	Very low	77 Å²	77	135.1 Å²	135.1	79%	0.794	80%	0.802	S	S	*	*			trans	120.1	153.3	162.6	0	0	0	0	0	120.1
428	V	26.3	Very low	32	Very low	148 Å²	148	134 Å²	134	90%	0.897	80%	0.796	S	S	*	*			trans	-148.9	-173.7	-175.2	-127.5	0	0	0	0	114.8
429	P	46.8	Very low	30.5	Very low	115 Å²	115	139 Å²	139	75%	0.747	80%	0.804	S	S	*	*				-129.3	-176.6	-127.1	45.5	-26.4	0	0	0	119.4
430	T	28.4	Very low	30.8	Very low	147 Å²	147	135.9 Å²	135.9	90%	0.902	80%	0.798	S	S	*	*			trans	-144.3	178.3	170.4	39	0	0	0	0	114.5
431	V	28.9	Very low	30.7	Very low	158 Å²	158	134 Å²	134	96%	0.958	80%	0.799	S	S	*	*			trans	-130.3	150	-150.9	173.8	0	0	0	0	116.3
432	G	24.1	Very low	30.8	Very low	75 Å²	75	133 Å²	133	77%	0.773	80%	0.795	S	S	*	*			trans	135.1	155.1	161.6	0	0	0	0	0	114.7
433	G	24.3	Very low	29.5	Very low	60 Å²	60	132.3 Å²	132.3	62%	0.619	81%	0.805	S	S	*	*			cis	160.9	149.2	-11	0	0	0	0	0	113.8
434	I	27.1	Very low	29.3	Very low	160 Å²	160	129.6 Å²	129.6	82%	0.821	80%	0.795	S	S	*	*			trans	89.6	146	161.2	-53.1	165.3	0	0	0	119.7
435	F	23.6	Very low	28.2	Very low	201 Å²	201	131.7 Å²	131.7	88%	0.882	80%	0.799	S	S	*	*			trans	-139.4	-171.7	177.1	-91.6	-74.3	0	0	0	107.8
436	P	41.1	Very low	28.2	Very low	100 Å²	100	135 Å²	135	65%	0.649	79%	0.793	S	S	*	*				-131	177.2	-54.7	40.2	-24.8	0	0	0	113.9
437	R	23.1	Very low	29.1	Very low	222 Å²	222	135.9 Å²	135.9	84%	0.838	78%	0.782	S	S	*	*			trans	178.6	146.4	152.2	-98.5	149.7	-175.7	-177.9	1.8	109.1
438	I	25.6	Very low	30.2	Very low	135 Å²	135	137 Å²	137	69%	0.692	78%	0.775	S	S	*	*			cis	88	137.4	23.2	-56.9	174.9	0	0	0	114.8
439	Y	24.6	Very low	30.3	Very low	198 Å²	198	137.5 Å²	137.5	78%	0.776	77%	0.768	S	S	*	*			trans	104.9	157.6	169	-67.9	-64.6	0	0	0	117.7
440	P	37.3	Very low	29.4	Very low	97 Å²	97	139.8 Å²	139.8	63%	0.63	77%	0.773	S	S	*	*			cis	-133	-179.4	-24.7	33.6	-14.8	0	0	0	114.6
441	V	25.1	Very low	29.3	Very low	145 Å²	145	137.4 Å²	137.4	88%	0.879	77%	0.768	S	S	*	*			trans	-120.8	143.1	150.3	174.2	0	0	0	0	107.8
442	Y	27.5	Very low	29.3	Very low	205 Å²	205	137.4 Å²	137.4	80%	0.804	76%	0.762	S	S	*	*			trans	-77.7	148	-173.3	-95.3	-97.7	0	0	0	114.5	T444	Y442-T444 HydrophobicContact CD1-CG2 4.11Å; Y442-T444 HydrophobicContact CE1-CG2 4.47Å
443	G	24.9	Very low	29.5	Very low	77 Å²	77	141.3 Å²	141.3	79%	0.794	76%	0.764	S	S	*	*			trans	-167.4	110.2	164.4	0	0	0	0	0	109.4
444	T	25.9	Very low	30.4	Very low	103 Å²	103	143.5 Å²	143.5	63%	0.632	77%	0.767	S	S	*	*			trans	-115.5	143.9	-169	43.3	0	0	0	0	113	Y442	Y442-T444 HydrophobicContact CD1-CG2 4.11Å; Y442-T444 HydrophobicContact CE1-CG2 4.47Å
445	L	27.9	Very low	30.5	Very low	166 Å²	166	141 Å²	141	87%	0.869	76%	0.764	S	S	*	*			trans	162.4	98.8	151.2	-88.6	161	0	0	0	106.4
446	M	28.2	Very low	30.8	Very low	157 Å²	157	139 Å²	139	77%	0.773	76%	0.763	S	S	*	*				78.5	150.9	66.9	-69	-68.6	171.4	0	0	114.5
447	P	44.7	Very low	30.9	Very low	107 Å²	107	139.4 Å²	139.4	70%	0.695	77%	0.765	S	S	*	*			cis	-129.4	-160.1	-32.1	39.7	-20.9	0	0	0	110.5
448	P	48.7	Very low	31.1	Very low	101 Å²	101	133.4 Å²	133.4	66%	0.656	76%	0.763	S	S	*	*				-150.1	178.2	75	29.8	-4.5	0	0	0	117.7
449	H	28.6	Very low	31.3	Very low	159 Å²	159	131.1 Å²	131.1	74%	0.736	77%	0.765	S	S	*	*			trans	98.8	94	160.8	-59.5	-67.2	0	0	0	122.2
450	L	27.5	Very low	31.6	Very low	163 Å²	163	131.8 Å²	131.8	85%	0.853	77%	0.765	S	S	*	*				67.4	107.9	124.3	-68.1	165.8	0	0	0	122.5
451	A	26.7	Very low	31.2	Very low	96 Å²	96	137.1 Å²	137.1	79%	0.793	77%	0.773	S	S	*	*				-160.2	118.3	125.1	0	0	0	0	0	113.2
452	L	29.2	Very low	31.2	Very low	159 Å²	159	137.1 Å²	137.1	83%	0.832	77%	0.768	S	S	*	*			trans	33.8	105.6	147.8	-57.5	170.3	0	0	0	122.4
453	L	28.7	Very low	31.2	Very low	157 Å²	157	133.5 Å²	133.5	82%	0.822	77%	0.767	S	S	*	*				32.1	157.5	116.5	-70.9	174.8	0	0	0	122.6
454	P	42.1	Very low	31.5	Very low	106 Å²	106	137.3 Å²	137.3	69%	0.688	77%	0.767	S	S	*	*			cis	-137.8	-173.2	6.1	36.5	-14.7	0	0	0	117.5
455	S	28.8	Very low	31.7	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	77%	0.774	S	S	*	*			trans	97	72.3	145.5	-56.9	0	0	0	0	123.5
456	D	31.1	Very low	31.5	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	77%	0.771	S	S	*	*				63.7	179.6	118.6	-126.5	25.6	0	0	0	121.1
457	P	42.3	Very low	32.7	Very low	107 Å²	107	135.7 Å²	135.7	70%	0.695	77%	0.765	S	S	*	*				-137.7	160.9	-114.7	42.2	-22.4	0	0	0	118.2
458	A	28.8	Very low	31.7	Very low	96 Å²	96	137.4 Å²	137.4	79%	0.793	77%	0.773	S	S	*	*			trans	-165.8	133.9	151.4	0	0	0	0	0	114.8
459	A	29.2	Very low	30.8	Very low	88 Å²	88	140.8 Å²	140.8	73%	0.727	78%	0.78	S	S	*	*				25.9	149.7	128.1	0	0	0	0	0	121.9
460	R	30.8	Very low	31	Very low	211 Å²	211	138.7 Å²	138.7	80%	0.796	78%	0.78	S	S	*	*			cis	-177	156.7	-2.8	-113	173.1	179.5	171.3	0.6	109.3
461	R	28.3	Very low	30.8	Very low	209 Å²	209	135.6 Å²	135.6	79%	0.789	77%	0.772	S	S	*	*			trans	65.5	166.9	149.5	-72.5	-178.7	179.9	-152.4	-1.3	117.4
462	L	26.3	Very low	30.8	Very low	146 Å²	146	136.2 Å²	136.2	76%	0.764	77%	0.771	S	S	*	*			cis	-174.5	174	-43.1	-112	-179.8	0	0	0	107
463	V	26.1	Very low	30.7	Very low	129 Å²	129	136.7 Å²	136.7	78%	0.782	77%	0.772	S	S	*	*			trans	84.8	135.2	164.2	-167	0	0	0	0	117.2
464	I	31	Very low	30.5	Very low	157 Å²	157	134.2 Å²	134.2	81%	0.805	77%	0.768	S	S	*	*			trans	-114.2	142.8	175.3	-49.7	163.4	0	0	0	106.4
465	P	30.8	Very low	29.7	Very low	121 Å²	121	132.9 Å²	132.9	79%	0.786	77%	0.766	S	S	*	*				-144.4	140.9	118.4	33.7	-17.6	0	0	0	115.3
466	E	23.3	Very low	29.5	Very low	173 Å²	173	135.8 Å²	135.8	81%	0.808	77%	0.767	S	S	*	*			trans	-90.4	-175.5	152.9	-113.4	-156.7	-174	0	0	108.9
467	P	53.6	Low	29.3	Very low	98 Å²	98	138.8 Å²	138.8	64%	0.636	77%	0.767	S	S	*	*			cis	-134.3	160.4	-40.1	35	-19.8	0	0	0	112.8
468	V	24.4	Very low	28.4	Very low	142 Å²	142	138.9 Å²	138.9	86%	0.861	76%	0.762	S	S	*	*			trans	-144.7	131.5	158.4	-179.5	0	0	0	0	111.7
469	H	29.4	Very low	28.3	Very low	173 Å²	173	143.9 Å²	143.9	80%	0.801	76%	0.761	S	S	*	*			trans	-107	145.2	160.1	-119.9	-58.3	0	0	0	108.3
470	P	32	Very low	28.2	Very low	114 Å²	114	147.4 Å²	147.4	74%	0.74	77%	0.767	S	S	*	*				-138.8	-153.2	113.3	37.8	-24.4	0	0	0	112.4
471	S	24.3	Very low	28.2	Very low	99 Å²	99	145 Å²	145	69%	0.692	77%	0.769	S	S	*	*			trans	-139.5	161.3	-151.6	-55.1	0	0	0	0	115.1
472	S	26.8	Very low	28.3	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	77%	0.769	S	S	*	*			trans	78.5	171.1	148.2	77.8	0	0	0	0	119.6
473	I	26.1	Very low	28.2	Very low	168 Å²	168	137 Å²	137	86%	0.862	77%	0.765	S	S	*	*			trans	73.9	144.7	-175	-52.7	175.3	0	0	0	113.4
474	S	24.6	Very low	28.8	Very low	105 Å²	105	136.3 Å²	136.3	73%	0.734	76%	0.763	S	S	*	*			cis	-176.5	169.6	-35.1	-167.6	0	0	0	0	107.9
475	A	25.9	Very low	28.5	Very low	79 Å²	79	140.1 Å²	140.1	65%	0.653	77%	0.768	S	S	*	*			trans	69	148	155.2	0	0	0	0	0	120.7
476	H	24.7	Very low	28.3	Very low	168 Å²	168	140.1 Å²	140.1	78%	0.778	77%	0.771	S	S	*	*			trans	15.7	143.3	150.9	-61.7	-84.1	0	0	0	120.2
477	R	26.3	Very low	28.3	Very low	223 Å²	223	135.4 Å²	135.4	84%	0.842	76%	0.761	S	S	*	*			cis	-161.3	176.1	47.1	-152.2	170.4	-177.6	-176.1	0.8	114.3
478	D	24.8	Very low	27	Very low	109 Å²	109	140.2 Å²	140.2	58%	0.583	77%	0.772	S	S	*	*			trans	-84.8	-175.4	-170.2	-38.4	-98.5	0	0	0	115.5
479	Y	26.5	Very low	26.9	Very low	200 Å²	200	139 Å²	139	78%	0.784	77%	0.77	S	S	*	*			trans	77.4	143.8	173.7	-49.6	-76.6	0	0	0	115.4
480	L	27.2	Very low	26.7	Very low	162 Å²	162	137 Å²	137	85%	0.848	77%	0.77	S	S	*	*			cis	-128.5	155.3	13.4	-75.2	163.7	0	0	0	113.6
481	L	30.5	Very low	26.3	Very low	160 Å²	160	135.5 Å²	135.5	84%	0.838	77%	0.768	S	S	*	*			trans	-88.8	156.8	158	-85	163.6	0	0	0	109.8
482	P	29.6	Very low	26.3	Very low	121 Å²	121	136.4 Å²	136.4	79%	0.786	77%	0.769	S	S	*	*				-140.1	165.2	99.7	37.4	-24.6	0	0	0	114.9
483	G	24.4	Very low	26.2	Very low	66 Å²	66	138 Å²	138	68%	0.68	77%	0.768	S	S	*	*			trans	-92.4	-143.7	163.5	0	0	0	0	0	111.5
484	P	39	Very low	26.1	Very low	116 Å²	116	139.5 Å²	139.5	75%	0.753	76%	0.763	S	S	*	*			cis	-145	170.5	7.2	44.1	-26	0	0	0	117.9
485	R	24.6	Very low	26.1	Very low	237 Å²	237	139.3 Å²	139.3	89%	0.894	75%	0.754	S	S	*	*			trans	58.2	151.8	138.4	-78.6	175.5	171.1	177.8	-3.2	123.4
486	S	26	Very low	26.1	Very low	121 Å²	121	144.1 Å²	144.1	85%	0.846	76%	0.76	S	S	*	*			trans	83.5	139.1	145.5	-155.7	0	0	0	0	117.9
487	A	23.9	Very low	26.1	Very low	74 Å²	74	141.2 Å²	141.2	61%	0.612	77%	0.765	S	S	*	*			cis	-167.6	158.9	-25.7	0	0	0	0	0	109
488	F	25.9	Very low	26	Very low	199 Å²	199	134 Å²	134	87%	0.873	76%	0.76	S	S	*	*				171.8	141.4	117.7	-104.6	-77.8	0	0	0	111.3
489	S	23.5	Very low	26	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	77%	0.773	S	S	*	*			trans	-147.5	124.4	176.4	-65.9	0	0	0	0	111.9
490	T	24.2	Very low	26	Very low	129 Å²	129	134 Å²	134	79%	0.791	77%	0.773	S	S	*	*			trans	-147.6	126.7	160.3	45	0	0	0	0	106.5
491	A	23.4	Very low	25.9	Very low	84 Å²	84	131 Å²	131	69%	0.694	77%	0.765	S	S	*	*				63.8	130	60.3	0	0	0	0	0	110.9
492	T	25.2	Very low	25.5	Very low	117 Å²	117	128.5 Å²	128.5	72%	0.718	76%	0.761	S	S	*	*			cis	-168	160.8	19.7	-2.9	0	0	0	0	111.7
493	L	23.9	Very low	25.2	Very low	143 Å²	143	133.5 Å²	133.5	75%	0.749	77%	0.766	S	S	*	*			trans	67.4	157	148.6	-66.2	166.6	0	0	0	119
494	R	24.3	Very low	26	Very low	199 Å²	199	136.2 Å²	136.2	75%	0.751	77%	0.772	S	S	*	*			cis	-175.5	144.5	-26.3	-159.7	-159.3	-168.4	137.3	6.5	110.9
495	D	24.6	Very low	25.3	Very low	102 Å²	102	134.3 Å²	134.3	55%	0.545	77%	0.773	S	S	.	*			trans	55.6	160.3	151.6	-80.1	-39.1	0	0	0	119.9
496	K	25.9	Very low	25.7	Very low	179 Å²	179	130.4 Å²	130.4	78%	0.778	77%	0.765	S	S	*	*			cis	-167.9	163.3	-32.3	-129.6	-171.1	-157.8	97.3	0	111.2
497	A	25.1	Very low	26.6	Very low	107 Å²	107	129.7 Å²	129.7	88%	0.884	76%	0.757	S	S	*	*			trans	65.5	147.4	173.1	0	0	0	0	0	116.3
498	G	24.6	Very low	27.1	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	77%	0.767	S	S	*	*			cis	-154.1	-150.2	-0.4	0	0	0	0	0	110.1
499	V	25	Very low	28.5	Very low	141 Å²	141	128.6 Å²	128.6	86%	0.855	76%	0.756	S	S	*	*			cis	-165.1	-173.3	-9.2	115.3	0	0	0	0	110.1
500	H	25.5	Very low	29.2	Very low	169 Å²	169	132.2 Å²	132.2	78%	0.782	76%	0.759	S	S	*	*			trans	-65.7	159.1	-176.1	-61.7	-125.2	0	0	0	115.2
501	S	24.5	Very low	29.3	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	75%	0.754	S	S	*	*			cis	-178.8	157.2	41.8	-155.6	0	0	0	0	115.3
502	S	23.1	Very low	30.9	Very low	108 Å²	108	130 Å²	130	76%	0.755	75%	0.752	S	S	*	*			trans	73.7	136.5	145.1	-59.5	0	0	0	0	126.3
503	Y	22.3	Very low	31.5	Very low	225 Å²	225	125.8 Å²	125.8	88%	0.882	73%	0.729	S	S	*	*			trans	-44.4	-179.2	161.3	-77.6	-78.5	0	0	0	119.5
504	P	41.6	Very low	32.2	Very low	123 Å²	123	123.9 Å²	123.9	80%	0.799	72%	0.716	S	S	*	*			cis	-135.9	-180	-20.5	32.2	-11.8	0	0	0	115.5
505	G	23.4	Very low	33	Very low	76 Å²	76	117.4 Å²	117.4	78%	0.784	71%	0.706	S	S	*	*			trans	157.4	138.7	153.8	0	0	0	0	0	120.7
506	H	33.7	Very low	34.6	Very low	156 Å²	156	118.1 Å²	118.1	72%	0.722	72%	0.715	S	S	*	*			trans	-153	174.1	169.5	-94.5	-61.2	0	0	0	107.1	R232	R232-H506 PolarHBondContact NH2-CD2 2.92Å; R232-H506 PolarHBondContact NH2-NE2 2.77Å
507	P	45.6	Very low	35.2	Very low	106 Å²	106	115 Å²	115	69%	0.688	72%	0.716	S	S	*	*			cis	-143.8	-167.7	15.2	42.3	-19.9	0	0	0	118.2
508	N	34.8	Very low	36	Very low	152 Å²	152	115.2 Å²	115.2	81%	0.813	71%	0.711	S	S	*	*			trans	-43.5	-178.5	157.1	-99.2	-2	0	0	0	117.3
509	P	54.3	Low	36.5	Very low	98 Å²	98	115.7 Å²	115.7	64%	0.636	72%	0.716	S	S	*	*			cis	-166.1	-172.7	40.5	49.4	-26.1	0	0	0	123.7
510	H	38.6	Very low	37	Very low	192 Å²	192	114.9 Å²	114.9	89%	0.889	72%	0.717	S	S	*	*			trans	69.5	164.1	144.1	-65.7	-31.9	0	0	0	125.1
511	G	26.7	Very low	38.6	Very low	67 Å²	67	112.6 Å²	112.6	69%	0.691	72%	0.717	S	S	*	*			cis	-163.8	-167.9	16.2	0	0	0	0	0	121.1
512	P	57.3	Low	39	Very low	101 Å²	101	114.4 Å²	114.4	66%	0.656	72%	0.724	S	S	*	*			trans	-101	-157.1	-156.5	42.7	-38.5	0	0	0	118.1	E281	E281-P512 HydrophobicContact CG-CG 4.39Å; E281-P512 WeakPolarHBondContact OE1-CG 3.35Å
513	A	35.7	Very low	39.4	Very low	28 Å²	28	114.1 Å²	114.1	23%	0.231	73%	0.728	C	S	.	*			cis	-144.1	-141	12.1	0	0	0	0	0	113.7	K151 E281	K151-A513 WeakPolarHBondContact CD-O 3.44Å; K151-A513 PolarHBondContact NZ-O 3.03Å; E281-A513 HydrophobicContact CG-CB 4.1Å
514	H	38.7	Very low	39.6	Very low	102 Å²	102	108.1 Å²	108.1	47%	0.472	73%	0.725	S	S	.	*			cis	-161.1	-167.5	-6.9	-135.5	-39.8	0	0	0	113.1
515	A	41.2	Very low	38.9	Very low	64 Å²	64	110.3 Å²	110.3	53%	0.529	73%	0.728	S	S	.	*			trans	-164.8	0	-177.8	0	0	0	0	0	113.2
516	P	59.8	Low	39.1	Very low	116 Å²	116	111.2 Å²	111.2	75%	0.753	73%	0.729	S	S	*	*				0	-150.9	0	46	-23.2	0	0	0	117.7
517	S	38.7	Very low	40.3	Very low	113 Å²	113	109.4 Å²	109.4	79%	0.79	73%	0.731	S	S	*	*			trans	85.3	164.8	158.9	-108.6	0	0	0	0	123.6
518	S	41.2	Very low	40.5	Very low	112 Å²	112	109.6 Å²	109.6	78%	0.783	73%	0.732	S	S	*	*			cis	174.9	147.2	-37.1	55.7	0	0	0	0	116.6
519	G	35.4	Very low	40.2	Very low	81 Å²	81	107.3 Å²	107.3	84%	0.835	73%	0.728	S	S	*	*			trans	173.2	149.2	166	0	0	0	0	0	121.8
520	S	34.5	Very low	38.9	Very low	125 Å²	125	109.9 Å²	109.9	87%	0.874	73%	0.731	S	S	*	*			trans	-149	0	-173.3	-47.5	0	0	0	0	113.5
521	P	59.7	Low	38.5	Very low	120 Å²	120	107.6 Å²	107.6	78%	0.779	72%	0.721	S	S	*	*				0	-135.6	0	30.1	-1.6	0	0	0	115.9
522	T	33.5	Very low	38.7	Very low	138 Å²	138	110.9 Å²	110.9	85%	0.847	72%	0.72	S	S	*	*			cis	-162.6	-165.5	18.8	-25.4	0	0	0	0	114.3
523	A	31.4	Very low	38.1	Very low	101 Å²	101	111.2 Å²	111.2	84%	0.835	72%	0.722	S	S	*	*			trans	-155.4	162	-168.2	0	0	0	0	0	120.7
524	A	25.3	Very low	37.7	Very low	99 Å²	99	115.1 Å²	115.1	82%	0.818	74%	0.743	S	S	*	*			trans	-179.3	120.8	153	0	0	0	0	0	120.1
525	I	28.2	Very low	37.4	Very low	170 Å²	170	118.8 Å²	118.8	87%	0.872	76%	0.758	S	S	*	*			trans	39.2	118.5	137	-54.2	-179.4	0	0	0	126.8
526	A	27.6	Very low	37.2	Very low	95 Å²	95	121.9 Å²	121.9	79%	0.785	77%	0.772	S	S	*	*			trans	77.3	155.3	138.9	0	0	0	0	0	126.5
527	P	58.5	Low	35.8	Very low	118 Å²	118	122 Å²	122	77%	0.766	77%	0.771	S	S	*	*			trans	-124.1	-166.5	-161.8	47.4	-31.6	0	0	0	115.5
528	P	49.8	Very low	35.4	Very low	110 Å²	110	121.9 Å²	121.9	71%	0.714	77%	0.77	S	S	*	*				-153	179.9	80.5	42.6	-23.2	0	0	0	117.9
529	S	28.3	Very low	34.8	Very low	104 Å²	104	120.7 Å²	120.7	73%	0.727	77%	0.768	S	S	*	*			trans	69	132.8	151.9	-78	0	0	0	0	119.6
530	E	27.4	Very low	34.5	Very low	151 Å²	151	124.9 Å²	124.9	71%	0.706	77%	0.765	S	S	*	*			cis	-161.8	173.4	11.5	-73.8	-122.7	112.2	0	0	110.1
531	Q	30.3	Very low	34.2	Very low	144 Å²	144	126.8 Å²	126.8	67%	0.673	76%	0.762	S	S	*	*			cis	-145.4	-101.6	-7.8	-130.2	-164.9	73.7	0	0	117
532	M	30	Very low	32.4	Very low	137 Å²	137	124.7 Å²	124.7	68%	0.675	76%	0.762	S	S	*	*			trans	-166.7	-175.3	-133.8	-86	-71.3	-170.3	0	0	113.8	T534	M532-T534 HydrophobicContact SD-CG2 4.09Å
533	P	44.3	Very low	32	Very low	107 Å²	107	125.5 Å²	125.5	70%	0.695	76%	0.762	S	S	*	*			cis	-133.3	142.9	-8.8	20	4.7	0	0	0	118.6
534	T	28.8	Very low	31.8	Very low	111 Å²	111	126.1 Å²	126.1	68%	0.681	76%	0.755	S	S	*	*			trans	31	128.8	133.2	67	0	0	0	0	126	M532	M532-T534 HydrophobicContact SD-CG2 4.09Å
535	K	30.7	Very low	31.8	Very low	178 Å²	178	126.9 Å²	126.9	77%	0.774	75%	0.754	S	S	*	*				37.3	148	110.2	-105.6	179.8	-179	-179.4	0	122.2
536	P	38.6	Very low	31.6	Very low	129 Å²	129	126.6 Å²	126.6	84%	0.838	75%	0.749	S	S	*	*				-144.4	-160.8	99.6	40.3	-24.5	0	0	0	116.5
537	T	28.6	Very low	31.4	Very low	119 Å²	119	132.3 Å²	132.3	73%	0.73	75%	0.751	S	S	*	*			trans	-159.9	143.1	-162.8	-55.8	0	0	0	0	114.4
538	S	31.6	Very low	30.1	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	75%	0.754	S	S	*	*			trans	-175.1	141.7	157.6	45.3	0	0	0	0	110
539	A	28.4	Very low	29.8	Very low	88 Å²	88	134.8 Å²	134.8	73%	0.727	75%	0.751	S	S	*	*				85.1	144.9	53.6	0	0	0	0	0	113.3
540	H	29	Very low	29.6	Very low	168 Å²	168	136.7 Å²	136.7	78%	0.778	75%	0.753	S	S	*	*			cis	-165.3	157.3	9.3	-140.6	25.9	0	0	0	114.5
541	M	27.7	Very low	29.8	Very low	166 Å²	166	138.9 Å²	138.9	82%	0.818	76%	0.763	S	S	*	*			trans	52.7	139.6	148	-70.3	-72.6	107.1	0	0	125.1
542	G	22.5	Very low	29.7	Very low	76 Å²	76	141.3 Å²	141.3	78%	0.784	77%	0.774	S	S	*	*			trans	178.2	151.5	166.9	0	0	0	0	0	111.3
543	N	25.7	Very low	29.7	Very low	155 Å²	155	138 Å²	138	83%	0.829	77%	0.768	S	S	*	*			trans	-151	166.5	-165.9	-162.7	15.5	0	0	0	116.3
544	T	25.8	Very low	29	Very low	113 Å²	113	140.9 Å²	140.9	69%	0.693	78%	0.776	S	S	*	*			trans	86.4	129.2	165.5	69.7	0	0	0	0	121.2
545	S	25.1	Very low	29.3	Very low	115 Å²	115	142 Å²	142	80%	0.804	78%	0.778	S	S	*	*			trans	48.9	144.8	141.3	-65.3	0	0	0	0	122.2
546	E	23.8	Very low	29.2	Very low	164 Å²	164	141 Å²	141	77%	0.766	78%	0.781	S	S	*	*			cis	-133.6	-150.7	13	-88.6	-141.7	101.2	0	0	114.2
547	R	23.4	Very low	28.8	Very low	216 Å²	216	140.2 Å²	140.2	82%	0.815	77%	0.773	S	S	*	*			trans	-98	154.3	-146.3	-52	170.8	-169.7	-164.7	-6.3	117.2
548	H	31.4	Very low	29	Very low	181 Å²	181	144.2 Å²	144.2	84%	0.838	78%	0.781	S	S	*	*			trans	-6.7	166.1	139.3	-92.1	-87.1	0	0	0	120.7
549	P	44.3	Very low	28.9	Very low	99 Å²	99	145.7 Å²	145.7	64%	0.643	79%	0.785	S	S	*	*			cis	-124.1	-172.2	5.7	27.8	-2	0	0	0	112.3
550	D	23.8	Very low	29	Very low	144 Å²	144	151 Å²	151	77%	0.77	79%	0.791	S	S	*	*			cis	-151.5	145.4	44.7	-74	-44.8	0	0	0	114.1
551	E	31.1	Very low	29.5	Very low	196 Å²	196	154.4 Å²	154.4	92%	0.916	80%	0.797	S	S	*	*			trans	-176.5	62.9	147.1	-95.5	-108	121.5	0	0	108.6
552	E	29.8	Very low	29.4	Very low	195 Å²	195	150.1 Å²	150.1	91%	0.911	80%	0.796	S	S	*	*			trans	-83.3	108.1	157.4	-76.5	-160.4	124.3	0	0	107.4
553	A	28.3	Very low	30.2	Very low	67 Å²	67	151.9 Å²	151.9	55%	0.554	80%	0.803	S	S	*	*				81.6	136.4	74.5	0	0	0	0	0	114.4
554	I	30.4	Very low	30.4	Very low	168 Å²	168	147.7 Å²	147.7	86%	0.862	80%	0.796	S	S	*	*			trans	-126.8	81.2	150.8	-48	-179.9	0	0	0	108.4
555	N	34.2	Very low	30.5	Very low	136 Å²	136	148.6 Å²	148.6	73%	0.727	81%	0.807	S	S	*	*			trans	-79.5	130.5	162	-93.9	-75.5	0	0	0	109.5
556	L	30.1	Very low	31.4	Very low	157 Å²	157	148.3 Å²	148.3	82%	0.822	81%	0.812	S	S	*	*			trans	-147	121.3	158.6	-76.6	-179.9	0	0	0	111.1
557	T	29.7	Very low	31.6	Very low	112 Å²	112	143.4 Å²	143.4	69%	0.687	81%	0.805	S	S	*	*			cis	-156.6	153.9	-31.4	-3.2	0	0	0	0	108.3
558	K	33.5	Very low	31.9	Very low	203 Å²	203	144 Å²	144	88%	0.883	81%	0.809	S	S	*	*			trans	-93.3	101.4	-179	-179.5	-178.4	-179.6	178.1	0	111.3
559	V	28	Very low	32.1	Very low	141 Å²	141	145 Å²	145	86%	0.855	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.6	133.8	167.9	-178.8	0	0	0	0	109.9
560	K	31.1	Very low	31.8	Very low	198 Å²	198	145 Å²	145	86%	0.861	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-84.1	148.4	-175.6	-168.6	176.2	177.6	-176.7	0	110.6
561	R	39.1	Very low	32.8	Very low	241 Å²	241	143.5 Å²	143.5	91%	0.909	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.8	133.1	-177.6	-61.3	177.2	-172.2	150.2	1.1	112.2
562	G	26.3	Very low	34.1	Very low	76 Å²	76	139.2 Å²	139.2	78%	0.784	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-84.6	157.4	137.2	0	0	0	0	0	109.6
563	A	38.3	Very low	35.6	Very low	113 Å²	113	132.7 Å²	132.7	93%	0.934	77%	0.767	S	S	*	*			trans	-106.7	128	176.1	0	0	0	0	0	110.3
564	G	30.8	Very low	37.5	Very low	67 Å²	67	132.8 Å²	132.8	69%	0.691	76%	0.762	S	S	*	*			trans	145.1	136	176.2	0	0	0	0	0	113
565	S	28.8	Very low	39.6	Very low	131 Å²	131	128.6 Å²	128.6	92%	0.916	74%	0.741	S	S	*	*	S	Bend	trans	63	152.7	-179	76.7	0	0	0	0	116.8
566	A	42.4	Very low	41.3	Very low	110 Å²	110	126.3 Å²	126.3	91%	0.909	72%	0.724	S	S	*	*			trans	-97.6	129.6	176.9	0	0	0	0	0	110.3
567	G	29.7	Very low	43.1	Very low	60 Å²	60	126.9 Å²	126.9	62%	0.619	72%	0.72	S	S	*	*			trans	-138.5	143.7	-178.6	0	0	0	0	0	112.5
568	Y	29.3	Very low	44.3	Very low	229 Å²	229	124.9 Å²	124.9	90%	0.898	70%	0.703	S	S	*	*			trans	-45.6	131.8	174	37.4	-90.2	0	0	0	112.8	A570	Y568-A570 PolarHBondContact O-N 2.96Å
569	K	35.8	Very low	45.3	Very low	203 Å²	203	121.9 Å²	121.9	88%	0.883	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-75.9	124	173	-68.7	-176	179.6	179.8	0	109.9
570	A	37.2	Very low	46.8	Very low	99 Å²	99	117.9 Å²	117.9	82%	0.818	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-61.6	147.8	174.3	0	0	0	0	0	111.9	Y568	Y568-A570 PolarHBondContact O-N 2.96Å
571	L	44.3	Very low	48.4	Very low	112 Å²	112	115.9 Å²	115.9	59%	0.586	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-81.7	148.2	-179.3	-72.3	165.4	0	0	0	111.6	Y573 L575	L571-Y573 PolarHBondContact O-N 3.32Å; L571-Y573 VanDerWaalsContact O-N 3.09Å; L571-L575 HydrophobicContact CD1-CD1 3.69Å; L571-L575 HydrophobicContact CD1-CG 4.42Å
572	P	59.8	Low	50.2	Low	105 Å²	105	109.3 Å²	109.3	68%	0.682	66%	0.657	S	S	*	*	S	Bend	trans	-72.5	-1.2	-174.1	-18.1	32.6	0	0	0	116.1
573	Y	60.8	Low	53	Low	59 Å²	59	108.6 Å²	108.6	23%	0.231	63%	0.633	C	S	.	*	S	Bend	trans	-136.4	138.7	-172.9	-50.6	-72.9	0	0	0	109.7	L571 L596 L599 L603	L571-Y573 PolarHBondContact O-N 3.32Å; L571-Y573 VanDerWaalsContact O-N 3.09Å; Y573-L596 HydrophobicContact CD2-CD1 3.63Å; Y573-L596 HydrophobicContact CE2-CD1 3.75Å; Y573-L599 HydrophobicContact CD1-CD2 3.94Å; Y573-L599 HydrophobicContact CD2-CD2 4.29Å; Y573-L599 HydrophobicContact CG-CD2 3.75Å; Y573-L603 HydrophobicContact CD1-CD1 4.24Å; Y573-L603 HydrophobicContact CE1-CD1 3.54Å
574	P	68.5	Low	55.1	Low	68 Å²	68	106 Å²	106	44%	0.442	60%	0.599	S	S	.	*			trans	-60.1	139.9	178.5	-19.3	30.5	0	0	0	111.6	E585	P574-E585 HydrophobicContact CB-CB 4.25Å; P574-E585 WeakPolarHBondContact O-CB 3.31Å; P574-E585 PolarHBondContact O-N 3.27Å
575	L	74	Confident	57.7	Low	80 Å²	80	103.5 Å²	103.5	42%	0.419	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.5	120.5	176.6	-67.4	-174.3	0	0	0	110.3	L571 I582 K583 Y584	L571-L575 HydrophobicContact CD1-CD1 3.69Å; L571-L575 HydrophobicContact CD1-CG 4.42Å; L575-I582 HydrophobicContact CB-CG2 4.1Å; L575-I582 HydrophobicContact CD1-CG2 3.95Å; L575-I582 HydrophobicContact CD2-CG2 3.92Å; L575-I582 HydrophobicContact CG-CG2 4.22Å; L575-K583 WeakPolarHBondContact CA-O 3.44Å; L575-Y584 HydrophobicContact CD2-CD1 3.45Å; L575-Y584 VanDerWaalsContact CD2-CD1 3.45Å; L575-Y584 HydrophobicContact CD2-CE1 3.73Å; L575-Y584 HydrophobicContact CD2-CG 4.14Å
576	K	70.6	Confident	60.3	Low	88 Å²	88	97.3 Å²	97.3	38%	0.383	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.5	177	-127	-173.6	-162.1	90.4	0	109.8	Q578 K583 E585 T592	K576-Q578 PolarHBondContact O-N 2.8Å; K576-K583 PolarHBondContact N-O 3.46Å; K576-K583 PolarHBondContact O-N 2.92Å; K576-E585 VanDerWaalsContact CD-OE2 3.24Å; K576-E585 WeakPolarHBondContact CD-OE2 3.49Å; K576-E585 WeakPolarHBondContact CE-OE2 3.4Å; K576-E585 WeakPolarHBondContact CG-OE2 3.34Å; K576-E585 IonicContact NZ-OE1 2.67Å; K576-E585 PolarHBondContact NZ-OE1 3.42Å; K576-E585 IonicContact NZ-OE2 2.99Å; K576-E585 PolarHBondContact NZ-OE2 2.86Å; K576-T592 HydrophobicContact CB-CG2 4.31Å; K576-T592 HydrophobicContact CD-CG2 4.03Å
577	K	67.1	Low	62.1	Low	169 Å²	169	97.2 Å²	97.2	74%	0.735	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	101.8	173.6	-170.4	173.9	-176.1	175.6	0	109.3
578	Q	55.8	Low	64.5	Low	70 Å²	70	98.4 Å²	98.4	33%	0.327	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.9	177.2	-73.8	-173.7	-5.3	0	0	109.9	K576 G580 K581 K583	K576-Q578 PolarHBondContact O-N 2.8Å; Q578-G580 VanDerWaalsContact C-N 3.31Å; Q578-G580 PolarHBondContact O-N 2.87Å; Q578-K581 PolarHBondContact N-O 3.18Å; Q578-K581 PolarHBondContact O-N 3.32Å; Q578-K581 VanDerWaalsContact O-N 3.16Å; Q578-K581 VanDerWaalsContact O-O 3.04Å; Q578-K583 HydrophobicContact CB-CD 4.42Å
579	N	52.7	Low	67	Low	140 Å²	140	89.9 Å²	89.9	75%	0.749	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	48.2	177.4	-59.6	-9.9	0	0	0	113.1	K581	N579-K581 PolarHBondContact O-N 2.67Å; N579-K581 VanDerWaalsContact O-N 3.09Å
580	G	60.8	Low	69.2	Low	57 Å²	57	84 Å²	84	59%	0.588	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-36.7	-179.2	0	0	0	0	0	114.5	Q578	Q578-G580 VanDerWaalsContact C-N 3.31Å; Q578-G580 PolarHBondContact O-N 2.87Å
581	K	64.7	Low	71.1	Confident	157 Å²	157	83.6 Å²	83.6	68%	0.683	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	139.5	-179.7	-59.2	-167.6	178.3	-169.7	0	111.4	Q578 N579	Q578-K581 PolarHBondContact N-O 3.18Å; Q578-K581 PolarHBondContact O-N 3.32Å; Q578-K581 VanDerWaalsContact O-N 3.16Å; Q578-K581 VanDerWaalsContact O-O 3.04Å; N579-K581 PolarHBondContact O-N 2.67Å; N579-K581 VanDerWaalsContact O-N 3.09Å
582	I	77.3	Confident	72.9	Confident	102 Å²	102	80.2 Å²	80.2	52%	0.523	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	130.4	176	-65.1	175.7	0	0	0	108.6	L575	L575-I582 HydrophobicContact CB-CG2 4.1Å; L575-I582 HydrophobicContact CD1-CG2 3.95Å; L575-I582 HydrophobicContact CD2-CG2 3.92Å; L575-I582 HydrophobicContact CG-CG2 4.22Å
583	K	83.7	Confident	74	Confident	62 Å²	62	76.1 Å²	76.1	27%	0.27	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.3	172.7	-63.3	-174.1	-177.9	177.3	0	111.2	L575 K576 Q578 F593	L575-K583 WeakPolarHBondContact CA-O 3.44Å; K576-K583 PolarHBondContact N-O 3.46Å; K576-K583 PolarHBondContact O-N 2.92Å; Q578-K583 HydrophobicContact CB-CD 4.42Å; K583-F593 WeakPolarHBondContact CA-O 3.14Å
584	Y	82.7	Confident	74.8	Confident	58 Å²	58	76.1 Å²	76.1	23%	0.227	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	122.3	174.2	-58.8	-87.5	0	0	0	109.8	L575 T592 F593 L596	L575-Y584 HydrophobicContact CD2-CD1 3.45Å; L575-Y584 VanDerWaalsContact CD2-CD1 3.45Å; L575-Y584 HydrophobicContact CD2-CE1 3.73Å; L575-Y584 HydrophobicContact CD2-CG 4.14Å; Y584-T592 CarbonylContact O-C 3.6Å; Y584-T592 WeakPolarHBondContact O-CA 3.49Å; Y584-F593 PolarHBondContact N-O 3Å; Y584-F593 PolarHBondContact O-N 3.11Å; Y584-L596 HydrophobicContact CD1-CB 4.14Å; Y584-L596 HydrophobicContact CD1-CD1 3.92Å; Y584-L596 HydrophobicContact CD2-CB 4.1Å; Y584-L596 HydrophobicContact CE1-CB 3.95Å; Y584-L596 HydrophobicContact CE1-CD1 4.26Å; Y584-L596 HydrophobicContact CE1-CD2 4.37Å; Y584-L596 HydrophobicContact CE1-CG 4.42Å; Y584-L596 HydrophobicContact CE2-CB 3.91Å; Y584-L596 HydrophobicContact CG-CB 4.21Å; Y584-L596 HydrophobicContact CG-CD1 4.34Å
585	E	84.7	Confident	75.4	Confident	15 Å²	15	77.9 Å²	77.9	7%	0.07	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	136.8	-178.5	-172.8	165.3	179.4	0	0	111.6	P574 K576 N587 S590 T592	P574-E585 HydrophobicContact CB-CB 4.25Å; P574-E585 WeakPolarHBondContact O-CB 3.31Å; P574-E585 PolarHBondContact O-N 3.27Å; K576-E585 VanDerWaalsContact CD-OE2 3.24Å; K576-E585 WeakPolarHBondContact CD-OE2 3.49Å; K576-E585 WeakPolarHBondContact CE-OE2 3.4Å; K576-E585 WeakPolarHBondContact CG-OE2 3.34Å; K576-E585 IonicContact NZ-OE1 2.67Å; K576-E585 PolarHBondContact NZ-OE1 3.42Å; K576-E585 IonicContact NZ-OE2 2.99Å; K576-E585 PolarHBondContact NZ-OE2 2.86Å; E585-N587 PolarHBondContact O-N 2.85Å; E585-S590 VanDerWaalsContact OE1-CB 3.23Å; E585-S590 WeakPolarHBondContact OE1-CB 3.24Å; E585-S590 PolarHBondContact OE1-OG 2.92Å; E585-T592 HydrophobicContact CB-CG2 4.23Å; E585-T592 HydrophobicContact CG-CG2 4.14Å
586	C	83.9	Confident	75.8	Confident	0 Å²	0	76 Å²	76	0%	0	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-72.7	121.6	170.7	-177.9	0	0	0	0	110.2	V588 S590 K591 F593 L599 H602	C586-V588 PolarHBondContact O-N 3.1Å; C586-V588 PolarHBondContact SG-N 2.8Å; C586-V588 VanDerWaalsContact SG-N 3.43Å; C586-S590 VanDerWaalsContact O-CA 3.24Å; C586-S590 WeakPolarHBondContact O-CA 3.25Å; C586-S590 PolarHBondContact O-N 3.49Å; C586-K591 PolarHBondContact N-O 3.22Å; C586-F593 HydrophobicContact CB-CE2 4.24Å; C586-L599 HydrophobicContact CB-CD1 3.71Å; C586-H602 PolarHBondContact SG-NE2 3.41Å
587	N	80.1	Confident	76.3	Confident	108 Å²	108	74.4 Å²	74.4	58%	0.578	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.7	176.4	61.1	-36.3	0	0	0	114.3	E585	E585-N587 PolarHBondContact O-N 2.85Å
588	V	80.2	Confident	77	Confident	86 Å²	86	69.9 Å²	69.9	52%	0.521	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-28.1	-178.6	-168.6	0	0	0	0	113	C586 H606	C586-V588 PolarHBondContact O-N 3.1Å; C586-V588 PolarHBondContact SG-N 2.8Å; C586-V588 VanDerWaalsContact SG-N 3.43Å; V588-H606 HydrophobicContact CB-CB 4.47Å; V588-H606 HydrophobicContact CG1-CB 4.31Å; V588-H606 WeakPolarHBondContact CG1-ND1 3.38Å; V588-H606 HydrophobicContact CG2-CB 4.36Å
589	C	81.4	Confident	78.4	Confident	50 Å²	50	66.5 Å²	66.5	34%	0.338	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.5	13.2	-179.1	71.4	0	0	0	0	115.7	K591 H602 H606	C589-K591 PolarHBondContact O-N 2.78Å; C589-H602 VanDerWaalsContact SG-CE1 3.51Å; C589-H602 PolarHBondContact SG-NE2 3.46Å; C589-H606 PolarHBondContact SG-NE2 2.83Å
590	S	82.1	Confident	79.7	Confident	78 Å²	78	65.5 Å²	65.5	55%	0.545	37%	0.365	S	S	.	.			trans	55.5	10.3	179.1	-87.2	0	0	0	0	117.2	E585 C586 T592	E585-S590 VanDerWaalsContact OE1-CB 3.23Å; E585-S590 WeakPolarHBondContact OE1-CB 3.24Å; E585-S590 PolarHBondContact OE1-OG 2.92Å; C586-S590 VanDerWaalsContact O-CA 3.24Å; C586-S590 WeakPolarHBondContact O-CA 3.25Å; C586-S590 PolarHBondContact O-N 3.49Å; S590-T592 PolarHBondContact O-N 2.8Å
591	K	78	Confident	80.7	Confident	92 Å²	92	64.4 Å²	64.4	40%	0.4	35%	0.347	S	S	.	.			trans	-64.2	131.5	171.7	-69	-171.5	-175.4	-168.6	0	110.4	C586 C589 F593 E757	C586-K591 PolarHBondContact N-O 3.22Å; C589-K591 PolarHBondContact O-N 2.78Å; K591-F593 HydrophobicContact CB-CE2 3.73Å; K591-F593 HydrophobicContact CB-CZ 3.74Å; K591-F593 WeakPolarHBondContact O-CD2 3.13Å; K591-F593 VanDerWaalsContact O-CE2 3.28Å; K591-F593 WeakPolarHBondContact O-CE2 3.26Å; K591-E757 IonicContact NZ-OE1 3.3Å; K591-E757 PolarHBondContact NZ-OE1 3.34Å
592	T	81.6	Confident	81.6	Confident	40 Å²	40	58.2 Å²	58.2	25%	0.245	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.7	-175.3	62.4	0	0	0	0	111.8	K576 Y584 E585 S590	K576-T592 HydrophobicContact CB-CG2 4.31Å; K576-T592 HydrophobicContact CD-CG2 4.03Å; Y584-T592 CarbonylContact O-C 3.6Å; Y584-T592 WeakPolarHBondContact O-CA 3.49Å; E585-T592 HydrophobicContact CB-CG2 4.23Å; E585-T592 HydrophobicContact CG-CG2 4.14Å; S590-T592 PolarHBondContact O-N 2.8Å
593	F	82.4	Confident	81.7	Confident	20 Å²	20	54.7 Å²	54.7	9%	0.088	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	140	-177	-58.5	-85	0	0	0	111.2	K583 Y584 C586 K591 Q595 N598 L599 H602	K583-F593 WeakPolarHBondContact CA-O 3.14Å; Y584-F593 PolarHBondContact N-O 3Å; Y584-F593 PolarHBondContact O-N 3.11Å; C586-F593 HydrophobicContact CB-CE2 4.24Å; K591-F593 HydrophobicContact CB-CE2 3.73Å; K591-F593 HydrophobicContact CB-CZ 3.74Å; K591-F593 WeakPolarHBondContact O-CD2 3.13Å; K591-F593 VanDerWaalsContact O-CE2 3.28Å; K591-F593 WeakPolarHBondContact O-CE2 3.26Å; F593-Q595 PolarHBondContact O-N 3.36Å; F593-N598 HydrophobicContact CB-CB 4.19Å; F593-N598 HydrophobicContact CD1-CB 3.93Å; F593-N598 HydrophobicContact CG-CB 4.33Å; F593-L599 HydrophobicContact CB-CB 4.28Å; F593-L599 HydrophobicContact CD2-CB 3.91Å; F593-L599 HydrophobicContact CD2-CD1 3.81Å; F593-L599 HydrophobicContact CD2-CG 4.42Å; F593-L599 HydrophobicContact CE2-CD1 3.96Å; F593-L599 HydrophobicContact CG-CB 4.24Å; F593-H602 HydrophobicContact CE1-CB 3.95Å; F593-H602 HydrophobicContact CE2-CB 4.02Å; F593-H602 AromaticContact CE2-CD2 3.29Å; F593-H602 WeakPolarHBondContact CE2-CD2 3.47Å; F593-H602 AromaticContact CE2-CG 3.68Å; F593-H602 AromaticContact CE2-NE2 3.96Å; F593-H602 HydrophobicContact CZ-CB 3.55Å; F593-H602 AromaticContact CZ-CD2 3.36Å; F593-H602 WeakPolarHBondContact CZ-CD2 3.31Å; F593-H602 AromaticContact CZ-CG 3.25Å; F593-H602 AromaticContact CZ-ND1 3.8Å; F593-H602 AromaticContact CZ-NE2 3.94Å
594	G	79.1	Confident	81.7	Confident	58 Å²	58	54.2 Å²	54.2	60%	0.598	30%	0.299	S	S	*	.	S	Bend	trans	-68.9	-17	174.8	0	0	0	0	0	113.9
595	Q	81.4	Confident	81.6	Confident	105 Å²	105	56.1 Å²	56.1	49%	0.491	32%	0.317	S	S	.	.	S	Bend	trans	-137.8	146.2	179.7	-57.2	-176.1	-2.1	0	0	111.6	F593 S597 N598 L599	F593-Q595 PolarHBondContact O-N 3.36Å; Q595-S597 VanDerWaalsContact C-N 3.29Å; Q595-S597 WeakPolarHBondContact CB-OG 3.4Å; Q595-S597 PolarHBondContact O-N 3.29Å; Q595-S597 PolarHBondContact OE1-OG 2.91Å; Q595-N598 PolarHBondContact O-N 3.47Å; Q595-L599 PolarHBondContact O-N 3.31Å
596	L	81.5	Confident	81.2	Confident	40 Å²	40	59.1 Å²	59.1	21%	0.209	33%	0.331	C	S	.	.	H	α-helix	trans	-68.3	-27.3	177.2	-177.5	59.5	0	0	0	112.9	Y573 Y584 L599 K600	Y573-L596 HydrophobicContact CD2-CD1 3.63Å; Y573-L596 HydrophobicContact CE2-CD1 3.75Å; Y584-L596 HydrophobicContact CD1-CB 4.14Å; Y584-L596 HydrophobicContact CD1-CD1 3.92Å; Y584-L596 HydrophobicContact CD2-CB 4.1Å; Y584-L596 HydrophobicContact CE1-CB 3.95Å; Y584-L596 HydrophobicContact CE1-CD1 4.26Å; Y584-L596 HydrophobicContact CE1-CD2 4.37Å; Y584-L596 HydrophobicContact CE1-CG 4.42Å; Y584-L596 HydrophobicContact CE2-CB 3.91Å; Y584-L596 HydrophobicContact CG-CB 4.21Å; Y584-L596 HydrophobicContact CG-CD1 4.34Å; L596-L599 HydrophobicContact CD1-CB 4.45Å; L596-L599 HydrophobicContact CD1-CD2 4.19Å; L596-L599 PolarHBondContact O-N 3.08Å; L596-K600 WeakPolarHBondContact O-CB 3.37Å; L596-K600 WeakPolarHBondContact O-CG 3.48Å; L596-K600 PolarHBondContact O-N 2.98Å
597	S	81.2	Confident	80.9	Confident	55 Å²	55	62.3 Å²	62.3	39%	0.385	35%	0.353	S	S	.	.	H	α-helix	trans	-53.4	-53.8	168	40	0	0	0	0	110.7	Q595 L599 K600 V601	Q595-S597 VanDerWaalsContact C-N 3.29Å; Q595-S597 WeakPolarHBondContact CB-OG 3.4Å; Q595-S597 PolarHBondContact O-N 3.29Å; Q595-S597 PolarHBondContact OE1-OG 2.91Å; S597-L599 PolarHBondContact O-N 3.43Å; S597-K600 PolarHBondContact O-N 3.35Å; S597-K600 VanDerWaalsContact O-N 3.17Å; S597-V601 WeakPolarHBondContact O-CG2 3.45Å; S597-V601 PolarHBondContact O-N 3.25Å
598	N	82.1	Confident	80.8	Confident	74 Å²	74	59.5 Å²	59.5	40%	0.396	35%	0.349	S	S	.	.	H	α-helix	trans	-65.9	-38.3	-178.7	-64.5	10.6	0	0	0	111.3	F593 Q595 V601 H602	F593-N598 HydrophobicContact CB-CB 4.19Å; F593-N598 HydrophobicContact CD1-CB 3.93Å; F593-N598 HydrophobicContact CG-CB 4.33Å; Q595-N598 PolarHBondContact O-N 3.47Å; N598-V601 PolarHBondContact O-N 3.36Å; N598-H602 VanDerWaalsContact O-CB 3.27Å; N598-H602 WeakPolarHBondContact O-CB 3.35Å; N598-H602 PolarHBondContact O-N 3.14Å
599	L	84.4	Confident	80.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.5	-46.3	170.9	176.8	58.4	0	0	0	111.8	Y573 C586 F593 Q595 L596 S597 V601 H602 L603	Y573-L599 HydrophobicContact CD1-CD2 3.94Å; Y573-L599 HydrophobicContact CD2-CD2 4.29Å; Y573-L599 HydrophobicContact CG-CD2 3.75Å; C586-L599 HydrophobicContact CB-CD1 3.71Å; F593-L599 HydrophobicContact CB-CB 4.28Å; F593-L599 HydrophobicContact CD2-CB 3.91Å; F593-L599 HydrophobicContact CD2-CD1 3.81Å; F593-L599 HydrophobicContact CD2-CG 4.42Å; F593-L599 HydrophobicContact CE2-CD1 3.96Å; F593-L599 HydrophobicContact CG-CB 4.24Å; Q595-L599 PolarHBondContact O-N 3.31Å; L596-L599 HydrophobicContact CD1-CB 4.45Å; L596-L599 HydrophobicContact CD1-CD2 4.19Å; L596-L599 PolarHBondContact O-N 3.08Å; S597-L599 PolarHBondContact O-N 3.43Å; L599-V601 VanDerWaalsContact C-N 3.3Å; L599-V601 PolarHBondContact O-N 2.88Å; L599-H602 CarbonylContact O-C 3.6Å; L599-H602 PolarHBondContact O-N 3.05Å; L599-H602 VanDerWaalsContact O-N 3.16Å; L599-L603 HydrophobicContact CD1-CD1 4.07Å; L599-L603 HydrophobicContact CD1-CD2 4.33Å; L599-L603 HydrophobicContact CD1-CG 3.86Å; L599-L603 HydrophobicContact CG-CD1 3.95Å; L599-L603 HydrophobicContact CG-CG 4.25Å; L599-L603 WeakPolarHBondContact O-CG 3.37Å; L599-L603 PolarHBondContact O-N 3.18Å
600	K	81.3	Confident	80.9	Confident	118 Å²	118	65.3 Å²	65.3	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-30.3	175.9	-77.1	-169.2	173.3	-164.8	0	113.4	L596 S597 R604	L596-K600 WeakPolarHBondContact O-CB 3.37Å; L596-K600 WeakPolarHBondContact O-CG 3.48Å; L596-K600 PolarHBondContact O-N 2.98Å; S597-K600 PolarHBondContact O-N 3.35Å; S597-K600 VanDerWaalsContact O-N 3.17Å; K600-R604 PolarHBondContact O-NE 2.94Å
601	V	81.6	Confident	80.9	Confident	35 Å²	35	64.9 Å²	64.9	21%	0.212	35%	0.354	C	S	.	.	H	α-helix	trans	-70.5	-41.4	171.6	169.3	0	0	0	0	110.8	S597 N598 L599 Q623	S597-V601 WeakPolarHBondContact O-CG2 3.45Å; S597-V601 PolarHBondContact O-N 3.25Å; N598-V601 PolarHBondContact O-N 3.36Å; L599-V601 VanDerWaalsContact C-N 3.3Å; L599-V601 PolarHBondContact O-N 2.88Å; V601-Q623 HydrophobicContact CG1-CG 3.68Å
602	H	82	Confident	81.3	Confident	26 Å²	26	63.5 Å²	63.5	12%	0.12	35%	0.349	C	S	.	.	H	α-helix	trans	-71.2	-38.1	178.8	166.3	67	0	0	0	113.3	C586 C589 F593 N598 L599 R604 V605 H606	C586-H602 PolarHBondContact SG-NE2 3.41Å; C589-H602 VanDerWaalsContact SG-CE1 3.51Å; C589-H602 PolarHBondContact SG-NE2 3.46Å; F593-H602 HydrophobicContact CE1-CB 3.95Å; F593-H602 HydrophobicContact CE2-CB 4.02Å; F593-H602 AromaticContact CE2-CD2 3.29Å; F593-H602 WeakPolarHBondContact CE2-CD2 3.47Å; F593-H602 AromaticContact CE2-CG 3.68Å; F593-H602 AromaticContact CE2-NE2 3.96Å; F593-H602 HydrophobicContact CZ-CB 3.55Å; F593-H602 AromaticContact CZ-CD2 3.36Å; F593-H602 WeakPolarHBondContact CZ-CD2 3.31Å; F593-H602 AromaticContact CZ-CG 3.25Å; F593-H602 AromaticContact CZ-ND1 3.8Å; F593-H602 AromaticContact CZ-NE2 3.94Å; N598-H602 VanDerWaalsContact O-CB 3.27Å; N598-H602 WeakPolarHBondContact O-CB 3.35Å; N598-H602 PolarHBondContact O-N 3.14Å; L599-H602 CarbonylContact O-C 3.6Å; L599-H602 PolarHBondContact O-N 3.05Å; L599-H602 VanDerWaalsContact O-N 3.16Å; H602-R604 PolarHBondContact O-N 3.45Å; H602-R604 VanDerWaalsContact O-N 3.16Å; H602-V605 WeakPolarHBondContact O-CA 3.35Å; H602-V605 WeakPolarHBondContact O-CB 3.36Å; H602-V605 WeakPolarHBondContact O-CG2 3.47Å; H602-V605 PolarHBondContact O-N 3.17Å; H602-H606 AromaticContact CE1-CD2 3.89Å; H602-H606 AromaticContact CE1-NE2 3.41Å; H602-H606 PolarHBondContact CE1-NE2 3.5Å; H602-H606 AromaticContact NE2-CD2 3.67Å; H602-H606 AromaticContact NE2-NE2 3.32Å; H602-H606 PolarHBondContact NE2-NE2 3.24Å
603	L	80.4	Confident	81.5	Confident	29 Å²	29	68.5 Å²	68.5	15%	0.152	37%	0.367	C	S	.	.	H	α-helix	trans	-59.4	-27.6	177.2	-75.5	168.5	0	0	0	112.6	Y573 L599 V605 H606 S607	Y573-L603 HydrophobicContact CD1-CD1 4.24Å; Y573-L603 HydrophobicContact CE1-CD1 3.54Å; L599-L603 HydrophobicContact CD1-CD1 4.07Å; L599-L603 HydrophobicContact CD1-CD2 4.33Å; L599-L603 HydrophobicContact CD1-CG 3.86Å; L599-L603 HydrophobicContact CG-CD1 3.95Å; L599-L603 HydrophobicContact CG-CG 4.25Å; L599-L603 WeakPolarHBondContact O-CG 3.37Å; L599-L603 PolarHBondContact O-N 3.18Å; L603-V605 PolarHBondContact O-N 3.45Å; L603-H606 WeakPolarHBondContact O-CA 3.41Å; L603-H606 WeakPolarHBondContact O-CB 3.34Å; L603-H606 PolarHBondContact O-N 3.26Å; L603-S607 PolarHBondContact O-N 3.03Å; L603-S607 PolarHBondContact O-OG 2.83Å
604	R	83.9	Confident	81.7	Confident	51 Å²	51	67.7 Å²	67.7	19%	0.192	36%	0.363	C	S	.	.	H	α-helix	trans	-67.7	-12.8	172.4	-68.5	-177.7	-88.1	179.6	-7.2	114.3	K600 H602 G608 E609 T622	K600-R604 PolarHBondContact O-NE 2.94Å; H602-R604 PolarHBondContact O-N 3.45Å; H602-R604 VanDerWaalsContact O-N 3.16Å; R604-G608 CarbonylContact O-C 3.17Å; R604-G608 WeakPolarHBondContact O-CA 3.15Å; R604-G608 PolarHBondContact O-N 3.39Å; R604-E609 HydrophobicContact CB-CB 4.05Å; R604-E609 HydrophobicContact CG-CB 3.8Å; R604-E609 PolarHBondContact O-N 3.35Å; R604-T622 HydrophobicContact CB-CG2 4.21Å; R604-T622 PolarHBondContact NH1-O 3.32Å
605	V	79.4	Confident	81.9	Confident	98 Å²	98	73.7 Å²	73.7	59%	0.594	38%	0.376	S	S	*	.	H	α-helix	trans	-74.9	-30.9	166.4	-174.4	0	0	0	0	110.8	H602 L603	H602-V605 WeakPolarHBondContact O-CA 3.35Å; H602-V605 WeakPolarHBondContact O-CB 3.36Å; H602-V605 WeakPolarHBondContact O-CG2 3.47Å; H602-V605 PolarHBondContact O-N 3.17Å; L603-V605 PolarHBondContact O-N 3.45Å
606	H	77.3	Confident	81.9	Confident	79 Å²	79	72.9 Å²	72.9	37%	0.366	38%	0.378	S	S	.	.	H	α-helix	trans	-86.9	-38.3	178.9	-67.8	-67.1	0	0	0	113.2	V588 C589 H602 L603 G608	V588-H606 HydrophobicContact CB-CB 4.47Å; V588-H606 HydrophobicContact CG1-CB 4.31Å; V588-H606 WeakPolarHBondContact CG1-ND1 3.38Å; V588-H606 HydrophobicContact CG2-CB 4.36Å; C589-H606 PolarHBondContact SG-NE2 2.83Å; H602-H606 AromaticContact CE1-CD2 3.89Å; H602-H606 AromaticContact CE1-NE2 3.41Å; H602-H606 PolarHBondContact CE1-NE2 3.5Å; H602-H606 AromaticContact NE2-CD2 3.67Å; H602-H606 AromaticContact NE2-NE2 3.32Å; H602-H606 PolarHBondContact NE2-NE2 3.24Å; L603-H606 WeakPolarHBondContact O-CA 3.41Å; L603-H606 WeakPolarHBondContact O-CB 3.34Å; L603-H606 PolarHBondContact O-N 3.26Å; H606-G608 VanDerWaalsContact C-N 3.31Å
607	S	77.9	Confident	82	Confident	67 Å²	67	73.6 Å²	73.6	47%	0.469	39%	0.386	S	S	.	.	S	Bend	trans	-81.1	-8.4	172.9	63.2	0	0	0	0	114	L603 E609	L603-S607 PolarHBondContact O-N 3.03Å; L603-S607 PolarHBondContact O-OG 2.83Å; S607-E609 VanDerWaalsContact CB-OE1 3.3Å; S607-E609 WeakPolarHBondContact CB-OE1 3.39Å; S607-E609 PolarHBondContact O-N 3.38Å; S607-E609 VanDerWaalsContact O-N 3.17Å; S607-E609 VanDerWaalsContact OG-CD 3.23Å; S607-E609 WeakPolarHBondContact OG-CG 3.28Å; S607-E609 PolarHBondContact OG-OE1 3.07Å
608	G	77.4	Confident	82.1	Confident	48 Å²	48	75.7 Å²	75.7	50%	0.495	40%	0.401	S	S	.	.			trans	71.2	0.2	-176.8	0	0	0	0	0	114.9	R604 H606 R610	R604-G608 CarbonylContact O-C 3.17Å; R604-G608 WeakPolarHBondContact O-CA 3.15Å; R604-G608 PolarHBondContact O-N 3.39Å; H606-G608 VanDerWaalsContact C-N 3.31Å; G608-R610 PolarHBondContact O-N 3.14Å
609	E	79.6	Confident	82	Confident	104 Å²	104	76.5 Å²	76.5	49%	0.486	40%	0.401	S	S	.	.			trans	-55.2	123	-179	-81.7	167.5	-116	0	0	112.7	R604 S607	R604-E609 HydrophobicContact CB-CB 4.05Å; R604-E609 HydrophobicContact CG-CB 3.8Å; R604-E609 PolarHBondContact O-N 3.35Å; S607-E609 VanDerWaalsContact CB-OE1 3.3Å; S607-E609 WeakPolarHBondContact CB-OE1 3.39Å; S607-E609 PolarHBondContact O-N 3.38Å; S607-E609 VanDerWaalsContact O-N 3.17Å; S607-E609 VanDerWaalsContact OG-CD 3.23Å; S607-E609 WeakPolarHBondContact OG-CG 3.28Å; S607-E609 PolarHBondContact OG-OE1 3.07Å
610	R	83.9	Confident	81.8	Confident	154 Å²	154	77.2 Å²	77.2	58%	0.581	41%	0.408	S	S	*	.			trans	-127	76.8	178.2	-77.3	164.3	164	172	-4.5	110.3	G608 F612 G620 F621 T622	G608-R610 PolarHBondContact O-N 3.14Å; R610-F612 VanDerWaalsContact C-N 3.29Å; R610-F612 PolarHBondContact O-N 3.38Å; R610-G620 VanDerWaalsContact CD-O 3.25Å; R610-G620 WeakPolarHBondContact CD-O 3.15Å; R610-G620 PolarHBondContact NE-O 3.08Å; R610-F621 CarbonylContact C-O 3.6Å; R610-F621 WeakPolarHBondContact CA-O 3.22Å; R610-T622 HydrophobicContact CG-CG2 4.4Å
611	P	82.6	Confident	81.8	Confident	69 Å²	69	73.2 Å²	73.2	45%	0.448	39%	0.391	S	S	.	.			trans	-65.5	-31.2	-174.4	-22.1	35	0	0	0	113.3	K613	P611-K613 PolarHBondContact O-N 3.33Å
612	F	86.1	Confident	81.7	Confident	64 Å²	64	72.9 Å²	72.9	28%	0.281	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	92.2	-174.1	-53.4	-75.8	0	0	0	109.9	R610 F621 L624 L627	R610-F612 VanDerWaalsContact C-N 3.29Å; R610-F612 PolarHBondContact O-N 3.38Å; F612-F621 HydrophobicContact CB-CB 4.35Å; F612-F621 PolarHBondContact N-O 3.19Å; F612-F621 PolarHBondContact O-N 2.95Å; F612-L624 HydrophobicContact CD1-CB 3.87Å; F612-L624 HydrophobicContact CD1-CD1 3.95Å; F612-L624 HydrophobicContact CD1-CG 4.46Å; F612-L624 HydrophobicContact CE1-CB 3.8Å; F612-L624 HydrophobicContact CE1-CD1 4.41Å; F612-L624 HydrophobicContact CG-CB 4.29Å; F612-L624 HydrophobicContact CZ-CB 4.14Å; F612-L627 HydrophobicContact CB-CB 4.19Å; F612-L627 HydrophobicContact CB-CD2 3.89Å
613	K	86.5	Confident	81.7	Confident	145 Å²	145	74.9 Å²	74.9	63%	0.63	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	137.3	178.9	-62.3	178.4	-176.6	175.6	0	111.1	P611	P611-K613 PolarHBondContact O-N 3.33Å
614	C	85.8	Confident	81.8	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.014	41%	0.412	C	S	.	.			trans	-72	128	170.2	-177.1	0	0	0	0	110.5	T616 S618 K619 F621 L627 Y631	C614-T616 VanDerWaalsContact C-N 3.26Å; C614-T616 PolarHBondContact O-N 3.13Å; C614-T616 PolarHBondContact SG-N 3.18Å; C614-T616 VanDerWaalsContact SG-N 3.43Å; C614-S618 WeakPolarHBondContact O-CA 3.44Å; C614-S618 PolarHBondContact O-N 2.74Å; C614-K619 PolarHBondContact N-O 3.28Å; C614-F621 HydrophobicContact CB-CE2 4.41Å; C614-L627 VanDerWaalsContact CA-CD1 3.48Å; C614-L627 HydrophobicContact CB-CD1 3.56Å; C614-Y631 WeakPolarHBondContact SG-CE1 3.23Å
615	Q	83.1	Confident	81.5	Confident	184 Å²	184	77 Å²	77	86%	0.86	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-24.3	177.5	-67.1	177.9	-8.5	0	0	112.4	Y631	Q615-Y631 PolarHBondContact N-OH 3.41Å
616	T	82.3	Confident	81.5	Confident	89 Å²	89	75.6 Å²	75.6	55%	0.546	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-28.6	-176.4	-40.6	0	0	0	0	113.7	C614 H634	C614-T616 VanDerWaalsContact C-N 3.26Å; C614-T616 PolarHBondContact O-N 3.13Å; C614-T616 PolarHBondContact SG-N 3.18Å; C614-T616 VanDerWaalsContact SG-N 3.43Å; T616-H634 HydrophobicContact CG2-CB 4.16Å
617	C	83.4	Confident	81.8	Confident	55 Å²	55	72.3 Å²	72.3	37%	0.372	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	5.3	-176.6	72.7	0	0	0	0	115.3	K619 H630 H634	C617-K619 PolarHBondContact O-N 3.16Å; C617-K619 VanDerWaalsContact SG-CB 3.57Å; C617-H630 PolarHBondContact SG-NE2 2.77Å; C617-H634 PolarHBondContact SG-NE2 3.27Å
618	S	82.8	Confident	81.9	Confident	98 Å²	98	74.7 Å²	74.7	69%	0.685	39%	0.394	S	S	*	.			trans	59.9	-0.4	-177.1	-58.9	0	0	0	0	116.6	C614 G620	C614-S618 WeakPolarHBondContact O-CA 3.44Å; C614-S618 PolarHBondContact O-N 2.74Å; S618-G620 PolarHBondContact O-N 3.45Å
619	K	80.5	Confident	81.8	Confident	91 Å²	91	78.7 Å²	78.7	40%	0.396	40%	0.398	S	S	.	.			trans	-60.5	127.1	176.8	-163.8	167.1	-176.4	173.8	0	109.3	C614 C617 F621 E748	C614-K619 PolarHBondContact N-O 3.28Å; C617-K619 PolarHBondContact O-N 3.16Å; C617-K619 VanDerWaalsContact SG-CB 3.57Å; K619-F621 HydrophobicContact CB-CE2 4.08Å; K619-F621 HydrophobicContact CB-CZ 4.26Å; K619-F621 HydrophobicContact CD-CZ 4.19Å; K619-F621 HydrophobicContact CG-CE2 4.2Å; K619-F621 HydrophobicContact CG-CZ 3.98Å; K619-F621 WeakPolarHBondContact O-CD2 3.33Å; K619-F621 WeakPolarHBondContact O-CE2 3.37Å; K619-E748 IonicContact NZ-OE1 2.76Å; K619-E748 PolarHBondContact NZ-OE1 3.14Å; K619-E748 IonicContact NZ-OE2 2.64Å; K619-E748 PolarHBondContact NZ-OE2 2.72Å
620	G	80.1	Confident	81.8	Confident	15 Å²	15	75.2 Å²	75.2	16%	0.155	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.7	-175.1	0	0	0	0	0	113	R610 S618	R610-G620 VanDerWaalsContact CD-O 3.25Å; R610-G620 WeakPolarHBondContact CD-O 3.15Å; R610-G620 PolarHBondContact NE-O 3.08Å; S618-G620 PolarHBondContact O-N 3.45Å
621	F	81.9	Confident	81.6	Confident	34 Å²	34	71.1 Å²	71.1	15%	0.149	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	148.7	-177.6	-60.2	-89.7	0	0	0	111.6	R610 F612 C614 K619 Q623 H626 L627 H630	R610-F621 CarbonylContact C-O 3.6Å; R610-F621 WeakPolarHBondContact CA-O 3.22Å; F612-F621 HydrophobicContact CB-CB 4.35Å; F612-F621 PolarHBondContact N-O 3.19Å; F612-F621 PolarHBondContact O-N 2.95Å; C614-F621 HydrophobicContact CB-CE2 4.41Å; K619-F621 HydrophobicContact CB-CE2 4.08Å; K619-F621 HydrophobicContact CB-CZ 4.26Å; K619-F621 HydrophobicContact CD-CZ 4.19Å; K619-F621 HydrophobicContact CG-CE2 4.2Å; K619-F621 HydrophobicContact CG-CZ 3.98Å; K619-F621 WeakPolarHBondContact O-CD2 3.33Å; K619-F621 WeakPolarHBondContact O-CE2 3.37Å; F621-Q623 VanDerWaalsContact C-N 3.33Å; F621-H626 HydrophobicContact CB-CB 4.33Å; F621-H626 HydrophobicContact CD1-CB 3.91Å; F621-H626 HydrophobicContact CG-CB 4.4Å; F621-L627 HydrophobicContact CB-CB 4.35Å; F621-L627 HydrophobicContact CD2-CB 4Å; F621-L627 HydrophobicContact CD2-CD1 3.9Å; F621-L627 HydrophobicContact CE2-CD1 4.06Å; F621-L627 HydrophobicContact CG-CB 4.29Å; F621-H630 HydrophobicContact CE1-CB 4.11Å; F621-H630 HydrophobicContact CE2-CB 4.1Å; F621-H630 AromaticContact CE2-CD2 3.28Å; F621-H630 WeakPolarHBondContact CE2-CD2 3.43Å; F621-H630 AromaticContact CE2-CG 3.79Å; F621-H630 AromaticContact CE2-NE2 3.95Å; F621-H630 HydrophobicContact CZ-CB 3.63Å; F621-H630 AromaticContact CZ-CD2 3.28Å; F621-H630 WeakPolarHBondContact CZ-CD2 3.41Å; F621-H630 AromaticContact CZ-CG 3.33Å; F621-H630 AromaticContact CZ-ND1 3.95Å; F621-H630 AromaticContact CZ-NE2 3.83Å
622	T	79.7	Confident	81.4	Confident	29 Å²	29	69.8 Å²	69.8	18%	0.178	36%	0.356	C	S	.	.	S	Bend	trans	-78.5	-15.8	176.8	52.1	0	0	0	0	113.1	R604 R610	R604-T622 HydrophobicContact CB-CG2 4.21Å; R604-T622 PolarHBondContact NH1-O 3.32Å; R610-T622 HydrophobicContact CG-CG2 4.4Å
623	Q	81.4	Confident	81.1	Confident	67 Å²	67	71.6 Å²	71.6	31%	0.313	37%	0.372	S	S	.	.	S	Bend	trans	-140.7	145.3	-178.1	-56	179.5	24.9	0	0	111.6	V601 F621 H626 L627	V601-Q623 HydrophobicContact CG1-CG 3.68Å; F621-Q623 VanDerWaalsContact C-N 3.33Å; Q623-H626 VanDerWaalsContact CD-CE1 3.44Å; Q623-H626 PolarHBondContact NE2-CE1 3.1Å; Q623-H626 PolarHBondContact O-N 3.34Å; Q623-H626 PolarHBondContact OE1-CE1 2.91Å; Q623-L627 PolarHBondContact O-N 3.35Å
624	L	81.2	Confident	80.6	Confident	84 Å²	84	68.2 Å²	68.2	44%	0.44	36%	0.358	S	S	.	.	H	α-helix	trans	-63.7	-40.4	178	-177.2	59.1	0	0	0	112.8	F612 H626 L627 Q628	F612-L624 HydrophobicContact CD1-CB 3.87Å; F612-L624 HydrophobicContact CD1-CD1 3.95Å; F612-L624 HydrophobicContact CD1-CG 4.46Å; F612-L624 HydrophobicContact CE1-CB 3.8Å; F612-L624 HydrophobicContact CE1-CD1 4.41Å; F612-L624 HydrophobicContact CG-CB 4.29Å; F612-L624 HydrophobicContact CZ-CB 4.14Å; L624-H626 PolarHBondContact O-N 3.2Å; L624-L627 HydrophobicContact CD1-CD2 4.35Å; L624-L627 CarbonylContact O-C 2.78Å; L624-L627 WeakPolarHBondContact O-CA 3.23Å; L624-L627 WeakPolarHBondContact O-CB 3.39Å; L624-L627 PolarHBondContact O-N 3.43Å; L624-Q628 HydrophobicContact CG-CG 4.49Å; L624-Q628 PolarHBondContact O-N 3.43Å
625	A	78	Confident	80.1	Confident	41 Å²	41	72 Å²	72	34%	0.339	38%	0.381	S	S	.	.	H	α-helix	trans	-62.3	-28.4	178.6	0	0	0	0	0	113.2	K629	A625-K629 WeakPolarHBondContact O-CB 3.17Å; A625-K629 VanDerWaalsContact O-CG 3.3Å; A625-K629 WeakPolarHBondContact O-CG 3.46Å; A625-K629 PolarHBondContact O-N 2.92Å; A625-K629 VanDerWaalsContact O-N 3.13Å
626	H	79.5	Confident	79.8	Confident	68 Å²	68	65.4 Å²	65.4	32%	0.315	36%	0.362	S	S	.	.	H	α-helix	trans	-74.3	-37.4	172.5	-64.8	151.2	0	0	0	111.9	F621 Q623 L624 H630	F621-H626 HydrophobicContact CB-CB 4.33Å; F621-H626 HydrophobicContact CD1-CB 3.91Å; F621-H626 HydrophobicContact CG-CB 4.4Å; Q623-H626 VanDerWaalsContact CD-CE1 3.44Å; Q623-H626 PolarHBondContact NE2-CE1 3.1Å; Q623-H626 PolarHBondContact O-N 3.34Å; Q623-H626 PolarHBondContact OE1-CE1 2.91Å; L624-H626 PolarHBondContact O-N 3.2Å; H626-H630 VanDerWaalsContact O-CB 3.26Å; H626-H630 WeakPolarHBondContact O-CB 3.43Å; H626-H630 PolarHBondContact O-N 2.98Å
627	L	83.6	Confident	79.4	Confident	11 Å²	11	66.3 Å²	66.3	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-64.8	-43	172.5	173.3	58.7	0	0	0	111.8	F612 C614 F621 Q623 L624 H630 Y631	F612-L627 HydrophobicContact CB-CB 4.19Å; F612-L627 HydrophobicContact CB-CD2 3.89Å; C614-L627 VanDerWaalsContact CA-CD1 3.48Å; C614-L627 HydrophobicContact CB-CD1 3.56Å; F621-L627 HydrophobicContact CB-CB 4.35Å; F621-L627 HydrophobicContact CD2-CB 4Å; F621-L627 HydrophobicContact CD2-CD1 3.9Å; F621-L627 HydrophobicContact CE2-CD1 4.06Å; F621-L627 HydrophobicContact CG-CB 4.29Å; Q623-L627 PolarHBondContact O-N 3.35Å; L624-L627 HydrophobicContact CD1-CD2 4.35Å; L624-L627 CarbonylContact O-C 2.78Å; L624-L627 WeakPolarHBondContact O-CA 3.23Å; L624-L627 WeakPolarHBondContact O-CB 3.39Å; L624-L627 PolarHBondContact O-N 3.43Å; L627-H630 CarbonylContact O-C 2.89Å; L627-H630 WeakPolarHBondContact O-CB 3.26Å; L627-H630 PolarHBondContact O-N 3.13Å; L627-H630 VanDerWaalsContact O-N 3.13Å; L627-Y631 HydrophobicContact CD1-CD2 3.97Å; L627-Y631 HydrophobicContact CD1-CE2 3.55Å; L627-Y631 HydrophobicContact CD2-CE2 4Å; L627-Y631 HydrophobicContact CG-CD2 3.99Å; L627-Y631 HydrophobicContact CG-CE2 3.56Å; L627-Y631 WeakPolarHBondContact O-CD2 3.45Å; L627-Y631 PolarHBondContact O-N 3.28Å
628	Q	80.1	Confident	79.2	Confident	116 Å²	116	68.9 Å²	68.9	54%	0.542	37%	0.365	S	S	.	.	H	α-helix	trans	-61.1	-48.2	175.9	-72.6	170.8	-44.3	0	0	112	L624 H630 Y631	L624-Q628 HydrophobicContact CG-CG 4.49Å; L624-Q628 PolarHBondContact O-N 3.43Å; Q628-H630 PolarHBondContact O-N 3.43Å; Q628-Y631 PolarHBondContact O-N 3.04Å
629	K	76	Confident	79	Confident	133 Å²	133	67.7 Å²	67.7	58%	0.578	36%	0.356	S	S	*	.	H	α-helix	trans	-61.3	-28.5	173.7	-72.2	171.1	-177.1	175.2	0	112.9	A625	A625-K629 WeakPolarHBondContact O-CB 3.17Å; A625-K629 VanDerWaalsContact O-CG 3.3Å; A625-K629 WeakPolarHBondContact O-CG 3.46Å; A625-K629 PolarHBondContact O-N 2.92Å; A625-K629 VanDerWaalsContact O-N 3.13Å
630	H	79.8	Confident	79	Confident	31 Å²	31	66 Å²	66	14%	0.144	35%	0.349	C	S	.	.	H	α-helix	trans	-77.5	-32.8	175.7	174.6	58.3	0	0	0	113.2	C617 F621 H626 L627 Q628 L632 V633 H634	C617-H630 PolarHBondContact SG-NE2 2.77Å; F621-H630 HydrophobicContact CE1-CB 4.11Å; F621-H630 HydrophobicContact CE2-CB 4.1Å; F621-H630 AromaticContact CE2-CD2 3.28Å; F621-H630 WeakPolarHBondContact CE2-CD2 3.43Å; F621-H630 AromaticContact CE2-CG 3.79Å; F621-H630 AromaticContact CE2-NE2 3.95Å; F621-H630 HydrophobicContact CZ-CB 3.63Å; F621-H630 AromaticContact CZ-CD2 3.28Å; F621-H630 WeakPolarHBondContact CZ-CD2 3.41Å; F621-H630 AromaticContact CZ-CG 3.33Å; F621-H630 AromaticContact CZ-ND1 3.95Å; F621-H630 AromaticContact CZ-NE2 3.83Å; H626-H630 VanDerWaalsContact O-CB 3.26Å; H626-H630 WeakPolarHBondContact O-CB 3.43Å; H626-H630 PolarHBondContact O-N 2.98Å; L627-H630 CarbonylContact O-C 2.89Å; L627-H630 WeakPolarHBondContact O-CB 3.26Å; L627-H630 PolarHBondContact O-N 3.13Å; L627-H630 VanDerWaalsContact O-N 3.13Å; Q628-H630 PolarHBondContact O-N 3.43Å; H630-L632 PolarHBondContact O-N 3.18Å; H630-V633 WeakPolarHBondContact O-CB 3.39Å; H630-V633 WeakPolarHBondContact O-CG2 3.3Å; H630-V633 PolarHBondContact O-N 2.99Å; H630-H634 AromaticContact CE1-NE2 3.69Å; H630-H634 AromaticContact NE2-CD2 3.96Å; H630-H634 AromaticContact NE2-NE2 3.43Å; H630-H634 PolarHBondContact NE2-NE2 2.82Å
631	Y	79.5	Confident	79.3	Confident	67 Å²	67	68 Å²	68	26%	0.263	35%	0.354	S	S	.	.	H	α-helix	trans	-59.7	-30.1	173.8	-81.7	-60.1	0	0	0	112.8	C614 Q615 L627 Q628 V633 H634 T635	C614-Y631 WeakPolarHBondContact SG-CE1 3.23Å; Q615-Y631 PolarHBondContact N-OH 3.41Å; L627-Y631 HydrophobicContact CD1-CD2 3.97Å; L627-Y631 HydrophobicContact CD1-CE2 3.55Å; L627-Y631 HydrophobicContact CD2-CE2 4Å; L627-Y631 HydrophobicContact CG-CD2 3.99Å; L627-Y631 HydrophobicContact CG-CE2 3.56Å; L627-Y631 WeakPolarHBondContact O-CD2 3.45Å; L627-Y631 PolarHBondContact O-N 3.28Å; Q628-Y631 PolarHBondContact O-N 3.04Å; Y631-V633 PolarHBondContact O-N 2.89Å; Y631-V633 VanDerWaalsContact O-N 3.14Å; Y631-H634 WeakPolarHBondContact O-CA 3.48Å; Y631-H634 WeakPolarHBondContact O-CB 3.5Å; Y631-H634 PolarHBondContact O-N 3.22Å; Y631-T635 PolarHBondContact O-N 2.97Å; Y631-T635 PolarHBondContact O-OG1 3.47Å
632	L	78.4	Confident	79.4	Confident	41 Å²	41	66.4 Å²	66.4	22%	0.215	35%	0.347	C	S	.	.	H	α-helix	trans	-59.5	-21.5	171.4	-58.2	176.4	0	0	0	113.6	H630 T635 G636 E637	H630-L632 PolarHBondContact O-N 3.18Å; L632-T635 WeakPolarHBondContact CA-OG1 3.48Å; L632-G636 CarbonylContact O-C 3.55Å; L632-G636 WeakPolarHBondContact O-CA 3.41Å; L632-G636 PolarHBondContact O-N 3.29Å; L632-G636 VanDerWaalsContact O-N 3.08Å; L632-E637 HydrophobicContact CD2-CB 3.9Å; L632-E637 PolarHBondContact O-N 2.81Å
633	V	78.6	Confident	79.7	Confident	102 Å²	102	72.4 Å²	72.4	62%	0.618	37%	0.373	S	S	*	.	H	α-helix	trans	-75.4	-28.5	173.2	-172.8	0	0	0	0	111.2	H630 Y631	H630-V633 WeakPolarHBondContact O-CB 3.39Å; H630-V633 WeakPolarHBondContact O-CG2 3.3Å; H630-V633 PolarHBondContact O-N 2.99Å; Y631-V633 PolarHBondContact O-N 2.89Å; Y631-V633 VanDerWaalsContact O-N 3.14Å
634	H	76.6	Confident	79.8	Confident	75 Å²	75	73.6 Å²	73.6	35%	0.347	39%	0.385	S	S	.	.	H	α-helix	trans	-87.2	-39.5	178.3	-71.2	-59.2	0	0	0	113.1	T616 C617 H630 Y631 G636	T616-H634 HydrophobicContact CG2-CB 4.16Å; C617-H634 PolarHBondContact SG-NE2 3.27Å; H630-H634 AromaticContact CE1-NE2 3.69Å; H630-H634 AromaticContact NE2-CD2 3.96Å; H630-H634 AromaticContact NE2-NE2 3.43Å; H630-H634 PolarHBondContact NE2-NE2 2.82Å; Y631-H634 WeakPolarHBondContact O-CA 3.48Å; Y631-H634 WeakPolarHBondContact O-CB 3.5Å; Y631-H634 PolarHBondContact O-N 3.22Å; H634-G636 VanDerWaalsContact C-N 3.25Å
635	T	75.8	Confident	80	Confident	81 Å²	81	71.6 Å²	71.6	50%	0.497	38%	0.377	S	S	.	.	H	α-helix	trans	-75.1	-18.4	172.6	59.9	0	0	0	0	112.3	Y631 L632 E637	Y631-T635 PolarHBondContact O-N 2.97Å; Y631-T635 PolarHBondContact O-OG1 3.47Å; L632-T635 WeakPolarHBondContact CA-OG1 3.48Å; T635-E637 VanDerWaalsContact CB-OE2 3.23Å; T635-E637 WeakPolarHBondContact CB-OE2 3.23Å; T635-E637 PolarHBondContact O-N 3.11Å; T635-E637 WeakPolarHBondContact OG1-CB 3.46Å; T635-E637 VanDerWaalsContact OG1-CD 3.24Å; T635-E637 VanDerWaalsContact OG1-CG 3.29Å; T635-E637 WeakPolarHBondContact OG1-CG 3.09Å; T635-E637 PolarHBondContact OG1-N 2.87Å; T635-E637 PolarHBondContact OG1-OE2 3.02Å
636	G	75.8	Confident	80.4	Confident	45 Å²	45	75.2 Å²	75.2	46%	0.464	39%	0.387	S	S	.	.			trans	72.2	4.9	-173.3	0	0	0	0	0	113.4	L632 H634 K638	L632-G636 CarbonylContact O-C 3.55Å; L632-G636 WeakPolarHBondContact O-CA 3.41Å; L632-G636 PolarHBondContact O-N 3.29Å; L632-G636 VanDerWaalsContact O-N 3.08Å; H634-G636 VanDerWaalsContact C-N 3.25Å; G636-K638 PolarHBondContact O-N 3.35Å
637	E	73.8	Confident	80.4	Confident	109 Å²	109	77.9 Å²	77.9	51%	0.509	40%	0.398	S	S	.	.			trans	-66.2	129.8	-174.5	-73.5	165.1	146.6	0	0	111.8	L632 T635	L632-E637 HydrophobicContact CD2-CB 3.9Å; L632-E637 PolarHBondContact O-N 2.81Å; T635-E637 VanDerWaalsContact CB-OE2 3.23Å; T635-E637 WeakPolarHBondContact CB-OE2 3.23Å; T635-E637 PolarHBondContact O-N 3.11Å; T635-E637 WeakPolarHBondContact OG1-CB 3.46Å; T635-E637 VanDerWaalsContact OG1-CD 3.24Å; T635-E637 VanDerWaalsContact OG1-CG 3.29Å; T635-E637 WeakPolarHBondContact OG1-CG 3.09Å; T635-E637 PolarHBondContact OG1-N 2.87Å; T635-E637 PolarHBondContact OG1-OE2 3.02Å
638	K	80.3	Confident	80.3	Confident	108 Å²	108	83.7 Å²	83.7	47%	0.47	42%	0.419	S	S	.	.			trans	-129.9	86.2	178.9	-66.6	178.1	-160.8	173.9	0	107.2	G636 H640 R648 F649	G636-K638 PolarHBondContact O-N 3.35Å; K638-H640 VanDerWaalsContact C-N 3.28Å; K638-H640 PolarHBondContact O-N 3.24Å; K638-R648 HydrophobicContact CB-CB 3.49Å; K638-R648 VanDerWaalsContact CB-CB 3.49Å; K638-R648 HydrophobicContact CD-CB 4.39Å; K638-R648 VanDerWaalsContact CD-O 3.31Å; K638-R648 WeakPolarHBondContact CD-O 3.28Å; K638-R648 PolarHBondContact O-NE 3.43Å; K638-R648 PolarHBondContact O-NH2 2.88Å; K638-F649 CarbonylContact C-O 3.57Å; K638-F649 WeakPolarHBondContact CA-O 3.45Å
639	P	78.1	Confident	80.2	Confident	74 Å²	74	80.1 Å²	80.1	48%	0.481	40%	0.402	S	S	.	.			trans	-72	-19.5	-172.8	25.6	-32.6	0	0	0	113.4
640	H	81.4	Confident	80.2	Confident	56 Å²	56	76 Å²	76	26%	0.259	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	104	-174.8	-50.2	-65.6	0	0	0	111.3	K638 R648 F649 S651 T652 L655	K638-H640 VanDerWaalsContact C-N 3.28Å; K638-H640 PolarHBondContact O-N 3.24Å; H640-R648 CarbonylContact O-C 3.44Å; H640-R648 WeakPolarHBondContact O-CA 3.15Å; H640-F649 PolarHBondContact N-O 3.15Å; H640-F649 PolarHBondContact O-N 3.02Å; H640-S651 WeakPolarHBondContact CD2-CA 3.38Å; H640-T652 PolarHBondContact CD2-N 3.44Å; H640-T652 VanDerWaalsContact CD2-N 3.33Å; H640-T652 WeakPolarHBondContact CE1-CG2 3.43Å; H640-L655 HydrophobicContact CB-CB 4.19Å; H640-L655 HydrophobicContact CB-CD2 3.88Å
641	E	85.9	Confident	80	Confident	56 Å²	56	75.7 Å²	75.7	26%	0.262	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	142.3	178.4	-167.4	161.8	133.3	0	0	112.6	H646 R648 L655	E641-H646 IonicContact OE1-CE1 2.66Å; E641-H646 IonicContact OE1-CG 2.66Å; E641-H646 IonicContact OE1-ND1 2.78Å; E641-H646 PolarHBondContact OE1-ND1 3.37Å; E641-R648 HydrophobicContact CB-CG 4.01Å; E641-R648 HydrophobicContact CG-CG 3.8Å; E641-R648 VanDerWaalsContact OE2-CD 3.23Å; E641-R648 WeakPolarHBondContact OE2-CD 3.27Å; E641-R648 VanDerWaalsContact OE2-CG 3.3Å; E641-R648 WeakPolarHBondContact OE2-CG 3.5Å; E641-R648 IonicContact OE2-CZ 3.9Å; E641-R648 IonicContact OE2-NE 2.74Å; E641-R648 IonicContact OE2-NH1 2.6Å; E641-R648 PolarHBondContact OE2-NH1 3.19Å; E641-L655 WeakPolarHBondContact O-CD2 3.36Å
642	C	84.4	Confident	79.8	Confident	0 Å²	0	77 Å²	77	0%	0	41%	0.406	C	S	.	.			trans	-87.7	109.9	171.5	-178.2	0	0	0	0	110.8	V644 C645 H646 K647 F649 L655 H658 H662	C642-V644 PolarHBondContact O-N 3.2Å; C642-C645 PolarHBondContact O-N 3.03Å; C642-C645 VanDerWaalsContact O-N 3.16Å; C642-H646 VanDerWaalsContact O-CA 3.31Å; C642-H646 WeakPolarHBondContact O-CA 3.15Å; C642-H646 PolarHBondContact O-N 3.2Å; C642-K647 WeakPolarHBondContact CB-O 3.32Å; C642-K647 PolarHBondContact N-O 3.3Å; C642-F649 HydrophobicContact CB-CE2 4.14Å; C642-L655 HydrophobicContact CB-CD1 3.57Å; C642-H658 PolarHBondContact SG-CD2 3.27Å; C642-H658 PolarHBondContact SG-NE2 3.42Å; C642-H658 VanDerWaalsContact SG-NE2 3.41Å; C642-H662 PolarHBondContact SG-NE2 3.08Å; C642-H662 VanDerWaalsContact SG-NE2 3.45Å
643	Q	86.1	Confident	79.7	Confident	155 Å²	155	77.2 Å²	77.2	72%	0.724	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-14.1	-179	-54.1	-62.7	10.7	0	0	114.6
644	V	82.5	Confident	79.7	Confident	92 Å²	92	75.8 Å²	75.8	56%	0.558	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-23	-179.5	-170.7	0	0	0	0	112.8	C642 L659 H662	C642-V644 PolarHBondContact O-N 3.2Å; V644-L659 HydrophobicContact CG2-CD2 4.42Å; V644-H662 HydrophobicContact CB-CB 4.48Å; V644-H662 HydrophobicContact CG1-CB 4.08Å; V644-H662 HydrophobicContact CG2-CB 4.47Å
645	C	85.4	Confident	79.9	Confident	42 Å²	42	73.6 Å²	73.6	28%	0.284	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.9	16.6	-178.1	72.7	0	0	0	0	115.5	C642 K647 H658 H662	C642-C645 PolarHBondContact O-N 3.03Å; C642-C645 VanDerWaalsContact O-N 3.16Å; C645-K647 PolarHBondContact O-N 3.07Å; C645-H658 PolarHBondContact SG-NE2 3.06Å; C645-H662 VanDerWaalsContact SG-CE1 3.57Å; C645-H662 PolarHBondContact SG-NE2 3.01Å; C645-H662 VanDerWaalsContact SG-NE2 3.35Å
646	H	85.8	Confident	80.1	Confident	118 Å²	118	73.8 Å²	73.8	55%	0.546	39%	0.385	S	S	.	.			trans	53.1	17.1	177.1	-56.2	-70.5	0	0	0	115.6	E641 C642 R648	E641-H646 IonicContact OE1-CE1 2.66Å; E641-H646 IonicContact OE1-CG 2.66Å; E641-H646 IonicContact OE1-ND1 2.78Å; E641-H646 PolarHBondContact OE1-ND1 3.37Å; C642-H646 VanDerWaalsContact O-CA 3.31Å; C642-H646 WeakPolarHBondContact O-CA 3.15Å; C642-H646 PolarHBondContact O-N 3.2Å; H646-R648 PolarHBondContact O-N 3Å
647	K	80.6	Confident	80.2	Confident	123 Å²	123	73 Å²	73	54%	0.535	37%	0.371	S	S	.	.			trans	-72.2	125.2	171.5	-69.4	-174.2	-166.8	-55.6	0	109.1	C642 C645 F649	C642-K647 WeakPolarHBondContact CB-O 3.32Å; C642-K647 PolarHBondContact N-O 3.3Å; C645-K647 PolarHBondContact O-N 3.07Å; K647-F649 HydrophobicContact CB-CE2 3.77Å; K647-F649 HydrophobicContact CB-CZ 3.88Å; K647-F649 WeakPolarHBondContact O-CD2 3.28Å; K647-F649 WeakPolarHBondContact O-CE2 3.21Å
648	R	81.1	Confident	80.6	Confident	133 Å²	133	68.7 Å²	68.7	50%	0.502	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.1	179.5	-56.2	-178.1	71	119.3	-10	111	K638 H640 E641 H646	K638-R648 HydrophobicContact CB-CB 3.49Å; K638-R648 VanDerWaalsContact CB-CB 3.49Å; K638-R648 HydrophobicContact CD-CB 4.39Å; K638-R648 VanDerWaalsContact CD-O 3.31Å; K638-R648 WeakPolarHBondContact CD-O 3.28Å; K638-R648 PolarHBondContact O-NE 3.43Å; K638-R648 PolarHBondContact O-NH2 2.88Å; H640-R648 CarbonylContact O-C 3.44Å; H640-R648 WeakPolarHBondContact O-CA 3.15Å; E641-R648 HydrophobicContact CB-CG 4.01Å; E641-R648 HydrophobicContact CG-CG 3.8Å; E641-R648 VanDerWaalsContact OE2-CD 3.23Å; E641-R648 WeakPolarHBondContact OE2-CD 3.27Å; E641-R648 VanDerWaalsContact OE2-CG 3.3Å; E641-R648 WeakPolarHBondContact OE2-CG 3.5Å; E641-R648 IonicContact OE2-CZ 3.9Å; E641-R648 IonicContact OE2-NE 2.74Å; E641-R648 IonicContact OE2-NH1 2.6Å; E641-R648 PolarHBondContact OE2-NH1 3.19Å; H646-R648 PolarHBondContact O-N 3Å
649	F	78.7	Confident	80.6	Confident	41 Å²	41	66.8 Å²	66.8	18%	0.18	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.2	-176.7	-61	-86.5	0	0	0	111.6	K638 H640 C642 K647 S651 N654 L655 H658	K638-F649 CarbonylContact C-O 3.57Å; K638-F649 WeakPolarHBondContact CA-O 3.45Å; H640-F649 PolarHBondContact N-O 3.15Å; H640-F649 PolarHBondContact O-N 3.02Å; C642-F649 HydrophobicContact CB-CE2 4.14Å; K647-F649 HydrophobicContact CB-CE2 3.77Å; K647-F649 HydrophobicContact CB-CZ 3.88Å; K647-F649 WeakPolarHBondContact O-CD2 3.28Å; K647-F649 WeakPolarHBondContact O-CE2 3.21Å; F649-S651 VanDerWaalsContact C-N 3.31Å; F649-N654 HydrophobicContact CB-CB 4.2Å; F649-N654 HydrophobicContact CD1-CB 3.99Å; F649-N654 HydrophobicContact CG-CB 4.39Å; F649-L655 HydrophobicContact CB-CB 4.39Å; F649-L655 HydrophobicContact CD2-CB 4.1Å; F649-L655 HydrophobicContact CD2-CD1 4.01Å; F649-L655 HydrophobicContact CE2-CD1 4.24Å; F649-L655 HydrophobicContact CG-CB 4.41Å; F649-H658 HydrophobicContact CE1-CB 3.95Å; F649-H658 HydrophobicContact CE2-CB 3.95Å; F649-H658 AromaticContact CE2-CD2 3.34Å; F649-H658 WeakPolarHBondContact CE2-CD2 3.34Å; F649-H658 AromaticContact CE2-CG 3.63Å; F649-H658 HydrophobicContact CZ-CB 3.51Å; F649-H658 AromaticContact CZ-CD2 3.41Å; F649-H658 VanDerWaalsContact CZ-CD2 3.41Å; F649-H658 WeakPolarHBondContact CZ-CD2 3.23Å; F649-H658 AromaticContact CZ-CG 3.22Å; F649-H658 AromaticContact CZ-ND1 3.71Å; F649-H658 AromaticContact CZ-NE2 3.98Å
650	S	75.5	Confident	80.9	Confident	48 Å²	48	64.7 Å²	64.7	34%	0.336	33%	0.328	S	S	.	.	S	Bend	trans	-83.2	-0.7	177.1	49.9	0	0	0	0	114.2
651	S	76.1	Confident	80.9	Confident	23 Å²	23	66.7 Å²	66.7	16%	0.161	34%	0.34	C	S	.	.	S	Bend	trans	-152.3	153.1	171.1	69.8	0	0	0	0	112.9	H640 F649 S653 N654 L655	H640-S651 WeakPolarHBondContact CD2-CA 3.38Å; F649-S651 VanDerWaalsContact C-N 3.31Å; S651-S653 VanDerWaalsContact C-N 3.28Å; S651-S653 PolarHBondContact O-N 3.08Å; S651-S653 PolarHBondContact OG-OG 2.87Å; S651-N654 PolarHBondContact O-N 3.34Å; S651-N654 WeakPolarHBondContact OG-CB 3.43Å; S651-N654 PolarHBondContact OG-N 2.93Å; S651-N654 PolarHBondContact OG-ND2 3.3Å; S651-N654 PolarHBondContact OG-OD1 2.94Å; S651-N654 VanDerWaalsContact OG-OD1 3.11Å; S651-L655 PolarHBondContact O-N 3.26Å; S651-L655 VanDerWaalsContact O-N 3.14Å
652	T	74.4	Confident	80.6	Confident	96 Å²	96	67.6 Å²	67.6	59%	0.589	34%	0.344	S	S	*	.	H	α-helix	trans	-59.7	-35.5	172.5	53	0	0	0	0	112.6	H640 N654 L655 K656	H640-T652 PolarHBondContact CD2-N 3.44Å; H640-T652 VanDerWaalsContact CD2-N 3.33Å; H640-T652 WeakPolarHBondContact CE1-CG2 3.43Å; T652-N654 VanDerWaalsContact C-N 3.27Å; T652-N654 PolarHBondContact O-N 3.16Å; T652-L655 PolarHBondContact O-N 3.2Å; T652-K656 VanDerWaalsContact O-CB 3.28Å; T652-K656 WeakPolarHBondContact O-CB 3.44Å; T652-K656 PolarHBondContact O-N 3.37Å
653	S	76.9	Confident	80.5	Confident	45 Å²	45	70.8 Å²	70.8	32%	0.315	37%	0.366	S	S	.	.	H	α-helix	trans	-60	-38.2	175.3	61.3	0	0	0	0	112.4	S651 T657	S651-S653 VanDerWaalsContact C-N 3.28Å; S651-S653 PolarHBondContact O-N 3.08Å; S651-S653 PolarHBondContact OG-OG 2.87Å; S653-T657 WeakPolarHBondContact O-CB 3.42Å; S653-T657 WeakPolarHBondContact O-CG2 3.25Å; S653-T657 PolarHBondContact O-N 3.19Å; S653-T657 PolarHBondContact O-OG1 3.44Å
654	N	78.1	Confident	80.2	Confident	71 Å²	71	65.6 Å²	65.6	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-79.8	-34.2	-176.2	-64.8	10.6	0	0	0	110.3	F649 S651 T652 T657 H658	F649-N654 HydrophobicContact CB-CB 4.2Å; F649-N654 HydrophobicContact CD1-CB 3.99Å; F649-N654 HydrophobicContact CG-CB 4.39Å; S651-N654 PolarHBondContact O-N 3.34Å; S651-N654 WeakPolarHBondContact OG-CB 3.43Å; S651-N654 PolarHBondContact OG-N 2.93Å; S651-N654 PolarHBondContact OG-ND2 3.3Å; S651-N654 PolarHBondContact OG-OD1 2.94Å; S651-N654 VanDerWaalsContact OG-OD1 3.11Å; T652-N654 VanDerWaalsContact C-N 3.27Å; T652-N654 PolarHBondContact O-N 3.16Å; N654-T657 WeakPolarHBondContact CA-OG1 3.46Å; N654-T657 PolarHBondContact O-OG1 3.49Å; N654-H658 WeakPolarHBondContact O-CB 3.2Å; N654-H658 PolarHBondContact O-N 3.26Å
655	L	82.1	Confident	80.2	Confident	30 Å²	30	64.6 Å²	64.6	16%	0.157	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-49.7	166.5	176.1	58.1	0	0	0	111.8	H640 E641 C642 F649 S651 T652 T657 H658 L659	H640-L655 HydrophobicContact CB-CB 4.19Å; H640-L655 HydrophobicContact CB-CD2 3.88Å; E641-L655 WeakPolarHBondContact O-CD2 3.36Å; C642-L655 HydrophobicContact CB-CD1 3.57Å; F649-L655 HydrophobicContact CB-CB 4.39Å; F649-L655 HydrophobicContact CD2-CB 4.1Å; F649-L655 HydrophobicContact CD2-CD1 4.01Å; F649-L655 HydrophobicContact CE2-CD1 4.24Å; F649-L655 HydrophobicContact CG-CB 4.41Å; S651-L655 PolarHBondContact O-N 3.26Å; S651-L655 VanDerWaalsContact O-N 3.14Å; T652-L655 PolarHBondContact O-N 3.2Å; L655-T657 VanDerWaalsContact C-N 3.33Å; L655-T657 PolarHBondContact O-N 2.81Å; L655-H658 CarbonylContact O-C 3.52Å; L655-H658 WeakPolarHBondContact O-CB 3.41Å; L655-H658 PolarHBondContact O-N 3.36Å; L655-H658 VanDerWaalsContact O-N 3.07Å; L655-L659 HydrophobicContact CD1-CD1 4.1Å; L655-L659 HydrophobicContact CD1-CD2 4.42Å; L655-L659 HydrophobicContact CD1-CG 3.97Å; L655-L659 HydrophobicContact CG-CD1 4.03Å; L655-L659 HydrophobicContact CG-CG 4.38Å; L655-L659 WeakPolarHBondContact O-CG 3.3Å; L655-L659 PolarHBondContact O-N 3.12Å
656	K	79.8	Confident	80	Confident	84 Å²	84	68.1 Å²	68.1	37%	0.365	35%	0.354	S	S	.	.	H	α-helix	trans	-59.1	-39.3	179.3	-179.4	173.9	173.2	177.2	0	112.5	T652 D769 L772	T652-K656 VanDerWaalsContact O-CB 3.28Å; T652-K656 WeakPolarHBondContact O-CB 3.44Å; T652-K656 PolarHBondContact O-N 3.37Å; K656-D769 IonicContact NZ-OD1 3.87Å; K656-L772 HydrophobicContact CD-CD2 4.43Å; K656-L772 VanDerWaalsContact CE-CD2 3.45Å
657	T	77.7	Confident	79.8	Confident	28 Å²	28	65 Å²	65	17%	0.172	34%	0.344	C	S	.	.	H	α-helix	trans	-78.5	-23.9	175.1	50.7	0	0	0	0	113.6	S653 N654 L655 Q679	S653-T657 WeakPolarHBondContact O-CB 3.42Å; S653-T657 WeakPolarHBondContact O-CG2 3.25Å; S653-T657 PolarHBondContact O-N 3.19Å; S653-T657 PolarHBondContact O-OG1 3.44Å; N654-T657 WeakPolarHBondContact CA-OG1 3.46Å; N654-T657 PolarHBondContact O-OG1 3.49Å; L655-T657 VanDerWaalsContact C-N 3.33Å; L655-T657 PolarHBondContact O-N 2.81Å; T657-Q679 HydrophobicContact CG2-CG 4.37Å
658	H	82.1	Confident	79.8	Confident	20 Å²	20	61.1 Å²	61.1	9%	0.093	33%	0.326	C	S	.	.	H	α-helix	trans	-74.9	-39.1	170.7	170.9	66.2	0	0	0	112.7	C642 C645 F649 N654 L655 R660 L661 H662	C642-H658 PolarHBondContact SG-CD2 3.27Å; C642-H658 PolarHBondContact SG-NE2 3.42Å; C642-H658 VanDerWaalsContact SG-NE2 3.41Å; C645-H658 PolarHBondContact SG-NE2 3.06Å; F649-H658 HydrophobicContact CE1-CB 3.95Å; F649-H658 HydrophobicContact CE2-CB 3.95Å; F649-H658 AromaticContact CE2-CD2 3.34Å; F649-H658 WeakPolarHBondContact CE2-CD2 3.34Å; F649-H658 AromaticContact CE2-CG 3.63Å; F649-H658 HydrophobicContact CZ-CB 3.51Å; F649-H658 AromaticContact CZ-CD2 3.41Å; F649-H658 VanDerWaalsContact CZ-CD2 3.41Å; F649-H658 WeakPolarHBondContact CZ-CD2 3.23Å; F649-H658 AromaticContact CZ-CG 3.22Å; F649-H658 AromaticContact CZ-ND1 3.71Å; F649-H658 AromaticContact CZ-NE2 3.98Å; N654-H658 WeakPolarHBondContact O-CB 3.2Å; N654-H658 PolarHBondContact O-N 3.26Å; L655-H658 CarbonylContact O-C 3.52Å; L655-H658 WeakPolarHBondContact O-CB 3.41Å; L655-H658 PolarHBondContact O-N 3.36Å; L655-H658 VanDerWaalsContact O-N 3.07Å; H658-R660 PolarHBondContact O-N 3.14Å; H658-L661 VanDerWaalsContact O-CB 3.23Å; H658-L661 WeakPolarHBondContact O-CB 3.5Å; H658-L661 WeakPolarHBondContact O-CG 3.44Å; H658-L661 PolarHBondContact O-N 3.16Å; H658-H662 AromaticContact CD2-NE2 3.92Å; H658-H662 AromaticContact CE1-NE2 3.5Å; H658-H662 PolarHBondContact CE1-NE2 3.46Å; H658-H662 AromaticContact NE2-CD2 3.82Å; H658-H662 AromaticContact NE2-NE2 3.05Å; H658-H662 PolarHBondContact NE2-NE2 3.21Å
659	L	80.1	Confident	79.8	Confident	68 Å²	68	59.8 Å²	59.8	36%	0.356	33%	0.326	S	S	.	.	H	α-helix	trans	-58.1	-29.7	177.3	-74.4	166.9	0	0	0	112.5	V644 L655 L661 H662 S663	V644-L659 HydrophobicContact CG2-CD2 4.42Å; L655-L659 HydrophobicContact CD1-CD1 4.1Å; L655-L659 HydrophobicContact CD1-CD2 4.42Å; L655-L659 HydrophobicContact CD1-CG 3.97Å; L655-L659 HydrophobicContact CG-CD1 4.03Å; L655-L659 HydrophobicContact CG-CG 4.38Å; L655-L659 WeakPolarHBondContact O-CG 3.3Å; L655-L659 PolarHBondContact O-N 3.12Å; L659-L661 PolarHBondContact O-N 2.97Å; L659-H662 WeakPolarHBondContact O-CB 3.23Å; L659-H662 PolarHBondContact O-N 3.19Å; L659-S663 PolarHBondContact O-N 3.43Å; L659-S663 PolarHBondContact O-OG 2.97Å
660	R	83.9	Confident	80	Confident	30 Å²	30	58.3 Å²	58.3	11%	0.113	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-15.5	171.7	-66.4	-179.7	-177.6	170.7	-1.4	115.1	H658 S663 G664 E665 Y668 T678	H658-R660 PolarHBondContact O-N 3.14Å; R660-S663 WeakPolarHBondContact CA-OG 3.27Å; R660-G664 CarbonylContact O-C 3.52Å; R660-G664 PolarHBondContact O-N 3.25Å; R660-E665 HydrophobicContact CB-CB 4.39Å; R660-E665 HydrophobicContact CG-CB 4.24Å; R660-E665 PolarHBondContact O-N 3.02Å; R660-Y668 VanDerWaalsContact NH1-CE2 3.32Å; R660-Y668 PolarHBondContact NH1-OH 3.3Å; R660-T678 HydrophobicContact CB-CG2 4.37Å; R660-T678 VanDerWaalsContact CD-O 3.23Å; R660-T678 WeakPolarHBondContact CD-O 3.49Å; R660-T678 PolarHBondContact NH1-O 2.85Å
661	L	81	Confident	80.4	Confident	98 Å²	98	64.5 Å²	64.5	51%	0.513	34%	0.341	S	S	.	.	H	α-helix	trans	-76.3	-32.1	170.6	-56.6	177.6	0	0	0	111	H658 L659 T678	H658-L661 VanDerWaalsContact O-CB 3.23Å; H658-L661 WeakPolarHBondContact O-CB 3.5Å; H658-L661 WeakPolarHBondContact O-CG 3.44Å; H658-L661 PolarHBondContact O-N 3.16Å; L659-L661 PolarHBondContact O-N 2.97Å; L661-T678 HydrophobicContact CD2-CG2 4.2Å
662	H	80.1	Confident	80.6	Confident	75 Å²	75	69.1 Å²	69.1	35%	0.347	36%	0.364	S	S	.	.	H	α-helix	trans	-83.3	-41.5	178.7	-59.7	-58.5	0	0	0	112.3	C642 V644 C645 H658 L659 G664	C642-H662 PolarHBondContact SG-NE2 3.08Å; C642-H662 VanDerWaalsContact SG-NE2 3.45Å; V644-H662 HydrophobicContact CB-CB 4.48Å; V644-H662 HydrophobicContact CG1-CB 4.08Å; V644-H662 HydrophobicContact CG2-CB 4.47Å; C645-H662 VanDerWaalsContact SG-CE1 3.57Å; C645-H662 PolarHBondContact SG-NE2 3.01Å; C645-H662 VanDerWaalsContact SG-NE2 3.35Å; H658-H662 AromaticContact CD2-NE2 3.92Å; H658-H662 AromaticContact CE1-NE2 3.5Å; H658-H662 PolarHBondContact CE1-NE2 3.46Å; H658-H662 AromaticContact NE2-CD2 3.82Å; H658-H662 AromaticContact NE2-NE2 3.05Å; H658-H662 PolarHBondContact NE2-NE2 3.21Å; L659-H662 WeakPolarHBondContact O-CB 3.23Å; L659-H662 PolarHBondContact O-N 3.19Å; H662-G664 PolarHBondContact O-N 2.92Å
663	S	82	Confident	81.2	Confident	67 Å²	67	66.6 Å²	66.6	47%	0.469	35%	0.35	S	S	.	.	S	Bend	trans	-75.1	-9.4	173.6	63.1	0	0	0	0	113.6	L659 R660 E665	L659-S663 PolarHBondContact O-N 3.43Å; L659-S663 PolarHBondContact O-OG 2.97Å; R660-S663 WeakPolarHBondContact CA-OG 3.27Å; S663-E665 PolarHBondContact O-N 3.3Å; S663-E665 VanDerWaalsContact O-N 3.16Å; S663-E665 WeakPolarHBondContact OG-CB 3.41Å; S663-E665 VanDerWaalsContact OG-CG 3.23Å; S663-E665 WeakPolarHBondContact OG-CG 3.26Å; S663-E665 PolarHBondContact OG-OE2 3.38Å
664	G	81.1	Confident	81.5	Confident	46 Å²	46	70.2 Å²	70.2	47%	0.474	37%	0.372	S	S	.	.			trans	67.7	5.2	-174.4	0	0	0	0	0	114.6	R660 H662 K666	R660-G664 CarbonylContact O-C 3.52Å; R660-G664 PolarHBondContact O-N 3.25Å; H662-G664 PolarHBondContact O-N 2.92Å; G664-K666 PolarHBondContact O-N 2.87Å; G664-K666 VanDerWaalsContact O-N 3.15Å
665	E	80.9	Confident	81.6	Confident	70 Å²	70	68.1 Å²	68.1	33%	0.327	37%	0.365	S	S	.	.			trans	-65.6	110.9	-171.3	-76.2	171.1	146	0	0	112.8	R660 S663 P667 T678 Q775	R660-E665 HydrophobicContact CB-CB 4.39Å; R660-E665 HydrophobicContact CG-CB 4.24Å; R660-E665 PolarHBondContact O-N 3.02Å; S663-E665 PolarHBondContact O-N 3.3Å; S663-E665 VanDerWaalsContact O-N 3.16Å; S663-E665 WeakPolarHBondContact OG-CB 3.41Å; S663-E665 VanDerWaalsContact OG-CG 3.23Å; S663-E665 WeakPolarHBondContact OG-CG 3.26Å; S663-E665 PolarHBondContact OG-OE2 3.38Å; E665-P667 WeakPolarHBondContact O-CD 3.23Å; E665-T678 WeakPolarHBondContact O-CG2 3.46Å; E665-Q775 PolarHBondContact OE1-NE2 3.17Å
666	K	83.1	Confident	81.8	Confident	117 Å²	117	73 Å²	73	51%	0.509	38%	0.384	S	S	.	.			trans	-113.6	68.5	179	-71.5	166.2	-180	178.2	0	110.7	G664 Y668 K676 F677 T678	G664-K666 PolarHBondContact O-N 2.87Å; G664-K666 VanDerWaalsContact O-N 3.15Å; K666-Y668 PolarHBondContact O-N 2.79Å; K666-K676 HydrophobicContact CB-CB 3.66Å; K666-K676 HydrophobicContact CD-CB 4.42Å; K666-F677 CarbonylContact C-O 3.57Å; K666-F677 VanDerWaalsContact C-O 3.26Å; K666-F677 VanDerWaalsContact CA-O 3.25Å; K666-F677 WeakPolarHBondContact CA-O 3.26Å; K666-T678 HydrophobicContact CG-CG2 3.68Å
667	P	79.6	Confident	81.8	Confident	52 Å²	52	71 Å²	71	34%	0.338	38%	0.376	S	S	.	.			trans	-66.9	-23.2	-173.3	27.3	-35.3	0	0	0	113.2	E665 H669	E665-P667 WeakPolarHBondContact O-CD 3.23Å; P667-H669 PolarHBondContact O-N 2.89Å
668	Y	80.6	Confident	81.8	Confident	41 Å²	41	70.3 Å²	70.3	16%	0.161	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	100.5	-176.5	-49.2	-68.9	0	0	0	110.3	R660 K666 K676 F677 T678 Q679 F680	R660-Y668 VanDerWaalsContact NH1-CE2 3.32Å; R660-Y668 PolarHBondContact NH1-OH 3.3Å; K666-Y668 PolarHBondContact O-N 2.79Å; Y668-K676 CarbonylContact O-C 2.96Å; Y668-K676 WeakPolarHBondContact O-CA 3.42Å; Y668-F677 WeakPolarHBondContact CD2-O 3.48Å; Y668-F677 PolarHBondContact N-O 3.39Å; Y668-F677 PolarHBondContact O-N 2.72Å; Y668-T678 WeakPolarHBondContact CE2-O 3.11Å; Y668-Q679 WeakPolarHBondContact CD2-O 3.31Å; Y668-F680 HydrophobicContact CD1-CB 3.99Å; Y668-F680 AromaticContact CD1-CD2 3.65Å; Y668-F680 HydrophobicContact CD1-CD2 3.65Å; Y668-F680 HydrophobicContact CD1-CG 4.31Å; Y668-F680 HydrophobicContact CD2-CB 4.32Å; Y668-F680 HydrophobicContact CE1-CB 3.86Å; Y668-F680 AromaticContact CE1-CD2 3.98Å; Y668-F680 HydrophobicContact CE1-CD2 3.98Å; Y668-F680 HydrophobicContact CE1-CG 4.43Å; Y668-F680 HydrophobicContact CE2-CB 4.18Å; Y668-F680 HydrophobicContact CG-CB 4.21Å; Y668-F680 HydrophobicContact CG-CD2 4.31Å
669	H	82.3	Confident	81.5	Confident	105 Å²	105	72.1 Å²	72.1	49%	0.486	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	146.2	-178.9	58.4	-86.5	0	0	0	111.8	P667 K676 L683	P667-H669 PolarHBondContact O-N 2.89Å; H669-K676 HydrophobicContact CB-CG 4.16Å; H669-L683 VanDerWaalsContact O-CD1 3.28Å; H669-L683 WeakPolarHBondContact O-CD1 3.25Å; H669-L683 WeakPolarHBondContact O-CD2 3.4Å
670	C	82.4	Confident	81.3	Confident	11 Å²	11	71 Å²	71	7%	0.074	37%	0.373	C	S	.	.			trans	-75.8	145.8	168.6	-167.1	0	0	0	0	110.5	L672 C673 A675 L683 H686	C670-L672 PolarHBondContact SG-N 2.9Å; C670-C673 WeakPolarHBondContact CB-O 3.46Å; C670-A675 PolarHBondContact N-O 3.3Å; C670-L683 HydrophobicContact CB-CD1 3.95Å; C670-H686 VanDerWaalsContact CB-CD2 3.42Å; C670-H686 WeakPolarHBondContact CB-CD2 3.42Å; C670-H686 PolarHBondContact SG-CD2 3.45Å
671	K	84.6	Confident	80.8	Confident	177 Å²	177	70.8 Å²	70.8	77%	0.77	37%	0.374	S	S	*	.	S	Bend	trans	-90.1	-9.6	172.1	-67.9	-166.2	174	-169.4	0	113
672	L	80.1	Confident	80.6	Confident	120 Å²	120	67 Å²	67	63%	0.628	35%	0.354	S	S	*	.	S	Bend	trans	-109.6	-12.9	-173.9	-56.2	176.8	0	0	0	113.2	C670 H690	C670-L672 PolarHBondContact SG-N 2.9Å; L672-H690 HydrophobicContact CD1-CB 3.56Å
673	C	86.2	Confident	80.6	Confident	44 Å²	44	63.8 Å²	63.8	30%	0.297	34%	0.339	S	S	.	.	S	Bend	trans	-159.9	170.1	170.7	102.3	0	0	0	0	110.3	C670 A675 H686	C670-C673 WeakPolarHBondContact CB-O 3.46Å; C673-A675 PolarHBondContact O-N 2.97Å; C673-A675 PolarHBondContact SG-N 3.16Å; C673-H686 PolarHBondContact SG-CE1 2.96Å; C673-H686 PolarHBondContact SG-NE2 3.09Å
674	P	83.9	Confident	80.2	Confident	121 Å²	121	61.5 Å²	61.5	79%	0.786	32%	0.321	S	S	*	.	S	Bend	trans	-71.2	3.1	-173.7	29.5	-37	0	0	0	116.1
675	A	80.9	Confident	79.7	Confident	27 Å²	27	59.5 Å²	59.5	22%	0.223	30%	0.299	C	S	.	.			trans	-67.1	134.6	-176.4	0	0	0	0	0	113	C670 C673 F677	C670-A675 PolarHBondContact N-O 3.3Å; C673-A675 PolarHBondContact O-N 2.97Å; C673-A675 PolarHBondContact SG-N 3.16Å; A675-F677 HydrophobicContact CB-CE2 3.6Å; A675-F677 HydrophobicContact CB-CZ 3.68Å
676	K	85.8	Confident	79.5	Confident	132 Å²	132	57.4 Å²	57.4	57%	0.574	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.6	-179.5	-50.8	-177.2	-175.6	177.1	0	111.2	K666 Y668 H669	K666-K676 HydrophobicContact CB-CB 3.66Å; K666-K676 HydrophobicContact CD-CB 4.42Å; Y668-K676 CarbonylContact O-C 2.96Å; Y668-K676 WeakPolarHBondContact O-CA 3.42Å; H669-K676 HydrophobicContact CB-CG 4.16Å
677	F	80.4	Confident	79.1	Confident	42 Å²	42	54.8 Å²	54.8	18%	0.184	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	147.5	-168.2	-57.1	-87.8	0	0	0	113	K666 Y668 A675 H682 L683 H686	K666-F677 CarbonylContact C-O 3.57Å; K666-F677 VanDerWaalsContact C-O 3.26Å; K666-F677 VanDerWaalsContact CA-O 3.25Å; K666-F677 WeakPolarHBondContact CA-O 3.26Å; Y668-F677 WeakPolarHBondContact CD2-O 3.48Å; Y668-F677 PolarHBondContact N-O 3.39Å; Y668-F677 PolarHBondContact O-N 2.72Å; A675-F677 HydrophobicContact CB-CE2 3.6Å; A675-F677 HydrophobicContact CB-CZ 3.68Å; F677-H682 HydrophobicContact CB-CB 3.84Å; F677-H682 HydrophobicContact CD1-CB 3.83Å; F677-H682 WeakPolarHBondContact CD1-O 3.28Å; F677-H682 HydrophobicContact CG-CB 4.12Å; F677-L683 HydrophobicContact CB-CB 4.21Å; F677-L683 VanDerWaalsContact CD2-CA 3.42Å; F677-L683 HydrophobicContact CD2-CB 3.87Å; F677-L683 HydrophobicContact CD2-CD1 4.02Å; F677-L683 HydrophobicContact CE2-CD1 4.28Å; F677-L683 HydrophobicContact CG-CB 4.29Å; F677-H686 HydrophobicContact CE1-CB 4.2Å; F677-H686 HydrophobicContact CE2-CB 3.58Å; F677-H686 AromaticContact CE2-CD2 3.88Å; F677-H686 AromaticContact CE2-CG 3.54Å; F677-H686 HydrophobicContact CZ-CB 3.33Å; F677-H686 AromaticContact CZ-CG 3.36Å; F677-H686 AromaticContact CZ-ND1 3.78Å
678	T	76.7	Confident	78.7	Confident	13 Å²	13	53.9 Å²	53.9	8%	0.08	27%	0.268	C	S	.	.	S	Bend	trans	-79.6	-24.3	-177.4	56	0	0	0	0	113.8	R660 L661 E665 K666 Y668	R660-T678 HydrophobicContact CB-CG2 4.37Å; R660-T678 VanDerWaalsContact CD-O 3.23Å; R660-T678 WeakPolarHBondContact CD-O 3.49Å; R660-T678 PolarHBondContact NH1-O 2.85Å; L661-T678 HydrophobicContact CD2-CG2 4.2Å; E665-T678 WeakPolarHBondContact O-CG2 3.46Å; K666-T678 HydrophobicContact CG-CG2 3.68Å; Y668-T678 WeakPolarHBondContact CE2-O 3.11Å
679	Q	76.6	Confident	78.3	Confident	58 Å²	58	55.8 Å²	55.8	27%	0.271	28%	0.281	S	S	.	.	S	Bend	trans	-124.1	145.6	179	-59.3	-174.6	3.9	0	0	110.4	T657 Y668 V681 H682 L683	T657-Q679 HydrophobicContact CG2-CG 4.37Å; Y668-Q679 WeakPolarHBondContact CD2-O 3.31Å; Q679-V681 VanDerWaalsContact C-N 3.3Å; Q679-V681 PolarHBondContact O-N 2.89Å; Q679-H682 HydrophobicContact CB-CB 4.35Å; Q679-H682 WeakPolarHBondContact O-CB 3.19Å; Q679-H682 PolarHBondContact O-N 2.82Å; Q679-H682 PolarHBondContact OE1-NE2 3.45Å; Q679-L683 PolarHBondContact O-N 3.26Å
680	F	75.1	Confident	77.9	Confident	46 Å²	46	54.1 Å²	54.1	20%	0.202	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-41.2	-178.7	-175.8	-81.9	0	0	0	110.7	Y668 H682 L683 K684 R758	Y668-F680 HydrophobicContact CD1-CB 3.99Å; Y668-F680 AromaticContact CD1-CD2 3.65Å; Y668-F680 HydrophobicContact CD1-CD2 3.65Å; Y668-F680 HydrophobicContact CD1-CG 4.31Å; Y668-F680 HydrophobicContact CD2-CB 4.32Å; Y668-F680 HydrophobicContact CE1-CB 3.86Å; Y668-F680 AromaticContact CE1-CD2 3.98Å; Y668-F680 HydrophobicContact CE1-CD2 3.98Å; Y668-F680 HydrophobicContact CE1-CG 4.43Å; Y668-F680 HydrophobicContact CE2-CB 4.18Å; Y668-F680 HydrophobicContact CG-CB 4.21Å; Y668-F680 HydrophobicContact CG-CD2 4.31Å; F680-H682 PolarHBondContact O-N 2.9Å; F680-H682 VanDerWaalsContact O-N 3.13Å; F680-L683 HydrophobicContact CD2-CD2 4.44Å; F680-L683 HydrophobicContact CE2-CD2 4.09Å; F680-L683 PolarHBondContact O-N 3.08Å; F680-L683 VanDerWaalsContact O-N 3.08Å; F680-K684 HydrophobicContact CD1-CB 4.06Å; F680-K684 HydrophobicContact CD1-CD 4.45Å; F680-K684 HydrophobicContact CE1-CB 3.73Å; F680-K684 HydrophobicContact CE1-CD 3.83Å; F680-K684 HydrophobicContact CE1-CG 4.18Å; F680-K684 VanDerWaalsContact O-CB 3.28Å; F680-K684 WeakPolarHBondContact O-CB 3.36Å; F680-K684 PolarHBondContact O-N 3.06Å; F680-R758 VanDerWaalsContact CE1-NH2 3.31Å
681	V	73.2	Confident	77.3	Confident	25 Å²	25	56.2 Å²	56.2	15%	0.152	29%	0.287	C	S	.	.	H	α-helix	trans	-46.2	-44	172.3	173.7	0	0	0	0	110.4	Q679 K684 P809 F810	Q679-V681 VanDerWaalsContact C-N 3.3Å; Q679-V681 PolarHBondContact O-N 2.89Å; V681-K684 WeakPolarHBondContact O-CA 3.37Å; V681-K684 VanDerWaalsContact O-CB 3.26Å; V681-K684 WeakPolarHBondContact O-CB 3.28Å; V681-K684 PolarHBondContact O-N 3.37Å; V681-K684 VanDerWaalsContact O-N 3.08Å; V681-P809 CarbonylContact C-O 3.47Å; V681-P809 HydrophobicContact CG1-CB 4.28Å; V681-P809 CarbonylContact O-C 3.42Å; V681-F810 HydrophobicContact CB-CE2 4.45Å; V681-F810 HydrophobicContact CB-CZ 4.37Å; V681-F810 HydrophobicContact CG1-CD1 4.15Å; V681-F810 HydrophobicContact CG1-CD2 3.44Å; V681-F810 VanDerWaalsContact CG1-CD2 3.44Å; V681-F810 HydrophobicContact CG1-CE1 4.12Å; V681-F810 HydrophobicContact CG1-CE2 3.39Å; V681-F810 HydrophobicContact CG1-CG 3.81Å; V681-F810 HydrophobicContact CG1-CZ 3.74Å; V681-F810 HydrophobicContact CG2-CE1 4.07Å; V681-F810 HydrophobicContact CG2-CE2 4.23Å; V681-F810 HydrophobicContact CG2-CZ 3.76Å; V681-F810 WeakPolarHBondContact O-CA 3.36Å; V681-F810 PolarHBondContact O-N 2.67Å
682	H	76.3	Confident	76.3	Confident	17 Å²	17	57.4 Å²	57.4	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-73.9	-33.7	-177.2	-62.7	-174.7	0	0	0	114.5	F677 Q679 F680 K684 G808 P809	F677-H682 HydrophobicContact CB-CB 3.84Å; F677-H682 HydrophobicContact CD1-CB 3.83Å; F677-H682 WeakPolarHBondContact CD1-O 3.28Å; F677-H682 HydrophobicContact CG-CB 4.12Å; Q679-H682 HydrophobicContact CB-CB 4.35Å; Q679-H682 WeakPolarHBondContact O-CB 3.19Å; Q679-H682 PolarHBondContact O-N 2.82Å; Q679-H682 PolarHBondContact OE1-NE2 3.45Å; F680-H682 PolarHBondContact O-N 2.9Å; F680-H682 VanDerWaalsContact O-N 3.13Å; H682-K684 PolarHBondContact O-N 3.13Å; H682-G808 WeakPolarHBondContact CD2-CA 3.09Å; H682-P809 CarbonylContact C-O 3.5Å; H682-P809 WeakPolarHBondContact CA-O 3.27Å
683	L	80.4	Confident	75.5	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-34.3	166.2	165.7	62.8	0	0	0	110.6	H669 C670 F677 Q679 F680 K687	H669-L683 VanDerWaalsContact O-CD1 3.28Å; H669-L683 WeakPolarHBondContact O-CD1 3.25Å; H669-L683 WeakPolarHBondContact O-CD2 3.4Å; C670-L683 HydrophobicContact CB-CD1 3.95Å; F677-L683 HydrophobicContact CB-CB 4.21Å; F677-L683 VanDerWaalsContact CD2-CA 3.42Å; F677-L683 HydrophobicContact CD2-CB 3.87Å; F677-L683 HydrophobicContact CD2-CD1 4.02Å; F677-L683 HydrophobicContact CE2-CD1 4.28Å; F677-L683 HydrophobicContact CG-CB 4.29Å; Q679-L683 PolarHBondContact O-N 3.26Å; F680-L683 HydrophobicContact CD2-CD2 4.44Å; F680-L683 HydrophobicContact CE2-CD2 4.09Å; F680-L683 PolarHBondContact O-N 3.08Å; F680-L683 VanDerWaalsContact O-N 3.08Å; L683-K687 PolarHBondContact O-N 3.07Å
684	K	73.7	Confident	74.7	Confident	18 Å²	18	59.2 Å²	59.2	8%	0.078	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-51	-168.1	166.7	143.7	-166	-172.3	0	108.9	F680 V681 H682 H686 K687 E754 F810 E811 S812	F680-K684 HydrophobicContact CD1-CB 4.06Å; F680-K684 HydrophobicContact CD1-CD 4.45Å; F680-K684 HydrophobicContact CE1-CB 3.73Å; F680-K684 HydrophobicContact CE1-CD 3.83Å; F680-K684 HydrophobicContact CE1-CG 4.18Å; F680-K684 VanDerWaalsContact O-CB 3.28Å; F680-K684 WeakPolarHBondContact O-CB 3.36Å; F680-K684 PolarHBondContact O-N 3.06Å; V681-K684 WeakPolarHBondContact O-CA 3.37Å; V681-K684 VanDerWaalsContact O-CB 3.26Å; V681-K684 WeakPolarHBondContact O-CB 3.28Å; V681-K684 PolarHBondContact O-N 3.37Å; V681-K684 VanDerWaalsContact O-N 3.08Å; H682-K684 PolarHBondContact O-N 3.13Å; K684-H686 PolarHBondContact O-N 2.85Å; K684-K687 VanDerWaalsContact O-CB 3.3Å; K684-K687 WeakPolarHBondContact O-CB 3.5Å; K684-K687 PolarHBondContact O-N 3.43Å; K684-E754 WeakPolarHBondContact CD-OE1 3.43Å; K684-E754 VanDerWaalsContact CD-OE2 3.3Å; K684-E754 WeakPolarHBondContact CD-OE2 3.3Å; K684-E754 VanDerWaalsContact CE-OE2 3.27Å; K684-E754 WeakPolarHBondContact CE-OE2 3.36Å; K684-E754 IonicContact NZ-OE1 3.99Å; K684-E754 PolarHBondContact NZ-OE1 2.9Å; K684-E754 IonicContact NZ-OE2 2.81Å; K684-E754 PolarHBondContact NZ-OE2 2.81Å; K684-F810 HydrophobicContact CD-CD1 4.02Å; K684-F810 HydrophobicContact CG-CD1 3.94Å; K684-E811 VanDerWaalsContact C-C 3.49Å; K684-E811 VanDerWaalsContact CG-CA 3.42Å; K684-E811 CarbonylContact O-C 3.54Å; K684-E811 WeakPolarHBondContact O-CA 3.45Å; K684-E811 PolarHBondContact O-N 3.08Å; K684-E811 VanDerWaalsContact O-N 3.11Å; K684-E811 VanDerWaalsContact O-O 3.13Å; K684-S812 VanDerWaalsContact CD-OG 3.32Å; K684-S812 WeakPolarHBondContact CD-OG 3.31Å; K684-S812 VanDerWaalsContact CE-O 3.31Å; K684-S812 WeakPolarHBondContact CE-O 3.29Å; K684-S812 WeakPolarHBondContact CE-OG 3.36Å; K684-S812 PolarHBondContact O-N 2.96Å
685	L	71.6	Confident	74.1	Confident	4 Å²	4	57 Å²	57	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-75.7	-30	-176.1	-157.9	6.8	0	0	0	113.7	K687 R688 L689 I706 H707 P809 F810 E811	L685-K687 CarbonylContact O-C 3.6Å; L685-K687 PolarHBondContact O-N 3.3Å; L685-R688 HydrophobicContact CD1-CB 3.35Å; L685-R688 HydrophobicContact CD1-CG 4.48Å; L685-R688 PolarHBondContact O-N 3.17Å; L685-L689 PolarHBondContact O-N 3.41Å; L685-I706 HydrophobicContact CD1-CB 4.46Å; L685-I706 HydrophobicContact CD1-CG2 3.52Å; L685-H707 VanDerWaalsContact CD1-ND1 3.25Å; L685-H707 WeakPolarHBondContact CD1-ND1 3.4Å; L685-H707 HydrophobicContact CD2-CB 3.54Å; L685-H707 WeakPolarHBondContact CD2-ND1 3.5Å; L685-H707 WeakPolarHBondContact CG-CE1 3.47Å; L685-H707 WeakPolarHBondContact CG-ND1 3.2Å; L685-P809 WeakPolarHBondContact CA-O 2.85Å; L685-P809 WeakPolarHBondContact CB-O 3.31Å; L685-P809 HydrophobicContact CD2-CG 3.7Å; L685-P809 PolarHBondContact N-O 2.72Å; L685-F810 WeakPolarHBondContact CA-O 3.28Å; L685-F810 WeakPolarHBondContact CB-O 3.33Å; L685-F810 WeakPolarHBondContact CD1-O 3.47Å; L685-F810 WeakPolarHBondContact CD2-O 3.49Å; L685-F810 WeakPolarHBondContact CG-O 3.41Å; L685-F810 VanDerWaalsContact N-CA 3.34Å; L685-F810 PolarHBondContact N-O 3.23Å; L685-E811 VanDerWaalsContact CA-N 3.32Å
686	H	76.9	Confident	73.7	Confident	27 Å²	27	57.2 Å²	57.2	13%	0.125	27%	0.265	C	S	.	.	H	α-helix	trans	-52.6	-27.7	170	-179.4	73.6	0	0	0	111.3	C670 C673 F677 K684 H690	C670-H686 VanDerWaalsContact CB-CD2 3.42Å; C670-H686 WeakPolarHBondContact CB-CD2 3.42Å; C670-H686 PolarHBondContact SG-CD2 3.45Å; C673-H686 PolarHBondContact SG-CE1 2.96Å; C673-H686 PolarHBondContact SG-NE2 3.09Å; F677-H686 HydrophobicContact CE1-CB 4.2Å; F677-H686 HydrophobicContact CE2-CB 3.58Å; F677-H686 AromaticContact CE2-CD2 3.88Å; F677-H686 AromaticContact CE2-CG 3.54Å; F677-H686 HydrophobicContact CZ-CB 3.33Å; F677-H686 AromaticContact CZ-CG 3.36Å; F677-H686 AromaticContact CZ-ND1 3.78Å; K684-H686 PolarHBondContact O-N 2.85Å; H686-H690 AromaticContact CD2-NE2 3.81Å; H686-H690 AromaticContact CE1-NE2 3.52Å; H686-H690 AromaticContact NE2-CD2 3.79Å; H686-H690 AromaticContact NE2-NE2 2.98Å; H686-H690 PolarHBondContact NE2-NE2 2.61Å; H686-H690 PolarHBondContact O-CD2 3.13Å; H686-H690 PolarHBondContact O-NE2 3.16Å
687	K	73.3	Confident	73.3	Confident	62 Å²	62	51.5 Å²	51.5	27%	0.27	24%	0.24	S	C	.	.	H	α-helix	trans	-73	-39.1	168.3	-64.3	-178.9	172	-170.9	0	114.8	L683 K684 L685 L689 H690 S691 E811	L683-K687 PolarHBondContact O-N 3.07Å; K684-K687 VanDerWaalsContact O-CB 3.3Å; K684-K687 WeakPolarHBondContact O-CB 3.5Å; K684-K687 PolarHBondContact O-N 3.43Å; L685-K687 CarbonylContact O-C 3.6Å; L685-K687 PolarHBondContact O-N 3.3Å; K687-L689 PolarHBondContact O-N 3.03Å; K687-H690 WeakPolarHBondContact O-CA 3.38Å; K687-H690 WeakPolarHBondContact O-CB 2.9Å; K687-H690 PolarHBondContact O-N 2.86Å; K687-S691 PolarHBondContact O-N 3.34Å; K687-S691 VanDerWaalsContact O-N 3.16Å; K687-E811 CarbonylContact C-O 3.45Å
688	R	72.8	Confident	73.2	Confident	32 Å²	32	49.5 Å²	49.5	12%	0.121	23%	0.231	C	C	.	.	H	α-helix	trans	-69.2	-20.6	176.9	-128.6	-163.4	-145.7	151.1	18.6	113.6	L685 H690 S691 R692 E693 H696 I706 E811	L685-R688 HydrophobicContact CD1-CB 3.35Å; L685-R688 HydrophobicContact CD1-CG 4.48Å; L685-R688 PolarHBondContact O-N 3.17Å; R688-H690 PolarHBondContact O-N 3.24Å; R688-S691 WeakPolarHBondContact CA-OG 3.39Å; R688-S691 WeakPolarHBondContact CG-OG 2.95Å; R688-S691 PolarHBondContact O-OG 2.93Å; R688-R692 PolarHBondContact O-N 2.63Å; R688-E693 HydrophobicContact CG-CB 4.26Å; R688-E693 WeakPolarHBondContact CG-OE2 3.34Å; R688-E693 IonicContact NE-OE2 2.7Å; R688-H696 PolarHBondContact NH1-NE2 3.41Å; R688-I706 HydrophobicContact CB-CG2 3.79Å; R688-I706 HydrophobicContact CG-CG2 4.27Å; R688-E811 WeakPolarHBondContact CA-O 3.42Å; R688-E811 HydrophobicContact CB-CB 3.88Å; R688-E811 WeakPolarHBondContact CB-O 3.33Å; R688-E811 HydrophobicContact CG-CB 3.77Å; R688-E811 IonicContact CZ-OE1 3.07Å; R688-E811 IonicContact CZ-OE2 3.53Å; R688-E811 PolarHBondContact N-O 3.2Å; R688-E811 IonicContact NH1-OE1 2.73Å; R688-E811 PolarHBondContact NH1-OE1 3.21Å; R688-E811 IonicContact NH1-OE2 3.43Å; R688-E811 PolarHBondContact NH1-OE2 2.7Å; R688-E811 VanDerWaalsContact NH2-CD 3.28Å; R688-E811 IonicContact NH2-OE1 3.82Å; R688-E811 IonicContact NH2-OE2 2.83Å; R688-E811 PolarHBondContact NH2-OE2 3.09Å
689	L	71.1	Confident	72.7	Confident	81 Å²	81	49.5 Å²	49.5	42%	0.424	23%	0.232	S	C	.	.	H	α-helix	trans	-58.5	-35.7	164.5	-64	179	0	0	0	111.6	L685 K687 I706	L685-L689 PolarHBondContact O-N 3.41Å; K687-L689 PolarHBondContact O-N 3.03Å; L689-I706 HydrophobicContact CD2-CD1 3.61Å; L689-I706 HydrophobicContact CD2-CG2 4.48Å
690	H	73.6	Confident	72.4	Confident	71 Å²	71	51 Å²	51	33%	0.329	24%	0.239	S	C	.	.	H	α-helix	trans	-82.8	-35.8	179.8	-62.3	-68.1	0	0	0	113.4	L672 H686 K687 R688 R692	L672-H690 HydrophobicContact CD1-CB 3.56Å; H686-H690 AromaticContact CD2-NE2 3.81Å; H686-H690 AromaticContact CE1-NE2 3.52Å; H686-H690 AromaticContact NE2-CD2 3.79Å; H686-H690 AromaticContact NE2-NE2 2.98Å; H686-H690 PolarHBondContact NE2-NE2 2.61Å; H686-H690 PolarHBondContact O-CD2 3.13Å; H686-H690 PolarHBondContact O-NE2 3.16Å; K687-H690 WeakPolarHBondContact O-CA 3.38Å; K687-H690 WeakPolarHBondContact O-CB 2.9Å; K687-H690 PolarHBondContact O-N 2.86Å; R688-H690 PolarHBondContact O-N 3.24Å; H690-R692 PolarHBondContact O-N 2.95Å
691	S	69.4	Low	72.6	Confident	54 Å²	54	50.6 Å²	50.6	38%	0.378	24%	0.241	S	C	.	.	H	α-helix	trans	-69.5	-10.7	176.6	66.1	0	0	0	0	113.6	K687 R688 E693	K687-S691 PolarHBondContact O-N 3.34Å; K687-S691 VanDerWaalsContact O-N 3.16Å; R688-S691 WeakPolarHBondContact CA-OG 3.39Å; R688-S691 WeakPolarHBondContact CG-OG 2.95Å; R688-S691 PolarHBondContact O-OG 2.93Å; S691-E693 WeakPolarHBondContact CB-OE2 3.47Å; S691-E693 PolarHBondContact O-N 2.59Å; S691-E693 VanDerWaalsContact OG-CD 3.31Å; S691-E693 WeakPolarHBondContact OG-CG 3.11Å; S691-E693 PolarHBondContact OG-OE2 3.49Å
692	R	64.3	Low	72.6	Confident	203 Å²	203	54.4 Å²	54.4	77%	0.766	26%	0.257	S	S	*	.			trans	62	-7.3	-175.3	-58.9	-176.4	173.5	-165.6	-0.9	115.4	R688 H690 R694	R688-R692 PolarHBondContact O-N 2.63Å; H690-R692 PolarHBondContact O-N 2.95Å; R692-R694 PolarHBondContact O-N 2.9Å; R692-R694 PolarHBondContact O-NH1 3.32Å
693	E	63	Low	72.5	Confident	85 Å²	85	61 Å²	61	40%	0.397	28%	0.281	S	S	.	.			trans	-53	133.5	177.5	-61.9	166.7	134.8	0	0	111.1	R688 S691 I706	R688-E693 HydrophobicContact CG-CB 4.26Å; R688-E693 WeakPolarHBondContact CG-OE2 3.34Å; R688-E693 IonicContact NE-OE2 2.7Å; S691-E693 WeakPolarHBondContact CB-OE2 3.47Å; S691-E693 PolarHBondContact O-N 2.59Å; S691-E693 VanDerWaalsContact OG-CD 3.31Å; S691-E693 WeakPolarHBondContact OG-CG 3.11Å; S691-E693 PolarHBondContact OG-OE2 3.49Å; E693-I706 WeakPolarHBondContact O-CG2 3.35Å
694	R	70.1	Confident	72.3	Confident	117 Å²	117	64.5 Å²	64.5	44%	0.442	30%	0.297	S	S	.	.			trans	-131.5	72.6	175.3	-70.8	167	167.4	77.3	-6.5	110.4	R692 H696 H704 Y705 I706	R692-R694 PolarHBondContact O-N 2.9Å; R692-R694 PolarHBondContact O-NH1 3.32Å; R694-H696 PolarHBondContact O-N 3.19Å; R694-H704 HydrophobicContact CB-CB 3.69Å; R694-H704 HydrophobicContact CG-CB 4.29Å; R694-Y705 CarbonylContact C-O 3.56Å; R694-Y705 VanDerWaalsContact CA-O 3.32Å; R694-Y705 WeakPolarHBondContact CA-O 3.48Å; R694-I706 HydrophobicContact CG-CB 4.36Å; R694-I706 HydrophobicContact CG-CG1 3.46Å; R694-I706 VanDerWaalsContact CG-CG1 3.46Å
695	P	70.3	Confident	72.3	Confident	75 Å²	75	65.8 Å²	65.8	49%	0.487	30%	0.301	S	S	.	.			trans	-65.1	-27.4	-174.1	-21.9	36	0	0	0	112.9	K697	P695-K697 PolarHBondContact O-N 3.42Å
696	H	72.6	Confident	72.2	Confident	31 Å²	31	66.7 Å²	66.7	14%	0.144	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	86.8	-170.2	-58.6	-60	0	0	0	110.5	R688 R694 Y705 L708 L711 E746 E811	R688-H696 PolarHBondContact NH1-NE2 3.41Å; R694-H696 PolarHBondContact O-N 3.19Å; H696-Y705 PolarHBondContact N-O 2.72Å; H696-Y705 WeakPolarHBondContact O-CA 3.23Å; H696-Y705 VanDerWaalsContact O-CB 3.31Å; H696-Y705 WeakPolarHBondContact O-CB 3.24Å; H696-Y705 PolarHBondContact O-N 3.3Å; H696-L708 HydrophobicContact CB-CD1 4.33Å; H696-L708 PolarHBondContact CD2-N 2.73Å; H696-L711 HydrophobicContact CB-CB 4.33Å; H696-L711 HydrophobicContact CB-CD2 3.88Å; H696-E746 IonicContact CE1-OE1 2.8Å; H696-E811 IonicContact NE2-OE1 2.62Å; H696-E811 IonicContact NE2-OE2 3.53Å; H696-E811 PolarHBondContact NE2-OE2 2.8Å
697	K	78	Confident	71.8	Confident	11 Å²	11	67.4 Å²	67.4	5%	0.048	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	155.9	177.7	-156.8	-164.3	102	149.5	0	112.4	L351 T352 H353 S354 P695 H702 R703 H704	L351-K697 CarbonylContact C-O 3.59Å; T352-K697 PolarHBondContact N-O 2.87Å; T352-K697 CarbonylContact O-C 3.16Å; T352-K697 WeakPolarHBondContact O-CB 3.46Å; T352-K697 WeakPolarHBondContact O-CD 3.47Å; T352-K697 WeakPolarHBondContact O-CE 3.24Å; T352-K697 VanDerWaalsContact O-CG 3.22Å; T352-K697 WeakPolarHBondContact O-CG 3.02Å; H353-K697 VanDerWaalsContact C-CD 3.45Å; H353-K697 WeakPolarHBondContact O-CE 3.33Å; H353-K697 PolarHBondContact O-NZ 3.45Å; S354-K697 WeakPolarHBondContact O-CD 3.42Å; S354-K697 VanDerWaalsContact O-CE 3.31Å; S354-K697 WeakPolarHBondContact O-CE 3.42Å; S354-K697 PolarHBondContact O-NZ 2.89Å; P695-K697 PolarHBondContact O-N 3.42Å; K697-H702 VanDerWaalsContact CD-O 3.27Å; K697-H702 WeakPolarHBondContact CD-O 3.27Å; K697-H702 VanDerWaalsContact CE-C 3.41Å; K697-H702 VanDerWaalsContact CE-CA 3.41Å; K697-H702 WeakPolarHBondContact CE-O 3.3Å; K697-H702 VanDerWaalsContact NZ-CA 3.29Å; K697-H702 PolarHBondContact NZ-ND1 3.46Å; K697-H702 PolarHBondContact NZ-O 2.99Å; K697-R703 CarbonylContact C-O 3.52Å; K697-R703 WeakPolarHBondContact CA-O 3.22Å; K697-R703 VanDerWaalsContact CG-C 3.41Å; K697-R703 WeakPolarHBondContact CG-O 3.37Å; K697-H704 WeakPolarHBondContact CD-CE1 3Å; K697-H704 VanDerWaalsContact CD-NE2 3.31Å; K697-H704 WeakPolarHBondContact CD-NE2 3.3Å; K697-H704 HydrophobicContact CG-CB 4.16Å; K697-H704 VanDerWaalsContact CG-CD2 3.45Å; K697-H704 WeakPolarHBondContact CG-CD2 3.1Å
698	C	77.9	Confident	71.6	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	30%	0.301	C	S	.	.			trans	-92.3	141.2	-173.6	155.6	0	0	0	0	115.7	T352 C701 H702 R703 Y705 L711 H714	T352-C698 CarbonylContact O-C 3.53Å; T352-C698 PolarHBondContact O-N 2.92Å; T352-C698 VanDerWaalsContact O-O 3.06Å; T352-C698 PolarHBondContact OG1-O 3.09Å; C698-C701 PolarHBondContact SG-N 3.47Å; C698-C701 VanDerWaalsContact SG-N 3.44Å; C698-H702 VanDerWaalsContact O-CA 3.26Å; C698-H702 WeakPolarHBondContact O-CA 3.35Å; C698-H702 PolarHBondContact O-N 2.9Å; C698-H702 PolarHBondContact O-ND1 3.26Å; C698-R703 WeakPolarHBondContact CB-O 3.46Å; C698-R703 PolarHBondContact N-O 2.78Å; C698-Y705 HydrophobicContact CB-CE2 4.08Å; C698-L711 HydrophobicContact CB-CD1 3.76Å; C698-H714 PolarHBondContact SG-NE2 2.74Å
699	P	67.3	Low	71.3	Confident	13 Å²	13	66.4 Å²	66.4	8%	0.084	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-59.4	-179.8	26	-41.3	0	0	0	114.9	P350 L351 T352 H702 L715	P350-P699 HydrophobicContact CB-CB 4.1Å; P350-P699 HydrophobicContact CB-CG 3.45Å; P350-P699 VanDerWaalsContact CB-CG 3.45Å; P350-P699 HydrophobicContact CG-CG 4.18Å; L351-P699 VanDerWaalsContact C-CD 3.48Å; L351-P699 WeakPolarHBondContact O-CA 3.4Å; L351-P699 WeakPolarHBondContact O-CB 3.32Å; L351-P699 WeakPolarHBondContact O-CD 3.31Å; T352-P699 WeakPolarHBondContact OG1-CA 3.33Å; T352-P699 PolarHBondContact OG1-O 2.89Å; P699-H702 PolarHBondContact O-CE1 3.44Å; P699-H702 VanDerWaalsContact O-CE1 3.22Å; P699-H702 PolarHBondContact O-ND1 3.18Å; P699-L715 HydrophobicContact CG-CD2 3.56Å
700	H	70.2	Confident	71.4	Confident	91 Å²	91	64.5 Å²	64.5	42%	0.421	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-35.2	-156.8	-40.7	-69.4	0	0	0	111.7	A721	H700-A721 HydrophobicContact CB-CB 3.64Å; H700-A721 WeakPolarHBondContact O-CB 3.23Å
701	C	78.1	Confident	71.5	Confident	36 Å²	36	61.1 Å²	61.1	24%	0.243	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-1.9	173.9	93.7	0	0	0	0	113.7	C698 R703 H714	C698-C701 PolarHBondContact SG-N 3.47Å; C698-C701 VanDerWaalsContact SG-N 3.44Å; C701-R703 PolarHBondContact O-N 2.7Å; C701-R703 VanDerWaalsContact O-N 3.09Å; C701-R703 VanDerWaalsContact SG-CD 3.59Å; C701-R703 VanDerWaalsContact SG-CG 3.57Å; C701-H714 PolarHBondContact SG-CE1 2.6Å; C701-H714 PolarHBondContact SG-NE2 3.32Å
702	H	74.9	Confident	71.4	Confident	106 Å²	106	62.5 Å²	62.5	49%	0.491	29%	0.286	S	S	.	.			trans	61.9	21.4	168.2	-84.6	-10.3	0	0	0	116.7	T352 K697 C698 P699	T352-H702 PolarHBondContact OG1-CE1 3.14Å; T352-H702 VanDerWaalsContact OG1-CE1 3.26Å; T352-H702 PolarHBondContact OG1-ND1 3.21Å; K697-H702 VanDerWaalsContact CD-O 3.27Å; K697-H702 WeakPolarHBondContact CD-O 3.27Å; K697-H702 VanDerWaalsContact CE-C 3.41Å; K697-H702 VanDerWaalsContact CE-CA 3.41Å; K697-H702 WeakPolarHBondContact CE-O 3.3Å; K697-H702 VanDerWaalsContact NZ-CA 3.29Å; K697-H702 PolarHBondContact NZ-ND1 3.46Å; K697-H702 PolarHBondContact NZ-O 2.99Å; C698-H702 VanDerWaalsContact O-CA 3.26Å; C698-H702 WeakPolarHBondContact O-CA 3.35Å; C698-H702 PolarHBondContact O-N 2.9Å; C698-H702 PolarHBondContact O-ND1 3.26Å; P699-H702 PolarHBondContact O-CE1 3.44Å; P699-H702 VanDerWaalsContact O-CE1 3.22Å; P699-H702 PolarHBondContact O-ND1 3.18Å
703	R	73.8	Confident	71.6	Confident	156 Å²	156	58 Å²	58	59%	0.589	28%	0.276	S	S	*	.			trans	-86.5	141.2	177.7	-68.9	176.8	-175.3	179	-0.8	113.4	K697 C698 C701 Y705	K697-R703 CarbonylContact C-O 3.52Å; K697-R703 WeakPolarHBondContact CA-O 3.22Å; K697-R703 VanDerWaalsContact CG-C 3.41Å; K697-R703 WeakPolarHBondContact CG-O 3.37Å; C698-R703 WeakPolarHBondContact CB-O 3.46Å; C698-R703 PolarHBondContact N-O 2.78Å; C701-R703 PolarHBondContact O-N 2.7Å; C701-R703 VanDerWaalsContact O-N 3.09Å; C701-R703 VanDerWaalsContact SG-CD 3.59Å; C701-R703 VanDerWaalsContact SG-CG 3.57Å; R703-Y705 HydrophobicContact CB-CE2 3.84Å; R703-Y705 WeakPolarHBondContact O-CD2 3.24Å; R703-Y705 VanDerWaalsContact O-CE2 3.31Å; R703-Y705 WeakPolarHBondContact O-CE2 3.42Å
704	H	74.6	Confident	72.1	Confident	82 Å²	82	54.4 Å²	54.4	38%	0.38	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.6	-178.2	-73.7	103.9	0	0	0	112.1	S354 R694 K697	S354-H704 PolarHBondContact O-CE1 2.77Å; R694-H704 HydrophobicContact CB-CB 3.69Å; R694-H704 HydrophobicContact CG-CB 4.29Å; K697-H704 WeakPolarHBondContact CD-CE1 3Å; K697-H704 VanDerWaalsContact CD-NE2 3.31Å; K697-H704 WeakPolarHBondContact CD-NE2 3.3Å; K697-H704 HydrophobicContact CG-CB 4.16Å; K697-H704 VanDerWaalsContact CG-CD2 3.45Å; K697-H704 WeakPolarHBondContact CG-CD2 3.1Å
705	Y	74.2	Confident	72.1	Confident	44 Å²	44	50.3 Å²	50.3	17%	0.173	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.2	178.3	-60.5	-87.7	0	0	0	111.8	R694 H696 C698 R703 H707 L711 H714	R694-Y705 CarbonylContact C-O 3.56Å; R694-Y705 VanDerWaalsContact CA-O 3.32Å; R694-Y705 WeakPolarHBondContact CA-O 3.48Å; H696-Y705 PolarHBondContact N-O 2.72Å; H696-Y705 WeakPolarHBondContact O-CA 3.23Å; H696-Y705 VanDerWaalsContact O-CB 3.31Å; H696-Y705 WeakPolarHBondContact O-CB 3.24Å; H696-Y705 PolarHBondContact O-N 3.3Å; C698-Y705 HydrophobicContact CB-CE2 4.08Å; R703-Y705 HydrophobicContact CB-CE2 3.84Å; R703-Y705 WeakPolarHBondContact O-CD2 3.24Å; R703-Y705 VanDerWaalsContact O-CE2 3.31Å; R703-Y705 WeakPolarHBondContact O-CE2 3.42Å; Y705-H707 VanDerWaalsContact C-N 3.29Å; Y705-L711 HydrophobicContact CD2-CB 4.1Å; Y705-L711 HydrophobicContact CD2-CD1 3.91Å; Y705-L711 HydrophobicContact CE2-CD1 4.2Å; Y705-L711 HydrophobicContact CG-CB 4.27Å; Y705-H714 HydrophobicContact CE1-CB 4.15Å; Y705-H714 HydrophobicContact CE2-CB 4.23Å; Y705-H714 AromaticContact CE2-CD2 3.72Å; Y705-H714 AromaticContact CE2-CG 3.96Å; Y705-H714 AromaticContact CZ-CD2 3.8Å; Y705-H714 AromaticContact CZ-CG 3.58Å; Y705-H714 PolarHBondContact OH-CD2 3.42Å; Y705-H714 PolarHBondContact OH-ND1 3.34Å
706	I	69.6	Low	72	Confident	23 Å²	23	55.6 Å²	55.6	12%	0.118	26%	0.262	C	S	.	.	S	Bend	trans	-75.9	-24.6	175	-47.7	172.1	0	0	0	109.6	L685 R688 L689 E693 R694	L685-I706 HydrophobicContact CD1-CB 4.46Å; L685-I706 HydrophobicContact CD1-CG2 3.52Å; R688-I706 HydrophobicContact CB-CG2 3.79Å; R688-I706 HydrophobicContact CG-CG2 4.27Å; L689-I706 HydrophobicContact CD2-CD1 3.61Å; L689-I706 HydrophobicContact CD2-CG2 4.48Å; E693-I706 WeakPolarHBondContact O-CG2 3.35Å; R694-I706 HydrophobicContact CG-CB 4.36Å; R694-I706 HydrophobicContact CG-CG1 3.46Å; R694-I706 VanDerWaalsContact CG-CG1 3.46Å
707	H	68.6	Low	71.5	Confident	42 Å²	42	56.9 Å²	56.9	19%	0.194	28%	0.283	C	S	.	.			trans	-123.9	132.3	-171.7	-33.1	-19.1	0	0	0	111	L685 Y705 V709 S710 L711	L685-H707 VanDerWaalsContact CD1-ND1 3.25Å; L685-H707 WeakPolarHBondContact CD1-ND1 3.4Å; L685-H707 HydrophobicContact CD2-CB 3.54Å; L685-H707 WeakPolarHBondContact CD2-ND1 3.5Å; L685-H707 WeakPolarHBondContact CG-CE1 3.47Å; L685-H707 WeakPolarHBondContact CG-ND1 3.2Å; Y705-H707 VanDerWaalsContact C-N 3.29Å; H707-V709 VanDerWaalsContact C-N 3.25Å; H707-V709 PolarHBondContact O-N 3.3Å; H707-S710 PolarHBondContact CD2-OG 3.44Å; H707-S710 PolarHBondContact O-N 3.22Å; H707-S710 VanDerWaalsContact O-N 3.1Å; H707-L711 PolarHBondContact O-N 3.21Å
708	L	69.1	Low	70.5	Confident	17 Å²	17	64.5 Å²	64.5	9%	0.089	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-28.2	175.5	-168.7	49	0	0	0	112.8	H696 L711 R712 V740 I747	H696-L708 HydrophobicContact CB-CD1 4.33Å; H696-L708 PolarHBondContact CD2-N 2.73Å; L708-L711 HydrophobicContact CD1-CB 4.47Å; L708-L711 HydrophobicContact CD1-CD2 3.99Å; L708-R712 WeakPolarHBondContact O-CB 2.87Å; L708-R712 PolarHBondContact O-N 3.48Å; L708-V740 HydrophobicContact CD1-CG1 4.44Å; L708-V740 HydrophobicContact CD1-CG2 3.35Å; L708-V740 HydrophobicContact CG-CG2 4.4Å; L708-I747 HydrophobicContact CB-CD1 4.12Å; L708-I747 HydrophobicContact CB-CG1 4.48Å; L708-I747 HydrophobicContact CD2-CD1 4Å; L708-I747 HydrophobicContact CD2-CG1 3.79Å; L708-I747 HydrophobicContact CG-CD1 3.84Å; L708-I747 HydrophobicContact CG-CG1 4.2Å
709	V	67.5	Low	70	Confident	57 Å²	57	65.1 Å²	65.1	35%	0.345	32%	0.317	S	S	.	.	H	α-helix	trans	-69.2	-37.7	171.8	-179.7	0	0	0	0	111.8	H707 R712 L713 I747	H707-V709 VanDerWaalsContact C-N 3.25Å; H707-V709 PolarHBondContact O-N 3.3Å; V709-R712 WeakPolarHBondContact O-CB 3.26Å; V709-R712 PolarHBondContact O-N 2.82Å; V709-L713 HydrophobicContact CG1-CD1 4.38Å; V709-L713 WeakPolarHBondContact O-CG 2.82Å; V709-L713 PolarHBondContact O-N 2.98Å; V709-I747 HydrophobicContact CG2-CD1 4.17Å
710	S	73.3	Confident	69.4	Low	40 Å²	40	70.6 Å²	70.6	28%	0.28	35%	0.345	S	S	.	.	H	α-helix	trans	-69.6	-36.2	175.5	-57.8	0	0	0	0	111.7	H707 H714	H707-S710 PolarHBondContact CD2-OG 3.44Å; H707-S710 PolarHBondContact O-N 3.22Å; H707-S710 VanDerWaalsContact O-N 3.1Å; S710-H714 WeakPolarHBondContact O-CB 3.03Å; S710-H714 PolarHBondContact O-N 2.99Å
711	L	74	Confident	68.6	Low	1 Å²	1	68.8 Å²	68.8	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-52.7	168.1	175.8	56.4	0	0	0	110.2	H696 C698 Y705 H707 L708 L713 H714 L715 V740	H696-L711 HydrophobicContact CB-CB 4.33Å; H696-L711 HydrophobicContact CB-CD2 3.88Å; C698-L711 HydrophobicContact CB-CD1 3.76Å; Y705-L711 HydrophobicContact CD2-CB 4.1Å; Y705-L711 HydrophobicContact CD2-CD1 3.91Å; Y705-L711 HydrophobicContact CE2-CD1 4.2Å; Y705-L711 HydrophobicContact CG-CB 4.27Å; H707-L711 PolarHBondContact O-N 3.21Å; L708-L711 HydrophobicContact CD1-CB 4.47Å; L708-L711 HydrophobicContact CD1-CD2 3.99Å; L711-L713 VanDerWaalsContact C-N 3.32Å; L711-L713 PolarHBondContact O-N 3.41Å; L711-H714 WeakPolarHBondContact O-CB 3.15Å; L711-H714 PolarHBondContact O-N 3.11Å; L711-H714 VanDerWaalsContact O-N 3.07Å; L711-L715 HydrophobicContact CD1-CD1 3.74Å; L711-L715 HydrophobicContact CD1-CD2 4.2Å; L711-L715 HydrophobicContact CD1-CG 3.87Å; L711-L715 HydrophobicContact CG-CD1 3.72Å; L711-L715 HydrophobicContact CG-CG 4.33Å; L711-L715 WeakPolarHBondContact O-CD1 3.41Å; L711-L715 WeakPolarHBondContact O-CG 3.11Å; L711-L715 PolarHBondContact O-N 3.43Å; L711-V740 HydrophobicContact CD2-CG2 4Å; L711-V740 HydrophobicContact CG-CG2 4.42Å
712	R	67.8	Low	67.2	Low	82 Å²	82	70.8 Å²	70.8	31%	0.309	36%	0.364	S	S	.	.	H	α-helix	trans	-52.1	-45	176.4	-169.3	-158.5	-72.6	156.4	-6.9	113.1	L708 V709 L715 K716 V740 N744 I747	L708-R712 WeakPolarHBondContact O-CB 2.87Å; L708-R712 PolarHBondContact O-N 3.48Å; V709-R712 WeakPolarHBondContact O-CB 3.26Å; V709-R712 PolarHBondContact O-N 2.82Å; R712-L715 PolarHBondContact O-N 3.05Å; R712-K716 WeakPolarHBondContact O-CB 3.33Å; R712-K716 PolarHBondContact O-N 2.92Å; R712-V740 HydrophobicContact CB-CG1 3.74Å; R712-V740 HydrophobicContact CG-CG1 3.99Å; R712-N744 PolarHBondContact NE-OD1 3.16Å; R712-N744 PolarHBondContact NH2-OD1 3.32Å; R712-I747 VanDerWaalsContact NH2-CD1 3.27Å
713	L	68.2	Low	65.9	Low	108 Å²	108	71 Å²	71	57%	0.565	37%	0.374	S	S	*	.	H	α-helix	trans	-65.8	-43	177.5	-73.8	170.8	0	0	0	112.1	V709 L711 L715 K716 G717	V709-L713 HydrophobicContact CG1-CD1 4.38Å; V709-L713 WeakPolarHBondContact O-CG 2.82Å; V709-L713 PolarHBondContact O-N 2.98Å; L711-L713 VanDerWaalsContact C-N 3.32Å; L711-L713 PolarHBondContact O-N 3.41Å; L713-L715 VanDerWaalsContact C-N 3.33Å; L713-L715 PolarHBondContact O-N 3.44Å; L713-K716 PolarHBondContact O-N 3.48Å; L713-G717 PolarHBondContact O-N 3.01Å
714	H	74.8	Confident	64.7	Low	10 Å²	10	68.1 Å²	68.1	5%	0.046	38%	0.377	C	S	.	.	H	α-helix	trans	-60.9	-42.2	176.4	166.3	64.5	0	0	0	112.3	C698 C701 Y705 S710 L711 Y718 C719	C698-H714 PolarHBondContact SG-NE2 2.74Å; C701-H714 PolarHBondContact SG-CE1 2.6Å; C701-H714 PolarHBondContact SG-NE2 3.32Å; Y705-H714 HydrophobicContact CE1-CB 4.15Å; Y705-H714 HydrophobicContact CE2-CB 4.23Å; Y705-H714 AromaticContact CE2-CD2 3.72Å; Y705-H714 AromaticContact CE2-CG 3.96Å; Y705-H714 AromaticContact CZ-CD2 3.8Å; Y705-H714 AromaticContact CZ-CG 3.58Å; Y705-H714 PolarHBondContact OH-CD2 3.42Å; Y705-H714 PolarHBondContact OH-ND1 3.34Å; S710-H714 WeakPolarHBondContact O-CB 3.03Å; S710-H714 PolarHBondContact O-N 2.99Å; L711-H714 WeakPolarHBondContact O-CB 3.15Å; L711-H714 PolarHBondContact O-N 3.11Å; L711-H714 VanDerWaalsContact O-N 3.07Å; H714-Y718 PolarHBondContact CE1-O 2.64Å; H714-Y718 PolarHBondContact ND1-O 3.22Å; H714-Y718 CarbonylContact O-C 3.53Å; H714-Y718 WeakPolarHBondContact O-CA 3.36Å; H714-Y718 PolarHBondContact O-N 2.84Å; H714-C719 PolarHBondContact O-N 3.43Å
715	L	70.1	Confident	62.9	Low	31 Å²	31	66.7 Å²	66.7	16%	0.162	39%	0.385	C	S	.	.	H	α-helix	trans	-64.6	-42.3	177.1	-65.4	165.8	0	0	0	112.4	P350 P699 L711 R712 L713 G717 V740	P350-L715 HydrophobicContact CB-CD1 3.76Å; P350-L715 HydrophobicContact CB-CD2 3.58Å; P350-L715 HydrophobicContact CB-CG 4.23Å; P350-L715 HydrophobicContact CG-CD1 4.33Å; P350-L715 HydrophobicContact CG-CD2 3.99Å; P350-L715 VanDerWaalsContact O-CD1 3.23Å; P350-L715 WeakPolarHBondContact O-CD1 3.5Å; P699-L715 HydrophobicContact CG-CD2 3.56Å; L711-L715 HydrophobicContact CD1-CD1 3.74Å; L711-L715 HydrophobicContact CD1-CD2 4.2Å; L711-L715 HydrophobicContact CD1-CG 3.87Å; L711-L715 HydrophobicContact CG-CD1 3.72Å; L711-L715 HydrophobicContact CG-CG 4.33Å; L711-L715 WeakPolarHBondContact O-CD1 3.41Å; L711-L715 WeakPolarHBondContact O-CG 3.11Å; L711-L715 PolarHBondContact O-N 3.43Å; R712-L715 PolarHBondContact O-N 3.05Å; L713-L715 VanDerWaalsContact C-N 3.33Å; L713-L715 PolarHBondContact O-N 3.44Å; L715-G717 PolarHBondContact O-N 2.7Å; L715-V740 HydrophobicContact CD1-CB 3.93Å; L715-V740 HydrophobicContact CD1-CG1 3.91Å
716	K	67.9	Low	61.6	Low	187 Å²	187	71.4 Å²	71.4	81%	0.813	42%	0.421	S	S	*	.	H	α-helix	trans	-72.8	-9.1	-175.4	-170.8	165.9	179.4	177.3	0	114.3	R712 L713	R712-K716 WeakPolarHBondContact O-CB 3.33Å; R712-K716 PolarHBondContact O-N 2.92Å; L713-K716 PolarHBondContact O-N 3.48Å
717	G	62.7	Low	60.6	Low	57 Å²	57	74 Å²	74	59%	0.588	45%	0.453	S	S	*	.	H	α-helix	trans	-167.6	0.4	-179.7	0	0	0	0	0	119.3	L713 L715	L713-G717 PolarHBondContact O-N 3.01Å; L715-G717 PolarHBondContact O-N 2.7Å
718	Y	56.8	Low	58.8	Low	172 Å²	172	77.2 Å²	77.2	68%	0.675	48%	0.479	S	S	*	.			trans	-132.9	12.6	-172.8	-58.5	-80.1	0	0	0	114.3	H714 L720	H714-Y718 PolarHBondContact CE1-O 2.64Å; H714-Y718 PolarHBondContact ND1-O 3.22Å; H714-Y718 CarbonylContact O-C 3.53Å; H714-Y718 WeakPolarHBondContact O-CA 3.36Å; H714-Y718 PolarHBondContact O-N 2.84Å; Y718-L720 PolarHBondContact O-N 3.44Å
719	C	65.7	Low	57.2	Low	13 Å²	13	81.5 Å²	81.5	9%	0.088	51%	0.508	C	S	.	.			trans	-96.8	73.9	-177.8	-165.1	0	0	0	0	111.9	H714 A721 A722	H714-C719 PolarHBondContact O-N 3.43Å; C719-A721 PolarHBondContact O-N 2.76Å; C719-A722 PolarHBondContact O-N 3.46Å
720	L	56.3	Low	56.1	Low	128 Å²	128	86.3 Å²	86.3	67%	0.67	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-52.4	-24.2	-171.5	-66.9	170.2	0	0	0	115.9	Y718 A722 T723	Y718-L720 PolarHBondContact O-N 3.44Å; L720-A722 PolarHBondContact O-N 3.35Å; L720-T723 WeakPolarHBondContact CA-OG1 3.25Å; L720-T723 PolarHBondContact O-N 3.41Å; L720-T723 PolarHBondContact O-OG1 2.92Å
721	A	52.9	Low	54.5	Low	53 Å²	53	90.1 Å²	90.1	44%	0.438	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-64.6	-13	175.8	0	0	0	0	0	114.3	H700 C719	H700-A721 HydrophobicContact CB-CB 3.64Å; H700-A721 WeakPolarHBondContact O-CB 3.23Å; C719-A721 PolarHBondContact O-N 2.76Å
722	A	49.1	Very low	53.1	Low	77 Å²	77	93 Å²	93	64%	0.636	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-87.3	-4.7	171.3	0	0	0	0	0	113.8	C719 L720	C719-A722 PolarHBondContact O-N 3.46Å; L720-A722 PolarHBondContact O-N 3.35Å
723	T	46.8	Very low	52.5	Low	111 Å²	111	93.3 Å²	93.3	68%	0.681	59%	0.588	S	S	*	*	S	Bend	trans	-123.5	5	-168.4	44.5	0	0	0	0	115	L720	L720-T723 WeakPolarHBondContact CA-OG1 3.25Å; L720-T723 PolarHBondContact O-N 3.41Å; L720-T723 PolarHBondContact O-OG1 2.92Å
724	S	48	Very low	51.5	Low	95 Å²	95	92.3 Å²	92.3	66%	0.664	58%	0.58	S	S	*	*			trans	-133.7	95.1	-176.2	60.2	0	0	0	0	112.5
725	G	38.3	Very low	50.2	Low	52 Å²	52	94.8 Å²	94.8	54%	0.536	60%	0.603	S	S	.	*			trans	167	82.6	175.2	0	0	0	0	0	115	G727	G725-G727 PolarHBondContact O-N 3.25Å; G725-G727 VanDerWaalsContact O-N 3.09Å
726	P	47.1	Very low	49.3	Very low	144 Å²	144	94.9 Å²	94.9	94%	0.935	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	97.9	172.4	30.7	-32.7	0	0	0	110.3
727	G	48.3	Very low	48.6	Very low	77 Å²	77	86.9 Å²	86.9	79%	0.794	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	145.1	-4.4	173.9	0	0	0	0	0	117.2	G725	G725-G727 PolarHBondContact O-N 3.25Å; G725-G727 VanDerWaalsContact O-N 3.09Å
728	C	30.4	Very low	48.3	Very low	109 Å²	109	87.8 Å²	87.8	74%	0.736	56%	0.563	S	S	*	*			trans	-84	147.5	172.9	-67.7	0	0	0	0	111.5
729	P	36.2	Very low	48.2	Very low	108 Å²	108	81.6 Å²	81.6	70%	0.701	54%	0.54	S	S	*	.			trans	-64.2	158	178.6	28.4	-35.7	0	0	0	111.4	V731	P729-V731 PolarHBondContact O-N 3.33Å
730	N	43.2	Very low	47.6	Very low	158 Å²	158	81.1 Å²	81.1	85%	0.845	54%	0.537	S	S	*	.			trans	-69.5	75.3	-179.3	-170.6	8.5	0	0	0	111.5	S732	N730-S732 VanDerWaalsContact C-N 3.32Å; N730-S732 PolarHBondContact O-N 3.49Å
731	V	39.4	Very low	47.5	Very low	120 Å²	120	78 Å²	78	73%	0.727	52%	0.519	S	S	*	.			trans	-67.4	95.5	171.6	178.9	0	0	0	0	107.1	P729 S733	P729-V731 PolarHBondContact O-N 3.33Å; V731-S733 PolarHBondContact O-N 3.47Å
732	S	44.3	Very low	47.9	Very low	62 Å²	62	81.4 Å²	81.4	43%	0.434	52%	0.52	S	S	.	.			trans	-44.2	137	-166.8	-178.5	0	0	0	0	113.4	N730 Q734 A735	N730-S732 VanDerWaalsContact C-N 3.32Å; N730-S732 PolarHBondContact O-N 3.49Å; S732-Q734 PolarHBondContact O-N 3.13Å; S732-Q734 WeakPolarHBondContact OG-CB 3.06Å; S732-Q734 PolarHBondContact OG-N 3.12Å; S732-A735 PolarHBondContact O-N 2.91Å
733	S	55.7	Low	48	Very low	88 Å²	88	77.9 Å²	77.9	62%	0.615	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	65.1	156.6	60.7	0	0	0	0	109.8	V731 L737	V731-S733 PolarHBondContact O-N 3.47Å; S733-L737 WeakPolarHBondContact O-CD1 3.1Å; S733-L737 VanDerWaalsContact O-CD2 3.26Å; S733-L737 WeakPolarHBondContact O-CD2 3.05Å
734	Q	48.6	Very low	48.1	Very low	86 Å²	86	74 Å²	74	40%	0.402	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.9	-40.9	171.3	-171	65.9	42.5	0	0	109	S732 L737 E738	S732-Q734 PolarHBondContact O-N 3.13Å; S732-Q734 WeakPolarHBondContact OG-CB 3.06Å; S732-Q734 PolarHBondContact OG-N 3.12Å; Q734-L737 VanDerWaalsContact O-CB 3.32Å; Q734-L737 WeakPolarHBondContact O-CB 3.43Å; Q734-L737 PolarHBondContact O-N 3.34Å; Q734-L737 VanDerWaalsContact O-N 3.14Å; Q734-E738 PolarHBondContact NE2-OE1 3.1Å; Q734-E738 WeakPolarHBondContact O-CB 3.04Å; Q734-E738 WeakPolarHBondContact O-CG 3.2Å; Q734-E738 PolarHBondContact O-N 3.19Å
735	A	47.6	Very low	48.5	Very low	63 Å²	63	73.3 Å²	73.3	52%	0.521	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-48.9	166	0	0	0	0	0	109.8	S732 L737 E738 E739	S732-A735 PolarHBondContact O-N 2.91Å; A735-L737 PolarHBondContact O-N 3.04Å; A735-E738 WeakPolarHBondContact O-CA 3.45Å; A735-E738 PolarHBondContact O-N 3.49Å; A735-E739 WeakPolarHBondContact O-CB 3.07Å; A735-E739 WeakPolarHBondContact O-CG 3.39Å
736	A	50.5	Low	49.1	Very low	32 Å²	32	74.7 Å²	74.7	26%	0.264	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-19	171.3	0	0	0	0	0	113.4	G348 Y349 P350 E738 E739	G348-A736 CarbonylContact C-O 3.4Å; Y349-A736 PolarHBondContact N-O 3.32Å; P350-A736 VanDerWaalsContact CD-O 3.28Å; P350-A736 WeakPolarHBondContact CD-O 3.32Å; P350-A736 WeakPolarHBondContact CG-O 3.42Å; A736-E738 VanDerWaalsContact C-N 3.3Å; A736-E739 VanDerWaalsContact O-CB 3.27Å; A736-E739 WeakPolarHBondContact O-CB 3.26Å
737	L	53.8	Low	49.2	Very low	19 Å²	19	69.7 Å²	69.7	10%	0.099	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-10.3	174.7	-85.8	47.3	0	0	0	112.9	H346 P347 Y349 S733 Q734 A735	H346-L737 WeakPolarHBondContact O-CD2 3.46Å; P347-L737 HydrophobicContact CB-CD1 3.33Å; P347-L737 HydrophobicContact CB-CD2 4.21Å; P347-L737 HydrophobicContact CB-CG 3.49Å; P347-L737 VanDerWaalsContact CB-CG 3.49Å; Y349-L737 VanDerWaalsContact CB-C 3.46Å; Y349-L737 WeakPolarHBondContact CB-O 3.39Å; Y349-L737 VanDerWaalsContact N-CA 3.27Å; Y349-L737 PolarHBondContact N-O 2.88Å; Y349-L737 VanDerWaalsContact N-O 3.13Å; S733-L737 WeakPolarHBondContact O-CD1 3.1Å; S733-L737 VanDerWaalsContact O-CD2 3.26Å; S733-L737 WeakPolarHBondContact O-CD2 3.05Å; Q734-L737 VanDerWaalsContact O-CB 3.32Å; Q734-L737 WeakPolarHBondContact O-CB 3.43Å; Q734-L737 PolarHBondContact O-N 3.34Å; Q734-L737 VanDerWaalsContact O-N 3.14Å; A735-L737 PolarHBondContact O-N 3.04Å
738	E	55	Low	49.2	Very low	76 Å²	76	70.9 Å²	70.9	36%	0.355	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	29.6	-162.6	-65.9	-147.5	-121.5	0	0	124.5	Y349 Q734 A735 A736 R742	Y349-E738 HydrophobicContact CD1-CB 4.42Å; Y349-E738 WeakPolarHBondContact CD1-O 3.17Å; Y349-E738 WeakPolarHBondContact CE1-O 3.35Å; Q734-E738 PolarHBondContact NE2-OE1 3.1Å; Q734-E738 WeakPolarHBondContact O-CB 3.04Å; Q734-E738 WeakPolarHBondContact O-CG 3.2Å; Q734-E738 PolarHBondContact O-N 3.19Å; A735-E738 WeakPolarHBondContact O-CA 3.45Å; A735-E738 PolarHBondContact O-N 3.49Å; A736-E738 VanDerWaalsContact C-N 3.3Å; E738-R742 IonicContact OE2-CZ 3.23Å; E738-R742 VanDerWaalsContact OE2-CZ 3.23Å; E738-R742 IonicContact OE2-NE 2.9Å; E738-R742 PolarHBondContact OE2-NE 3.3Å; E738-R742 IonicContact OE2-NH2 2.72Å; E738-R742 PolarHBondContact OE2-NH2 2.88Å
739	E	55.4	Low	50	Low	42 Å²	42	71.5 Å²	71.5	20%	0.196	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	cis	137.6	0	-8.2	-63.2	-57.8	87	0	0	122.7	Y349 P350 L351 A735 A736	Y349-E739 WeakPolarHBondContact CD2-O 3.23Å; Y349-E739 VanDerWaalsContact CE2-C 3.48Å; Y349-E739 WeakPolarHBondContact CE2-O 3.33Å; Y349-E739 HydrophobicContact CG-CB 4.25Å; P350-E739 CarbonylContact C-O 3.56Å; P350-E739 VanDerWaalsContact C-O 3.22Å; P350-E739 VanDerWaalsContact CA-CA 3.44Å; P350-E739 VanDerWaalsContact CA-OE2 3.23Å; P350-E739 WeakPolarHBondContact CA-OE2 3.46Å; P350-E739 HydrophobicContact CB-CB 3.94Å; P350-E739 HydrophobicContact CB-CG 4.2Å; P350-E739 WeakPolarHBondContact CB-OE2 3.14Å; P350-E739 HydrophobicContact CG-CB 3.86Å; P350-E739 HydrophobicContact CG-CG 4.25Å; P350-E739 VanDerWaalsContact N-C 3.29Å; P350-E739 VanDerWaalsContact N-CB 3.26Å; L351-E739 WeakPolarHBondContact CD1-O 3.38Å; L351-E739 PolarHBondContact N-O 3.48Å; L351-E739 PolarHBondContact N-OE1 3.14Å; L351-E739 PolarHBondContact N-OE2 3.42Å; A735-E739 WeakPolarHBondContact O-CB 3.07Å; A735-E739 WeakPolarHBondContact O-CG 3.39Å; A736-E739 VanDerWaalsContact O-CB 3.27Å; A736-E739 WeakPolarHBondContact O-CB 3.26Å
740	V	52.8	Low	50.1	Low	4 Å²	4	68.9 Å²	68.9	2%	0.024	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn		0	16.3	0	174.5	0	0	0	0	133.5	Y349 P350 L351 L708 L711 R712 L715 N744	Y349-V740 CarbonylContact O-C 3.22Å; Y349-V740 WeakPolarHBondContact O-CA 3.49Å; Y349-V740 WeakPolarHBondContact O-CB 3.35Å; Y349-V740 VanDerWaalsContact O-CG1 3.26Å; Y349-V740 WeakPolarHBondContact O-CG1 3.44Å; Y349-V740 PolarHBondContact O-N 2.59Å; P350-V740 WeakPolarHBondContact O-CB 3.32Å; P350-V740 WeakPolarHBondContact O-CG2 3.39Å; P350-V740 PolarHBondContact O-N 2.9Å; L351-V740 HydrophobicContact CD1-CG2 4.26Å; L708-V740 HydrophobicContact CD1-CG1 4.44Å; L708-V740 HydrophobicContact CD1-CG2 3.35Å; L708-V740 HydrophobicContact CG-CG2 4.4Å; L711-V740 HydrophobicContact CD2-CG2 4Å; L711-V740 HydrophobicContact CG-CG2 4.42Å; R712-V740 HydrophobicContact CB-CG1 3.74Å; R712-V740 HydrophobicContact CG-CG1 3.99Å; L715-V740 HydrophobicContact CD1-CB 3.93Å; L715-V740 HydrophobicContact CD1-CG1 3.91Å; V740-N744 PolarHBondContact O-OD1 3.01Å; V740-N744 VanDerWaalsContact O-OD1 3.12Å
741	H	54.8	Low	49.8	Very low	63 Å²	63	65.4 Å²	65.4	29%	0.292	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.8	-43.3	176.4	-163.2	-41.4	0	0	0	115.6	H346 G348 A743 N744	H346-H741 AromaticContact ND1-NE2 3.85Å; G348-H741 VanDerWaalsContact CA-CB 3.43Å; G348-H741 PolarHBondContact N-CD2 3.22Å; H741-A743 PolarHBondContact O-N 3.02Å; H741-A743 VanDerWaalsContact O-N 3.14Å; H741-N744 HydrophobicContact CB-CB 4.48Å; H741-N744 PolarHBondContact CD2-ND2 2.73Å; H741-N744 PolarHBondContact ND1-ND2 2.83Å; H741-N744 WeakPolarHBondContact O-CB 3.32Å; H741-N744 PolarHBondContact O-N 3.34Å
742	R	60.5	Low	49.6	Very low	124 Å²	124	64.1 Å²	64.1	47%	0.468	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	4.4	159.4	-179.8	-98.3	-73.2	170.3	0.7	111.6	Y349 E738	Y349-R742 VanDerWaalsContact CD1-CA 3.43Å; Y349-R742 HydrophobicContact CD1-CB 3.41Å; Y349-R742 VanDerWaalsContact CD1-CB 3.41Å; Y349-R742 HydrophobicContact CD1-CG 4.47Å; Y349-R742 HydrophobicContact CE1-CB 3.73Å; Y349-R742 HydrophobicContact CE1-CG 4.34Å; Y349-R742 HydrophobicContact CG-CB 4.34Å; E738-R742 IonicContact OE2-CZ 3.23Å; E738-R742 VanDerWaalsContact OE2-CZ 3.23Å; E738-R742 IonicContact OE2-NE 2.9Å; E738-R742 PolarHBondContact OE2-NE 3.3Å; E738-R742 IonicContact OE2-NH2 2.72Å; E738-R742 PolarHBondContact OE2-NH2 2.88Å
743	A	51.9	Low	49.4	Very low	3 Å²	3	64.1 Å²	64.1	3%	0.025	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	41.2	143.9	0	0	0	0	0	114.8	Y349 H741 E745 E746	Y349-A743 HydrophobicContact CD2-CB 3.89Å; Y349-A743 HydrophobicContact CE2-CB 3.19Å; H741-A743 PolarHBondContact O-N 3.02Å; H741-A743 VanDerWaalsContact O-N 3.14Å; A743-E745 PolarHBondContact O-N 3.16Å; A743-E746 VanDerWaalsContact C-N 3.28Å; A743-E746 HydrophobicContact CB-CB 3.74Å; A743-E746 WeakPolarHBondContact O-CB 3.48Å; A743-E746 PolarHBondContact O-N 2.86Å
744	N	47.9	Very low	48.8	Very low	28 Å²	28	60.8 Å²	60.8	15%	0.15	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-28.4	139.4	-89.9	-26	0	0	0	108.4	R712 V740 H741 E746 I747 E748	R712-N744 PolarHBondContact NE-OD1 3.16Å; R712-N744 PolarHBondContact NH2-OD1 3.32Å; V740-N744 PolarHBondContact O-OD1 3.01Å; V740-N744 VanDerWaalsContact O-OD1 3.12Å; H741-N744 HydrophobicContact CB-CB 4.48Å; H741-N744 PolarHBondContact CD2-ND2 2.73Å; H741-N744 PolarHBondContact ND1-ND2 2.83Å; H741-N744 WeakPolarHBondContact O-CB 3.32Å; H741-N744 PolarHBondContact O-N 3.34Å; N744-E746 PolarHBondContact O-N 2.92Å; N744-I747 CarbonylContact O-C 3.53Å; N744-I747 WeakPolarHBondContact O-CA 3.45Å; N744-I747 WeakPolarHBondContact O-CB 3.23Å; N744-I747 PolarHBondContact O-N 3.02Å; N744-E748 PolarHBondContact O-N 2.81Å
745	E	56.1	Low	48.3	Very low	81 Å²	81	60.7 Å²	60.7	38%	0.379	31%	0.307	S	S	.	.	H	α-helix	trans	-51.3	-23.2	160.2	-46	175.3	-167.8	0	0	114.3	A743 R749	A743-E745 PolarHBondContact O-N 3.16Å; E745-R749 VanDerWaalsContact CB-NH2 3.33Å; E745-R749 WeakPolarHBondContact O-CA 3.28Å; E745-R749 WeakPolarHBondContact O-CB 3.46Å; E745-R749 WeakPolarHBondContact O-CD 3.23Å; E745-R749 WeakPolarHBondContact O-CG 3.09Å; E745-R749 PolarHBondContact O-N 3Å; E745-R749 PolarHBondContact O-NE 3.43Å; E745-R749 IonicContact OE2-CZ 3.67Å; E745-R749 IonicContact OE2-NE 3.49Å; E745-R749 IonicContact OE2-NH2 3.7Å; E745-R749 PolarHBondContact OE2-NH2 2.83Å
746	E	52.3	Low	48	Very low	82 Å²	82	59.9 Å²	59.9	38%	0.383	30%	0.3	S	S	.	.	H	α-helix	trans	-72.1	-38.4	172.7	-163.2	176	154.7	0	0	110.2	H696 A743 N744 R749 F750	H696-E746 IonicContact CE1-OE1 2.8Å; A743-E746 VanDerWaalsContact C-N 3.28Å; A743-E746 HydrophobicContact CB-CB 3.74Å; A743-E746 WeakPolarHBondContact O-CB 3.48Å; A743-E746 PolarHBondContact O-N 2.86Å; N744-E746 PolarHBondContact O-N 2.92Å; E746-R749 PolarHBondContact O-N 3.44Å; E746-F750 WeakPolarHBondContact O-CB 3.48Å; E746-F750 PolarHBondContact O-N 3.26Å
747	I	49.5	Very low	47.5	Very low	39 Å²	39	62 Å²	62	20%	0.2	31%	0.305	C	S	.	.	H	α-helix	trans	-66.6	-43.3	169	-67.5	169.2	0	0	0	110.6	L708 V709 R712 N744 F750 D751	L708-I747 HydrophobicContact CB-CD1 4.12Å; L708-I747 HydrophobicContact CB-CG1 4.48Å; L708-I747 HydrophobicContact CD2-CD1 4Å; L708-I747 HydrophobicContact CD2-CG1 3.79Å; L708-I747 HydrophobicContact CG-CD1 3.84Å; L708-I747 HydrophobicContact CG-CG1 4.2Å; V709-I747 HydrophobicContact CG2-CD1 4.17Å; R712-I747 VanDerWaalsContact NH2-CD1 3.27Å; N744-I747 CarbonylContact O-C 3.53Å; N744-I747 WeakPolarHBondContact O-CA 3.45Å; N744-I747 WeakPolarHBondContact O-CB 3.23Å; N744-I747 PolarHBondContact O-N 3.02Å; I747-F750 PolarHBondContact O-N 3.21Å; I747-D751 VanDerWaalsContact O-CB 3.26Å; I747-D751 WeakPolarHBondContact O-CB 3.46Å; I747-D751 PolarHBondContact O-N 2.97Å
748	E	48.2	Very low	47	Very low	101 Å²	101	63.6 Å²	63.6	47%	0.472	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-44.2	173.2	-64.5	-167.5	171.3	0	0	111.5	K619 N744 F750 V752	K619-E748 IonicContact NZ-OE1 2.76Å; K619-E748 PolarHBondContact NZ-OE1 3.14Å; K619-E748 IonicContact NZ-OE2 2.64Å; K619-E748 PolarHBondContact NZ-OE2 2.72Å; N744-E748 PolarHBondContact O-N 2.81Å; E748-F750 VanDerWaalsContact C-N 3.32Å; E748-F750 PolarHBondContact O-N 3.06Å; E748-V752 VanDerWaalsContact O-CB 3.31Å; E748-V752 WeakPolarHBondContact O-CB 3.18Å; E748-V752 VanDerWaalsContact O-CG2 3.23Å; E748-V752 WeakPolarHBondContact O-CG2 3.47Å; E748-V752 PolarHBondContact O-N 3.05Å
749	R	47.3	Very low	46.3	Very low	123 Å²	123	64.7 Å²	64.7	46%	0.464	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-40.4	176.7	-77.8	170.7	-122.2	140.2	-9.8	110.7	E745 E746 S753	E745-R749 VanDerWaalsContact CB-NH2 3.33Å; E745-R749 WeakPolarHBondContact O-CA 3.28Å; E745-R749 WeakPolarHBondContact O-CB 3.46Å; E745-R749 WeakPolarHBondContact O-CD 3.23Å; E745-R749 WeakPolarHBondContact O-CG 3.09Å; E745-R749 PolarHBondContact O-N 3Å; E745-R749 PolarHBondContact O-NE 3.43Å; E745-R749 IonicContact OE2-CZ 3.67Å; E745-R749 IonicContact OE2-NE 3.49Å; E745-R749 IonicContact OE2-NH2 3.7Å; E745-R749 PolarHBondContact OE2-NH2 2.83Å; E746-R749 PolarHBondContact O-N 3.44Å; R749-S753 WeakPolarHBondContact O-CB 3.41Å; R749-S753 PolarHBondContact O-N 2.71Å; R749-S753 PolarHBondContact O-OG 3.22Å
750	F	36.8	Very low	45.7	Very low	52 Å²	52	67.9 Å²	67.9	23%	0.228	33%	0.332	C	S	.	.	H	α-helix	trans	-74.8	-44.4	-176.9	-169.2	-152.7	0	0	0	112.6	E746 I747 E748 V752 E754 F810 E811	E746-F750 WeakPolarHBondContact O-CB 3.48Å; E746-F750 PolarHBondContact O-N 3.26Å; I747-F750 PolarHBondContact O-N 3.21Å; E748-F750 VanDerWaalsContact C-N 3.32Å; E748-F750 PolarHBondContact O-N 3.06Å; F750-V752 VanDerWaalsContact C-N 3.31Å; F750-V752 PolarHBondContact O-N 3.07Å; F750-E754 PolarHBondContact O-N 2.85Å; F750-F810 HydrophobicContact CD1-CB 4.43Å; F750-F810 AromaticContact CD1-CD1 3.78Å; F750-F810 HydrophobicContact CD1-CD1 3.78Å; F750-F810 AromaticContact CD1-CD2 3.89Å; F750-F810 HydrophobicContact CD1-CD2 3.89Å; F750-F810 AromaticContact CD1-CE1 3.87Å; F750-F810 HydrophobicContact CD1-CE1 3.87Å; F750-F810 AromaticContact CD1-CE2 3.98Å; F750-F810 HydrophobicContact CD1-CE2 3.98Å; F750-F810 AromaticContact CD1-CG 3.81Å; F750-F810 HydrophobicContact CD1-CG 3.81Å; F750-F810 AromaticContact CD1-CZ 3.97Å; F750-F810 HydrophobicContact CD1-CZ 3.97Å; F750-F810 HydrophobicContact CD2-CD1 4.45Å; F750-F810 HydrophobicContact CD2-CE1 4.08Å; F750-F810 HydrophobicContact CE1-CB 3.64Å; F750-F810 AromaticContact CE1-CD1 3.26Å; F750-F810 HydrophobicContact CE1-CD1 3.26Å; F750-F810 AromaticContact CE1-CD2 3.92Å; F750-F810 HydrophobicContact CE1-CD2 3.92Å; F750-F810 AromaticContact CE1-CE1 3.77Å; F750-F810 HydrophobicContact CE1-CE1 3.77Å; F750-F810 HydrophobicContact CE1-CE2 4.36Å; F750-F810 AromaticContact CE1-CG 3.35Å; F750-F810 HydrophobicContact CE1-CG 3.35Å; F750-F810 HydrophobicContact CE1-CZ 4.3Å; F750-F810 AromaticContact CE2-CD1 4Å; F750-F810 HydrophobicContact CE2-CD1 4Å; F750-F810 AromaticContact CE2-CE1 3.96Å; F750-F810 HydrophobicContact CE2-CE1 3.96Å; F750-F810 HydrophobicContact CG-CD1 4.37Å; F750-F810 HydrophobicContact CG-CE1 4.04Å; F750-F810 HydrophobicContact CG-CE2 4.47Å; F750-F810 HydrophobicContact CG-CZ 4.11Å; F750-F810 HydrophobicContact CZ-CB 4.25Å; F750-F810 AromaticContact CZ-CD1 3.39Å; F750-F810 HydrophobicContact CZ-CD1 3.39Å; F750-F810 AromaticContact CZ-CE1 3.83Å; F750-F810 HydrophobicContact CZ-CE1 3.83Å; F750-F810 AromaticContact CZ-CG 3.97Å; F750-F810 HydrophobicContact CZ-CG 3.97Å; F750-E811 HydrophobicContact CE1-CG 3.91Å; F750-E811 WeakPolarHBondContact CE1-OE2 3Å; F750-E811 HydrophobicContact CZ-CG 3.58Å; F750-E811 WeakPolarHBondContact CZ-OE2 3.27Å
751	D	37.5	Very low	44.9	Very low	85 Å²	85	74 Å²	74	46%	0.455	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-35.8	176.1	-159.5	41.5	0	0	0	111.8	I747 H755	I747-D751 VanDerWaalsContact O-CB 3.26Å; I747-D751 WeakPolarHBondContact O-CB 3.46Å; I747-D751 PolarHBondContact O-N 2.97Å; D751-H755 WeakPolarHBondContact O-CB 3.31Å
752	V	34.8	Very low	44.1	Very low	94 Å²	94	74.2 Å²	74.2	57%	0.57	36%	0.364	S	S	*	.	H	α-helix	trans	-81.6	-46.1	176.7	175.1	0	0	0	0	112.9	E748 F750 A756	E748-V752 VanDerWaalsContact O-CB 3.31Å; E748-V752 WeakPolarHBondContact O-CB 3.18Å; E748-V752 VanDerWaalsContact O-CG2 3.23Å; E748-V752 WeakPolarHBondContact O-CG2 3.47Å; E748-V752 PolarHBondContact O-N 3.05Å; F750-V752 VanDerWaalsContact C-N 3.31Å; F750-V752 PolarHBondContact O-N 3.07Å; V752-A756 PolarHBondContact O-N 2.92Å; V752-A756 VanDerWaalsContact O-N 3.13Å
753	S	41.1	Very low	43	Very low	62 Å²	62	76 Å²	76	43%	0.434	38%	0.377	S	S	.	.	H	α-helix	trans	-70.5	-43.4	-172.4	58.8	0	0	0	0	113.1	R749 A756 E757	R749-S753 WeakPolarHBondContact O-CB 3.41Å; R749-S753 PolarHBondContact O-N 2.71Å; R749-S753 PolarHBondContact O-OG 3.22Å; S753-A756 WeakPolarHBondContact O-CB 3.41Å; S753-A756 PolarHBondContact O-N 3.46Å; S753-E757 PolarHBondContact O-N 3.5Å
754	E	42.3	Very low	42.4	Very low	17 Å²	17	79 Å²	79	8%	0.079	41%	0.409	C	S	.	.	H	α-helix	trans	-79.8	-25.2	-178.9	-167.3	176.4	-174.3	0	0	112.5	K684 F750 A756 E757 R758 F810	K684-E754 WeakPolarHBondContact CD-OE1 3.43Å; K684-E754 VanDerWaalsContact CD-OE2 3.3Å; K684-E754 WeakPolarHBondContact CD-OE2 3.3Å; K684-E754 VanDerWaalsContact CE-OE2 3.27Å; K684-E754 WeakPolarHBondContact CE-OE2 3.36Å; K684-E754 IonicContact NZ-OE1 3.99Å; K684-E754 PolarHBondContact NZ-OE1 2.9Å; K684-E754 IonicContact NZ-OE2 2.81Å; K684-E754 PolarHBondContact NZ-OE2 2.81Å; F750-E754 PolarHBondContact O-N 2.85Å; E754-A756 VanDerWaalsContact C-N 3.28Å; E754-E757 PolarHBondContact O-N 2.72Å; E754-R758 VanDerWaalsContact CG-NH1 3.3Å; E754-R758 PolarHBondContact O-N 3.26Å; E754-R758 IonicContact OE1-CZ 2.66Å; E754-R758 VanDerWaalsContact OE1-CZ 3.28Å; E754-R758 IonicContact OE1-NH1 2.76Å; E754-R758 PolarHBondContact OE1-NH1 3.44Å; E754-R758 IonicContact OE1-NH2 3.95Å; E754-R758 PolarHBondContact OE1-NH2 3.2Å; E754-F810 WeakPolarHBondContact OE2-CE1 3.09Å
755	H	39	Very low	41.7	Very low	84 Å²	84	80 Å²	80	39%	0.389	42%	0.418	S	S	.	.	H	α-helix	trans	-68.9	-29.5	169.6	-159	-35.8	0	0	0	111.4	D751 L759	D751-H755 WeakPolarHBondContact O-CB 3.31Å; H755-L759 WeakPolarHBondContact O-CG 3.46Å; H755-L759 PolarHBondContact O-N 3.32Å; H755-L759 VanDerWaalsContact O-N 3.12Å
756	A	41	Very low	41.1	Very low	46 Å²	46	82.1 Å²	82.1	38%	0.38	44%	0.436	S	S	.	.	H	α-helix	trans	-67.7	-51.4	167.8	0	0	0	0	0	111.5	V752 S753 E754 R758 L759 E760	V752-A756 PolarHBondContact O-N 2.92Å; V752-A756 VanDerWaalsContact O-N 3.13Å; S753-A756 WeakPolarHBondContact O-CB 3.41Å; S753-A756 PolarHBondContact O-N 3.46Å; E754-A756 VanDerWaalsContact C-N 3.28Å; A756-R758 PolarHBondContact O-N 2.96Å; A756-R758 VanDerWaalsContact O-N 3.14Å; A756-L759 WeakPolarHBondContact O-CB 3.04Å; A756-L759 PolarHBondContact O-N 2.64Å; A756-E760 PolarHBondContact O-N 3.34Å
757	E	38.8	Very low	40.7	Very low	76 Å²	76	86 Å²	86	36%	0.355	45%	0.454	S	S	.	.	H	α-helix	trans	-59.4	-28.3	179.2	-69.9	-176.1	160.7	0	0	113.2	K591 S753 E754 Q761	K591-E757 IonicContact NZ-OE1 3.3Å; K591-E757 PolarHBondContact NZ-OE1 3.34Å; S753-E757 PolarHBondContact O-N 3.5Å; E754-E757 PolarHBondContact O-N 2.72Å; E757-Q761 VanDerWaalsContact O-CG 3.3Å; E757-Q761 WeakPolarHBondContact O-CG 2.97Å; E757-Q761 PolarHBondContact O-N 3.49Å; E757-Q761 VanDerWaalsContact O-N 3.08Å
758	R	44.9	Very low	40.3	Very low	54 Å²	54	87.8 Å²	87.8	20%	0.204	46%	0.462	C	S	.	.	H	α-helix	trans	-85.1	-21.5	171	-79.3	-159.2	-173	70.7	20.1	116.4	F680 E754 A756 E760 L762	F680-R758 VanDerWaalsContact CE1-NH2 3.31Å; E754-R758 VanDerWaalsContact CG-NH1 3.3Å; E754-R758 PolarHBondContact O-N 3.26Å; E754-R758 IonicContact OE1-CZ 2.66Å; E754-R758 VanDerWaalsContact OE1-CZ 3.28Å; E754-R758 IonicContact OE1-NH1 2.76Å; E754-R758 PolarHBondContact OE1-NH1 3.44Å; E754-R758 IonicContact OE1-NH2 3.95Å; E754-R758 PolarHBondContact OE1-NH2 3.2Å; A756-R758 PolarHBondContact O-N 2.96Å; A756-R758 VanDerWaalsContact O-N 3.14Å; R758-E760 VanDerWaalsContact C-N 3.33Å; R758-L762 VanDerWaalsContact O-CB 3.27Å; R758-L762 WeakPolarHBondContact O-CB 3.32Å; R758-L762 WeakPolarHBondContact O-CD1 3.42Å; R758-L762 VanDerWaalsContact O-CG 3.23Å; R758-L762 WeakPolarHBondContact O-CG 3.43Å; R758-L762 PolarHBondContact O-N 3.44Å
759	L	40.3	Very low	39.9	Very low	98 Å²	98	87.2 Å²	87.2	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-65.9	-43.3	165.1	-77.6	162.5	0	0	0	109.5	H755 A756 Q761 L762 Q763	H755-L759 WeakPolarHBondContact O-CG 3.46Å; H755-L759 PolarHBondContact O-N 3.32Å; H755-L759 VanDerWaalsContact O-N 3.12Å; A756-L759 WeakPolarHBondContact O-CB 3.04Å; A756-L759 PolarHBondContact O-N 2.64Å; L759-Q761 VanDerWaalsContact C-N 3.35Å; L759-Q761 PolarHBondContact O-N 2.79Å; L759-L762 PolarHBondContact O-N 3Å; L759-Q763 WeakPolarHBondContact O-CG 3.08Å; L759-Q763 PolarHBondContact O-N 3.37Å
760	E	42.2	Very low	39.7	Very low	110 Å²	110	83.2 Å²	83.2	51%	0.514	46%	0.456	S	S	.	.	H	α-helix	trans	-65.4	-32.1	175.7	-65	-177.7	160.3	0	0	113.2	A756 R758	A756-E760 PolarHBondContact O-N 3.34Å; R758-E760 VanDerWaalsContact C-N 3.33Å
761	Q	36.4	Very low	39.9	Very low	131 Å²	131	86.6 Å²	86.6	61%	0.612	47%	0.474	S	S	*	.	H	α-helix	trans	-78.2	-36.9	173.4	-73.4	173.6	2.9	0	0	113.8	E757 L759 Q763 G764	E757-Q761 VanDerWaalsContact O-CG 3.3Å; E757-Q761 WeakPolarHBondContact O-CG 2.97Å; E757-Q761 PolarHBondContact O-N 3.49Å; E757-Q761 VanDerWaalsContact O-N 3.08Å; L759-Q761 VanDerWaalsContact C-N 3.35Å; L759-Q761 PolarHBondContact O-N 2.79Å; Q761-Q763 VanDerWaalsContact C-N 3.34Å; Q761-G764 PolarHBondContact O-N 2.99Å; Q761-G764 VanDerWaalsContact O-N 3.08Å
762	L	38	Very low	40.1	Very low	69 Å²	69	84.8 Å²	84.8	36%	0.361	46%	0.464	S	S	.	.	H	α-helix	trans	-71.4	-29.4	178.9	-75.3	167	0	0	0	112.4	R758 L759 G764 S765 M768	R758-L762 VanDerWaalsContact O-CB 3.27Å; R758-L762 WeakPolarHBondContact O-CB 3.32Å; R758-L762 WeakPolarHBondContact O-CD1 3.42Å; R758-L762 VanDerWaalsContact O-CG 3.23Å; R758-L762 WeakPolarHBondContact O-CG 3.43Å; R758-L762 PolarHBondContact O-N 3.44Å; L759-L762 PolarHBondContact O-N 3Å; L762-G764 PolarHBondContact O-N 2.92Å; L762-S765 PolarHBondContact O-N 3.37Å; L762-S765 PolarHBondContact O-OG 3.13Å; L762-M768 HydrophobicContact CD2-SD 4.01Å
763	Q	37.8	Very low	40.5	Very low	160 Å²	160	86.1 Å²	86.1	75%	0.748	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-9.3	166.8	-77	175.6	-22.9	0	0	113.8	L759 Q761	L759-Q763 WeakPolarHBondContact O-CG 3.08Å; L759-Q763 PolarHBondContact O-N 3.37Å; Q761-Q763 VanDerWaalsContact C-N 3.34Å
764	G	38.8	Very low	40.4	Very low	67 Å²	67	90.8 Å²	90.8	69%	0.691	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-4.5	172.2	0	0	0	0	0	115.9	Q761 L762	Q761-G764 PolarHBondContact O-N 2.99Å; Q761-G764 VanDerWaalsContact O-N 3.08Å; L762-G764 PolarHBondContact O-N 2.92Å
765	S	32.3	Very low	40.2	Very low	50 Å²	50	94 Å²	94	35%	0.35	49%	0.492	S	S	.	.			trans	-126.8	83.6	-172.7	60.2	0	0	0	0	113.3	L762 E767 M768	L762-S765 PolarHBondContact O-N 3.37Å; L762-S765 PolarHBondContact O-OG 3.13Å; S765-E767 PolarHBondContact O-N 2.95Å; S765-E767 VanDerWaalsContact O-N 3.1Å; S765-M768 PolarHBondContact O-N 3.27Å
766	V	43.7	Very low	40.2	Very low	125 Å²	125	93 Å²	93	76%	0.758	49%	0.491	S	S	*	.	H	α-helix	trans	-52.3	-33	-176	-178.4	0	0	0	0	113.7	M768 A770	V766-M768 VanDerWaalsContact C-N 3.32Å; V766-M768 PolarHBondContact O-N 3.08Å; V766-A770 WeakPolarHBondContact O-CB 3.35Å; V766-A770 PolarHBondContact O-N 3.44Å
767	E	43.8	Very low	40.1	Very low	162 Å²	162	94.9 Å²	94.9	76%	0.757	50%	0.495	S	S	*	.	H	α-helix	trans	-62.9	-32.1	-178	-64.5	-176.3	127.3	0	0	113.9	S765 M771	S765-E767 PolarHBondContact O-N 2.95Å; S765-E767 VanDerWaalsContact O-N 3.1Å; E767-M771 WeakPolarHBondContact O-CB 3.45Å; E767-M771 PolarHBondContact O-N 2.97Å
768	M	40.4	Very low	40	Very low	77 Å²	77	93.4 Å²	93.4	38%	0.379	50%	0.5	S	S	.	.	H	α-helix	trans	-78.1	-36.5	-172.5	-152.8	-176.6	-142.1	0	0	112.7	L762 S765 V766 L772	L762-M768 HydrophobicContact CD2-SD 4.01Å; S765-M768 PolarHBondContact O-N 3.27Å; V766-M768 VanDerWaalsContact C-N 3.32Å; V766-M768 PolarHBondContact O-N 3.08Å; M768-L772 WeakPolarHBondContact O-CB 3.38Å; M768-L772 PolarHBondContact O-N 2.92Å; M768-L772 VanDerWaalsContact O-N 3.08Å
769	D	40.6	Very low	39.5	Very low	90 Å²	90	97.2 Å²	97.2	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-75.5	-39.1	173.1	-78.1	-35.9	0	0	0	110.9	K656 M771 L772 E773	K656-D769 IonicContact NZ-OD1 3.87Å; D769-M771 VanDerWaalsContact C-N 3.29Å; D769-M771 PolarHBondContact O-N 3.18Å; D769-L772 PolarHBondContact O-N 3.29Å; D769-E773 WeakPolarHBondContact O-CB 3.35Å; D769-E773 PolarHBondContact O-N 3.28Å
770	A	43.3	Very low	39.3	Very low	39 Å²	39	98.6 Å²	98.6	32%	0.322	53%	0.529	S	S	.	.	H	α-helix	trans	-62.7	-32.8	173.6	0	0	0	0	0	113.5	V766 K774	V766-A770 WeakPolarHBondContact O-CB 3.35Å; V766-A770 PolarHBondContact O-N 3.44Å; A770-K774 WeakPolarHBondContact O-CB 3.48Å; A770-K774 WeakPolarHBondContact O-CG 3.11Å; A770-K774 PolarHBondContact O-N 3.16Å
771	M	41.8	Very low	39	Very low	122 Å²	122	103.8 Å²	103.8	60%	0.601	54%	0.544	S	S	*	.	H	α-helix	trans	-70.9	-45.5	173.8	-172.5	-170.5	-46.9	0	0	111.4	E767 D769 K774 Q775	E767-M771 WeakPolarHBondContact O-CB 3.45Å; E767-M771 PolarHBondContact O-N 2.97Å; D769-M771 VanDerWaalsContact C-N 3.29Å; D769-M771 PolarHBondContact O-N 3.18Å; M771-K774 PolarHBondContact O-N 3.3Å; M771-Q775 WeakPolarHBondContact O-CB 3.02Å; M771-Q775 PolarHBondContact O-N 2.81Å
772	L	41.1	Very low	39	Very low	48 Å²	48	107.9 Å²	107.9	25%	0.251	55%	0.554	S	S	.	*	H	α-helix	trans	-67	-41.5	177.8	-176.9	104.7	0	0	0	112.1	K656 M768 D769 Q775 V776	K656-L772 HydrophobicContact CD-CD2 4.43Å; K656-L772 VanDerWaalsContact CE-CD2 3.45Å; M768-L772 WeakPolarHBondContact O-CB 3.38Å; M768-L772 PolarHBondContact O-N 2.92Å; M768-L772 VanDerWaalsContact O-N 3.08Å; D769-L772 PolarHBondContact O-N 3.29Å; L772-Q775 CarbonylContact O-C 3.51Å; L772-Q775 WeakPolarHBondContact O-CA 3.17Å; L772-Q775 WeakPolarHBondContact O-CB 3.31Å; L772-Q775 PolarHBondContact O-N 2.95Å; L772-V776 HydrophobicContact CG-CG2 4.27Å; L772-V776 WeakPolarHBondContact O-CB 3.13Å; L772-V776 WeakPolarHBondContact O-CG2 3.4Å; L772-V776 PolarHBondContact O-N 3.5Å
773	E	42.3	Very low	38.5	Very low	122 Å²	122	113.4 Å²	113.4	57%	0.57	58%	0.577	S	S	*	*	H	α-helix	trans	-59.6	-46.8	176.6	-177.9	173.9	-132.6	0	0	110.2	D769 Q775 V776 L777	D769-E773 WeakPolarHBondContact O-CB 3.35Å; D769-E773 PolarHBondContact O-N 3.28Å; E773-Q775 VanDerWaalsContact C-N 3.29Å; E773-Q775 PolarHBondContact O-N 3.32Å; E773-V776 PolarHBondContact O-N 3.17Å; E773-L777 HydrophobicContact CG-CD1 3.92Å; E773-L777 VanDerWaalsContact O-CB 3.27Å; E773-L777 WeakPolarHBondContact O-CB 3.26Å; E773-L777 VanDerWaalsContact O-CG 3.23Å; E773-L777 WeakPolarHBondContact O-CG 3.22Å; E773-L777 PolarHBondContact O-N 2.75Å
774	K	40.7	Very low	38.2	Very low	160 Å²	160	111.8 Å²	111.8	70%	0.696	58%	0.584	S	S	*	*	H	α-helix	trans	-61.8	-33.5	171.1	-75.3	176.9	179.1	178.8	0	113.4	A770 M771 G778	A770-K774 WeakPolarHBondContact O-CB 3.48Å; A770-K774 WeakPolarHBondContact O-CG 3.11Å; A770-K774 PolarHBondContact O-N 3.16Å; M771-K774 PolarHBondContact O-N 3.3Å; K774-G778 WeakPolarHBondContact O-CA 3.45Å; K774-G778 PolarHBondContact O-N 3.09Å
775	Q	37.8	Very low	37.7	Very low	84 Å²	84	116 Å²	116	39%	0.393	59%	0.59	S	S	.	*	H	α-helix	trans	-76	-35.4	178.3	-157	177.4	-2	0	0	112.4	E665 M771 L772 E773 M779	E665-Q775 PolarHBondContact OE1-NE2 3.17Å; M771-Q775 WeakPolarHBondContact O-CB 3.02Å; M771-Q775 PolarHBondContact O-N 2.81Å; L772-Q775 CarbonylContact O-C 3.51Å; L772-Q775 WeakPolarHBondContact O-CA 3.17Å; L772-Q775 WeakPolarHBondContact O-CB 3.31Å; L772-Q775 PolarHBondContact O-N 2.95Å; E773-Q775 VanDerWaalsContact C-N 3.29Å; E773-Q775 PolarHBondContact O-N 3.32Å; Q775-M779 WeakPolarHBondContact O-CG 3.08Å; Q775-M779 PolarHBondContact O-N 3.22Å; Q775-M779 VanDerWaalsContact O-N 3.08Å
776	V	37.3	Very low	37.5	Very low	62 Å²	62	121.3 Å²	121.3	38%	0.376	61%	0.614	S	S	.	*	H	α-helix	trans	-73	-46.7	175.1	168.6	0	0	0	0	110.6	L772 E773 G778 M779 L780	L772-V776 HydrophobicContact CG-CG2 4.27Å; L772-V776 WeakPolarHBondContact O-CB 3.13Å; L772-V776 WeakPolarHBondContact O-CG2 3.4Å; L772-V776 PolarHBondContact O-N 3.5Å; E773-V776 PolarHBondContact O-N 3.17Å; V776-G778 VanDerWaalsContact C-N 3.3Å; V776-G778 PolarHBondContact O-N 3.25Å; V776-M779 PolarHBondContact O-N 3.21Å; V776-L780 HydrophobicContact CG1-CD1 3.82Å; V776-L780 WeakPolarHBondContact O-CB 2.74Å; V776-L780 WeakPolarHBondContact O-CG 3.35Å; V776-L780 PolarHBondContact O-N 2.89Å
777	L	39.9	Very low	36.8	Very low	87 Å²	87	125.3 Å²	125.3	46%	0.455	62%	0.621	S	S	.	*	H	α-helix	trans	-60.9	-40	171.6	-68.7	170	0	0	0	111.3	E773 M779 L780 W781	E773-L777 HydrophobicContact CG-CD1 3.92Å; E773-L777 VanDerWaalsContact O-CB 3.27Å; E773-L777 WeakPolarHBondContact O-CB 3.26Å; E773-L777 VanDerWaalsContact O-CG 3.23Å; E773-L777 WeakPolarHBondContact O-CG 3.22Å; E773-L777 PolarHBondContact O-N 2.75Å; L777-M779 VanDerWaalsContact C-N 3.29Å; L777-M779 PolarHBondContact O-N 3.04Å; L777-L780 PolarHBondContact O-N 3.26Å; L777-W781 WeakPolarHBondContact O-CB 3.35Å; L777-W781 PolarHBondContact O-N 3.29Å
778	G	36.2	Very low	36	Very low	45 Å²	45	122.9 Å²	122.9	46%	0.464	62%	0.622	S	S	.	*	H	α-helix	trans	-66.8	-22.9	175.7	0	0	0	0	0	114.9	K774 V776	K774-G778 WeakPolarHBondContact O-CA 3.45Å; K774-G778 PolarHBondContact O-N 3.09Å; V776-G778 VanDerWaalsContact C-N 3.3Å; V776-G778 PolarHBondContact O-N 3.25Å
779	M	36	Very low	35.9	Very low	133 Å²	133	123.8 Å²	123.8	66%	0.655	63%	0.634	S	S	*	*	H	α-helix	trans	-84.8	-36.5	168.5	-71.9	-173	-58.9	0	0	112.1	Q775 V776 L777 W781	Q775-M779 WeakPolarHBondContact O-CG 3.08Å; Q775-M779 PolarHBondContact O-N 3.22Å; Q775-M779 VanDerWaalsContact O-N 3.08Å; V776-M779 PolarHBondContact O-N 3.21Å; L777-M779 VanDerWaalsContact C-N 3.29Å; L777-M779 PolarHBondContact O-N 3.04Å; M779-W781 VanDerWaalsContact C-N 3.27Å; M779-W781 PolarHBondContact O-N 3.28Å
780	L	35.4	Very low	35.2	Very low	127 Å²	127	125.9 Å²	125.9	67%	0.665	65%	0.645	S	S	*	*	H	α-helix	trans	-73.1	-14.9	179	-72.8	167.3	0	0	0	114	V776 L777	V776-L780 HydrophobicContact CG1-CD1 3.82Å; V776-L780 WeakPolarHBondContact O-CB 2.74Å; V776-L780 WeakPolarHBondContact O-CG 3.35Å; V776-L780 PolarHBondContact O-N 2.89Å; L777-L780 PolarHBondContact O-N 3.26Å
781	W	35	Very low	34.2	Very low	219 Å²	219	133.7 Å²	133.7	83%	0.83	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	29.8	178.4	-81.7	73.3	0	0	0	114.4	L777 M779	L777-W781 WeakPolarHBondContact O-CB 3.35Å; L777-W781 PolarHBondContact O-N 3.29Å; M779-W781 VanDerWaalsContact C-N 3.27Å; M779-W781 PolarHBondContact O-N 3.28Å
782	R	36.5	Very low	33.6	Very low	218 Å²	218	136.3 Å²	136.3	82%	0.823	68%	0.683	S	S	*	*	S	Bend	trans	-135.1	53	164.1	-73.7	-157	-60.5	-168.5	-0.1	113.9
783	E	28.8	Very low	33	Very low	184 Å²	184	139.5 Å²	139.5	86%	0.86	71%	0.706	S	S	*	*			trans	-157.6	85.1	156.1	-122.7	166.5	-143.4	0	0	111.4
784	S	30.9	Very low	32.1	Very low	127 Å²	127	138 Å²	138	89%	0.888	71%	0.709	S	S	*	*			trans	-160.3	45.5	168.1	-80.9	0	0	0	0	111.9
785	D	28.1	Very low	31.3	Very low	154 Å²	154	138.2 Å²	138.2	82%	0.824	71%	0.707	S	S	*	*	S	Bend	trans	-137.5	151.3	159	-118.1	-40.1	0	0	0	108.9
786	L	29	Very low	30.6	Very low	163 Å²	163	140.5 Å²	140.5	85%	0.853	72%	0.722	S	S	*	*			trans	65.6	84.3	-175.3	-51.9	-179.7	0	0	0	117
787	K	27.9	Very low	29.9	Very low	209 Å²	209	141.4 Å²	141.4	91%	0.909	74%	0.744	S	S	*	*			trans	-85.6	112.8	140.5	-76.1	179.3	179.2	174.9	0	107.2
788	S	26.6	Very low	29.2	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	76%	0.764	S	S	*	*				82.2	156.8	98.4	-125.1	0	0	0	0	113.4
789	P	39	Very low	28.6	Very low	97 Å²	97	145.9 Å²	145.9	63%	0.63	77%	0.774	S	S	*	*			cis	-141.2	178.8	14.3	45	-27.1	0	0	0	118.1
790	N	25.6	Very low	28.1	Very low	133 Å²	133	144.9 Å²	144.9	71%	0.711	78%	0.776	S	S	*	*			trans	62.3	101.3	151.8	-58.6	-19.6	0	0	0	120.8
791	F	23.4	Very low	27.6	Very low	203 Å²	203	145.4 Å²	145.4	89%	0.89	78%	0.779	S	S	*	*				-179.8	150.5	90.2	-110.7	-83.1	0	0	0	112.1
792	H	28.1	Very low	27.2	Very low	178 Å²	178	141.2 Å²	141.2	82%	0.824	77%	0.772	S	S	*	*			trans	-111.4	149.8	165.7	-94.4	-63	0	0	0	109.2
793	P	27.7	Very low	26.8	Very low	115 Å²	115	137.8 Å²	137.8	75%	0.747	77%	0.77	S	S	*	*				-142.4	149.8	100	37	-23	0	0	0	115.8
794	S	23.4	Very low	26.7	Very low	91 Å²	91	134 Å²	134	64%	0.636	76%	0.764	S	S	*	*				25.6	132.1	118.6	-157.8	0	0	0	0	118
795	Y	24.1	Very low	26.5	Very low	164 Å²	164	132.5 Å²	132.5	64%	0.643	76%	0.758	S	S	*	*			cis	-163.7	160.7	23.9	-145.6	-146.9	0	0	0	113.7
796	N	23.6	Very low	26.4	Very low	132 Å²	132	127.4 Å²	127.4	71%	0.706	74%	0.742	S	S	*	*			trans	44	127	154.2	-69.7	-0.7	0	0	0	123
797	G	23.4	Very low	26.3	Very low	81 Å²	81	129.2 Å²	129.2	84%	0.835	74%	0.739	S	S	*	*			trans	-166.1	84.2	165.2	0	0	0	0	0	111.7
798	T	24.1	Very low	26.3	Very low	143 Å²	143	121 Å²	121	88%	0.877	71%	0.714	S	S	*	*			trans	-54.6	144.4	-174.2	49.5	0	0	0	0	116.2
799	A	23.8	Very low	26.6	Very low	83 Å²	83	116.8 Å²	116.8	69%	0.686	68%	0.684	S	S	*	*				179.8	153.7	116	0	0	0	0	0	113.7
800	T	25.6	Very low	26	Very low	112 Å²	112	113 Å²	113	69%	0.687	66%	0.658	S	S	*	*			trans	34.2	117.5	143.1	58.3	0	0	0	0	118.7
801	D	25	Very low	25.9	Very low	137 Å²	137	107.4 Å²	107.4	73%	0.733	63%	0.627	S	S	*	*				125	160.8	67	-91.4	-11.5	0	0	0	107.5
802	L	27.6	Very low	26.5	Very low	131 Å²	131	98.6 Å²	98.6	69%	0.686	59%	0.591	S	S	*	*			cis	-150.6	160.2	-6.5	-106	154.2	0	0	0	107.7
803	L	26.6	Very low	26.8	Very low	147 Å²	147	93.6 Å²	93.6	77%	0.77	57%	0.574	S	S	*	*			trans	35.1	124	152.6	-58.9	171.6	0	0	0	120.6
804	S	27.6	Very low	26.7	Very low	105 Å²	105	94.6 Å²	94.6	73%	0.734	57%	0.573	S	S	*	*				76	146	58	-164.8	0	0	0	0	115
805	A	25.8	Very low	26.8	Very low	94 Å²	94	97.9 Å²	97.9	78%	0.777	58%	0.579	S	S	*	*			trans	59.9	130.2	-178.3	0	0	0	0	0	116.1
806	G	27.5	Very low	26.8	Very low	47 Å²	47	95.7 Å²	95.7	49%	0.485	58%	0.582	S	S	.	*			cis	96.4	122.6	6.6	0	0	0	0	0	111.9
807	Y	25.3	Very low	26.9	Very low	201 Å²	201	95.2 Å²	95.2	79%	0.788	59%	0.589	S	S	*	*			trans	64.5	150.3	-174.1	-50.6	-80.3	0	0	0	113.9
808	G	28.8	Very low	26.9	Very low	36 Å²	36	97.6 Å²	97.6	37%	0.371	59%	0.587	S	S	.	*			cis	105	-176	8.6	0	0	0	0	0	112.4	H682	H682-G808 WeakPolarHBondContact CD2-CA 3.09Å
809	P	32.8	Very low	26.9	Very low	22 Å²	22	97.9 Å²	97.9	14%	0.143	58%	0.582	C	S	.	*			cis	-124.9	-124.9	1.5	38.8	-20.6	0	0	0	112.2	V681 H682 L685	V681-P809 CarbonylContact C-O 3.47Å; V681-P809 HydrophobicContact CG1-CB 4.28Å; V681-P809 CarbonylContact O-C 3.42Å; H682-P809 CarbonylContact C-O 3.5Å; H682-P809 WeakPolarHBondContact CA-O 3.27Å; L685-P809 WeakPolarHBondContact CA-O 2.85Å; L685-P809 WeakPolarHBondContact CB-O 3.31Å; L685-P809 HydrophobicContact CD2-CG 3.7Å; L685-P809 PolarHBondContact N-O 2.72Å
810	F	25.3	Very low	27	Very low	19 Å²	19	102.1 Å²	102.1	8%	0.083	59%	0.585	C	S	.	*			trans	-74.9	142.7	-168.4	-83.8	-77.9	0	0	0	127.2	V681 K684 L685 F750 E754	V681-F810 HydrophobicContact CB-CE2 4.45Å; V681-F810 HydrophobicContact CB-CZ 4.37Å; V681-F810 HydrophobicContact CG1-CD1 4.15Å; V681-F810 HydrophobicContact CG1-CD2 3.44Å; V681-F810 VanDerWaalsContact CG1-CD2 3.44Å; V681-F810 HydrophobicContact CG1-CE1 4.12Å; V681-F810 HydrophobicContact CG1-CE2 3.39Å; V681-F810 HydrophobicContact CG1-CG 3.81Å; V681-F810 HydrophobicContact CG1-CZ 3.74Å; V681-F810 HydrophobicContact CG2-CE1 4.07Å; V681-F810 HydrophobicContact CG2-CE2 4.23Å; V681-F810 HydrophobicContact CG2-CZ 3.76Å; V681-F810 WeakPolarHBondContact O-CA 3.36Å; V681-F810 PolarHBondContact O-N 2.67Å; K684-F810 HydrophobicContact CD-CD1 4.02Å; K684-F810 HydrophobicContact CG-CD1 3.94Å; L685-F810 WeakPolarHBondContact CA-O 3.28Å; L685-F810 WeakPolarHBondContact CB-O 3.33Å; L685-F810 WeakPolarHBondContact CD1-O 3.47Å; L685-F810 WeakPolarHBondContact CD2-O 3.49Å; L685-F810 WeakPolarHBondContact CG-O 3.41Å; L685-F810 VanDerWaalsContact N-CA 3.34Å; L685-F810 PolarHBondContact N-O 3.23Å; F750-F810 HydrophobicContact CD1-CB 4.43Å; F750-F810 AromaticContact CD1-CD1 3.78Å; F750-F810 HydrophobicContact CD1-CD1 3.78Å; F750-F810 AromaticContact CD1-CD2 3.89Å; F750-F810 HydrophobicContact CD1-CD2 3.89Å; F750-F810 AromaticContact CD1-CE1 3.87Å; F750-F810 HydrophobicContact CD1-CE1 3.87Å; F750-F810 AromaticContact CD1-CE2 3.98Å; F750-F810 HydrophobicContact CD1-CE2 3.98Å; F750-F810 AromaticContact CD1-CG 3.81Å; F750-F810 HydrophobicContact CD1-CG 3.81Å; F750-F810 AromaticContact CD1-CZ 3.97Å; F750-F810 HydrophobicContact CD1-CZ 3.97Å; F750-F810 HydrophobicContact CD2-CD1 4.45Å; F750-F810 HydrophobicContact CD2-CE1 4.08Å; F750-F810 HydrophobicContact CE1-CB 3.64Å; F750-F810 AromaticContact CE1-CD1 3.26Å; F750-F810 HydrophobicContact CE1-CD1 3.26Å; F750-F810 AromaticContact CE1-CD2 3.92Å; F750-F810 HydrophobicContact CE1-CD2 3.92Å; F750-F810 AromaticContact CE1-CE1 3.77Å; F750-F810 HydrophobicContact CE1-CE1 3.77Å; F750-F810 HydrophobicContact CE1-CE2 4.36Å; F750-F810 AromaticContact CE1-CG 3.35Å; F750-F810 HydrophobicContact CE1-CG 3.35Å; F750-F810 HydrophobicContact CE1-CZ 4.3Å; F750-F810 AromaticContact CE2-CD1 4Å; F750-F810 HydrophobicContact CE2-CD1 4Å; F750-F810 AromaticContact CE2-CE1 3.96Å; F750-F810 HydrophobicContact CE2-CE1 3.96Å; F750-F810 HydrophobicContact CG-CD1 4.37Å; F750-F810 HydrophobicContact CG-CE1 4.04Å; F750-F810 HydrophobicContact CG-CE2 4.47Å; F750-F810 HydrophobicContact CG-CZ 4.11Å; F750-F810 HydrophobicContact CZ-CB 4.25Å; F750-F810 AromaticContact CZ-CD1 3.39Å; F750-F810 HydrophobicContact CZ-CD1 3.39Å; F750-F810 AromaticContact CZ-CE1 3.83Å; F750-F810 HydrophobicContact CZ-CE1 3.83Å; F750-F810 AromaticContact CZ-CG 3.97Å; F750-F810 HydrophobicContact CZ-CG 3.97Å; E754-F810 WeakPolarHBondContact OE2-CE1 3.09Å
811	E	25.2	Very low	26.9	Very low	15 Å²	15	103.4 Å²	103.4	7%	0.07	59%	0.586	C	S	.	*			trans	129.2	76.2	152.6	-65.1	139.4	-41.8	0	0	123.7	K684 L685 K687 R688 H696 F750	K684-E811 VanDerWaalsContact C-C 3.49Å; K684-E811 VanDerWaalsContact CG-CA 3.42Å; K684-E811 CarbonylContact O-C 3.54Å; K684-E811 WeakPolarHBondContact O-CA 3.45Å; K684-E811 PolarHBondContact O-N 3.08Å; K684-E811 VanDerWaalsContact O-N 3.11Å; K684-E811 VanDerWaalsContact O-O 3.13Å; L685-E811 VanDerWaalsContact CA-N 3.32Å; K687-E811 CarbonylContact C-O 3.45Å; R688-E811 WeakPolarHBondContact CA-O 3.42Å; R688-E811 HydrophobicContact CB-CB 3.88Å; R688-E811 WeakPolarHBondContact CB-O 3.33Å; R688-E811 HydrophobicContact CG-CB 3.77Å; R688-E811 IonicContact CZ-OE1 3.07Å; R688-E811 IonicContact CZ-OE2 3.53Å; R688-E811 PolarHBondContact N-O 3.2Å; R688-E811 IonicContact NH1-OE1 2.73Å; R688-E811 PolarHBondContact NH1-OE1 3.21Å; R688-E811 IonicContact NH1-OE2 3.43Å; R688-E811 PolarHBondContact NH1-OE2 2.7Å; R688-E811 VanDerWaalsContact NH2-CD 3.28Å; R688-E811 IonicContact NH2-OE1 3.82Å; R688-E811 IonicContact NH2-OE2 2.83Å; R688-E811 PolarHBondContact NH2-OE2 3.09Å; H696-E811 IonicContact NE2-OE1 2.62Å; H696-E811 IonicContact NE2-OE2 3.53Å; H696-E811 PolarHBondContact NE2-OE2 2.8Å; F750-E811 HydrophobicContact CE1-CG 3.91Å; F750-E811 WeakPolarHBondContact CE1-OE2 3Å; F750-E811 HydrophobicContact CZ-CG 3.58Å; F750-E811 WeakPolarHBondContact CZ-OE2 3.27Å
812	S	34.3	Very low	26.9	Very low	18 Å²	18	108.7 Å²	108.7	13%	0.126	60%	0.596	C	S	.	*			trans	-59.7	161	133	59.2	0	0	0	0	109.8	K684	K684-S812 VanDerWaalsContact CD-OG 3.32Å; K684-S812 WeakPolarHBondContact CD-OG 3.31Å; K684-S812 VanDerWaalsContact CE-O 3.31Å; K684-S812 WeakPolarHBondContact CE-O 3.29Å; K684-S812 WeakPolarHBondContact CE-OG 3.36Å; K684-S812 PolarHBondContact O-N 2.96Å
813	P	34.7	Very low	26.8	Very low	73 Å²	73	113.5 Å²	113.5	47%	0.474	61%	0.605	S	S	.	*				-137	169.7	111.7	37.7	-26.8	0	0	0	113.4
814	N	26.7	Very low	26.9	Very low	136 Å²	136	112 Å²	112	73%	0.727	61%	0.607	S	S	*	*			trans	52.9	160	141.7	-61.5	17.7	0	0	0	120.4
815	E	25.7	Very low	26.9	Very low	160 Å²	160	113.9 Å²	113.9	75%	0.748	61%	0.608	S	S	*	*			cis	-136	177.6	1.3	-146	140.9	-109.3	0	0	113.9
816	T	23.2	Very low	27.6	Very low	118 Å²	118	114.7 Å²	114.7	72%	0.724	61%	0.606	S	S	*	*			trans	-66.3	147.4	-173.5	50.5	0	0	0	0	115
817	S	26.4	Very low	27.6	Very low	122 Å²	122	119.7 Å²	119.7	85%	0.853	62%	0.62	S	S	*	*			trans	-144	123.7	142.7	-87.4	0	0	0	0	109.2
818	V	22.7	Very low	28	Very low	131 Å²	131	115.4 Å²	115.4	79%	0.794	62%	0.619	S	S	*	*			trans	-104.2	126.7	177.9	173.9	0	0	0	0	109
819	I	24.1	Very low	28.6	Very low	148 Å²	148	119.2 Å²	119.2	76%	0.759	64%	0.638	S	S	*	*			trans	-130.6	123.4	166	-57.7	-177.1	0	0	0	108.9	I821	I819-I821 HydrophobicContact CG2-CD1 4.39Å; I819-I821 HydrophobicContact CG2-CG1 4.01Å
820	K	25.1	Very low	28.3	Very low	173 Å²	173	124.9 Å²	124.9	75%	0.752	67%	0.672	S	S	*	*			trans	-79.3	135.2	165.1	-71.7	177.5	177.6	174.1	0	109
821	I	23.5	Very low	28.5	Very low	139 Å²	139	129 Å²	129	71%	0.713	71%	0.709	S	S	*	*			trans	-139.7	134.4	158.3	-56.8	-178.5	0	0	0	109	I819 R823	I819-I821 HydrophobicContact CG2-CD1 4.39Å; I819-I821 HydrophobicContact CG2-CG1 4.01Å; I821-R823 HydrophobicContact CG2-CG 4.48Å
822	R	26.3	Very low	28.6	Very low	248 Å²	248	132.9 Å²	132.9	94%	0.936	74%	0.743	S	S	*	*			trans	-117.9	149.5	144.9	-111.9	-173.4	177.3	-172.7	-1.4	107.7
823	R	26.2	Very low	28.3	Very low	232 Å²	232	137.5 Å²	137.5	88%	0.875	78%	0.776	S	S	*	*			trans	-84.5	169.2	-174.2	-66.8	175.4	176.9	168.2	-2.8	109.2	I821	I821-R823 HydrophobicContact CG2-CG 4.48Å
824	S	28.2	Very low	27.9	Very low	116 Å²	116	141 Å²	141	81%	0.811	79%	0.789	S	S	*	*			cis	-161.9	168.1	42.1	47.3	0	0	0	0	117.3
825	N	26	Very low	27.8	Very low	143 Å²	143	140.8 Å²	140.8	77%	0.765	79%	0.793	S	S	*	*			trans	-60.8	171.1	171.1	-81.8	19.4	0	0	0	114
826	P	41.1	Very low	27.9	Very low	112 Å²	112	139.9 Å²	139.9	73%	0.727	80%	0.798	S	S	*	*			cis	-151.2	149.6	36.8	40.8	-18.2	0	0	0	123.3
827	I	28.1	Very low	28	Very low	151 Å²	151	143 Å²	143	77%	0.774	80%	0.801	S	S	*	*				55.5	108	129.6	-52.8	173.9	0	0	0	122.3
828	S	32.4	Very low	28.1	Very low	112 Å²	112	145.2 Å²	145.2	78%	0.783	80%	0.798	S	S	*	*				46.9	160.3	130	-97.7	0	0	0	0	123.4
829	P	42	Very low	28.3	Very low	116 Å²	116	145.9 Å²	145.9	75%	0.753	79%	0.793	S	S	*	*			cis	-144.2	166.5	31.1	42.2	-21.9	0	0	0	120.8
830	V	28	Very low	28.6	Very low	141 Å²	141	143 Å²	143	86%	0.855	79%	0.785	S	S	*	*			trans	21.3	123.7	145.4	-173.3	0	0	0	0	122.5
831	A	27.7	Very low	28.8	Very low	105 Å²	105	142.6 Å²	142.6	87%	0.868	79%	0.787	S	S	*	*			trans	-171.3	163	131.4	0	0	0	0	0	112.1
832	A	28.1	Very low	29	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	79%	0.787	S	S	*	*			trans	-117.1	154.8	-161.7	0	0	0	0	0	117.2
833	S	27.6	Very low	29.2	Very low	115 Å²	115	139.7 Å²	139.7	80%	0.804	78%	0.784	S	S	*	*			trans	174.4	157.3	149.1	36.9	0	0	0	0	111.3
834	I	27	Very low	29.6	Very low	147 Å²	147	137.2 Å²	137.2	75%	0.754	81%	0.814	S	S	*	*			cis	-165.8	134.2	-41.3	-114.2	159.1	0	0	0	108.2
835	T	24.8	Very low	29.7	Very low	131 Å²	131	138.3 Å²	138.3	80%	0.804	81%	0.814	S	S	*	*			trans	60.6	156.6	172.1	51.4	0	0	0	0	117.1
836	V	26.4	Very low	29.9	Very low	141 Å²	141	138 Å²	138	86%	0.855	82%	0.816	S	S	*	*			cis	-126.8	161.8	33.5	176.3	0	0	0	0	113.2
837	K	25.7	Very low	29.3	Very low	183 Å²	183	139.4 Å²	139.4	80%	0.796	82%	0.821	S	S	*	*			trans	-73.6	155.8	-177.9	-46.1	172.2	-179	179.2	0	113.1
838	Q	28.9	Very low	29.3	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.794	82%	0.824	S	S	*	*				-158.6	163	107.7	-161.6	145	8.3	0	0	112.7
839	E	27.8	Very low	29.1	Very low	144 Å²	144	140.4 Å²	140.4	67%	0.673	83%	0.826	S	S	*	*			trans	-50.9	165.5	172.6	-69.3	103.9	-150.8	0	0	116
840	S	29.4	Very low	28.3	Very low	87 Å²	87	142.1 Å²	142.1	61%	0.608	83%	0.831	S	S	*	*			cis	-163.8	169.5	-15.1	53.2	0	0	0	0	111.6
841	E	28.9	Very low	28.3	Very low	166 Å²	166	142.1 Å²	142.1	78%	0.776	83%	0.83	S	S	*	*			trans	66.5	133.3	148.2	-73.4	152.3	147.7	0	0	123.7
842	D	28.7	Very low	28.4	Very low	137 Å²	137	145 Å²	145	73%	0.733	83%	0.827	S	S	*	*			trans	65.1	107.5	138.4	-65.4	8.3	0	0	0	124.8
843	H	30.4	Very low	28.4	Very low	188 Å²	188	149.1 Å²	149.1	87%	0.87	83%	0.829	S	S	*	*				36.8	100.9	126.3	-72.3	-57.8	0	0	0	121.1
844	A	35.1	Very low	28.5	Very low	180 Å²	180	152.2 Å²	152.2	100%	1.488	83%	0.832	S	S	*	*			trans	-153.4	0	130.7	0	0	0	0	0	111.1

Retrieved 844 of 844 residues in 583.6 ms (Link to these results)

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